#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2em9 s SER 2 N 0.00 -1.44 0.04 1.61 0.01 -1.26 -5.14 113.70 107.52 2em9 s SER 2 Ca 0.00 0.70 -0.30 0.00 1.31 0.00 0.00 55.95 57.66 2em9 s SER 2 Cb 0.00 2.13 -0.06 0.00 0.21 0.00 0.00 66.02 68.30 2em9 s SER 2 CO 0.00 -0.27 1.30 -0.44 0.41 0.00 0.00 173.24 174.24 2em9 s SER 3 N 2.85 6.95 0.00 2.44 0.01 -1.26 -4.62 113.70 120.07 2em9 s SER 3 Ca 0.18 2.08 0.00 0.00 1.31 0.00 0.00 55.95 59.53 2em9 s SER 3 Cb -0.14 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.52 2em9 s SER 3 CO -0.22 -0.61 0.00 0.61 0.41 0.00 0.00 173.24 173.43 2em9 n GLY 4 N 3.43 0.35 3.19 3.44 0.00 -1.26 -5.14 105.19 109.20 2em9 n GLY 4 Ca 0.11 -0.53 -0.27 0.00 0.00 0.00 0.00 46.02 45.34 2em9 n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2em9 n SER 5 N 0.00 -2.84 -0.02 1.61 3.41 -1.26 -5.01 113.62 109.51 2em9 n SER 5 Ca 0.00 -0.35 -0.07 0.00 -0.26 0.00 0.00 58.87 58.20 2em9 n SER 5 Cb 0.00 -0.91 -0.02 0.00 -0.26 0.00 0.00 64.21 63.01 2em9 n SER 5 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2em9 n SER 6 N -2.42 0.81 -2.95 4.04 2.88 -1.26 -5.08 113.62 109.64 2em9 n SER 6 Ca 0.04 0.13 -0.06 0.00 -1.33 0.00 0.00 58.87 57.65 2em9 n SER 6 Cb 0.52 -0.30 0.01 0.00 -0.75 0.00 0.00 64.21 63.68 2em9 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2em9 n GLY 7 N 2.63 0.03 0.02 0.46 0.00 -1.26 -4.91 105.19 102.16 2em9 n GLY 7 Ca -0.12 0.17 0.06 0.00 0.00 0.00 0.00 46.02 46.13 2em9 n GLY 7 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2em9 n THR 8 N 0.98 0.15 -3.12 2.61 5.66 -1.26 -5.11 114.28 114.18 2em9 n THR 8 Ca -0.01 -0.39 0.00 0.00 -3.05 0.00 0.00 64.05 60.59 2em9 n THR 8 Cb 0.47 0.03 0.00 0.00 -1.55 0.00 0.00 70.33 69.28 2em9 n THR 8 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2em9 n GLY 9 N 1.69 -1.64 3.23 1.09 0.00 -1.26 -4.92 105.19 103.38 2em9 n GLY 9 Ca -0.06 -1.47 -0.27 0.00 0.00 0.00 0.00 46.02 44.22 2em9 n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2em9 s GLU 10 N 0.00 1.58 0.01 1.61 2.02 -1.26 -5.14 118.70 117.52 2em9 s GLU 10 Ca 0.00 -0.82 0.02 0.00 0.02 0.00 0.00 54.97 54.20 2em9 s GLU 10 Cb 0.00 -1.59 -0.01 0.00 0.10 0.00 0.00 34.13 32.63 2em9 s GLU 10 CO 0.00 0.43 -0.08 0.15 0.02 0.00 0.00 175.26 175.78 2em9 s LYS 11 N -0.74 0.58 0.27 1.61 1.02 -1.26 -4.99 119.74 116.23 2em9 s LYS 11 Ca 0.08 -0.37 0.05 0.00 0.02 0.00 0.00 55.97 55.75 2em9 s LYS 11 Cb -0.08 -0.53 0.37 0.00 -0.52 0.00 0.00 37.83 37.06 2em9 s LYS 11 CO 0.00 0.14 1.65 -1.00 -0.92 0.00 0.00 175.35 175.22 2em9 h PRO 12 N 5.66 0.29 -5.43 -1.68 0.13 -1.81 -3.43 132.00 125.73 2em9 h PRO 12 Ca -0.31 -0.15 -0.63 0.00 -0.87 0.00 0.00 66.00 64.04 2em9 h PRO 12 Cb 1.19 0.01 -0.13 0.00 0.13 