#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2emy s SER 2 N 0.00 4.87 -0.52 1.61 0.15 -1.26 -5.02 113.70 113.52 2emy s SER 2 Ca 0.00 -2.04 0.04 0.00 0.70 0.00 0.00 55.95 54.65 2emy s SER 2 Cb 0.00 -1.67 0.16 0.00 -1.71 0.00 0.00 66.02 62.80 2emy s SER 2 CO 0.00 -0.40 0.37 -0.44 1.20 0.00 0.00 173.24 173.97 2emy s SER 3 N 1.15 3.18 0.00 5.45 0.01 -1.26 -4.97 113.70 117.26 2emy s SER 3 Ca 0.08 -3.24 0.00 0.00 1.31 0.00 0.00 55.95 54.10 2emy s SER 3 Cb -0.20 -1.00 0.00 0.00 0.21 0.00 0.00 66.02 65.03 2emy s SER 3 CO -0.07 -0.16 0.00 0.61 0.41 0.00 0.00 173.24 174.03 2emy n GLY 4 N 2.70 2.23 0.13 3.44 0.00 -1.26 -5.08 105.19 107.35 2emy n GLY 4 Ca 0.21 -0.51 -0.23 0.00 0.00 0.00 0.00 46.02 45.49 2emy n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2emy n SER 5 N 0.00 1.98 -4.74 1.61 2.88 -1.26 -4.92 113.62 109.17 2emy n SER 5 Ca 0.00 0.12 -0.34 0.00 -1.33 0.00 0.00 58.87 57.32 2emy n SER 5 Cb 0.00 -0.66 0.07 0.00 -0.75 0.00 0.00 64.21 62.87 2emy n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2emy s SER 6 N -6.97 4.61 0.00 -3.46 0.15 -1.26 -3.52 113.70 103.26 2emy s SER 6 Ca -0.35 2.23 0.00 0.00 0.70 0.00 0.00 55.95 58.54 2emy s SER 6 Cb 0.11 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.84 2emy s SER 6 CO 0.58 -1.97 0.00 0.61 1.20 0.00 0.00 173.24 173.65 2emy n GLY 7 N 0.09 3.02 3.51 9.45 0.00 -1.26 -5.00 105.19 115.00 2emy n GLY 7 Ca 0.12 -0.82 -0.36 0.00 0.00 0.00 0.00 46.02 44.96 2emy n GLY 7 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2emy s THR 8 N -0.62 4.56 0.00 2.61 -1.32 -1.23 -4.76 115.64 114.88 2emy s THR 8 Ca 0.00 -0.09 0.00 0.00 -1.21 0.00 0.00 61.69 60.39 2emy s THR 8 Cb 0.00 -3.12 0.00 0.00 -1.51 0.00 0.00 72.50 67.87 2emy s THR 8 CO 0.00 0.35 0.00 0.61 -2.21 0.00 0.00 174.62 173.37 2emy n GLY 9 N 4.64 0.00 2.05 6.08 0.00 -1.26 -5.01 105.19 111.69 2emy n GLY 9 Ca -0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.61 2emy n GLY 9 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2emy n GLU 10 N 0.00 2.68 -3.70 1.61 4.07 -1.26 -4.84 120.64 119.19 2emy n GLU 10 Ca 0.00 -3.42 -0.30 0.00 -0.06 0.00 0.00 57.16 53.38 2emy n GLU 10 Cb 0.00 -2.19 -0.14 0.00 -0.06 0.00 0.00 31.44 29.05 2emy n GLU 10 CO 0.00 0.00 0.00 -0.80 -0.06 0.00 0.00 177.13 176.27 2emy s ASN 11 N -2.26 3.75 0.00 4.31 0.02 -1.26 -4.77 114.94 114.73 2emy s ASN 11 Ca 0.57 -2.22 0.15 0.00 -1.02 0.00 0.00 52.86 50.34 2emy s ASN 11 Cb 0.47 -0.93 0.78 0.00 0.02 0.00 0.00 41.25 41.59 2emy s ASN 11 CO 0.02 -0.33 1.39 -0.81 0.02 0.00 0.00 177.10 177.39 2emy n PRO 12 N 4.07 0.27 -3.93 -0.60 -0.04 -1.25 -4.36 135.00 129.15 2emy n PRO 12 Ca 0.05 0.11 -0.31 0.00 -0.04 0.00 0.00 63.50 63.32 2emy n PRO 12 Cb 0.37 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.18 2emy n PRO 12 