#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 3.45 -0.20 1.61 0.15 -1.26 -5.09 113.70 112.35 2emy s SER 2 Ca 0.00 -0.76 -0.09 0.00 0.70 0.00 0.00 55.95 55.80 2emy s SER 2 Cb 0.00 -1.51 0.08 0.00 -1.71 0.00 0.00 66.02 62.88 2emy s SER 2 CO 0.00 -0.04 0.46 -0.55 1.20 0.00 0.00 173.24 174.32 2emy s SER 3 N 1.27 -0.51 0.00 5.45 0.15 -1.26 -5.01 113.70 113.79 2emy s SER 3 Ca 0.03 1.06 0.00 0.00 0.70 0.00 0.00 55.95 57.73 2emy s SER 3 Cb -0.14 1.18 0.00 0.00 -1.71 0.00 0.00 66.02 65.35 2emy s SER 3 CO -0.11 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 174.73 2emy n GLY 4 N 4.79 0.04 3.17 9.45 0.00 -1.26 -5.09 105.19 116.28 2emy n GLY 4 Ca -0.16 -0.05 -0.44 0.00 0.00 0.00 0.00 46.02 45.37 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 -1.19 0.41 -2.41 1.61 2.88 -1.26 -4.76 113.62 108.89 2emy n SER 5 Ca 0.00 0.32 -0.34 0.00 -1.33 0.00 0.00 58.87 57.51 2emy n SER 5 Cb 0.00 -0.85 0.06 0.00 -0.75 0.00 0.00 64.21 62.68 2emy n SER 5 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2emy n SER 6 N 8.82 7.21 -4.72 -3.46 7.64 -1.26 -4.99 113.62 122.87 2emy n SER 6 Ca 0.58 -3.79 -0.39 0.00 1.01 0.00 0.00 58.87 56.27 2emy n SER 6 Cb 0.01 -0.89 -0.05 0.00 -1.01 0.00 0.00 64.21 62.26 2emy n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2emy s GLY 7 N -1.98 2.55 -0.57 0.23 0.00 -1.26 -5.03 107.32 101.26 2emy s GLY 7 Ca 0.60 0.04 0.00 0.00 0.00 0.00 0.00 44.72 45.36 2emy s GLY 7 CO -0.09 1.09 0.35 -0.51 0.00 0.00 0.00 173.10 173.94 2emy s THR 8 N 0.80 3.20 0.89 0.90 -4.23 -1.26 -5.09 115.64 110.84 2emy s THR 8 Ca 0.34 -3.09 -0.15 0.00 -1.18 0.00 0.00 61.69 57.62 2emy s THR 8 Cb -0.17 -3.14 -0.04 0.00 1.34 0.00 0.00 72.50 70.50 2emy s THR 8 CO 0.16 -0.83 0.11 0.61 -0.54 0.00 0.00 174.62 174.12 2emy n GLY 9 N 3.36 -2.62 2.52 3.99 0.00 -1.26 -4.75 105.19 106.43 2emy n GLY 9 Ca 0.06 -0.65 -0.34 0.00 0.00 0.00 0.00 46.02 45.09 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 -0.29 2.90 -3.70 1.61 4.07 -1.26 -4.70 120.64 119.27 2emy n GLU 10 Ca 0.05 -1.98 -0.28 0.00 -0.06 0.00 0.00 57.16 54.89 2emy n GLU 10 Cb 0.53 -2.75 -0.12 0.00 -0.06 0.00 0.00 31.44 29.04 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 2.92 3.46 0.00 4.31 -0.87 -1.26 -4.53 114.94 118.97 2emy s ASN 11 Ca 0.56 -3.20 0.15 0.00 -1.57 0.00 0.00 52.86 48.80 2emy s ASN 11 Cb 0.15 -1.10 0.78 0.00 -0.02 0.00 0.00 41.25 41.06 2emy s ASN 11 CO -0.04 -0.17 1.40 -0.81 -2.57 0.00 0.00 177.10 174.90 2emy n PRO 12 N 2.78 0.26 -3.97 -0.60 -0.04 -1.24 -4.39 135.00 127.80 2emy n PRO 12 Ca 0.18 0.12 -0.31 0.00 -0.04 0.00 0.00 63.50 63.46 2emy n PRO 12 Cb 0.38 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.19 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 -2.47 2.97 0.02 0.54 