0.00 0.00 31.00 32.20 2em9 h PRO 12 CO 0.48 0.69 -0.53 0.71 -0.23 0.00 0.00 178.00 179.13 2em9 s TYR 13 N -4.07 3.37 -0.12 1.56 2.02 -1.06 -5.03 117.35 114.03 2em9 s TYR 13 Ca -0.05 0.27 -0.04 0.00 -0.37 0.00 0.00 57.07 56.88 2em9 s TYR 13 Cb 0.13 -2.04 0.06 0.00 -0.40 0.00 0.00 41.96 39.70 2em9 s TYR 13 CO 0.79 0.36 0.23 0.54 -1.57 0.00 0.00 175.55 175.90 2em9 s ASN 14 N -0.08 0.48 0.27 2.29 4.22 -1.26 -0.21 114.94 120.66 2em9 s ASN 14 Ca 0.08 0.51 -0.30 0.00 -2.14 0.00 0.00 52.86 51.02 2em9 s ASN 14 Cb -0.12 0.57 -0.10 0.00 1.28 0.00 0.00 41.25 42.89 2em9 s ASN 14 CO 0.01 -0.24 1.39 0.00 -2.04 0.00 0.00 177.10 176.21 2em9 n LYS 16 N 1.83 0.66 0.16 0.00 3.00 -1.26 -2.47 118.16 120.08 2em9 n LYS 16 Ca 0.04 0.08 -0.17 0.00 -0.00 0.00 0.00 58.31 58.26 2em9 n LYS 16 Cb 0.41 -1.63 -0.10 0.00 0.00 0.00 0.00 35.03 33.71 2em9 n LYS 16 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 2em9 h GLU 17 N 0.00 -0.80 0.00 1.64 4.39 -1.99 -3.35 114.58 114.48 2em9 h GLU 17 Ca -0.38 0.05 -0.35 0.00 0.34 0.00 0.00 59.36 59.02 2em9 h GLU 17 Cb 1.98 0.18 -0.06 0.00 -0.10 0.00 0.00 28.75 30.75 2em9 h GLU 17 CO 0.04 -0.53 -2.32 0.00 -1.16 0.00 0.00 179.01 175.04 2em9 n GLY 19 N 2.31 0.77 3.23 0.00 0.00 -1.03 -5.11 105.19 105.36 2em9 n GLY 19 Ca -0.42 -0.10 -0.22 0.00 0.00 0.00 0.00 46.02 45.29 2em9 n GLY 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2em9 n LYS 20 N 0.00 0.79 -4.17 1.61 5.02 -1.10 -4.90 118.16 115.42 2em9 n LYS 20 Ca 0.00 -2.88 -0.15 0.00 -2.02 0.00 0.00 58.31 53.26 2em9 n LYS 20 Cb 0.00 0.26 -0.11 0.00 -0.02 0.00 0.00 35.03 35.16 2em9 n LYS 20 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2em9 s SER 21 N -3.76 1.45 -0.15 4.39 1.04 -1.26 -0.91 113.70 114.50 2em9 s SER 21 Ca 0.29 -0.77 -0.14 0.00 0.48 0.00 0.00 55.95 55.81 2em9 s SER 21 Cb -0.02 -0.00 0.04 0.00 0.10 0.00 0.00 66.02 66.14 2em9 s SER 21 CO 0.18 -0.23 0.41 -0.36 0.98 0.00 0.00 173.24 174.22 2em9 s PHE 22 N -2.19 -0.45 -0.05 5.02 0.08 0.70 -4.92 117.98 116.17 2em9 s PHE 22 Ca 0.03 1.10 -0.22 0.00 0.12 0.00 0.00 56.93 57.96 2em9 s PHE 22 Cb -0.04 0.15 -0.17 0.00 -0.57 0.00 0.00 43.02 42.39 2em9 s PHE 22 CO 0.00 -0.22 0.93 0.00 -0.10 0.00 0.00 175.22 175.84 2em9 h ARG 23 N 5.52 -0.16 -6.88 0.44 3.08 -1.94 -2.81 114.38 111.62 2em9 h ARG 23 Ca -0.27 0.01 -0.45 0.00 0.07 0.00 0.00 59.98 59.34 2em9 h ARG 23 Cb 1.18 0.04 0.06 0.00 0.08 0.00 0.00 29.97 31.32 2em9 h ARG 23 CO 0.25 0.31 -0.01 -1.58 -1.07 0.00 0.00 179.97 177.87 2em9 s TRP 24 N -3.48 2.23 -0.05 3.04 0.52 -1.26 -4.57 118.94 115.37 2em9 s TRP 24 Ca -0.14 -0.22 -0.00 0.00 0.02 0.00 0.00 56.10 55.76 2em9 s TRP 24 Cb 0.00 -2.74 -0.00 0.00 -1.15 0.00 0.00 33.47 29.58 2em9 s TRP 24 CO 0.52 -1.17 