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2emy s TYR 13 N -2.45 2.89 0.01 0.54 2.02 -1.20 -5.04 117.35 114.12 2emy s TYR 13 Ca 0.16 -2.34 0.08 0.00 -0.37 0.00 0.00 57.07 54.59 2emy s TYR 13 Cb 0.10 -2.23 -0.03 0.00 -0.40 0.00 0.00 41.96 39.41 2emy s TYR 13 CO 0.21 -0.88 -0.22 -1.21 -1.57 0.00 0.00 175.55 171.88 2emy s GLU 14 N 1.21 2.06 -0.52 -0.62 2.02 -1.26 0.66 118.70 122.25 2emy s GLU 14 Ca 0.05 -0.97 -0.28 0.00 0.02 0.00 0.00 54.97 53.79 2emy s GLU 14 Cb -0.19 -2.11 0.02 0.00 0.10 0.00 0.00 34.13 31.95 2emy s GLU 14 CO -0.12 0.55 1.36 0.00 0.02 0.00 0.00 175.26 177.07 2emy n HIS 16 N 9.09 0.00 -0.08 0.00 1.44 -1.26 0.51 115.22 124.92 2emy n HIS 16 Ca 0.13 0.00 -0.15 0.00 -2.01 0.00 0.00 57.72 55.69 2emy n HIS 16 Cb 0.49 -0.20 -0.11 0.00 0.12 0.00 0.00 29.99 30.29 2emy n HIS 16 CO 0.00 0.00 0.00 0.93 -2.81 0.00 0.00 176.34 174.46 2emy h GLU 17 N 0.00 0.00 0.00 -1.40 5.08 -1.98 -3.44 114.58 112.85 2emy h GLU 17 Ca 0.00 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.23 2emy h GLU 17 Cb 0.07 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 2emy h GLU 17 CO 0.00 0.89 -1.45 0.00 -1.00 0.00 0.00 179.01 177.45 2emy n GLY 19 N 2.85 1.33 3.67 0.00 0.00 0.18 -5.05 105.19 108.17 2emy n GLY 19 Ca -0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.57 2emy n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2emy s LYS 20 N 0.00 -0.60 -0.02 1.61 2.20 -1.23 -4.68 119.74 117.03 2emy s LYS 20 Ca 0.00 -0.04 -0.05 0.00 -0.36 0.00 0.00 55.97 55.52 2emy s LYS 20 Cb 0.00 -1.67 0.00 0.00 -1.51 0.00 0.00 37.83 34.66 2emy s LYS 20 CO 0.00 -3.30 0.11 0.00 -0.36 0.00 0.00 175.35 171.80 2emy s ALA 21 N -3.17 -0.25 0.03 3.13 0.00 -1.26 -0.94 121.76 119.30 2emy s ALA 21 Ca 0.70 0.04 -0.02 0.00 0.00 0.00 0.00 51.96 52.68 2emy s ALA 21 Cb -0.10 -0.04 -0.02 0.00 0.00 0.00 0.00 23.12 22.96 2emy s ALA 21 CO 0.55 -0.13 0.02 -0.06 0.00 0.00 0.00 175.76 176.15 2emy s PHE 22 N -0.68 0.31 -0.04 0.00 0.40 0.21 -4.97 117.98 113.21 2emy s PHE 22 Ca -0.08 -0.67 -0.26 0.00 -0.60 0.00 0.00 56.93 55.33 2emy s PHE 22 Cb -0.05 -0.23 -0.21 0.00 0.51 0.00 0.00 43.02 43.05 2emy s PHE 22 CO 0.01 -0.31 1.20 1.03 0.70 0.00 0.00 175.22 177.85 2emy h SER 23 N 3.86 -0.01 -1.34 1.36 0.87 -1.86 -3.19 113.55 113.25 2emy h SER 23 Ca -0.33 -0.54 -0.47 0.00 -1.23 0.00 0.00 61.79 59.22 2emy h SER 23 Cb 1.18 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.13 2emy h SER 23 CO 0.51 0.54 -0.30 -0.13 -0.53 0.00 0.00 176.83 176.92 2emy s ARG 24 N -4.01 2.59 -0.02 2.24 0.52 -1.26 -4.59 118.95 114.42 2emy s ARG 24 Ca -0.16 -1.49 -0.25 0.00 -0.52 0.00 0.00 55.73 53.31 2emy s ARG 24 Cb 0.01 -2.51 -0.19 0.00 0.52 0.00 0.00 34.95 32.77 2emy s ARG 24 CO 0.67 -0.32 1.22 -0.22 0.02 0.00 0.00 175.30 176.66 2emy h LYS 25 N 0.79 -0.07 -0.99 3.54 1.63 -1.96 -3.21 116.57 