#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ytd s SER 2 N 0.00 -0.56 -0.14 1.61 0.01 -1.26 -5.17 113.70 108.19 2ytd s SER 2 Ca 0.00 0.73 -0.09 0.00 1.31 0.00 0.00 55.95 57.90 2ytd s SER 2 Cb 0.00 0.69 0.05 0.00 0.21 0.00 0.00 66.02 66.96 2ytd s SER 2 CO 0.00 -0.47 0.34 -0.44 0.41 0.00 0.00 173.24 173.08 2ytd s SER 3 N -0.81 -0.39 0.00 2.44 0.01 -1.26 -5.04 113.70 108.65 2ytd s SER 3 Ca -0.09 0.72 0.00 0.00 1.31 0.00 0.00 55.95 57.89 2ytd s SER 3 Cb -0.02 0.65 0.00 0.00 0.21 0.00 0.00 66.02 66.86 2ytd s SER 3 CO 0.06 -0.16 0.00 0.61 0.41 0.00 0.00 173.24 174.17 2ytd n GLY 4 N 3.73 -0.62 0.94 3.44 0.00 -1.26 -5.08 105.19 106.34 2ytd n GLY 4 Ca -0.20 0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2ytd n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ytd n SER 5 N 0.00 0.58 -3.25 1.61 3.41 -1.26 -5.04 113.62 109.66 2ytd n SER 5 Ca 0.00 0.00 -0.37 0.00 -0.26 0.00 0.00 58.87 58.24 2ytd n SER 5 Cb 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 63.85 2ytd n SER 5 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2ytd n SER 6 N -2.30 0.38 -3.57 4.04 3.41 -1.26 -4.86 113.62 109.47 2ytd n SER 6 Ca 0.00 0.32 -0.11 0.00 -0.26 0.00 0.00 58.87 58.81 2ytd n SER 6 Cb 0.16 -0.68 -0.11 0.00 -0.26 0.00 0.00 64.21 63.33 2ytd n SER 6 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2ytd s GLY 7 N 5.59 -0.25 -0.36 5.00 0.00 -1.26 -5.12 107.32 110.91 2ytd s GLY 7 Ca 0.95 1.02 -0.14 0.00 0.00 0.00 0.00 44.72 46.55 2ytd s GLY 7 CO 0.43 2.29 0.28 -0.45 0.00 0.00 0.00 173.10 175.65 2ytd s SER 8 N 2.50 6.10 -0.03 1.64 0.15 -1.26 -4.81 113.70 117.98 2ytd s SER 8 Ca 0.04 -0.52 -0.03 0.00 0.70 0.00 0.00 55.95 56.14 2ytd s SER 8 Cb -0.13 -2.16 0.01 0.00 -1.71 0.00 0.00 66.02 62.03 2ytd s SER 8 CO -0.12 -0.32 0.06 0.61 1.20 0.00 0.00 173.24 174.68 2ytd n GLY 9 N 5.10 -5.43 3.05 9.45 0.00 -1.26 -5.06 105.19 111.04 2ytd n GLY 9 Ca -0.11 0.46 -0.12 0.00 0.00 0.00 0.00 46.02 46.25 2ytd n GLY 9 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ytd s GLU 10 N -0.75 0.21 0.21 1.61 2.12 -1.26 -5.15 118.70 115.68 2ytd s GLU 10 Ca -0.07 0.78 -0.20 0.00 0.36 0.00 0.00 54.97 55.83 2ytd s GLU 10 Cb 0.00 -0.04 -0.08 0.00 0.26 0.00 0.00 34.13 34.28 2ytd s GLU 10 CO 0.20 -0.32 0.72 0.15 -0.54 0.00 0.00 175.26 175.47 2ytd s LYS 11 N 2.47 4.28 0.28 4.30 1.02 -1.26 -4.96 119.74 125.87 2ytd s LYS 11 Ca 0.02 0.89 0.24 0.00 0.02 0.00 0.00 55.97 57.14 2ytd s LYS 11 Cb -0.12 -2.93 1.02 0.00 -0.52 0.00 0.00 37.83 35.28 2ytd s LYS 11 CO -0.10 0.42 1.74 -1.00 -0.92 0.00 0.00 175.35 175.48 2ytd h PRO 12 N 3.54 0.00 -4.39 -1.68 0.13 -1.91 -3.39 132.00 124.30 2ytd h PRO 12 Ca -0.48 0.00 -0.73 0.00 -0.87 0.00 0.00 66.00 63.92 2ytd h PRO 12 Cb 1.19 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 32.11 2ytd h PRO 12 CO 0.65 0.00 