#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yts n SER 2 N 0.00 1.70 -4.07 1.61 2.88 -1.26 -4.88 113.62 109.60 2yts n SER 2 Ca 0.00 0.80 -0.35 0.00 -1.33 0.00 0.00 58.87 57.99 2yts n SER 2 Cb 0.00 -1.07 -0.09 0.00 -0.75 0.00 0.00 64.21 62.30 2yts n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2yts s SER 3 N 5.21 5.42 0.35 -3.46 0.01 -1.26 -5.07 113.70 114.90 2yts s SER 3 Ca 1.08 -3.33 0.07 0.00 1.31 0.00 0.00 55.95 55.08 2yts s SER 3 Cb -1.19 -1.84 -0.01 0.00 0.21 0.00 0.00 66.02 63.19 2yts s SER 3 CO 0.64 -0.25 0.43 -0.83 0.41 0.00 0.00 173.24 173.63 2yts s GLY 4 N 0.03 1.72 -0.18 3.44 0.00 -1.26 -5.11 107.32 105.96 2yts s GLY 4 Ca 0.22 -1.56 -0.04 0.00 0.00 0.00 0.00 44.72 43.34 2yts s GLY 4 CO -0.08 -1.46 -0.04 -0.45 0.00 0.00 0.00 173.10 171.07 2yts s SER 5 N -4.14 4.60 -0.23 1.64 0.15 -1.26 -5.09 113.70 109.37 2yts s SER 5 Ca 0.45 -0.23 -0.26 0.00 0.70 0.00 0.00 55.95 56.61 2yts s SER 5 Cb -0.08 -1.76 0.07 0.00 -1.71 0.00 0.00 66.02 62.54 2yts s SER 5 CO 0.30 0.10 0.74 -0.55 1.20 0.00 0.00 173.24 175.03 2yts s SER 6 N 0.77 -0.71 0.00 5.45 0.15 -1.26 -5.10 113.70 113.00 2yts s SER 6 Ca -0.01 1.28 0.00 0.00 0.70 0.00 0.00 55.95 57.91 2yts s SER 6 Cb -0.15 1.26 0.00 0.00 -1.71 0.00 0.00 66.02 65.42 2yts s SER 6 CO 0.02 -0.31 0.00 0.61 1.20 0.00 0.00 173.24 174.76 2yts n GLY 7 N 2.33 -2.03 0.15 9.45 0.00 -1.26 -4.98 105.19 108.86 2yts n GLY 7 Ca -0.15 -0.60 -0.13 0.00 0.00 0.00 0.00 46.02 45.14 2yts n GLY 7 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2yts h THR 8 N 0.00 0.86 -2.10 2.61 2.02 -2.07 -3.47 112.91 110.76 2yts h THR 8 Ca 0.00 -0.50 0.00 0.00 0.77 0.00 0.00 66.41 66.68 2yts h THR 8 Cb 0.00 1.14 0.00 0.00 -1.74 0.00 0.00 68.15 67.55 2yts h THR 8 CO 0.00 0.11 0.00 0.61 0.37 0.00 0.00 175.52 176.61 2yts n GLY 9 N -0.52 4.24 3.30 2.16 0.00 -1.26 -5.17 105.19 107.94 2yts n GLY 9 Ca -0.09 -1.69 -0.26 0.00 0.00 0.00 0.00 46.02 43.98 2yts n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2yts s GLU 10 N -1.61 1.33 0.77 1.61 2.02 -1.26 -5.13 118.70 116.43 2yts s GLU 10 Ca 0.00 -1.13 -0.13 0.00 0.02 0.00 0.00 54.97 53.73 2yts s GLU 10 Cb 0.00 -1.59 0.06 0.00 0.10 0.00 0.00 34.13 32.70 2yts s GLU 10 CO 0.00 0.39 