116.30 2emy h LYS 25 Ca -0.39 0.00 0.09 0.00 -0.85 0.00 0.00 60.65 59.50 2emy h LYS 25 Cb 1.28 0.02 -0.07 0.00 -0.60 0.00 0.00 32.23 32.85 2emy h LYS 25 CO 0.51 0.40 0.63 0.10 -3.45 0.00 0.00 179.45 177.64 2emy h TYR 26 N -0.56 1.15 -0.47 1.91 -0.00 -1.99 0.10 116.97 117.11 2emy h TYR 26 Ca -0.01 0.03 0.14 0.00 -0.00 0.00 0.00 58.73 58.89 2emy h TYR 26 Cb 0.50 -0.37 -0.02 0.00 -0.00 0.00 0.00 36.73 36.83 2emy h TYR 26 CO 0.09 0.54 0.48 1.96 -0.00 0.00 0.00 178.16 181.22 2emy h GLN 27 N 1.08 0.00 0.04 0.10 4.20 -1.97 -1.11 115.11 117.45 2emy h GLN 27 Ca 0.45 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.94 2emy h GLN 27 Cb 0.30 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.05 2emy h GLN 27 CO -0.21 0.00 -1.19 1.25 -0.67 0.00 0.00 178.83 178.01 2emy h LEU 28 N 0.00 0.13 -0.46 1.46 5.85 -1.05 -3.35 115.31 117.88 2emy h LEU 28 Ca 0.22 -0.70 0.09 0.00 0.84 0.00 0.00 57.88 58.34 2emy h LEU 28 Cb 1.17 -0.04 -0.08 0.00 0.37 0.00 0.00 40.66 42.08 2emy h LEU 28 CO -0.00 1.49 -0.06 0.40 -0.34 0.00 0.00 178.44 179.93 2emy h ILE 29 N -0.74 0.59 -0.85 4.05 5.03 -0.80 0.99 117.51 125.78 2emy h ILE 29 Ca -0.30 -0.02 0.20 0.00 -0.12 0.00 0.00 64.86 64.62 2emy h ILE 29 Cb 1.43 0.53 -0.06 0.00 -3.03 0.00 0.00 36.82 35.70 2emy h ILE 29 CO -0.09 0.01 0.57 -1.28 -0.68 0.00 0.00 178.15 176.68 2emy h SER 30 N 0.05 0.32 -0.00 1.72 0.87 -1.43 -1.48 113.55 113.60 2emy h SER 30 Ca 0.23 0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 60.82 2emy h SER 30 Cb 0.35 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.28 2emy h SER 30 CO -0.43 0.13 -0.01 -0.74 -0.53 0.00 0.00 176.83 175.25 2emy h HIS 31 N 0.32 0.01 -1.21 2.24 -0.00 -0.98 -3.20 115.15 112.33 2emy h HIS 31 Ca 0.43 -0.00 0.34 0.00 -0.00 0.00 0.00 60.37 61.14 2emy h HIS 31 Cb 1.18 -0.00 -0.07 0.00 -0.00 0.00 0.00 27.41 28.52 2emy h HIS 31 CO -0.00 0.69 0.83 1.96 -0.00 0.00 0.00 177.93 181.41 2emy h GLN 32 N -0.67 0.13 -1.03 5.26 4.20 -0.21 0.12 115.11 122.92 2emy h GLN 32 Ca -0.00 -0.01 0.31 0.00 0.06 0.00 0.00 58.65 59.01 2emy h GLN 32 Cb 0.69 -0.03 -0.14 0.00 0.30 0.00 0.00 27.48 28.30 2emy h GLN 32 CO 0.00 0.08 0.60 0.00 -0.67 0.00 0.00 178.83 178.85 2emy h ARG 33 N 0.13 0.35 -0.81 1.46 2.47 -1.46 0.67 114.38 117.20 2emy h ARG 33 Ca 0.62 -0.02 0.01 0.00 -1.26 0.00 0.00 59.98 59.34 2emy h ARG 33 Cb 2.16 -0.08 -0.04 0.00 -1.65 0.00 0.00 29.97 30.36 2emy h ARG 33 CO -0.14 0.23 0.53 1.79 0.56 0.00 0.00 179.97 182.95 2emy h THR 34 N 0.36 1.19 -0.22 2.04 1.35 -0.94 -2.60 112.91 114.08 2emy h THR 34 Ca 0.71 -0.37 -0.09 0.00 -0.55 0.00 0.00 66.41 66.11 2emy h THR 34 Cb 1.64 0.03 -0.00 0.00 -1.73 0.00 0.00 68.15 68.08 2emy h THR 34 CO -0.54 0.19 -0.22 0.45 -0.25 0.00 0.00 175.52 175.15 2emy h HIS 35 N 1.07 0.65 -0.70 4.73 3.86 0.19 -3.45 115.15 121.49 2emy