#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2emi n SER 2 N 0.00 -1.77 -4.19 1.61 7.64 -1.26 -4.96 113.62 110.70 2emi n SER 2 Ca 0.00 0.65 -0.23 0.00 1.01 0.00 0.00 58.87 60.30 2emi n SER 2 Cb 0.00 -0.65 -0.14 0.00 -1.01 0.00 0.00 64.21 62.40 2emi n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2emi s SER 3 N -0.73 2.05 0.00 6.43 0.15 -1.26 -5.07 113.70 115.28 2emi s SER 3 Ca 0.44 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.65 2emi s SER 3 Cb -0.52 -0.18 0.00 0.00 -1.71 0.00 0.00 66.02 63.61 2emi s SER 3 CO 0.44 0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.62 2emi n GLY 4 N 2.10 2.88 2.53 9.45 0.00 -1.26 -5.05 105.19 115.82 2emi n GLY 4 Ca -0.17 -0.97 -0.12 0.00 0.00 0.00 0.00 46.02 44.76 2emi n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2emi n SER 5 N 0.00 2.91 -4.64 1.61 7.64 -1.26 -5.07 113.62 114.81 2emi n SER 5 Ca 0.00 -2.84 -0.43 0.00 1.01 0.00 0.00 58.87 56.61 2emi n SER 5 Cb 0.00 -0.44 -0.02 0.00 -1.01 0.00 0.00 64.21 62.73 2emi n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2emi s SER 6 N -3.61 6.83 0.00 6.43 0.15 -1.26 -4.96 113.70 117.28 2emi s SER 6 Ca 0.37 1.38 0.00 0.00 0.70 0.00 0.00 55.95 58.40 2emi s SER 6 Cb 0.38 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 62.15 2emi s SER 6 CO -0.02 -0.92 0.00 0.61 1.20 0.00 0.00 173.24 174.12 2emi n GLY 7 N 3.94 0.61 0.61 9.45 0.00 -1.26 -4.99 105.19 113.56 2emi n GLY 7 Ca 0.14 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.04 2emi n GLY 7 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2emi n THR 8 N -0.17 0.62 -0.03 2.61 -1.04 -1.26 -5.06 114.28 109.94 2emi n THR 8 Ca 0.00 -0.16 0.00 0.00 -2.04 0.00 0.00 64.05 61.85 2emi n THR 8 Cb 0.00 -1.60 0.00 0.00 -1.82 0.00 0.00 70.33 66.91 2emi n THR 8 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2emi n GLY 9 N 2.33 1.27 3.56 3.41 0.00 -1.26 -4.81 105.19 109.69 2emi n GLY 9 Ca -0.22 -1.51 -0.21 0.00 0.00 0.00 0.00 46.02 44.08 2emi n GLY 9 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2emi n GLU 10 N 0.00 -6.69 -0.08 1.61 2.13 -1.26 -4.92 120.64 111.43 2emi n GLU 10 Ca 0.00 0.79 -0.10 0.00 0.66 0.00 0.00 57.16 58.51 2emi n GLU 10 Cb 0.00 -5.74 -0.08 0.00 0.27 0.00 0.00 31.44 25.89 2emi n GLU 10 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 2emi n ARG 11 N -4.46 0.74 -2.42 5.31 0.63 -1.26 -4.96 116.66 110.23 2emi n ARG 11 Ca -0.18 0.07 -0.42 0.00 -0.92 0.00 0.00 57.85 56.40 2emi n ARG 11 Cb 0.63 -1.32 -0.03 0.00 0.45 0.00 0.00 32.46 32.19 2emi n ARG 11 CO 0.00 0.00 0.00 -3.38 -2.51 0.00 0.00 177.63 171.74 2emi s HIS 12 N -2.31 3.21 -0.39 -0.14 -3.43 -1.26 -4.89 115.29 106.08 2emi s HIS 12 Ca -0.18 1.19 -0.38 0.00 -0.80 0.00 0.00 55.06 54.89 2emi s HIS 12 Cb 0.05 -3.45 -0.17 0.00 -1.43 0.00 0.00 32.58 27.59 2emi s HIS 12 CO 0.40 -1.43 1.29 0.66 -2.00 0.00 0.00 174.74 173.66 2emi n TYR 13 N 4.90 1.40 -4.09 0.38 4.02 -1.17 -4.56 117.16 118.03 2emi n TYR 13 Ca 0.11 0.94 -0.30 0.00 -0.01 0.00 0.00 57.90 58.64 2emi n TYR 13 Cb 0.46 -1.83 -0.07 0.00 -0.02 0.00 0.00 39.34 37.87 2emi n TYR 13 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 2emi s GLU 14 N 2.32 2.70 -0.10 -0.72 8.01 -1.26 -1.29 118.70 128.35 2emi s GLU 14 Ca 0.86 -0.77 -0.23 0.00 0.01 0.00 0.00 54.97 54.84 2emi s GLU 14 Cb -1.23 -2.62 -0.03 0.00 -4.31 0.00 0.00 34.13 25.94 2emi s GLU 14 CO 0.66 0.55 0.70 0.00 0.01 0.00 0.00 175.26 177.19 2emi n SER 16 N 4.19 3.70 -0.03 0.00 7.64 -1.26 -2.52 113.62 125.34 2emi n SER 16 Ca -0.01 -2.72 -0.07 0.00 1.01 0.00 0.00 58.87 57.09 2emi n SER 16 Cb 0.51 -0.65 -0.03 0.00 -1.01 0.00 0.00 64.21 63.03 2emi n SER 16 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2emi n GLU 17 N 0.03 0.15 0.00 1.43 -0.58 -1.26 -4.92 120.64 115.49 2emi n GLU 17 Ca 0.24 0.06 0.00 0.00 -0.42 0.00 0.00 57.16 57.04 2emi n GLU 17 Cb 0.97 -0.84 0.00 0.00 -0.57 0.00 0.00 31.44 31.01 2emi n GLU 17 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2emi n GLY 19 N 2.95 1.61 3.75 0.00 0.00 -1.05 -5.06 105.19 107.39 2emi n GLY 19 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2emi n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2emi s LYS 20 N 0.00 4.58 -0.02 1.61 2.20 -1.26 -4.64 119.74 122.21 2emi s LYS 20 Ca 0.00 1.82 0.03 0.00 -0.36 0.00 0.00 55.97 57.45 2emi s LYS 20 Cb 0.00 -3.22 -0.03 0.00 -1.51 0.00 0.00 37.83 33.07 2emi s LYS 20 CO 0.00 0.09 -0.08 0.00 -0.36 0.00 0.00 175.35 175.00 2emi s ALA 21 N -0.67 2.93 -0.05 3.13 0.00 -1.26 0.55 121.76 126.40 2emi s ALA 21 Ca 0.48 -0.98 0.01 0.00 0.00 0.00 0.00 51.96 51.46 2emi s ALA 21 Cb -0.32 -1.12 0.02 0.00 0.00 0.00 0.00 23.12 21.71 2emi s ALA 21 CO 0.39 0.59 -0.03 -0.06 0.00 0.00 0.00 175.76 176.65 2emi s PHE 22 N -0.90 0.65 0.41 0.00 0.40 -0.41 -5.02 117.98 113.11 2emi s PHE 22 Ca 0.15 -0.16 0.15 0.00 -0.60 0.00 0.00 56.93 56.47 2emi s PHE 22 Cb -0.11 -0.63 1.01 0.00 0.51 0.00 0.00 43.02 43.80 2emi s PHE 22 CO 0.05 -0.20 1.89 0.97 0.70 0.00 0.00 175.22 178.62 2emi h ILE 23 N 6.19 0.76 -1.93 0.64 2.10 -1.92 -3.09 117.51 120.27 2emi h ILE 23 Ca -0.36 -0.16 -0.49 0.00 1.08 0.00 0.00 64.86 64.92 2emi h ILE 23 Cb 1.14 0.25 -0.04 0.00 -1.09 0.00 0.00 36.82 37.09 2emi h ILE 23 CO 0.44 0.09 -0.46 -1.10 -1.08 0.00 0.00 178.15 176.03 2emi s GLN 24 N -5.47 2.80 0.03 2.19 -1.52 -1.26 -4.67 119.66 111.75 2emi s GLN 24 Ca -0.08 -1.22 0.12 0.00 -1.95 0.00 0.00 55.36 52.23 2emi s GLN 24 Cb 0.22 -2.52 -0.19 0.00 -0.22 0.00 0.00 33.01 30.30 2emi s GLN 24 CO 0.78 0.17 0.89 -0.22 -0.25 0.00 0.00 175.29 176.65 2emi h LYS 25 N 1.29 0.00 -0.24 2.91 3.11 -1.96 -3.35 116.57 118.33 2emi h LYS 25 Ca -0.46 0.00 -0.10 0.00 -2.81 0.00 0.00 60.65 57.28 2emi h LYS 25 Cb 1.25 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 32.48 2emi h LYS 25 CO 0.59 0.59 -0.23 0.77 -2.81 0.00 0.00 179.45 178.35 2emi h SER 26 N 0.00 0.63 -0.30 4.20 0.02 -1.96 -2.32 113.55 113.82 2emi h SER 26 Ca -0.18 -0.47 0.09 0.00 -0.84 0.00 0.00 61.79 60.39 2emi h SER 26 Cb 1.85 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 64.20 2emi h SER 26 CO 0.09 0.97 0.22 0.74 -1.14 0.00 0.00 176.83 177.70 2emi h THR 27 N 0.30 0.80 0.14 -2.27 2.02 -1.97 -1.89 112.91 110.03 2emi h THR 27 Ca 0.04 0.00 -0.18 0.00 0.77 0.00 0.00 66.41 67.04 2emi h THR 27 Cb 0.78 0.84 0.02 0.00 -1.74 0.00 0.00 68.15 68.06 2emi h THR 27 CO 0.06 0.00 -0.80 0.25 0.37 0.00 0.00 175.52 175.40 2emi h LEU 28 N 0.00 0.46 -2.00 2.58 5.85 -1.65 -3.20 115.31 117.35 2emi h LEU 28 Ca 0.14 -0.95 0.10 0.00 0.84 0.00 0.00 57.88 58.01 2emi h LEU 28 Cb 0.59 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 2emi h LEU 28 CO -0.00 1.38 0.25 -1.28 -0.34 0.00 0.00 178.44 178.45 2emi h SER 29 N -0.37 0.00 1.54 1.25 0.87 -0.80 0.28 113.55 116.31 2emi h SER 29 Ca -0.14 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.37 2emi h SER 29 Cb 1.63 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.58 2emi h SER 29 CO 0.15 0.00 -0.24 0.00 -0.53 0.00 0.00 176.83 176.21 2emi h MET 30 N 0.00 0.00 0.01 2.24 -0.00 -1.45 -3.33 114.93 112.40 2emi h MET 30 Ca 0.16 0.00 -0.19 0.00 -0.00 0.00 0.00 59.70 59.67 2emi h MET 30 Cb 0.65 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.23 2emi h MET 30 CO -0.00 0.24 -1.02 1.25 -0.00 0.00 0.00 176.91 177.38 2emi h HIS 31 N 0.00 0.04 -0.29 -0.10 -0.00 -0.58 -3.34 115.15 110.88 2emi h HIS 31 Ca -0.00 -0.03 0.08 0.00 -0.00 0.00 0.00 60.37 60.42 2emi h HIS 31 Cb 1.08 -0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.47 2emi h HIS 31 CO 0.00 1.40 0.83 1.96 -0.00 0.00 0.00 177.93 182.12 2emi h GLN 32 N -0.93 0.00 -0.51 5.26 4.20 -0.90 0.80 115.11 123.03 2emi h GLN 32 Ca -0.27 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.33 2emi h GLN 32 Cb 1.29 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.05 2emi h GLN 32 CO -0.14 0.00 -0.09 0.07 -0.67 0.00 0.00 178.83 178.00 2emi h ARG 33 N 0.00 0.95 0.00 1.46 0.11 -1.68 -2.41 114.38 112.81 2emi h ARG 33 Ca 0.14 -0.35 0.00 0.00 0.10 0.00 0.00 59.98 59.87 2emi h ARG 33 Cb 1.80 -0.06 0.00 0.00 1.11 0.00 0.00 29.97 32.82 2emi h ARG 33 CO -0.00 1.01 0.00 -0.84 0.10 0.00 0.00 179.97 180.24 2emi h ILE 34 N 0.81 0.00 0.20 0.08 -0.00 0.42 0.22 117.51 119.25 2emi h ILE 34 Ca 0.13 -0.19 -0.34 0.00 -0.00 0.00 0.00 64.86 64.47 2emi h ILE 34 Cb 0.64 1.00 0.02 0.00 -0.00 0.00 0.00 36.82 38.47 2emi h ILE 34 CO 0.04 0.00 -1.63 0.45 -0.00 0.00 0.00 178.15 177.01 2emi h HIS 35 N 0.00 0.78 0.20 0.16 3.86 -1.46 -3.37 115.15 115.32 2emi