2.02 -1.17 -5.04 117.35 114.23 2emy s TYR 13 Ca 0.16 -2.32 0.07 0.00 -0.37 0.00 0.00 57.07 54.60 2emy s TYR 13 Cb 0.10 -2.15 -0.03 0.00 -0.40 0.00 0.00 41.96 39.48 2emy s TYR 13 CO 0.22 -0.87 -0.19 -1.21 -1.57 0.00 0.00 175.55 171.92 2emy s GLU 14 N 1.19 2.12 -0.04 -0.62 2.02 -1.26 0.58 118.70 122.69 2emy s GLU 14 Ca 0.02 -0.94 -0.30 0.00 0.02 0.00 0.00 54.97 53.77 2emy s GLU 14 Cb -0.19 -2.19 -0.04 0.00 0.10 0.00 0.00 34.13 31.81 2emy s GLU 14 CO -0.09 0.55 1.36 0.00 0.02 0.00 0.00 175.26 177.11 2emy n HIS 16 N 5.70 0.71 -0.01 0.00 1.44 -1.26 -2.39 115.22 119.42 2emy n HIS 16 Ca 0.13 -0.52 -0.02 0.00 -2.01 0.00 0.00 57.72 55.30 2emy n HIS 16 Cb 0.44 -0.32 -0.01 0.00 0.12 0.00 0.00 29.99 30.22 2emy n HIS 16 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 2emy n GLU 17 N 0.11 0.04 -0.06 -1.40 1.02 -1.26 -4.94 120.64 114.16 2emy n GLU 17 Ca 0.12 0.02 -0.11 0.00 -0.02 0.00 0.00 57.16 57.17 2emy n GLU 17 Cb 0.66 -0.57 -0.04 0.00 -0.02 0.00 0.00 31.44 31.47 2emy n GLU 17 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2emy n GLY 19 N 2.53 1.32 3.87 0.00 0.00 -1.00 -5.06 105.19 106.84 2emy n GLY 19 Ca -0.21 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.52 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 1.56 0.01 1.61 2.20 -1.25 -4.75 119.74 119.11 2emy s LYS 20 Ca 0.00 0.11 0.01 0.00 -0.36 0.00 0.00 55.97 55.73 2emy s LYS 20 Cb 0.00 -1.90 -0.01 0.00 -1.51 0.00 0.00 37.83 34.41 2emy s LYS 20 CO 0.00 -1.87 -0.04 0.00 -0.36 0.00 0.00 175.35 173.08 2emy s ALA 21 N -3.52 0.27 0.04 3.13 0.00 -1.26 -0.72 121.76 119.70 2emy s ALA 21 Ca 0.64 -0.28 0.01 0.00 0.00 0.00 0.00 51.96 52.33 2emy s ALA 21 Cb -0.11 -0.02 -0.03 0.00 0.00 0.00 0.00 23.12 22.96 2emy s ALA 21 CO 0.51 0.02 -0.05 -0.06 0.00 0.00 0.00 175.76 176.18 2emy s PHE 22 N -0.44 0.49 -0.02 0.00 0.40 0.19 -4.98 117.98 113.63 2emy s PHE 22 Ca -0.03 -0.66 -0.25 0.00 -0.60 0.00 0.00 56.93 55.39 2emy s PHE 22 Cb -0.04 -0.32 -0.20 0.00 0.51 0.00 0.00 43.02 42.98 2emy s PHE 22 CO -0.00 -0.19 1.23 0.77 0.70 0.00 0.00 175.22 177.73 2emy h SER 23 N 4.15 -0.05 -0.85 1.36 0.02 -1.85 -3.09 113.55 113.25 2emy h SER 23 Ca -0.34 -0.45 -0.51 0.00 -0.84 0.00 0.00 61.79 59.66 2emy h SER 23 Cb 1.19 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.75 2emy h SER 23 CO 0.48 0.43 -0.18 -0.13 -1.14 0.00 0.00 176.83 176.29 2emy s ARG 24 N -4.22 2.36 -0.08 3.45 0.52 -1.26 -4.49 118.95 115.23 2emy s ARG 24 Ca -0.15 -1.69 -0.27 0.00 -0.52 0.00 0.00 55.73 53.09 2emy s ARG 24 Cb 0.02 -2.50 -0.23 0.00 0.52 0.00 0.00 34.95 32.75 2emy s ARG 24 CO 0.64 -0.70 1.01 -0.22 0.02 0.00 0.00 175.30 176.06 2emy h LYS 25 N 0.43 -0.00 -0.96 3.54 1.63 -1.96 -3.30 116.57 115.95 2emy h LYS 25 Ca -0.33 0.00 0.07 0.00 -0.85 0.00 