#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ytm n SER 2 N 0.00 -0.44 -3.37 1.61 2.88 -1.26 -0.95 113.62 112.09 2ytm n SER 2 Ca 0.00 -1.02 -0.20 0.00 -1.33 0.00 0.00 58.87 56.32 2ytm n SER 2 Cb 0.00 -3.01 0.08 0.00 -0.75 0.00 0.00 64.21 60.53 2ytm n SER 2 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2ytm n SER 3 N -2.97 -4.40 -0.74 -3.46 2.88 -1.26 -4.73 113.62 98.94 2ytm n SER 3 Ca -0.30 -0.54 0.09 0.00 -1.33 0.00 0.00 58.87 56.78 2ytm n SER 3 Cb 0.68 -4.82 -0.05 0.00 -0.75 0.00 0.00 64.21 59.27 2ytm n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ytm n GLY 4 N -1.59 -2.86 2.94 0.46 0.00 -0.12 -4.82 105.19 99.20 2ytm n GLY 4 Ca -0.11 -1.25 -0.30 0.00 0.00 0.00 0.00 46.02 44.36 2ytm n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ytm s SER 5 N -5.78 4.36 0.28 1.61 0.15 -1.26 -4.82 113.70 108.25 2ytm s SER 5 Ca 0.00 -3.12 -0.05 0.00 0.70 0.00 0.00 55.95 53.48 2ytm s SER 5 Cb 0.00 -1.63 -0.01 0.00 -1.71 0.00 0.00 66.02 62.67 2ytm s SER 5 CO 0.00 -0.21 0.39 -0.44 1.20 0.00 0.00 173.24 174.18 2ytm s SER 6 N -0.43 0.44 0.00 5.45 0.01 -1.26 -5.14 113.70 112.77 2ytm s SER 6 Ca 0.18 -1.29 0.00 0.00 1.31 0.00 0.00 55.95 56.15 2ytm s SER 6 Cb -0.23 0.57 0.00 0.00 0.21 0.00 0.00 66.02 66.57 2ytm s SER 6 CO -0.02 -1.13 0.00 0.61 0.41 0.00 0.00 173.24 173.10 2ytm n GLY 7 N -0.44 3.63 2.84 3.44 0.00 -1.26 -5.11 105.19 108.29 2ytm n GLY 7 Ca 0.01 -0.92 -0.29 0.00 0.00 0.00 0.00 46.02 44.81 2ytm n GLY 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ytm s THR 8 N 0.00 1.14 -0.30 2.61 -4.23 -1.26 -4.94 115.64 108.66 2ytm s THR 8 Ca 0.00 -1.11 -0.25 0.00 -1.18 0.00 0.00 61.69 59.16 2ytm s THR 8 Cb 0.00 -1.58 0.04 0.00 1.34 0.00 0.00 72.50 72.29 2ytm s THR 8 CO 0.00 -0.27 0.43 0.61 -0.54 0.00 0.00 174.62 174.85 2ytm n GLY 9 N 4.80 -0.06 3.28 3.99 0.00 -1.26 -4.94 105.19 111.00 2ytm n GLY 9 Ca -0.08 0.77 -0.36 0.00 0.00 0.00 0.00 46.02 46.35 2ytm n GLY 9 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ytm s GLU 10 N -1.96 3.07 -0.19 1.61 -6.30 -1.26 -5.08 118.70 108.59 2ytm s GLU 10 Ca 0.24 -0.84 -0.27 0.00 -2.50 0.00 0.00 54.97 51.60 2ytm s GLU 10 Cb -0.03 -3.14 0.08 0.00 0.00 0.00 0.00 34.13 31.04 2ytm s GLU 10 CO 0.58 -0.37 0.75 -1.59 0.02 0.00 0.00 175.26 174.65 2ytm s LYS 11 N 1.43 0.88 0.00 4.30 -2.85 -1.26 -5.02 119.74 117.21 2ytm s LYS 11 Ca 0.02 0.66 0.15 0.00 -1.00 0.00 0.00 55.97 55.80 2ytm s LYS 11 Cb -0.16 0.42 0.69 0.00 -2.06 0.00 0.00 37.83 36.72 2ytm s LYS 11 CO -0.01 -0.18 1.42 -0.35 0.10 0.00 0.00 175.35 176.33 2ytm n PRO 12 N 1.93 0.13 -1.51 1.78 -0.04 -1.26 -3.71 135.00 132.32 2ytm n PRO 12 Ca -0.15 0.19 -0.27 0.00 -0.04 0.00 0.00 63.50 63.22 2ytm n PRO 12 Cb 0.56 