0.08 0.71 -0.23 0.00 0.00 178.00 179.21 2ytd s TYR 13 N -3.35 3.22 -0.34 1.56 2.02 -1.26 -4.98 117.35 114.21 2ytd s TYR 13 Ca 0.04 -1.28 0.00 0.00 -0.37 0.00 0.00 57.07 55.46 2ytd s TYR 13 Cb 0.09 -3.94 0.11 0.00 -0.40 0.00 0.00 41.96 37.82 2ytd s TYR 13 CO 0.40 -1.18 0.12 0.21 -1.57 0.00 0.00 175.55 173.54 2ytd s LYS 14 N 1.92 0.93 -0.32 -0.62 2.47 -1.26 -2.42 119.74 120.44 2ytd s LYS 14 Ca 0.12 -1.38 -0.30 0.00 -1.56 0.00 0.00 55.97 52.84 2ytd s LYS 14 Cb -0.22 -2.21 -0.08 0.00 -1.46 0.00 0.00 37.83 33.87 2ytd s LYS 14 CO 0.01 -1.02 2.26 0.00 0.16 0.00 0.00 175.35 176.76 2ytd h SER 16 N 14.79 0.38 -0.79 0.00 0.87 -1.94 1.88 113.55 128.74 2ytd h SER 16 Ca -0.33 -0.18 0.15 0.00 -1.23 0.00 0.00 61.79 60.20 2ytd h SER 16 Cb 1.27 -0.11 -0.15 0.00 -0.44 0.00 0.00 62.40 62.98 2ytd h SER 16 CO 1.02 0.79 -0.24 -0.33 -0.53 0.00 0.00 176.83 177.54 2ytd h GLU 17 N 0.28 -0.03 0.00 2.24 5.08 -1.98 -3.31 114.58 116.86 2ytd h GLU 17 Ca 0.02 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 2ytd h GLU 17 Cb 0.94 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.20 2ytd h GLU 17 CO 0.08 -0.02 -1.02 0.00 -1.00 0.00 0.00 179.01 177.05 2ytd n GLY 19 N 3.34 1.75 3.92 0.00 0.00 0.63 -5.08 105.19 109.75 2ytd n GLY 19 Ca -0.01 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 2ytd n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ytd s LYS 20 N -0.22 2.96 -0.02 1.61 -0.14 -0.91 -4.79 119.74 118.24 2ytd s LYS 20 Ca 0.00 0.00 0.01 0.00 -1.36 0.00 0.00 55.97 54.62 2ytd s LYS 20 Cb 0.00 -2.28 0.01 0.00 -1.68 0.00 0.00 37.83 33.88 2ytd s LYS 20 CO 0.00 -0.66 -0.02 0.00 -0.76 0.00 0.00 175.35 173.91 2ytd s ALA 21 N -2.97 0.31 0.05 5.17 0.00 -1.26 0.19 121.76 123.24 2ytd s ALA 21 Ca 0.53 0.02 0.04 0.00 0.00 0.00 0.00 51.96 52.55 2ytd s ALA 21 Cb -0.11 -0.20 -0.02 0.00 0.00 0.00 0.00 23.12 22.79 2ytd s ALA 21 CO 0.45 -0.00 -0.11 -0.06 0.00 0.00 0.00 175.76 176.04 2ytd s PHE 22 N 0.49 0.97 0.04 0.00 0.40 -1.01 -5.03 117.98 113.84 2ytd s PHE 22 Ca -0.05 -0.43 -0.26 0.00 -0.60 0.00 0.00 56.93 55.59 2ytd s PHE 22 Cb -0.08 -0.56 -0.17 0.00 0.51 0.00 0.00 43.02 42.72 2ytd s PHE 22 CO -0.01 -0.00 1.45 1.25 0.70 0.00 0.00 175.22 178.61 2ytd h HIS 23 N 4.58 -0.30 -1.76 0.36 2.76 -2.00 -3.39 115.15 115.39 2ytd h HIS 23 Ca -0.38 -0.01 -0.47 0.00 -2.20 0.00 0.00 60.37 57.31 2ytd h HIS 23 Cb 1.19 0.10 -0.02 0.00 1.55 0.00 0.00 27.41 30.23 2ytd h HIS 23 CO 0.61 -0.04 -0.39 1.03 -1.30 0.00 0.00 177.93 177.83 2ytd s ARG 24 N -5.29 2.83 -0.01 5.26 1.81 -1.26 -4.87 118.95 117.42 2ytd s ARG 24 Ca -0.15 -1.24 -0.24 0.00 -1.72 0.00 0.00 55.73 52.39 2ytd s ARG 24 Cb 0.03 -2.59 -0.19 0.00 -0.45 0.00 0.00 34.95 31.76 2ytd s ARG 24 CO 0.61 0.02 1.24 1.25 -0.68 0.00 0.00 175.30 177.74 2ytd h HIS 25 N 1.07 0.18 -0.99 -0.53 -0.00 -2.00 -3.17 115.15 