0.00 60.65 59.54 2emy h LYS 25 Cb 1.29 0.00 -0.07 0.00 -0.60 0.00 0.00 32.23 32.85 2emy h LYS 25 CO 0.46 0.74 0.61 0.10 -3.45 0.00 0.00 179.45 177.91 2emy h TYR 26 N -0.75 1.12 -0.62 1.91 -0.00 -1.99 -0.33 116.97 116.30 2emy h TYR 26 Ca -0.00 0.03 0.18 0.00 -0.00 0.00 0.00 58.73 58.94 2emy h TYR 26 Cb 0.74 -0.36 -0.02 0.00 -0.00 0.00 0.00 36.73 37.08 2emy h TYR 26 CO 0.19 0.55 0.54 1.96 -0.00 0.00 0.00 178.16 181.40 2emy h GLN 27 N 1.08 0.00 0.10 0.10 4.20 -1.97 -0.63 115.11 117.99 2emy h GLN 27 Ca 0.42 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.86 2emy h GLN 27 Cb 0.22 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 2emy h GLN 27 CO -0.19 0.00 -1.41 1.25 -0.67 0.00 0.00 178.83 177.81 2emy h LEU 28 N 0.00 0.33 -0.50 1.46 5.85 -1.17 -3.35 115.31 117.94 2emy h LEU 28 Ca 0.30 -0.83 0.09 0.00 0.84 0.00 0.00 57.88 58.27 2emy h LEU 28 Cb 1.38 -0.11 -0.07 0.00 0.37 0.00 0.00 40.66 42.23 2emy h LEU 28 CO -0.00 1.61 0.08 0.40 -0.34 0.00 0.00 178.44 180.19 2emy h ILE 29 N -0.37 0.70 -0.79 4.05 5.03 -0.67 0.05 117.51 125.51 2emy h ILE 29 Ca -0.31 -0.07 0.15 0.00 -0.12 0.00 0.00 64.86 64.51 2emy h ILE 29 Cb 1.71 0.47 -0.05 0.00 -3.03 0.00 0.00 36.82 35.92 2emy h ILE 29 CO 0.03 0.04 0.52 -1.28 -0.68 0.00 0.00 178.15 176.78 2emy h SER 30 N 0.21 0.44 -0.03 1.72 0.87 -1.44 -1.76 113.55 113.56 2emy h SER 30 Ca 0.25 0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 60.81 2emy h SER 30 Cb 0.34 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.24 2emy h SER 30 CO -0.34 0.22 -0.10 -0.74 -0.53 0.00 0.00 176.83 175.34 2emy h HIS 31 N 0.46 0.17 -1.10 2.24 -0.00 -1.16 -3.19 115.15 112.58 2emy h HIS 31 Ca 0.39 -0.07 0.30 0.00 -0.00 0.00 0.00 60.37 61.00 2emy h HIS 31 Cb 0.85 -0.03 -0.09 0.00 -0.00 0.00 0.00 27.41 28.14 2emy h HIS 31 CO -0.00 0.72 0.72 1.96 -0.00 0.00 0.00 177.93 181.33 2emy h GLN 32 N -0.43 0.28 -0.98 5.26 4.20 -0.38 0.85 115.11 123.91 2emy h GLN 32 Ca -0.00 -0.02 0.31 0.00 0.06 0.00 0.00 58.65 59.00 2emy h GLN 32 Cb 0.72 -0.06 -0.15 0.00 0.30 0.00 0.00 27.48 28.29 2emy h GLN 32 CO 0.02 0.19 0.51 0.00 -0.67 0.00 0.00 178.83 178.87 2emy h ARG 33 N 0.29 0.28 -0.91 1.46 2.47 -1.46 0.71 114.38 117.22 2emy h ARG 33 Ca 0.62 -0.02 0.06 0.00 -1.26 0.00 0.00 59.98 59.39 2emy h ARG 33 Cb 1.76 -0.06 -0.06 0.00 -1.65 0.00 0.00 29.97 29.96 2emy h ARG 33 CO -0.27 0.19 0.59 1.79 0.56 0.00 0.00 179.97 182.83 2emy h THR 34 N 0.29 1.07 -0.29 2.04 1.35 -1.01 -2.15 112.91 114.22 2emy h THR 34 Ca 0.71 -0.36 -0.15 0.00 -0.55 0.00 0.00 66.41 66.05 2emy h THR 34 Cb 1.59 -0.07 -0.00 0.00 -1.73 0.00 0.00 68.15 67.94 2emy h THR 34 CO -0.62 0.19 -0.42 0.45 -0.25 0.00 0.00 175.52 174.87 2emy h HIS 35 N 1.05 0.97 -1.11 4.73 3.86 0.27 -3.44 115.15 121.48 2emy h HIS 35 