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.46 2ytm n PRO 12 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2ytm n TYR 13 N -1.37 1.57 -4.52 0.54 4.01 -1.26 -4.88 117.16 111.25 2ytm n TYR 13 Ca 0.06 -2.05 -0.21 0.00 -0.16 0.00 0.00 57.90 55.54 2ytm n TYR 13 Cb 0.14 -1.51 -0.15 0.00 -0.31 0.00 0.00 39.34 37.51 2ytm n TYR 13 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 2ytm s LYS 14 N -1.20 0.99 0.28 -0.72 1.02 -1.24 -4.78 119.74 114.08 2ytm s LYS 14 Ca 0.59 -0.42 -0.29 0.00 0.02 0.00 0.00 55.97 55.87 2ytm s LYS 14 Cb 0.34 -0.95 -0.14 0.00 -0.52 0.00 0.00 37.83 36.56 2ytm s LYS 14 CO -0.17 0.24 1.20 0.00 -0.92 0.00 0.00 175.35 175.70 2ytm n MET 16 N 1.11 0.67 0.11 0.00 1.56 -1.26 -3.04 117.12 116.27 2ytm n MET 16 Ca 0.09 0.09 -0.16 0.00 -0.27 0.00 0.00 57.70 57.46 2ytm n MET 16 Cb 0.32 -1.60 -0.09 0.00 2.15 0.00 0.00 33.22 33.99 2ytm n MET 16 CO 0.00 0.00 0.00 0.93 -0.73 0.00 0.00 175.97 176.17 2ytm h GLU 17 N 0.00 -0.70 0.00 2.12 3.07 -2.00 -3.39 114.58 113.68 2ytm h GLU 17 Ca -0.47 0.05 -0.08 0.00 -0.50 0.00 0.00 59.36 58.35 2ytm h GLU 17 Cb 2.16 0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 30.22 2ytm h GLU 17 CO 0.04 -0.46 -1.29 0.00 -1.40 0.00 0.00 179.01 175.89 2ytm n GLY 19 N 2.91 1.14 3.43 0.00 0.00 -1.17 -5.07 105.19 106.42 2ytm n GLY 19 Ca -0.10 -0.85 -0.13 0.00 0.00 0.00 0.00 46.02 44.94 2ytm n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ytm s LYS 20 N -0.78 0.61 0.47 1.61 2.20 -1.26 -4.96 119.74 117.63 2ytm s LYS 20 Ca 0.00 0.77 -0.11 0.00 -0.36 0.00 0.00 55.97 56.26 2ytm s LYS 20 Cb 0.00 0.27 -0.06 0.00 -1.51 0.00 0.00 37.83 36.53 2ytm s LYS 20 CO 0.00 -0.08 0.86 0.00 -0.36 0.00 0.00 175.35 175.76 2ytm s ALA 21 N 0.44 3.25 0.27 3.13 0.00 -1.26 -3.76 121.76 123.82 2ytm s ALA 21 Ca -0.01 -0.13 -0.04 0.00 0.00 0.00 0.00 51.96 51.78 2ytm s ALA 21 Cb -0.04 -2.84 -0.02 0.00 0.00 0.00 0.00 23.12 20.22 2ytm s ALA 21 CO -0.01 -0.20 0.34 -0.06 0.00 0.00 0.00 175.76 175.82 2ytm s PHE 22 N -2.59 0.98 -0.15 0.00 0.08 -1.26 -5.08 117.98 109.95 2ytm s PHE 22 Ca 0.53 -1.21 -0.12 0.00 0.12 0.00 0.00 56.93 56.26 2ytm s PHE 22 Cb -0.10 -0.24 -0.05 0.00 -0.57 0.00 0.00 43.02 42.06 2ytm s PHE 22 CO 0.36 -0.90 -0.20 0.41 -0.10 0.00 0.00 175.22 174.79 2ytm n GLY 23 N -0.42 -0.86 3.44 4.36 0.00 -1.26 -4.94 105.19 105.51 2ytm n GLY 23 Ca 0.01 -0.19 -0.33 0.00 0.00 0.00 0.00 46.02 45.51 2ytm n GLY 23 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2ytm s ASP 24 N -5.86 4.41 0.25 1.61 1.01 -1.26 -5.01 116.67 111.83 2ytm s ASP 24 Ca -0.19 -0.23 -0.04 0.00 0.71 0.00 0.00 52.55 52.81 2ytm s ASP 24 Cb 0.03 -1.70 0.51 0.00 1.01 0.00 0.00 42.92 42.77 2ytm s ASP 24 CO 0.29 0.17 1.66 -1.13 0.21 0.00 0.00 175.17 176.37 2ytm h ASN 25 N 6.69 -0.08 -0.74 0.27 -0.73 -1.96 -1.71 115.58 117.32 2ytm h ASN 25 Ca -0.28 0.17 0.09 0.00 1.87 0.00 0.00 56.30 58.15 2ytm h ASN 25 Cb 1.20 0.25 -0.11 0.00 0.27 0.00 0.00 38.32 39.93 2ytm h ASN 25 CO 0.59 -0.10 -0.35 -1.20 -0.37 0.00 0.00 177.43 176.00 2ytm n SER 26 N -5.22 -0.61 -0.09 1.15 7.64 -1.26 0.78 113.62 116.01 2ytm n SER 26 Ca 0.16 1.30 -0.14 0.00 1.01 0.00 0.00 58.87 61.19 2ytm n SER 26 Cb 0.51 -0.24 -0.04 0.00 -1.01 0.00 0.00 64.21 63.43 2ytm n SER 26 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2ytm h SER 27 N 0.00 0.83 -0.88 6.43 0.02 -1.76 -3.26 113.55 114.94 2ytm h SER 27 Ca 0.20 -0.51 0.15 0.00 -0.84 0.00 0.00 61.79 60.79 2ytm h SER 27 Cb 0.38 -0.24 -0.15 0.00 0.14 0.00 0.00 62.40 62.53 2ytm h SER 27 CO -0.72 1.17 -0.30 0.00 -1.14 0.00 0.00 176.83 175.85 2ytm h THR 29 N 0.00 0.78 -0.48 0.00 1.35 -1.44 -2.43 112.91 110.70 2ytm h THR 29 Ca 0.35 -0.08 0.09 0.00 -0.55 0.00 0.00 66.41 66.22 2ytm h THR 29 Cb 0.57 0.51 -0.10 0.00 -1.73 0.00 0.00 68.15 67.40 2ytm h THR 29 CO -0.89 0.05 -0.25 -0.61 -0.25 0.00 0.00 175.52 173.57 2ytm h GLN 30 N 0.25 -0.14 -0.91 4.72 -0.00 0.34 -0.02 115.11 119.35 2ytm h GLN 30 Ca 0.22 0.01 0.25 0.00 -0.00 0.00 0.00 58.65 59.13 2ytm h GLN 30 Cb 0.26 0.03 -0.15 0.00 0.00 0.00 0.00 27.48 27.62 2ytm h GLN 30 CO -0.27 -0.10 0.20 1.25 0.00 0.00 0.00 178.83 179.91 2ytm h HIS 31 N -0.15 0.27 -0.97 3.99 2.76 -0.97 0.77 115.15 120.85 2ytm h HIS 31 Ca 0.22 0.05 0.21 0.00 -2.20 0.00 0.00 60.37 58.65 2ytm h HIS 31 Cb 0.49 0.03 -0.08 0.00 1.55 0.00 0.00 27.41 29.40 2ytm h HIS 31 CO -0.52 -0.29 0.62 0.37 -1.30 0.00 0.00 177.93 176.82 2ytm h GLN 32 N 0.14 0.52 -0.97 5.26 4.15 -0.98 -0.39 115.11 122.84 2ytm h GLN 32 Ca 0.58 -0.03 0.29 0.00 0.77 0.00 0.00 58.65 60.26 2ytm h GLN 32 Cb 1.21 -0.12 -0.15 0.00 0.21 0.00 0.00 27.48 28.64 2ytm h GLN 32 CO -0.73 0.34 0.48 0.00 -1.93 0.00 0.00 178.83 177.00 2ytm h ARG 33 N 0.54 0.31 -0.44 1.69 3.08 0.57 0.13 114.38 120.26 2ytm h ARG 33 Ca 0.53 -0.02 0.05 0.00 0.07 0.00 0.00 59.98 60.61 2ytm h ARG 33 Cb 1.13 -0.07 -0.08 0.00 0.08 0.00 0.00 29.97 31.03 2ytm h ARG 33 CO -0.27 0.20 -0.54 -0.07 -1.07 0.00 0.00 179.97 178.23 2ytm h LEU 34 N 0.32 -1.82 -0.17 3.04 -0.00 -1.17 1.05 115.31 116.55 2ytm h LEU 34 Ca 0.68 0.24 -0.16 0.00 -0.00 0.00 0.00 57.88 58.65 2ytm h LEU 34 Cb 1.49 0.75 0.00 0.00 -0.00 0.00 0.00 40.66 42.91 2ytm h LEU 34 CO -0.61 -0.38 -0.50 0.45 -0.00 0.00 0.00 178.44 177.40 2ytm h HIS 35 N -0.35 0.84 -2.84 1.13 3.86 -1.36 -3.38 115.15 113.04 2ytm h HIS 35 Ca 0.08 -0.33 -0.61 0.00 -1.16 0.00 0.00 60.37 58.34 2ytm h HIS 35 Cb 0.56 -0.14 -0.41 0.00 1.06 0.00 0.00 27.41 28.47 