109.71 2ytd h HIS 25 Ca -0.44 -0.06 0.26 0.00 -0.00 0.00 0.00 60.37 60.13 2ytd h HIS 25 Cb 1.26 -0.04 -0.19 0.00 -0.00 0.00 0.00 27.41 28.45 2ytd h HIS 25 CO 0.49 0.66 -0.02 1.79 -0.00 0.00 0.00 177.93 180.85 2ytd h THR 26 N -0.35 0.01 0.34 6.26 1.35 -1.99 0.23 112.91 118.76 2ytd h THR 26 Ca 0.00 -0.00 -0.02 0.00 -0.55 0.00 0.00 66.41 65.85 2ytd h THR 26 Cb 0.65 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.08 2ytd h THR 26 CO 0.02 0.00 -0.16 0.45 -0.25 0.00 0.00 175.52 175.58 2ytd h HIS 27 N 0.00 -0.42 -0.27 4.73 3.86 -1.98 -0.03 115.15 121.05 2ytd h HIS 27 Ca 0.58 -0.01 0.06 0.00 -1.16 0.00 0.00 60.37 59.85 2ytd h HIS 27 Cb 1.16 0.14 -0.08 0.00 1.06 0.00 0.00 27.41 29.70 2ytd h HIS 27 CO -0.54 -0.18 -0.31 1.25 0.86 0.00 0.00 177.93 179.01 2ytd h LEU 28 N -0.60 -1.01 0.71 2.43 5.85 -0.61 -0.29 115.31 121.79 2ytd h LEU 28 Ca -0.05 0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.81 2ytd h LEU 28 Cb 0.44 0.46 0.00 0.00 0.37 0.00 0.00 40.66 41.92 2ytd h LEU 28 CO 0.08 -0.33 -0.37 -1.13 -0.34 0.00 0.00 178.44 176.35 2ytd h ASN 29 N -0.31 -0.90 -0.13 1.25 -1.24 -0.96 0.40 115.58 113.68 2ytd h ASN 29 Ca 0.14 0.04 0.04 0.00 0.71 0.00 0.00 56.30 57.22 2ytd h ASN 29 Cb 0.53 0.24 -0.01 0.00 0.73 0.00 0.00 38.32 39.82 2ytd h ASN 29 CO -0.44 -0.61 0.71 -0.33 -1.29 0.00 0.00 177.43 175.47 2ytd h GLU 30 N -0.99 0.00 0.00 6.67 5.08 -0.80 0.75 114.58 125.29 2ytd h GLU 30 Ca -0.10 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.16 2ytd h GLU 30 Cb 0.77 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.00 2ytd h GLU 30 CO 0.14 0.00 -0.70 1.25 -1.00 0.00 0.00 179.01 178.70 2ytd h HIS 31 N 0.00 0.00 -1.40 4.33 2.76 -0.25 -3.35 115.15 117.24 2ytd h HIS 31 Ca 0.06 0.00 0.41 0.00 -2.20 0.00 0.00 60.37 58.64 2ytd h HIS 31 Cb 1.48 0.00 -0.06 0.00 1.55 0.00 0.00 27.41 30.39 2ytd h HIS 31 CO 0.00 0.89 1.20 0.54 -1.30 0.00 0.00 177.93 179.26 2ytd n ARG 32 N -4.55 0.01 -0.22 5.26 1.74 0.25 0.50 116.66 119.65 2ytd n ARG 32 Ca -0.19 0.94 0.03 0.00 -0.77 0.00 0.00 57.85 57.86 2ytd n ARG 32 Cb 0.47 -2.25 0.13 0.00 -1.02 0.00 0.00 32.46 29.79 2ytd n ARG 32 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2ytd h ARG 33 N 0.00 0.18 -0.13 5.56 -0.00 -1.67 0.33 114.38 118.65 2ytd h ARG 33 Ca 0.67 -0.01 0.04 0.00 -0.50 0.00 0.00 59.98 60.17 2ytd h ARG 33 Cb 3.05 -0.04 -0.01 0.00 0.00 0.00 0.00 29.97 32.98 2ytd h ARG 33 CO -0.01 0.12 0.73 -0.84 0.00 0.00 0.00 179.97 179.97 2ytd h ILE 34 N 0.19 0.03 0.04 2.04 3.07 -0.20 1.17 117.51 123.84 2ytd h ILE 34 Ca 0.36 0.00 -0.32 0.00 1.55 0.00 0.00 64.86 66.44 2ytd h ILE 34 Cb 0.58 0.30 -0.04 0.00 -0.27 0.00 0.00 36.82 37.39 2ytd h ILE 34 CO -0.51 0.00 -1.87 1.41 -1.05 0.00 0.00 178.15 176.13 2ytd n HIS 35 N -2.81 0.99 -1.12 0.16 8.25 0.12 -4.21 115.22 116.60 2ytd n HIS 35 Ca 0.02 