0.00 0.00 0.02 0.00 0.00 176.95 176.32 2em9 h ALA 25 N -0.09 -0.00 -0.85 0.98 0.00 -2.00 -3.34 119.26 113.95 2em9 h ALA 25 Ca -0.38 -0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.61 2em9 h ALA 25 Cb 1.28 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.97 2em9 h ALA 25 CO 0.46 -0.00 -0.49 -1.13 0.00 0.00 0.00 179.25 178.09 2em9 n SER 26 N -3.37 -0.88 -0.31 0.00 3.41 -1.26 0.55 113.62 111.76 2em9 n SER 26 Ca -0.00 1.51 0.08 0.00 -0.26 0.00 0.00 58.87 60.20 2em9 n SER 26 Cb 0.00 -0.21 0.16 0.00 -0.26 0.00 0.00 64.21 63.91 2em9 n SER 26 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2em9 h LEU 28 N 0.00 0.36 -0.03 0.00 5.85 -0.02 -2.40 115.31 119.07 2em9 h LEU 28 Ca 0.46 -0.24 0.03 0.00 0.84 0.00 0.00 57.88 58.97 2em9 h LEU 28 Cb 0.78 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 41.65 2em9 h LEU 28 CO -0.88 0.51 -0.38 0.25 -0.34 0.00 0.00 178.44 177.59 2em9 h LEU 29 N 0.20 -1.17 -0.83 2.25 6.46 0.13 -0.56 115.31 121.80 2em9 h LEU 29 Ca 0.07 0.15 0.11 0.00 -0.12 0.00 0.00 57.88 58.09 2em9 h LEU 29 Cb 0.30 0.47 -0.08 0.00 -0.73 0.00 0.00 40.66 40.61 2em9 h LEU 29 CO 0.00 -0.43 0.46 0.50 -0.62 0.00 0.00 178.44 178.36 2em9 h LYS 30 N -0.52 0.71 -0.73 1.25 3.11 -1.09 -1.24 116.57 118.06 2em9 h LYS 30 Ca 0.06 -0.04 0.04 0.00 -2.81 0.00 0.00 60.65 57.89 2em9 h LYS 30 Cb 0.62 -0.16 -0.05 0.00 -1.00 0.00 0.00 32.23 31.64 2em9 h LYS 30 CO -0.32 0.47 0.45 1.25 -2.81 0.00 0.00 179.45 178.50 2em9 h HIS 31 N 0.73 0.85 -0.24 1.91 2.76 -0.76 -0.82 115.15 119.58 2em9 h HIS 31 Ca 0.42 0.02 0.07 0.00 -2.20 0.00 0.00 60.37 58.68 2em9 h HIS 31 Cb 0.45 -0.28 -0.01 0.00 1.55 0.00 0.00 27.41 29.13 2em9 h HIS 31 CO -0.07 0.48 0.33 1.96 -1.30 0.00 0.00 177.93 179.32 2em9 h GLN 32 N 0.88 0.00 -1.19 5.26 4.20 0.12 -1.32 115.11 123.05 2em9 h GLN 32 Ca 0.30 0.00 0.34 0.00 0.06 0.00 0.00 58.65 59.35 2em9 h GLN 32 Cb 0.04 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 27.76 2em9 h GLN 32 CO -0.12 0.00 0.83 0.00 -0.67 0.00 0.00 178.83 178.87 2em9 h ARG 33 N 0.00 0.11 -0.77 1.46 2.47 -1.07 0.58 114.38 117.16 2em9 h ARG 33 Ca 0.12 -0.01 -0.04 0.00 -1.26 0.00 0.00 59.98 58.79 2em9 h ARG 33 Cb 0.77 -0.02 -0.03 0.00 -1.65 0.00 0.00 29.97 29.03 2em9 h ARG 33 CO -0.00 0.07 0.32 -0.39 0.56 0.00 0.00 179.97 180.52 2em9 h VAL 34 N 0.11 1.25 0.03 2.04 -1.51 -1.43 -2.94 116.25 113.81 2em9 h VAL 34 Ca 0.61 -0.78 -0.27 0.00 -1.23 0.00 0.00 66.70 65.03 2em9 h VAL 34 Cb 2.15 0.33 -0.03 0.00 -2.13 0.00 0.00 31.29 31.61 2em9 h VAL 34 CO -0.11 0.32 -1.41 0.45 -1.23 0.00 0.00 177.57 175.59 2em9 h HIS 35 N 1.11 0.12 -0.92 5.19 3.86 -0.19 -3.34 115.15 120.98 2em9 h HIS 35 Ca 0.26 -0.09 0.27 0.00 -1.16 0.00 0.00 60.37 59.64 2em9 h HIS 35 Cb 