1.15 0.15 0.02 0.00 0.00 175.26 176.97 2yts s LYS 11 N -1.65 1.99 0.05 1.61 -0.14 -1.26 -4.97 119.74 115.38 2yts s LYS 11 Ca 0.09 1.54 -0.20 0.00 -1.36 0.00 0.00 55.97 56.04 2yts s LYS 11 Cb -0.10 -1.84 -0.14 0.00 -1.68 0.00 0.00 37.83 34.08 2yts s LYS 11 CO 0.04 -1.90 1.36 -1.00 -0.76 0.00 0.00 175.35 173.08 2yts h PRO 12 N -0.78 0.40 -4.92 -1.68 0.13 -1.94 -3.42 132.00 119.78 2yts h PRO 12 Ca -0.46 -0.21 -0.64 0.00 -0.87 0.00 0.00 66.00 63.82 2yts h PRO 12 Cb 1.27 0.01 -0.18 0.00 0.13 0.00 0.00 31.00 32.22 2yts h PRO 12 CO 0.49 0.77 -0.55 0.71 -0.23 0.00 0.00 178.00 179.19 2yts s TYR 13 N -4.32 3.19 -0.19 1.56 2.02 -1.25 -5.05 117.35 113.30 2yts s TYR 13 Ca -0.14 -0.02 -0.04 0.00 -0.37 0.00 0.00 57.07 56.49 2yts s TYR 13 Cb 0.06 -2.34 0.10 0.00 -0.40 0.00 0.00 41.96 39.38 2yts s TYR 13 CO 0.76 -0.20 0.32 0.42 -1.57 0.00 0.00 175.55 175.28 2yts s ILE 14 N 1.69 -0.51 0.68 2.71 1.01 -1.26 -1.11 121.20 124.41 2yts s ILE 14 Ca 0.07 0.07 -0.17 0.00 0.00 0.00 0.00 60.65 60.62 2yts s ILE 14 Cb -0.16 -0.65 -0.02 0.00 0.01 0.00 0.00 42.46 41.64 2yts s ILE 14 CO 0.09 -0.03 0.93 0.00 0.00 0.00 0.00 174.94 175.93 2yts n ASN 16 N -1.26 2.17 0.23 0.00 2.85 -1.26 -3.34 115.26 114.65 2yts n ASN 16 Ca 0.13 -0.01 -0.15 0.00 -0.11 0.00 0.00 54.58 54.45 2yts n ASN 16 Cb 0.49 0.72 -0.08 0.00 1.24 0.00 0.00 39.78 42.15 2yts n ASN 16 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 2yts h GLU 17 N 0.00 -0.55 0.01 1.20 4.39 -1.97 -3.37 114.58 114.30 2yts h GLU 17 Ca -0.32 0.04 -0.40 0.00 0.34 0.00 0.00 59.36 59.02 2yts h GLU 17 Cb 1.71 0.12 -0.06 0.00 -0.10 0.00 0.00 28.75 30.42 2yts h GLU 17 CO 0.01 -0.30 -2.40 0.00 -1.16 0.00 0.00 179.01 175.16 2yts n GLY 19 N 1.95 0.58 3.80 0.00 0.00 -1.21 -5.09 105.19 105.21 2yts n GLY 19 Ca -0.46 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.34 2yts n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yts s LYS 20 N 0.85 2.77 0.12 1.61 1.02 -1.24 -4.87 119.74 119.98 2yts s LYS 20 Ca 0.00 -1.18 0.08 0.00 0.02 0.00 0.00 55.97 54.89 2yts s LYS 20 Cb 0.00 -2.47 -0.04 0.00 -0.52 0.00 0.00 37.83 34.80 2yts s LYS 20 CO 0.00 0.32 -0.14 -1.12 -0.92 0.00 0.00 175.35 173.49 2yts s SER 21 N -3.85 4.12 0.29 2.83 0.01 -1.26 -0.24 