#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yto n SER 2 N 0.00 3.41 -2.39 1.61 7.64 -1.26 -4.85 113.62 117.79 2yto n SER 2 Ca 0.00 -3.04 -0.34 0.00 1.01 0.00 0.00 58.87 56.50 2yto n SER 2 Cb 0.00 -0.42 0.06 0.00 -1.01 0.00 0.00 64.21 62.84 2yto n SER 2 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2yto n SER 3 N -0.59 7.18 0.00 6.43 3.41 -1.26 -4.96 113.62 123.82 2yto n SER 3 Ca 0.27 -3.79 0.00 0.00 -0.26 0.00 0.00 58.87 55.09 2yto n SER 3 Cb 0.86 -0.88 0.00 0.00 -0.26 0.00 0.00 64.21 63.93 2yto n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yto n GLY 4 N -0.81 0.42 3.79 5.00 0.00 -1.26 -5.01 105.19 107.32 2yto n GLY 4 Ca 0.58 -0.42 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 2yto n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2yto n SER 5 N 0.00 -1.03 -3.97 1.61 2.88 -1.26 -4.83 113.62 107.02 2yto n SER 5 Ca 0.00 -0.94 -0.31 0.00 -1.33 0.00 0.00 58.87 56.29 2yto n SER 5 Cb 0.00 -1.20 -0.11 0.00 -0.75 0.00 0.00 64.21 62.15 2yto n SER 5 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2yto s SER 6 N -2.90 5.00 -0.03 -3.46 0.01 -1.26 -5.04 113.70 106.01 2yto s SER 6 Ca 0.53 -3.56 -0.04 0.00 1.31 0.00 0.00 55.95 54.18 2yto s SER 6 Cb -0.31 -1.71 0.01 0.00 0.21 0.00 0.00 66.02 64.22 2yto s SER 6 CO 0.77 -0.16 0.11 -0.83 0.41 0.00 0.00 173.24 173.53 2yto s GLY 7 N -0.75 -0.04 -0.92 3.44 0.00 -1.26 -5.07 107.32 102.72 2yto s GLY 7 Ca 0.23 0.18 -0.30 0.00 0.00 0.00 0.00 44.72 44.83 2yto s GLY 7 CO -0.11 0.12 2.53 2.41 0.00 0.00 0.00 173.10 178.05 2yto n THR 8 N 2.66 0.00 0.00 0.90 -1.04 -1.26 -3.89 114.28 111.65 2yto n THR 8 Ca -0.15 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.86 2yto n THR 8 Cb 0.58 -0.48 0.00 0.00 -1.82 0.00 0.00 70.33 68.62 2yto n THR 8 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2yto n GLY 9 N 6.26 0.00 3.55 3.41 0.00 -1.26 -5.09 105.19 112.06 2yto n GLY 9 Ca 0.62 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 46.26 2yto n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2yto s GLU 10 N 0.00 3.01 0.36 1.61 0.41 -1.25 -4.96 118.70 117.88 2yto s GLU 10 Ca 0.00 -0.16 -0.24 0.00 -0.41 0.00 0.00 54.97 54.16 2yto s GLU 10 Cb 0.00 -4.58 -0.14 0.00 -1.78 0.00 0.00 34.13 27.63 2yto s GLU 10 CO 0.00 -2.50 0.56 1.63 -0.49 0.00 0.00 175.26 174.45 2yto n LYS 11 N 9.16 0.52 -0.03 1.61 5.02 -1.26 -4.88 118.16 128.30 2yto n LYS 11 Ca 0.19 0.19 -0.09 0.00 -2.02 0.00 0.00 58.31 56.58 2yto n LYS 11 Cb 0.50 -1.40 0.07 0.00 -0.02 0.00 0.00 35.03 34.18 2yto n LYS 11 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2yto h PRO 12 N 0.96 0.64 -6.46 1.97 0.13 -1.86 -3.45 132.00 123.94 2yto h PRO 12 Ca -0.37 -0.34 -0.52 0.00 -0.87 0.00 0.00 66.00 63.90 2yto h PRO 12 Cb 1.40 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.53 