#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 6.07 1.15 1.61 0.15 -1.26 -5.08 113.70 116.35 2emy s SER 2 Ca 0.00 -0.79 -0.14 0.00 0.70 0.00 0.00 55.95 55.72 2emy s SER 2 Cb 0.00 -2.14 0.27 0.00 -1.71 0.00 0.00 66.02 62.44 2emy s SER 2 CO 0.00 -0.39 1.04 -0.94 1.20 0.00 0.00 173.24 174.15 2emy s SER 3 N 1.68 1.15 0.00 5.45 1.04 -1.26 -4.61 113.70 117.15 2emy s SER 3 Ca 0.05 1.29 0.00 0.00 0.48 0.00 0.00 55.95 57.77 2emy s SER 3 Cb -0.19 -2.00 0.00 0.00 0.10 0.00 0.00 66.02 63.94 2emy s SER 3 CO 0.10 -4.06 0.00 0.61 0.98 0.00 0.00 173.24 170.87 2emy n GLY 4 N 0.24 3.19 3.62 7.32 0.00 -1.26 -5.09 105.19 113.21 2emy n GLY 4 Ca 0.04 -0.63 -0.56 0.00 0.00 0.00 0.00 46.02 44.87 2emy n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2emy n SER 5 N 0.00 2.21 -3.69 1.61 3.41 -1.26 -4.89 113.62 111.01 2emy n SER 5 Ca 0.00 0.90 -0.05 0.00 -0.26 0.00 0.00 58.87 59.46 2emy n SER 5 Cb 0.00 -1.15 -0.02 0.00 -0.26 0.00 0.00 64.21 62.79 2emy n SER 5 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2emy s SER 6 N 4.58 -0.24 0.00 4.04 1.04 -1.26 -5.10 113.70 116.76 2emy s SER 6 Ca 1.03 -0.30 0.00 0.00 0.48 0.00 0.00 55.95 57.16 2emy s SER 6 Cb -1.06 0.47 0.00 0.00 0.10 0.00 0.00 66.02 65.53 2emy s SER 6 CO 0.62 -0.85 0.00 0.61 0.98 0.00 0.00 173.24 174.60 2emy n GLY 7 N -0.41 -0.01 3.85 7.32 0.00 -1.26 -5.15 105.19 109.52 2emy n GLY 7 Ca -0.07 -0.36 -0.36 0.00 0.00 0.00 0.00 46.02 45.22 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 0.00 4.98 0.00 2.61 -1.32 -1.26 -4.97 115.64 115.68 2emy s THR 8 Ca 0.00 0.75 0.00 0.00 -1.21 0.00 0.00 61.69 61.23 2emy s THR 8 Cb 0.00 -3.71 0.00 0.00 -1.51 0.00 0.00 72.50 67.28 2emy s THR 8 CO 0.00 0.40 0.00 0.61 -2.21 0.00 0.00 174.62 173.42 2emy n GLY 9 N 1.25 2.62 3.58 6.08 0.00 -1.26 -4.89 105.19 112.57 2emy n GLY 9 Ca -0.09 -1.57 -0.43 0.00 0.00 0.00 0.00 46.02 43.92 2emy n GLY 9 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2emy s GLU 10 N -4.90 3.98 -0.60 1.61 -6.30 -1.26 -4.84 118.70 106.39 2emy s GLU 10 Ca 0.00 -2.00 0.04 0.00 -2.50 0.00 0.00 54.97 50.51 2emy s GLU 10 Cb 0.00 -5.52 0.16 0.00 0.00 0.00 0.00 34.13 28.77 2emy s GLU 10 CO 0.00 -2.24 0.41 -0.80 0.02 0.00 0.00 175.26 172.65 2emy s ASN 11 N 4.20 3.93 0.00 -1.70 0.01 -1.26 -4.44 114.94 115.67 2emy s ASN 11 Ca 0.53 -3.47 0.15 0.00 -0.71 0.00 0.00 52.86 49.36 2emy s ASN 11 Cb 0.04 -1.31 0.78 0.00 0.41 0.00 0.00 41.25 41.17 2emy s ASN 11 CO 0.07 -0.14 1.40 -0.81 -1.51 0.00 0.00 177.10 176.12 2emy n PRO 12 N 2.44 0.26 -3.94 -0.60 -0.04 -1.22 -4.42 135.00 127.48 2emy n PRO 12 Ca 0.19 0.12 -0.34 0.00 -0.04 0.00 0.00 63.50 63.44 2emy n PRO 12 Cb 0.37 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.20 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 -2.48 3.46 0.02 0.54 1.51 -1.14 -5.02 117.35 114.25 2emy s TYR 13 Ca 0.16 -2.36 0.07 0.00 -1.01 0.00 0.00 57.07 53.92 2emy s TYR 13 Cb 0.10 -2.53 -0.03 0.00 -0.11 0.00 0.00 41.96 39.39 2emy s TYR 13 CO 0.22 -0.89 -0.21 -1.21 -1.11 0.00 0.00 175.55 172.35 2emy s GLU 14 N 1.11 2.07 -0.04 -0.62 2.02 -1.26 0.77 118.70 122.76 2emy s GLU 14 Ca 0.01 -0.96 -0.30 0.00 0.02 0.00 0.00 54.97 53.74 2emy s GLU 14 Cb -0.20 -2.15 -0.04 0.00 0.10 0.00 0.00 34.13 31.84 2emy s GLU 14 CO -0.04 0.55 1.28 0.00 0.02 0.00 0.00 175.26 177.06 2emy n HIS 16 N 5.30 0.50 -0.03 0.00 1.44 -1.26 -2.28 115.22 118.88 2emy n HIS 16 Ca 0.12 -0.18 -0.08 0.00 -2.01 0.00 0.00 57.72 55.57 2emy n HIS 16 Cb 0.45 -0.19 -0.03 0.00 0.12 0.00 0.00 29.99 30.35 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 0.15 0.20 -0.08 -1.40 1.02 -1.26 -4.92 120.64 114.34 2emy n GLU 17 Ca 0.07 0.08 -0.16 0.00 -0.02 0.00 0.00 57.16 57.14 2emy n GLU 17 Cb 0.46 -0.83 -0.06 0.00 -0.02 0.00 0.00 31.44 30.99 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 2.21 1.35 3.69 0.00 0.00 -0.97 -5.06 105.19 106.41 2emy n GLY 19 Ca -0.31 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.14 0.00 1.61 2.20 -1.26 -4.71 119.74 117.45 2emy s LYS 20 Ca 0.00 0.12 -0.01 0.00 -0.36 0.00 0.00 55.97 55.72 2emy s LYS 20 Cb 0.00 -1.71 -0.01 0.00 -1.51 0.00 0.00 37.83 34.61 2emy s LYS 20 CO 0.00 -3.03 0.02 0.00 -0.36 0.00 0.00 175.35 171.98 2emy s ALA 21 N -3.14 -0.02 0.04 3.13 0.00 -1.26 -1.18 121.76 119.33 2emy s ALA 21 Ca 0.68 -0.23 -0.02 0.00 0.00 0.00 0.00 51.96 52.39 2emy s ALA 21 Cb -0.13 0.05 -0.03 0.00 0.00 0.00 0.00 23.12 23.02 2emy s ALA 21 CO 0.56 -0.10 0.01 -0.06 0.00 0.00 0.00 175.76 176.17 2emy s PHE 22 N -0.80 0.36 -0.08 0.00 0.40 0.23 -4.97 117.98 113.12 2emy s PHE 22 Ca -0.09 -0.79 -0.27 0.00 -0.60 0.00 0.00 56.93 55.18 2emy s PHE 22 Cb -0.05 -0.27 -0.23 0.00 0.51 0.00 0.00 43.02 42.98 2emy s PHE 22 CO -0.00 -0.35 1.02 1.03 0.70 0.00 0.00 175.22 177.62 2emy h SER 23 N 3.57 -0.00 -1.18 1.36 0.87 -1.84 -3.00 113.55 113.32 2emy h SER 23 Ca -0.33 -0.72 -0.48 0.00 -1.23 0.00 0.00 61.79 59.02 2emy h SER 23 Cb 1.17 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.13 2emy h SER 23 CO 0.56 0.72 -0.26 -0.13 -0.53 0.00 0.00 176.83 177.19 2emy s ARG 24 N -3.28 2.52 -0.03 2.24 0.52 -1.26 -4.47 118.95 115.20 2emy s ARG 24 Ca -0.17 -1.55 -0.25 0.00 -0.52 0.00 0.00 55.73 53.24 2emy s ARG 24 Cb -0.01 -2.51 -0.19 0.00 0.52 0.00 0.00 34.95 32.76 2emy s ARG 24 CO 0.67 -0.44 1.15 -0.22 0.02 0.00 0.00 175.30 176.48 2emy h LYS 25 N 0.67 -0.10 -1.00 3.54 1.63 -1.96 -3.23 116.57 116.12 2emy h LYS 25 Ca -0.37 0.01 0.09 0.00 -0.85 0.00 0.00 60.65 59.53 2emy h LYS 25 Cb 1.28 0.02 -0.08 0.00 -0.60 0.00 0.00 