113.70 115.61 2yts s SER 21 Ca 0.34 -0.50 -0.09 0.00 1.31 0.00 0.00 55.95 57.02 2yts s SER 21 Cb -0.07 -0.68 0.00 0.00 0.21 0.00 0.00 66.02 65.49 2yts s SER 21 CO 0.24 0.17 0.49 -0.36 0.41 0.00 0.00 173.24 174.19 2yts s PHE 22 N -1.24 0.64 -0.07 2.43 0.08 -0.27 -4.98 117.98 114.58 2yts s PHE 22 Ca 0.20 -0.97 -0.02 0.00 0.12 0.00 0.00 56.93 56.26 2yts s PHE 22 Cb -0.11 0.11 -0.04 0.00 -0.57 0.00 0.00 43.02 42.42 2yts s PHE 22 CO 0.12 -1.08 -0.07 -0.89 -0.10 0.00 0.00 175.22 173.20 2yts n ILE 23 N -0.46 0.37 -3.17 0.64 5.41 -1.26 -3.95 119.36 116.93 2yts n ILE 23 Ca -0.01 -0.12 -0.39 0.00 1.00 0.00 0.00 62.75 63.23 2yts n ILE 23 Cb 0.62 -1.17 -0.05 0.00 -0.71 0.00 0.00 39.64 38.33 2yts n ILE 23 CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 2yts s GLN 24 N -2.13 4.36 0.40 0.38 1.11 -1.26 -4.82 119.66 117.70 2yts s GLN 24 Ca -0.09 0.73 0.08 0.00 0.01 0.00 0.00 55.36 56.10 2yts s GLN 24 Cb 0.03 -3.39 0.87 0.00 -1.01 0.00 0.00 33.01 29.52 2yts s GLN 24 CO 0.13 0.25 2.02 -0.22 0.01 0.00 0.00 175.29 177.48 2yts h LYS 25 N 6.12 0.55 -0.39 2.91 3.64 -2.00 -1.87 116.57 125.52 2yts h LYS 25 Ca -0.43 -0.03 -0.15 0.00 -1.27 0.00 0.00 60.65 58.76 2yts h LYS 25 Cb 1.20 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.89 2yts h LYS 25 CO 0.72 0.36 -0.35 0.77 -2.27 0.00 0.00 179.45 178.68 2yts h SER 26 N 0.57 0.99 -0.59 4.20 0.02 -1.98 -0.91 113.55 115.85 2yts h SER 26 Ca 0.22 -0.46 0.07 0.00 -0.84 0.00 0.00 61.79 60.79 2yts h SER 26 Cb 0.16 -0.28 -0.06 0.00 0.14 0.00 0.00 62.40 62.36 2yts h SER 26 CO -0.06 1.24 0.26 0.45 -1.14 0.00 0.00 176.83 177.58 2yts h HIS 27 N 0.75 0.46 0.14 3.45 3.86 -1.75 -0.21 115.15 121.85 2yts h HIS 27 Ca 0.07 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.30 2yts h HIS 27 Cb 0.94 -0.12 0.00 0.00 1.06 0.00 0.00 27.41 29.30 2yts h HIS 27 CO 0.06 0.17 -0.07 1.25 0.86 0.00 0.00 177.93 180.21 2yts h LEU 28 N 0.48 -0.15 -1.07 2.43 5.85 -1.47 -1.91 115.31 119.46 2yts h LEU 28 Ca 0.28 -0.39 0.30 0.00 0.84 0.00 0.00 57.88 58.91 2yts h LEU 28 Cb 0.28 0.04 -0.13 0.00 0.37 0.00 0.00 40.66 41.22 2yts h LEU 28 CO -0.24 0.43 0.61 -1.13 -0.34 0.00 0.00 178.44 177.77 2yts h ASN 29 N -0.88 0.55 0.82 1.25 -0.73 -1.04 0.72 115.58 