2yto h PRO 12 CO 0.53 0.94 -0.16 0.71 -0.23 0.00 0.00 178.00 179.79 2yto s TYR 13 N -4.25 3.48 -0.27 1.56 2.02 -1.17 -5.01 117.35 113.71 2yto s TYR 13 Ca -0.08 0.62 -0.26 0.00 -0.37 0.00 0.00 57.07 56.97 2yto s TYR 13 Cb 0.12 -2.08 0.16 0.00 -0.40 0.00 0.00 41.96 39.76 2yto s TYR 13 CO 0.84 0.19 1.26 0.21 -1.57 0.00 0.00 175.55 176.48 2yto s LYS 14 N -3.51 0.25 0.22 -0.62 2.20 -1.26 -1.32 119.74 115.70 2yto s LYS 14 Ca 0.43 0.21 -0.30 0.00 -0.36 0.00 0.00 55.97 55.96 2yto s LYS 14 Cb -0.11 0.12 -0.09 0.00 -1.51 0.00 0.00 37.83 36.25 2yto s LYS 14 CO 0.30 -0.05 1.24 0.00 -0.36 0.00 0.00 175.35 176.47 2yto n SER 16 N 2.18 6.19 0.00 0.00 7.64 -1.26 -3.75 113.62 124.62 2yto n SER 16 Ca 0.04 -3.77 0.00 0.00 1.01 0.00 0.00 58.87 56.15 2yto n SER 16 Cb 0.44 -0.77 0.00 0.00 -1.01 0.00 0.00 64.21 62.87 2yto n SER 16 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2yto n ASP 17 N -0.90 0.66 -0.01 6.43 9.92 -1.26 -4.98 116.55 126.42 2yto n ASP 17 Ca 0.55 0.00 -0.02 0.00 -0.53 0.00 0.00 54.79 54.79 2yto n ASP 17 Cb 0.86 0.00 -0.01 0.00 -0.64 0.00 0.00 41.12 41.33 2yto n ASP 17 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2yto n GLY 19 N 3.02 0.62 2.68 0.00 0.00 -1.25 -4.75 105.19 105.52 2yto n GLY 19 Ca -0.03 -0.54 -0.25 0.00 0.00 0.00 0.00 46.02 45.19 2yto n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2yto s LYS 20 N 0.00 0.30 0.30 1.61 2.20 -1.26 -4.67 119.74 118.22 2yto s LYS 20 Ca 0.00 -0.10 -0.28 0.00 -0.36 0.00 0.00 55.97 55.23 2yto s LYS 20 Cb 0.00 -1.62 -0.09 0.00 -1.51 0.00 0.00 37.83 34.61 2yto s LYS 20 CO 0.00 -0.56 1.01 0.00 -0.36 0.00 0.00 175.35 175.44 2yto s ALA 21 N 2.03 3.29 0.00 3.13 0.00 -1.26 -0.20 121.76 128.76 2yto s ALA 21 Ca 0.02 0.70 0.05 0.00 0.00 0.00 0.00 51.96 52.73 2yto s ALA 21 Cb -0.15 -3.25 -0.01 0.00 0.00 0.00 0.00 23.12 19.70 2yto s ALA 21 CO -0.07 0.01 -0.15 -0.06 0.00 0.00 0.00 175.76 175.48 2yto s PHE 22 N -1.35 1.36 0.19 0.00 0.40 -0.43 -4.91 117.98 113.24 2yto s PHE 22 Ca 0.47 -0.28 -0.04 0.00 -0.60 0.00 0.00 56.93 56.47 2yto s PHE 22 Cb -0.26 -0.86 0.12 0.00 0.51 0.00 0.00 43.02 42.54 2yto s PHE 22 CO 0.32 -0.00 1.53 1.79 0.70 0.00 0.00 175.22 179.57 2yto h THR 23 N 4.68 1.30 -2.43 0.64 1.35 -1.96 -3.10 112.91 113.39 2yto h THR 23 Ca -0.36 -1.65 -0.55 0.00 -0.55 0.00 0.00 66.41 63.30 2yto h THR 23 Cb 1.16 1.59 -0.14 0.00 -1.73 0.00 0.00 68.15 69.03 2yto h THR 23 CO 0.47 0.52 -0.73 -0.13 -0.25 0.00 0.00 175.52 175.41 2yto s ARG 24 N -4.19 1.58 0.09 4.72 1.81 -1.26 -4.75 118.95 116.95 2yto s ARG 24 Ca -0.08 -1.74 -0.35 0.00 -1.72 0.00 0.00 55.73 51.84 2yto s ARG 24 Cb 0.12 -1.49 -0.16 0.00 -0.45 0.00 0.00 34.95 32.97 2yto s ARG 24 CO 0.84 0.22 1.57 -0.22 -0.68 0.00 0.00 175.30 177.04 2yto h LYS 25 N 2.32 -0.91 -0.70 3.54 3.11 -1.99 -3.04 116.57 118.91 2yto h LYS 25 Ca -0.40 0.06 0.06 0.00 -2.81 0.00 0.00 60.65 57.57 2yto h LYS 25 Cb 1.24 0.21 -0.09 0.00 -1.00 0.00 0.00 32.23 32.59 2yto h LYS 25 CO 0.63 -0.60 -0.46 0.77 -2.81 0.00 0.00 179.45 176.98 2yto h SER 26 N -0.94 -1.66 -1.17 4.20 0.02 -1.98 0.54 113.55 112.57 2yto h SER 26 Ca -0.05 0.25 0.38 0.00 -0.84 0.00 0.00 61.79 61.53 2yto h SER 26 Cb 0.83 0.72 -0.09 0.00 0.14 0.00 0.00 62.40 64.00 2yto h SER 26 CO -0.09 -0.20 0.78 0.61 -1.14 0.00 0.00 176.83 176.78 2yto n GLY 27 N -1.21 -0.67 0.13 -3.77 0.00 -1.15 0.17 105.19 98.69 2yto n GLY 27 Ca 0.01 0.57 -0.22 0.00 0.00 0.00 0.00 46.02 46.37 2yto n GLY 27 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2yto h LEU 28 N 0.00 0.45 0.09 0.99 5.85 -0.00 -3.30 115.31 119.38 2yto h LEU 28 Ca 0.68 -0.89 0.00 0.00 0.84 0.00 0.00 57.88 58.52 2yto h LEU 28 Cb 2.35 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 43.22 2yto h LEU 28 CO -0.27 1.74 -0.25 -0.74 -0.34 0.00 0.00 178.44 178.59 2yto h HIS 29 N -0.10 -0.71 -0.80 1.25 2.76 0.32 0.36 115.15 118.24 2yto h HIS 29 Ca -0.36 0.02 0.19 0.00 -2.20 0.00 0.00 60.37 58.02 2yto h HIS 29 Cb 1.92 0.30 -0.13 0.00 1.55 0.00 0.00 27.41 31.05 2yto h HIS 29 CO 0.10 -0.29 0.16 0.82 -1.30 0.00 0.00 177.93 177.42 2yto h ILE 30 N -0.38 0.40 -0.23 6.26 5.03 -1.54 0.14 117.51 127.19 2yto h ILE 30 Ca -0.01 -0.07 0.04 0.00 -0.12 0.00 0.00 64.86 64.70 2yto h ILE 30 Cb 0.37 0.17 -0.03 0.00 -3.03 0.00 0.00 36.82 34.29 2yto h ILE 30 CO -0.11 0.04 0.01 -0.74 -0.68 0.00 0.00 178.15 176.67 2yto h HIS 31 N 0.21 0.01 -0.22 1.37 2.76 -1.51 -0.50 115.15 117.27 2yto h HIS 31 Ca 0.47 0.02 0.06 0.00 -2.20 0.00 0.00 60.37 58.72 2yto h HIS 31 Cb 0.86 0.03 -0.01 0.00 1.55 0.00 0.00 27.41 29.84 2yto h HIS 31 CO -0.30 -0.02 0.59 1.96 -1.30 0.00 0.00 177.93 178.86 2yto h GLN 32 N 0.09 0.00 -1.64 5.26 1.08 0.12 -0.16 115.11 119.86 2yto h GLN 32 Ca 0.11 0.00 -0.28 0.00 -1.45 0.00 0.00 58.65 57.03 2yto h GLN 32 Cb 0.13 0.00 -0.12 0.00 -0.05 0.00 0.00 27.48 27.45 2yto h GLN 32 CO -0.17 0.00 0.33 1.04 -0.95 0.00 0.00 178.83 179.08 2yto n GLN 33 N -3.05 1.71 0.00 1.46 1.13 -0.20 -3.72 117.38 114.71 2yto n GLN 33 Ca 0.04 -1.34 0.00 0.00 -1.94 0.00 0.00 57.00 53.76 2yto n GLN 33 Cb 0.69 -1.55 0.00 0.00 0.11 0.00 0.00 30.24 29.49 2yto n GLN 33 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 2yto n SER 34 N 0.62 2.17 -1.96 1.08 2.88 -0.07 -4.80 113.62 113.53 2yto n SER 34 Ca 0.26 0.00 -0.17 0.00 -1.33 0.00 0.00 58.87 57.64 2yto n SER 34 Cb 0.57 0.11 0.01 0.00 -0.75 0.00 0.00 64.21 64.15 2yto n SER 34 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2yto n HIS 35 N -1.65 1.39 -3.74 0.66 8.25 -1.24 -4.84 115.22 114.04 2yto n HIS 35 Ca 0.00 -1.88 -0.14 0.00 -0.26 0.00 0.00 57.72 