h HIS 35 Ca 0.30 -0.20 -0.54 0.00 -1.16 0.00 0.00 60.37 58.78 2emy h HIS 35 Cb -0.08 -0.14 0.04 0.00 1.06 0.00 0.00 27.41 28.29 2emy h HIS 35 CO -0.00 0.88 -0.04 0.00 0.86 0.00 0.00 177.93 179.63 2emy n ALA 36 N -2.46 -2.64 -0.25 2.45 0.00 -0.81 -4.84 120.51 111.96 2emy n ALA 36 Ca -0.05 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.79 2emy n ALA 36 Cb 0.42 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.66 2emy n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2emy n GLY 37 N 1.13 -0.45 3.20 0.00 0.00 -1.26 -5.04 105.19 102.76 2emy n GLY 37 Ca 0.14 0.08 -0.13 0.00 0.00 0.00 0.00 46.02 46.11 2emy n GLY 37 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2emy s GLU 38 N -0.75 0.56 0.26 1.61 2.02 -1.26 -5.18 118.70 115.96 2emy s GLU 38 Ca 0.00 -0.10 0.09 0.00 0.02 0.00 0.00 54.97 54.98 2emy s GLU 38 Cb 0.00 0.25 -0.05 0.00 0.10 0.00 0.00 34.13 34.43 2emy s GLU 38 CO 0.00 -0.14 -0.14 0.15 0.02 0.00 0.00 175.26 175.15 2emy s LYS 39 N -1.01 1.56 0.00 1.61 1.02 -1.26 -5.01 119.74 116.65 2emy s LYS 39 Ca -0.11 -1.74 0.12 0.00 0.02 0.00 0.00 55.97 54.27 2emy s LYS 39 Cb -0.05 -1.44 0.74 0.00 -0.52 0.00 0.00 37.83 36.56 2emy s LYS 39 CO 0.03 0.20 1.17 -0.35 -0.92 0.00 0.00 175.35 175.48 2emy n PRO 40 N -0.56 0.49 -3.39 -1.68 -0.04 -1.26 -4.45 135.00 124.11 2emy n PRO 40 Ca -0.06 0.00 -0.45 0.00 -0.04 0.00 0.00 63.50 62.95 2emy n PRO 40 Cb 0.61 -1.40 -0.05 0.00 -0.04 0.00 0.00 33.50 32.62 2emy n PRO 40 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2emy s SER 41 N -1.90 6.15 0.25 3.54 0.15 -1.26 -5.05 113.70 115.58 2emy s SER 41 Ca 0.19 -2.04 0.02 0.00 0.70 0.00 0.00 55.95 54.81 2emy s SER 41 Cb 0.09 -2.15 0.02 0.00 -1.71 0.00 0.00 66.02 62.27 2emy s SER 41 CO 0.14 -0.74 0.19 0.61 1.20 0.00 0.00 173.24 174.63 2emy n GLY 42 N 4.84 2.90 3.57 9.45 0.00 -1.26 -5.02 105.19 119.67 2emy n GLY 42 Ca -0.06 -2.23 -0.27 0.00 0.00 0.00 0.00 46.02 43.46 2emy n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2emy s PRO 43 N -3.01 2.52 -0.06 1.61 0.04 -1.26 -4.89 135.00 129.95 2emy s PRO 43 Ca 0.14 -0.64 -0.02 0.00 0.04 0.00 0.00 61.00 60.52 2emy s PRO 43 Cb -0.01 -5.13 0.04 0.00 0.04 0.00 0.00 34.50 29.43 2emy s PRO 43 CO 0.09 -3.63 0.13 -1.12 0.04 0.00 0.00 177.00 172.50 2emy s SER 44 N 7.44 0.01 -0.18 6.66 0.01 -1.26 -5.11 113.70 121.27 2emy s SER 44 Ca 0.70 0.26 -0.41 0.00 1.31 0.00 0.00 55.95 57.81 2emy s SER 44 Cb -0.04 0.15 -0.18 0.00 0.21 0.00 0.00 66.02 66.16 2emy s SER 44 CO 0.05 -0.16 1.49 -0.24 0.41 0.00 0.00 173.24 174.79 2emy n SER 45 N 4.32 1.53 0.00 2.44 2.88 -1.26 -5.22 113.62 118.31 2emy n SER 45 Ca -0.25 1.13 0.00 0.00 -1.33 0.00 0.00 58.87 58.42 2emy n SER 45 Cb 0.51 -1.06 0.00 0.00 -0.75 0.00 0.00 64.21 62.91 2emy n SER 45 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42