116.27 2yts h ASN 29 Ca -0.02 0.16 -0.21 0.00 1.87 0.00 0.00 56.30 58.10 2yts h ASN 29 Cb 0.53 0.09 -0.02 0.00 0.27 0.00 0.00 38.32 39.19 2yts h ASN 29 CO 0.03 -0.03 -0.96 -0.09 -0.37 0.00 0.00 177.43 176.00 2yts h ARG 30 N 0.40 0.08 -0.30 6.67 1.12 -1.08 -3.29 114.38 117.98 2yts h ARG 30 Ca 0.69 -0.11 -0.11 0.00 -1.11 0.00 0.00 59.98 59.35 2yts h ARG 30 Cb 1.56 0.04 -0.01 0.00 -0.01 0.00 0.00 29.97 31.55 2yts h ARG 30 CO -0.52 0.98 -0.25 1.25 -3.11 0.00 0.00 179.97 178.32 2yts h HIS 31 N 0.03 0.83 0.00 2.20 2.76 0.11 -2.69 115.15 118.39 2yts h HIS 31 Ca -0.03 -0.24 0.00 0.00 -2.20 0.00 0.00 60.37 57.90 2yts h HIS 31 Cb 1.67 -0.18 0.00 0.00 1.55 0.00 0.00 27.41 30.45 2yts h HIS 31 CO 0.01 0.97 0.00 0.54 -1.30 0.00 0.00 177.93 178.16 2yts n ARG 32 N -4.29 0.04 0.09 5.26 1.74 0.80 -2.18 116.66 118.12 2yts n ARG 32 Ca -0.03 0.54 0.20 0.00 -0.77 0.00 0.00 57.85 57.79 2yts n ARG 32 Cb 0.45 -1.65 0.75 0.00 -1.02 0.00 0.00 32.46 30.98 2yts n ARG 32 CO 0.00 0.00 0.00 0.07 -1.52 0.00 0.00 177.63 176.18 2yts h ARG 33 N 0.00 0.00 -0.09 5.56 0.11 -1.57 0.32 114.38 118.70 2yts h ARG 33 Ca 0.00 0.00 -0.17 0.00 0.10 0.00 0.00 59.98 59.91 2yts h ARG 33 Cb 0.00 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.08 2yts h ARG 33 CO 0.00 0.00 -0.69 -0.84 0.10 0.00 0.00 179.97 178.54 2yts h ILE 34 N 0.00 1.37 0.00 0.08 3.07 -1.67 -3.35 117.51 117.00 2yts h ILE 34 Ca 0.20 -2.07 -0.05 0.00 1.55 0.00 0.00 64.86 64.49 2yts h ILE 34 Cb 1.07 2.05 -0.01 0.00 -0.27 0.00 0.00 36.82 39.66 2yts h ILE 34 CO -0.00 0.62 -0.46 0.45 -1.05 0.00 0.00 178.15 177.71 2yts h HIS 35 N 0.28 0.00 -2.21 0.16 3.86 -0.75 -3.44 115.15 113.05 2yts h HIS 35 Ca -0.02 0.00 -0.61 0.00 -1.16 0.00 0.00 60.37 58.58 2yts h HIS 35 Cb 1.25 0.00 0.07 0.00 1.06 0.00 0.00 27.41 29.78 2yts h HIS 35 CO 0.04 0.45 0.62 0.25 0.86 0.00 0.00 177.93 180.15 2yts n THR 36 N -4.62 0.33 0.00 2.45 -2.24 0.44 -2.39 114.28 108.26 2yts n THR 36 Ca -0.11 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 2yts n THR 36 Cb 0.31 -1.30 0.00 0.00 -2.10 0.00 0.00 70.33 67.24 2yts n THR 36 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2yts n GLY 37 N 2.76 3.20 3.86 3.38 0.00 -1.26 -4.82 105.19 112.31 2yts n GLY 