Ca 0.39 -0.32 -0.82 0.00 -1.16 0.00 0.00 60.37 58.45 2emy h HIS 35 Cb 0.19 -0.19 0.01 0.00 1.06 0.00 0.00 27.41 28.47 2emy h HIS 35 CO -0.00 1.12 0.82 0.00 0.86 0.00 0.00 177.93 180.73 2emy n ALA 36 N -2.54 -0.82 -2.01 2.45 0.00 -0.78 -4.80 120.51 112.02 2emy n ALA 36 Ca -0.04 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.83 2emy n ALA 36 Cb 0.55 -2.04 0.00 0.00 0.00 0.00 0.00 19.45 17.96 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 4.37 3.33 3.24 0.00 0.00 -1.26 -5.01 105.19 109.86 2emy n GLY 37 Ca 0.31 -0.17 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 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 3.02 3.36 0.44 1.61 2.02 -1.26 -5.06 118.70 122.83 2emy s GLU 38 Ca 0.00 -2.69 -0.25 0.00 0.02 0.00 0.00 54.97 52.05 2emy s GLU 38 Cb 0.00 -4.19 -0.09 0.00 0.10 0.00 0.00 34.13 29.95 2emy s GLU 38 CO 0.00 -1.25 1.30 1.63 0.02 0.00 0.00 175.26 176.96 2emy n LYS 39 N 3.45 1.95 -0.74 1.61 5.02 -1.26 -5.00 118.16 123.19 2emy n LYS 39 Ca 0.15 0.70 -0.21 0.00 -2.02 0.00 0.00 58.31 56.92 2emy n LYS 39 Cb 0.42 -2.44 0.18 0.00 -0.02 0.00 0.00 35.03 33.17 2emy n LYS 39 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2emy n PRO 40 N -0.11 -2.54 -1.31 1.97 -0.04 -1.26 -4.92 135.00 126.78 2emy n PRO 40 Ca 0.07 -1.25 -0.42 0.00 -0.04 0.00 0.00 63.50 61.86 2emy n PRO 40 Cb 0.40 -1.17 -0.00 0.00 -0.04 0.00 0.00 33.50 32.69 2emy n PRO 40 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2emy n SER 41 N -4.34 -2.65 -4.21 3.54 3.41 -1.26 -4.98 113.62 103.14 2emy n SER 41 Ca 0.11 0.84 -0.23 0.00 -0.26 0.00 0.00 58.87 59.32 2emy n SER 41 Cb 0.42 -0.90 -0.14 0.00 -0.26 0.00 0.00 64.21 63.33 2emy n SER 41 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2emy s GLY 42 N -1.00 1.01 0.47 5.00 0.00 -1.26 -5.13 107.32 106.41 2emy s GLY 42 Ca 0.60 -0.99 -0.22 0.00 0.00 0.00 0.00 44.72 44.11 2emy s GLY 42 CO 0.62 -0.94 1.16 2.56 0.00 0.00 0.00 173.10 176.50 2emy s PRO 43 N -1.23 3.70 -1.62 2.90 0.04 -1.26 -3.37 135.00 134.16 2emy s PRO 43 Ca 0.05 1.75 -0.16 0.00 0.04 0.00 0.00 61.00 62.68 2emy s PRO 43 Cb -0.09 -2.34 0.16 0.00 0.04 0.00 0.00 34.50 32.27 2emy s PRO 43 CO 0.02 -0.60 0.41 0.45 0.04 0.00 0.00 177.00 177.32 2emy n SER 44 N -0.61 -1.02 -4.63 6.66 2.88 -1.26 -4.74 113.62 110.90 2emy n SER 44 Ca 0.08 -1.13 -0.43 0.00 -1.33 0.00 0.00 58.87 56.06 2emy n SER 44 Cb 0.48 -1.44 -0.03 0.00 -0.75 0.00 0.00 64.21 62.48 2emy n SER 44 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2emy s SER 45 N -3.33 5.95 0.00 -3.46 1.04 -1.22 -5.33 113.70 107.35 2emy s SER 45 Ca 0.57 2.09 0.16 0.00 0.48 0.00 0.00 55.95 59.25 2emy s SER 45 Cb -0.33 -2.52 0.97 0.00 0.10 0.00 0.00 66.02 64.23 2emy s SER 45 CO 0.92 -1.54 1.37 0.61 0.98 0.00 0.00 173.24 175.59