h HIS 35 Ca 0.00 -0.57 -0.28 0.00 -1.16 0.00 0.00 60.37 58.35 2emi h HIS 35 Cb 0.22 -0.03 0.03 0.00 1.06 0.00 0.00 27.41 28.68 2emi h HIS 35 CO 0.00 1.63 -1.28 0.07 0.86 0.00 0.00 177.93 179.22 2emi h ARG 36 N 0.08 0.43 -6.63 2.45 0.11 -1.17 -3.47 114.38 106.18 2emi h ARG 36 Ca -0.31 -0.74 -0.45 0.00 0.10 0.00 0.00 59.98 58.58 2emi h ARG 36 Cb 2.09 0.27 0.24 0.00 1.11 0.00 0.00 29.97 33.68 2emi h ARG 36 CO 0.20 1.35 -1.17 0.41 0.10 0.00 0.00 179.97 180.86 2emi n GLY 37 N 1.72 -2.54 3.41 0.08 0.00 0.72 -4.94 105.19 103.65 2emi n GLY 37 Ca -0.17 -0.76 -0.29 0.00 0.00 0.00 0.00 46.02 44.81 2emi n GLY 37 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2emi n GLU 38 N -1.87 -2.73 -4.05 1.61 2.13 -1.26 -4.97 120.64 109.50 2emi n GLU 38 Ca 0.00 -0.77 -0.13 0.00 0.66 0.00 0.00 57.16 56.92 2emi n GLU 38 Cb 0.63 -2.08 -0.13 0.00 0.27 0.00 0.00 31.44 30.13 2emi n GLU 38 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2emi s LYS 39 N -4.31 0.35 -0.22 5.31 1.02 -1.26 -4.98 119.74 115.65 2emi s LYS 39 Ca 0.67 -0.36 -0.29 0.00 0.02 0.00 0.00 55.97 56.02 2emi s LYS 39 Cb -0.23 -0.23 -0.03 0.00 -0.52 0.00 0.00 37.83 36.82 2emi s LYS 39 CO 0.65 0.05 1.61 -1.25 -0.92 0.00 0.00 175.35 175.50 2emi s PRO 40 N -0.66 3.80 -0.12 -1.68 0.04 -1.26 -4.91 135.00 130.20 2emi s PRO 40 Ca -0.04 1.66 -0.10 0.00 0.04 0.00 0.00 61.00 62.56 2emi s PRO 40 Cb -0.05 -4.03 -0.08 0.00 0.04 0.00 0.00 34.50 30.38 2emi s PRO 40 CO -0.00 -1.29 0.21 0.77 0.04 0.00 0.00 177.00 176.73 2emi h SER 41 N 10.71 0.00 -0.98 6.66 0.02 -2.06 -3.46 113.55 124.44 2emi h SER 41 Ca -0.34 -0.30 -0.12 0.00 -0.84 0.00 0.00 61.79 60.20 2emi h SER 41 Cb 1.15 0.00 -0.17 0.00 0.14 0.00 0.00 62.40 63.52 2emi h SER 41 CO 1.00 0.69 -0.47 -0.83 -1.14 0.00 0.00 176.83 176.09 2emi s GLY 42 N -3.83 -1.28 0.31 -3.77 0.00 -1.26 -5.15 107.32 92.34 2emi s GLY 42 Ca -0.07 -0.18 -0.29 0.00 0.00 0.00 0.00 44.72 44.17 2emi s GLY 42 CO 0.23 3.68 1.23 2.56 0.00 0.00 0.00 173.10 180.80 2emi s PRO 43 N 1.19 4.46 -0.69 2.90 0.04 -1.26 -4.95 135.00 136.68 2emi s PRO 43 Ca 0.25 2.06 -0.27 0.00 0.04 0.00 0.00 61.00 63.08 2emi s PRO 43 Cb -0.01 -3.12 0.02 0.00 0.04 0.00 0.00 34.50 31.43 2emi s PRO 43 CO -0.06 -0.04 1.40 -1.12 0.04 0.00 0.00 177.00 177.22 2emi s SER 44 N -0.62 6.01 -0.11 6.66 0.01 -1.26 -4.84 113.70 119.54 2emi s SER 44 Ca 0.47 -0.22 -0.21 0.00 1.31 0.00 0.00 55.95 57.31 2emi s SER 44 Cb -0.37 -2.55 -0.27 0.00 0.21 0.00 0.00 66.02 63.04 2emi s SER 44 CO 0.48 -1.91 0.63 -1.28 0.41 0.00 0.00 173.24 171.57 2emi h SER 45 N 11.01 0.27 0.00 2.44 0.87 -2.07 -3.57 113.55 122.50 2emi h SER 45 Ca -0.27 -0.85 0.00 0.00 -1.23 0.00 0.00 61.79 59.43 2emi h SER 45 Cb 1.07 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.95 2emi h SER 45 CO 1.26 1.42 0.00 0.61 -0.53 0.00 0.00 176.83 179.59