32.23 32.86 2emy h LYS 25 CO 0.50 0.38 0.63 0.10 -3.45 0.00 0.00 179.45 177.61 2emy h TYR 26 N -0.63 1.16 -0.71 1.91 -0.00 -1.99 -0.03 116.97 116.67 2emy h TYR 26 Ca -0.01 0.03 0.21 0.00 -0.00 0.00 0.00 58.73 58.96 2emy h TYR 26 Cb 0.52 -0.37 -0.03 0.00 -0.00 0.00 0.00 36.73 36.85 2emy h TYR 26 CO 0.09 0.53 0.55 1.96 -0.00 0.00 0.00 178.16 181.29 2emy h GLN 27 N 1.07 0.00 0.04 0.10 4.20 -1.97 -1.21 115.11 117.34 2emy h GLN 27 Ca 0.47 0.00 -0.18 0.00 0.06 0.00 0.00 58.65 59.00 2emy h GLN 27 Cb 0.34 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 2emy h GLN 27 CO -0.22 0.00 -0.92 1.25 -0.67 0.00 0.00 178.83 178.26 2emy h LEU 28 N 0.00 0.12 -0.51 1.46 5.85 -1.08 -3.35 115.31 117.81 2emy h LEU 28 Ca 0.34 -0.77 0.10 0.00 0.84 0.00 0.00 57.88 58.39 2emy h LEU 28 Cb 1.44 -0.04 -0.10 0.00 0.37 0.00 0.00 40.66 42.34 2emy h LEU 28 CO -0.00 1.38 -0.11 0.40 -0.34 0.00 0.00 178.44 179.77 2emy h ILE 29 N -0.78 0.50 -0.95 4.05 5.03 -0.77 0.13 117.51 124.71 2emy h ILE 29 Ca -0.23 -0.00 0.21 0.00 -0.12 0.00 0.00 64.86 64.72 2emy h ILE 29 Cb 1.36 0.49 -0.08 0.00 -3.03 0.00 0.00 36.82 35.55 2emy h ILE 29 CO -0.06 0.00 0.62 -1.28 -0.68 0.00 0.00 178.15 176.75 2emy h SER 30 N 0.01 0.52 0.07 1.72 0.87 -1.43 -1.48 113.55 113.83 2emy h SER 30 Ca 0.25 0.06 -0.00 0.00 -1.23 0.00 0.00 61.79 60.87 2emy h SER 30 Cb 0.38 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.31 2emy h SER 30 CO -0.52 0.19 -0.03 -0.74 -0.53 0.00 0.00 176.83 175.20 2emy h HIS 31 N 0.51 -0.08 -1.25 2.24 -0.00 -0.91 -3.07 115.15 112.59 2emy h HIS 31 Ca 0.52 -0.00 0.36 0.00 -0.00 0.00 0.00 60.37 61.25 2emy h HIS 31 Cb 1.14 0.03 -0.05 0.00 -0.00 0.00 0.00 27.41 28.53 2emy h HIS 31 CO -0.00 0.39 0.95 1.96 -0.00 0.00 0.00 177.93 181.23 2emy h GLN 32 N -0.60 0.00 -1.05 5.26 4.20 -0.31 0.18 115.11 122.79 2emy h GLN 32 Ca -0.01 0.00 0.28 0.00 0.06 0.00 0.00 58.65 58.98 2emy h GLN 32 Cb 0.51 0.00 -0.11 0.00 0.30 0.00 0.00 27.48 28.18 2emy h GLN 32 CO 0.02 0.00 0.65 0.00 -0.67 0.00 0.00 178.83 178.82 2emy h ARG 33 N 0.00 0.41 -0.80 1.46 2.47 -1.38 0.43 114.38 116.98 2emy h ARG 33 Ca 0.59 -0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 59.28 2emy h ARG 33 Cb 2.49 -0.09 -0.04 0.00 -1.65 0.00 0.00 29.97 30.68 2emy h ARG 33 CO -0.01 0.27 0.44 1.79 0.56 0.00 0.00 179.97 183.03 2emy h THR 34 N 0.43 1.23 -0.19 2.04 1.35 -0.83 -2.70 112.91 114.24 2emy h THR 34 Ca 0.65 -0.58 -0.18 0.00 -0.55 0.00 0.00 66.41 65.76 2emy h THR 34 Cb 1.52 0.15 0.01 0.00 -1.73 0.00 0.00 68.15 68.09 2emy h THR 34 CO -0.41 0.26 -0.57 0.45 -0.25 0.00 0.00 175.52 175.00 2emy h HIS 35 N 1.12 0.94 -0.53 4.73 3.86 -0.34 -3.26 115.15 121.67 2emy h HIS 35 Ca 0.28 -0.38 0.11 0.00 -1.16 0.00 0.00 60.37 59.22 2emy h HIS 35 Cb 0.02 -0.16 -0.09 0.00 1.06 0.00 0.00 27.41 28.24 2emy h HIS 35 CO 0.01 1.18 -0.04 0.00 0.86 0.00 0.00 177.93 179.93 2emy h ALA 36 N 0.58 0.45 -3.00 2.45 0.00 -0.92 -3.43 119.26 115.38 2emy h ALA 36 Ca -0.02 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2emy h ALA 36 Cb 1.19 0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.30 2emy h ALA 36 CO 0.12 -0.41 0.00 0.41 0.00 0.00 0.00 179.25 179.37 2emy n GLY 37 N -1.34 2.35 3.25 0.00 0.00 -1.06 -4.89 105.19 103.50 2emy n GLY 37 Ca 0.06 -1.73 -0.17 0.00 0.00 0.00 0.00 46.02 44.17 2emy n GLY 37 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2emy n GLU 38 N 0.00 -6.33 -4.95 1.61 1.02 -1.26 -4.97 120.64 105.76 2emy n GLU 38 Ca 0.00 0.76 -0.27 0.00 -0.02 0.00 0.00 57.16 57.64 2emy n GLU 38 Cb 0.00 -5.56 -0.16 0.00 -0.02 0.00 0.00 31.44 25.71 2emy n GLU 38 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2emy s LYS 39 N -5.49 1.74 0.00 3.49 2.20 -1.26 -5.01 119.74 115.42 2emy s LYS 39 Ca 0.14 -0.69 0.07 0.00 -0.36 0.00 0.00 55.97 55.13 2emy s LYS 39 Cb -0.06 -1.60 0.44 0.00 -1.51 0.00 0.00 37.83 35.10 2emy s LYS 39 CO 0.66 0.37 0.90 -0.35 -0.36 0.00 0.00 175.35 176.56 2emy n PRO 40 N 2.80 0.49 -0.18 4.03 -0.04 -1.26 -4.23 135.00 136.60 2emy n PRO 40 Ca -0.16 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.25 2emy n PRO 40 Cb 0.53 -1.24 -0.04 0.00 -0.04 0.00 0.00 33.50 32.71 2emy n PRO 40 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2emy n SER 41 N -0.74 -0.46 -3.97 3.54 7.64 -1.26 -3.19 113.62 115.18 2emy n SER 41 Ca 0.06 0.95 -0.30 0.00 1.01 0.00 0.00 58.87 60.58 2emy n SER 41 Cb 0.03 -0.19 -0.14 0.00 -1.01 0.00 0.00 64.21 62.89 2emy n SER 41 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2emy s GLY 42 N -2.18 2.24 -0.60 0.23 0.00 -1.26 -5.06 107.32 100.69 2emy s GLY 42 Ca -0.05 -2.99 -0.27 0.00 0.00 0.00 0.00 44.72 41.42 2emy s GLY 42 CO 0.27 0.99 1.85 2.56 0.00 0.00 0.00 173.10 178.77 2emy s PRO 43 N 0.17 2.67 -0.00 2.90 0.04 -1.19 -4.76 135.00 134.82 2emy s PRO 43 Ca 0.15 0.65 -0.05 0.00 0.04 0.00 0.00 61.00 61.79 2emy s PRO 43 Cb -0.23 -4.38 -0.02 0.00 0.04 0.00 0.00 34.50 29.92 2emy s PRO 43 CO -0.03 -2.68 -0.09 -1.13 0.04 0.00 0.00 177.00 173.10 2emy n SER 44 N 12.60 1.03 -2.49 6.66 3.41 -1.26 -4.79 113.62 128.78 2emy n SER 44 Ca 0.20 0.15 -0.34 0.00 -0.26 0.00 0.00 58.87 58.63 2emy n SER 44 Cb 0.52 -0.41 0.05 0.00 -0.26 0.00 0.00 64.21 64.11 2emy n SER 44 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2emy n SER 45 N -3.49 6.81 0.00 4.04 3.41 -1.26 -5.32 113.62 117.81 2emy n SER 45 Ca -0.04 -3.79 0.00 0.00 -0.26 0.00 0.00 58.87 54.78 2emy n SER 45 Cb 0.14 -0.84 0.00 0.00 -0.26 0.00 0.00 64.21 63.25 2emy n SER 45 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49