55.44 2yto n HIS 35 Cb 0.24 -1.01 -0.09 0.00 1.12 0.00 0.00 29.99 30.26 2yto n HIS 35 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 2yto s THR 36 N -2.02 0.05 0.43 1.59 -1.32 -1.26 -5.16 115.64 107.95 2yto s THR 36 Ca 0.34 -0.38 0.04 0.00 -1.21 0.00 0.00 61.69 60.48 2yto s THR 36 Cb 0.25 -0.62 -0.02 0.00 -1.51 0.00 0.00 72.50 70.60 2yto s THR 36 CO -0.04 -0.21 0.14 -0.83 -2.21 0.00 0.00 174.62 171.47 2yto s GLY 37 N -1.10 2.75 -0.50 6.08 0.00 -1.26 -5.08 107.32 108.20 2yto s GLY 37 Ca -0.11 -1.05 -0.21 0.00 0.00 0.00 0.00 44.72 43.34 2yto s GLY 37 CO 0.04 -1.86 0.72 1.85 0.00 0.00 0.00 173.10 173.85 2yto s GLU 38 N -3.67 3.22 0.41 2.90 2.56 -1.26 -5.03 118.70 117.84 2yto s GLU 38 Ca 0.20 -0.58 -0.25 0.00 0.00 0.00 0.00 54.97 54.34 2yto s GLU 38 Cb 0.01 -4.05 -0.10 0.00 2.00 0.00 0.00 34.13 31.99 2yto s GLU 38 CO 0.14 -1.24 1.18 -2.13 -0.56 0.00 0.00 175.26 172.65 2yto n ARG 39 N 6.56 1.73 -1.15 4.30 3.00 -1.26 -4.87 116.66 124.97 2yto n ARG 39 Ca -0.03 0.62 -0.22 0.00 -0.00 0.00 0.00 57.85 58.22 2yto n ARG 39 Cb 0.47 -2.26 0.00 0.00 0.00 0.00 0.00 32.46 30.67 2yto n ARG 39 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.63 175.24 2yto n HIS 40 N -0.27 1.67 -3.73 -0.14 1.44 -1.26 -4.70 115.22 108.22 2yto n HIS 40 Ca 0.08 -2.03 -0.34 0.00 -2.01 0.00 0.00 57.72 53.42 2yto n HIS 40 Cb 0.39 -1.15 -0.09 0.00 0.12 0.00 0.00 29.99 29.26 2yto n HIS 40 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 2yto s SER 41 N 0.12 5.43 -0.39 4.39 0.15 -1.26 -4.76 113.70 117.37 2yto s SER 41 Ca 0.44 -3.44 -0.02 0.00 0.70 0.00 0.00 55.95 53.63 2yto s SER 41 Cb 0.31 -1.82 -0.03 0.00 -1.71 0.00 0.00 66.02 62.77 2yto s SER 41 CO -0.09 -0.22 0.35 0.61 1.20 0.00 0.00 173.24 175.08 2yto n GLY 42 N 2.67 0.12 3.57 9.45 0.00 -1.26 -5.05 105.19 114.69 2yto n GLY 42 Ca 0.16 0.05 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 2yto n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yto s PRO 43 N -3.52 -1.60 0.52 1.61 0.04 -1.26 -4.98 135.00 125.82 2yto s PRO 43 Ca 0.17 -0.20 -0.22 0.00 0.04 0.00 0.00 61.00 60.79 2yto s PRO 43 Cb -0.02 -1.56 -0.06 0.00 0.04 0.00 0.00 34.50 32.90 2yto s PRO 43 CO 0.28 -3.94 1.31 0.45 0.04 0.00 0.00 177.00 175.14 2yto s SER 44 N -4.00 5.53 -0.04 6.66 0.15 -1.26 -4.96 113.70 115.79 2yto s SER 44 Ca 0.72 2.64 -0.25 0.00 0.70 0.00 0.00 55.95 59.77 2yto s SER 44 Cb -0.08 -2.63 -0.19 0.00 -1.71 0.00 0.00 66.02 61.42 2yto s SER 44 CO 0.56 -1.38 1.08 0.77 1.20 0.00 0.00 173.24 175.47 2yto h SER 45 N 1.64 -0.09 0.00 5.45 4.64 -2.06 -3.55 113.55 119.58 2yto h SER 45 Ca -0.50 -0.47 0.00 0.00 -0.47 0.00 0.00 61.79 60.34 2yto h SER 45 Cb 1.28 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 2yto h SER 45 CO 0.58 0.47 0.00 0.61 -0.87 0.00 0.00 176.83 177.62