0.30 -0.21 0.00 -0.26 0.00 0.00 57.72 57.57 2ytd n HIS 35 Cb 0.79 -1.16 0.00 0.00 1.12 0.00 0.00 29.99 30.74 2ytd n HIS 35 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2ytd n THR 36 N -3.18 3.00 0.00 1.59 -2.24 0.40 -4.56 114.28 109.29 2ytd n THR 36 Ca -0.24 -2.15 0.00 0.00 -2.27 0.00 0.00 64.05 59.39 2ytd n THR 36 Cb 1.06 -1.44 0.00 0.00 -2.10 0.00 0.00 70.33 67.85 2ytd n THR 36 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ytd n GLY 37 N 0.54 -0.06 3.29 3.38 0.00 -1.17 -4.98 105.19 106.19 2ytd n GLY 37 Ca 0.38 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.10 2ytd n GLY 37 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2ytd s TYR 38 N -0.73 2.16 0.03 1.61 -0.85 -1.26 -5.14 117.35 113.16 2ytd s TYR 38 Ca 0.00 -0.41 0.07 0.00 -0.52 0.00 0.00 57.07 56.22 2ytd s TYR 38 Cb 0.00 -1.37 -0.03 0.00 0.38 0.00 0.00 41.96 40.94 2ytd s TYR 38 CO 0.00 -0.00 -0.20 1.03 -1.52 0.00 0.00 175.55 174.86 2ytd s ARG 39 N -0.72 2.08 -0.02 -3.49 1.81 -1.26 -5.05 118.95 112.29 2ytd s ARG 39 Ca 0.10 -0.96 -0.25 0.00 -1.72 0.00 0.00 55.73 52.89 2ytd s ARG 39 Cb -0.09 -2.16 -0.20 0.00 -0.45 0.00 0.00 34.95 32.05 2ytd s ARG 39 CO -0.00 0.55 1.23 -1.00 -0.68 0.00 0.00 175.30 175.40 2ytd h PRO 40 N 4.76 -0.05 0.00 3.54 0.13 -2.03 -3.41 132.00 134.95 2ytd h PRO 40 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2ytd h PRO 40 Cb 1.15 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2ytd h PRO 40 CO 0.47 0.41 0.00 0.43 -0.23 0.00 0.00 178.00 179.08 2ytd n SER 41 N -4.89 0.00 -1.84 1.44 7.64 -1.26 -5.08 113.62 109.63 2ytd n SER 41 Ca -0.08 0.22 -0.02 0.00 1.01 0.00 0.00 58.87 59.99 2ytd n SER 41 Cb 0.25 -0.49 0.00 0.00 -1.01 0.00 0.00 64.21 62.96 2ytd n SER 41 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ytd n GLY 42 N 1.73 -0.86 0.00 0.23 0.00 -1.26 -4.91 105.19 100.12 2ytd n GLY 42 Ca 0.00 0.24 0.07 0.00 0.00 0.00 0.00 46.02 46.33 2ytd n GLY 42 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ytd n PRO 43 N -0.45 0.06 -0.17 1.61 -0.04 -1.26 -4.03 135.00 130.72 2ytd n PRO 43 Ca 0.03 0.22 -0.04 0.00 -0.04 0.00 0.00 63.50 63.67 2ytd n PRO 43 Cb 0.12 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.04 2ytd n PRO 43 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2ytd n SER 44 N -1.44 -0.42 -4.70 3.54 7.64 -1.26 -4.04 113.62 112.94 2ytd n SER 44 Ca 0.04 1.04 -0.39 0.00 1.01 0.00 0.00 58.87 60.57 2ytd n SER 44 Cb 0.15 -0.26 -0.06 0.00 -1.01 0.00 0.00 64.21 63.03 2ytd n SER 44 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2ytd s SER 45 N -4.29 6.70 0.00 6.43 1.04 -1.26 -5.33 113.70 117.00 2ytd s SER 45 Ca -0.05 0.84 0.00 0.00 0.48 0.00 0.00 55.95 57.23 2ytd s SER 45 Cb 0.04 -2.31 0.00 0.00 0.10 0.00 0.00 66.02 63.85 2ytd s SER 45 CO 0.25 -0.08 0.00 0.61 0.98 0.00 0.00 173.24 174.99