2ytm h HIS 35 CO -0.75 1.12 -0.65 2.41 0.86 0.00 0.00 177.93 180.92 2ytm n THR 36 N -4.17 1.25 -1.69 2.45 -1.04 0.33 -5.04 114.28 106.36 2ytm n THR 36 Ca -0.07 -4.68 0.00 0.00 -2.04 0.00 0.00 64.05 57.27 2ytm n THR 36 Cb 0.60 -2.09 0.00 0.00 -1.82 0.00 0.00 70.33 67.01 2ytm n THR 36 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2ytm n GLY 37 N 1.93 -0.64 2.53 3.41 0.00 0.36 -4.05 105.19 108.72 2ytm n GLY 37 Ca 0.23 -0.54 -0.10 0.00 0.00 0.00 0.00 46.02 45.60 2ytm n GLY 37 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2ytm n GLN 38 N 0.00 -2.93 -3.39 1.61 -0.06 -1.25 -3.74 117.38 107.61 2ytm n GLN 38 Ca 0.00 0.53 -0.17 0.00 -2.00 0.00 0.00 57.00 55.36 2ytm n GLN 38 Cb 0.00 -4.40 0.08 0.00 -4.06 0.00 0.00 30.24 21.86 2ytm n GLN 38 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 2ytm n ARG 39 N -2.77 -4.90 -2.06 3.69 1.74 -1.26 -4.85 116.66 106.25 2ytm n ARG 39 Ca -0.12 0.84 -0.27 0.00 -0.77 0.00 0.00 57.85 57.52 2ytm n ARG 39 Cb 0.59 -5.79 -0.06 0.00 -1.02 0.00 0.00 32.46 26.18 2ytm n ARG 39 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2ytm s PRO 40 N -5.06 2.52 0.00 5.56 0.04 -1.25 -4.47 135.00 132.34 2ytm s PRO 40 Ca 0.17 -0.70 0.00 0.00 0.04 0.00 0.00 61.00 60.51 2ytm s PRO 40 Cb -0.02 -5.15 0.00 0.00 0.04 0.00 0.00 34.50 29.37 2ytm s PRO 40 CO 0.74 -3.67 0.00 0.43 0.04 0.00 0.00 177.00 174.54 2ytm n SER 41 N 14.18 2.71 -3.61 6.66 7.64 -1.26 -5.06 113.62 134.88 2ytm n SER 41 Ca 0.42 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 60.21 2ytm n SER 41 Cb 0.47 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.61 2ytm n SER 41 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2ytm s GLY 42 N -4.29 -0.16 0.00 0.23 0.00 -1.26 -5.01 107.32 96.83 2ytm s GLY 42 Ca 0.00 2.40 0.14 0.00 0.00 0.00 0.00 44.72 47.26 2ytm s GLY 42 CO 0.00 1.35 1.45 -1.55 0.00 0.00 0.00 173.10 174.35 2ytm n PRO 43 N 1.23 0.04 -2.02 2.90 -0.04 -1.26 -4.77 135.00 131.07 2ytm n PRO 43 Ca -0.10 0.24 -0.28 0.00 -0.04 0.00 0.00 63.50 63.31 2ytm n PRO 43 Cb 0.57 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.66 2ytm n PRO 43 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2ytm s SER 44 N -2.93 3.95 0.02 3.54 0.01 -1.26 -5.11 113.70 111.92 2ytm s SER 44 Ca 0.08 0.41 -0.00 0.00 1.31 0.00 0.00 55.95 57.75 2ytm s SER 44 Cb 0.09 -0.73 -0.02 0.00 0.21 0.00 0.00 66.02 65.57 2ytm s SER 44 CO 0.25 -2.21 -0.02 -0.55 0.41 0.00 0.00 173.24 171.12 2ytm s SER 45 N -4.72 0.27 0.00 2.44 0.15 -1.26 -5.11 113.70 105.47 2ytm s SER 45 Ca 0.67 -0.56 0.00 0.00 0.70 0.00 0.00 55.95 56.76 2ytm s SER 45 Cb -0.07 0.12 0.00 0.00 -1.71 0.00 0.00 66.02 64.35 2ytm s SER 45 CO 0.50 -0.34 0.00 0.61 1.20 0.00 0.00 173.24 175.20