37 Ca 0.16 -0.91 -0.31 0.00 0.00 0.00 0.00 46.02 44.95 2yts n GLY 37 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2yts s GLU 38 N 0.00 3.84 0.39 1.61 2.12 -1.00 -4.99 118.70 120.66 2yts s GLU 38 Ca 0.00 0.77 -0.23 0.00 0.36 0.00 0.00 54.97 55.87 2yts s GLU 38 Cb 0.00 -2.20 -0.14 0.00 0.26 0.00 0.00 34.13 32.04 2yts s GLU 38 CO 0.00 -0.25 0.39 1.63 -0.54 0.00 0.00 175.26 176.49 2yts n LYS 39 N -1.69 0.32 -1.19 4.30 4.01 -1.26 -4.93 118.16 117.72 2yts n LYS 39 Ca 0.05 0.12 -0.29 0.00 -0.51 0.00 0.00 58.31 57.67 2yts n LYS 39 Cb 0.54 -1.28 0.15 0.00 -0.51 0.00 0.00 35.03 33.94 2yts n LYS 39 CO 0.00 0.00 0.00 -1.25 -1.11 0.00 0.00 177.40 175.04 2yts s PRO 40 N -1.31 0.92 -0.22 1.97 0.04 -1.26 -5.07 135.00 130.08 2yts s PRO 40 Ca 0.62 0.70 -0.07 0.00 0.04 0.00 0.00 61.00 62.28 2yts s PRO 40 Cb -0.65 -1.78 0.10 0.00 0.04 0.00 0.00 34.50 32.21 2yts s PRO 40 CO 0.60 -2.44 0.46 -1.12 0.04 0.00 0.00 177.00 174.54 2yts s SER 41 N -3.43 -0.43 0.00 6.66 0.01 -1.26 -5.15 113.70 110.10 2yts s SER 41 Ca 0.64 1.10 0.00 0.00 1.31 0.00 0.00 55.95 59.00 2yts s SER 41 Cb -0.18 1.54 0.00 0.00 0.21 0.00 0.00 66.02 67.59 2yts s SER 41 CO 0.57 -0.23 0.00 0.61 0.41 0.00 0.00 173.24 174.60 2yts n GLY 42 N 5.40 3.77 3.71 3.44 0.00 -1.26 -5.05 105.19 115.20 2yts n GLY 42 Ca -0.09 -0.41 -0.29 0.00 0.00 0.00 0.00 46.02 45.23 2yts n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yts s PRO 43 N -1.57 1.09 0.82 1.61 0.04 -1.26 -5.03 135.00 130.70 2yts s PRO 43 Ca 0.00 0.75 -0.12 0.00 0.04 0.00 0.00 61.00 61.68 2yts s PRO 43 Cb 0.00 -1.79 0.08 0.00 0.04 0.00 0.00 34.50 32.83 2yts s PRO 43 CO 0.00 -2.34 1.10 -1.12 0.04 0.00 0.00 177.00 174.68 2yts s SER 44 N -3.43 4.30 0.44 6.66 0.01 -1.26 -5.08 113.70 115.33 2yts s SER 44 Ca 0.64 1.28 0.07 0.00 1.31 0.00 0.00 55.95 59.25 2yts s SER 44 Cb -0.18 -1.99 -0.03 0.00 0.21 0.00 0.00 66.02 64.03 2yts s SER 44 CO 0.57 -2.09 0.23 -0.44 0.41 0.00 0.00 173.24 171.92 2yts s SER 45 N -3.88 4.53 0.00 2.44 0.01 -1.26 -5.34 113.70 110.20 2yts s SER 45 Ca 0.61 -1.09 0.04 0.00 1.31 0.00 0.00 55.95 56.82 2yts s SER 45 Cb -0.15 -0.29 0.03 0.00 0.21 0.00 0.00 66.02 65.82 2yts s SER 45 CO 0.54 -0.67 0.63 0.61 0.41 0.00 0.00 173.24 174.77