0.19 -0.00 -0.15 0.00 1.06 0.00 0.00 27.41 28.51 2em9 h HIS 35 CO 0.02 1.11 0.33 0.66 0.86 0.00 0.00 177.93 180.91 2em9 h SER 36 N 0.02 0.14 -3.03 2.45 4.64 -0.55 -3.37 113.55 113.85 2em9 h SER 36 Ca -0.18 0.20 -0.63 0.00 -0.47 0.00 0.00 61.79 60.72 2em9 h SER 36 Cb 1.93 0.24 -0.10 0.00 -0.31 0.00 0.00 62.40 64.15 2em9 h SER 36 CO 0.12 -0.16 -0.47 -0.83 -0.87 0.00 0.00 176.83 174.61 2em9 s GLY 37 N -4.04 2.10 -0.25 -0.77 0.00 -1.22 -5.07 107.32 98.08 2em9 s GLY 37 Ca -0.11 -0.65 0.00 0.00 0.00 0.00 0.00 44.72 43.96 2em9 s GLY 37 CO 0.78 -0.04 -0.01 1.85 0.00 0.00 0.00 173.10 175.67 2em9 s GLU 38 N -0.19 1.35 0.20 2.90 2.56 -1.26 -4.95 118.70 119.31 2em9 s GLU 38 Ca 0.11 -0.99 0.09 0.00 0.00 0.00 0.00 54.97 54.19 2em9 s GLU 38 Cb -0.12 -2.49 -0.04 0.00 2.00 0.00 0.00 34.13 33.48 2em9 s GLU 38 CO 0.01 -0.68 -0.11 0.15 -0.56 0.00 0.00 175.26 174.07 2em9 s LYS 39 N 1.45 2.00 -1.01 4.30 3.01 -1.26 -5.05 119.74 123.19 2em9 s LYS 39 Ca -0.02 -1.35 -0.24 0.00 -1.01 0.00 0.00 55.97 53.35 2em9 s LYS 39 Cb -0.18 -2.10 -0.06 0.00 -1.01 0.00 0.00 37.83 34.48 2em9 s LYS 39 CO -0.09 0.41 1.94 -1.25 0.51 0.00 0.00 175.35 176.87 2em9 s PRO 40 N -2.98 2.53 0.18 -1.68 0.04 -1.26 -4.83 135.00 127.00 2em9 s PRO 40 Ca 0.26 -0.62 -0.23 0.00 0.04 0.00 0.00 61.00 60.44 2em9 s PRO 40 Cb -0.08 -5.13 0.07 0.00 0.04 0.00 0.00 34.50 29.40 2em9 s PRO 40 CO 0.15 -3.60 0.99 -1.12 0.04 0.00 0.00 177.00 173.46 2em9 s SER 41 N 7.45 -0.09 -0.39 6.66 0.01 -1.26 -5.10 113.70 120.98 2em9 s SER 41 Ca 0.69 -0.56 0.10 0.00 1.31 0.00 0.00 55.95 57.50 2em9 s SER 41 Cb -0.04 0.51 0.31 0.00 0.21 0.00 0.00 66.02 67.00 2em9 s SER 41 CO 0.04 -0.98 0.70 0.61 0.41 0.00 0.00 173.24 174.03 2em9 n GLY 42 N -0.57 2.95 3.58 3.44 0.00 -1.26 -5.06 105.19 108.27 2em9 n GLY 42 Ca -0.05 -1.43 -0.41 0.00 0.00 0.00 0.00 46.02 44.14 2em9 n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2em9 s PRO 43 N -1.65 3.04 -1.23 1.61 0.04 -1.26 -3.08 135.00 132.46 2em9 s PRO 43 Ca 0.37 0.99 -0.07 0.00 0.04 0.00 0.00 61.00 62.33 2em9 s PRO 43 Cb 0.28 -4.26 0.01 0.00 0.04 0.00 0.00 34.50 30.57 2em9 s PRO 43 CO -0.10 -2.22 1.07 0.45 0.04 0.00 0.00 177.00 176.24 2em9 n SER 44 N 11.22 -5.28 -0.12 6.66 2.88 -1.26 -4.93 113.62 122.79 2em9 n SER 44 Ca 0.21 -0.52 -0.24 0.00 -1.33 0.00 0.00 58.87 56.99 2em9 n SER 44 Cb 0.49 -4.73 -0.09 0.00 -0.75 0.00 0.00 64.21 59.13 2em9 n SER 44 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2em9 n SER 45 N -2.75 1.85 0.00 -3.46 2.88 -1.18 -5.33 113.62 105.64 2em9 n SER 45 Ca -0.05 0.20 0.00 0.00 -1.33 0.00 0.00 58.87 57.70 2em9 n SER 45 Cb 0.58 -0.64 0.00 0.00 -0.75 0.00 0.00 64.21 63.39 2em9 n SER 45 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42