#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2emi s SER 2 N 0.00 -0.49 0.26 1.61 0.15 -1.26 -5.16 113.70 108.82 2emi s SER 2 Ca 0.00 0.96 -0.15 0.00 0.70 0.00 0.00 55.95 57.47 2emi s SER 2 Cb 0.00 1.61 0.00 0.00 -1.71 0.00 0.00 66.02 65.93 2emi s SER 2 CO 0.00 -0.25 0.56 -0.44 1.20 0.00 0.00 173.24 174.31 2emi s SER 3 N 2.69 -0.10 0.00 5.45 0.01 -1.26 -5.11 113.70 115.39 2emi s SER 3 Ca 0.03 -0.87 0.00 0.00 1.31 0.00 0.00 55.95 56.42 2emi s SER 3 Cb -0.13 0.64 0.00 0.00 0.21 0.00 0.00 66.02 66.74 2emi s SER 3 CO -0.16 -1.22 0.00 0.61 0.41 0.00 0.00 173.24 172.88 2emi n GLY 4 N -0.42 -0.30 2.22 3.44 0.00 -1.26 -5.06 105.19 103.82 2emi n GLY 4 Ca -0.02 0.07 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 2emi n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2emi n SER 5 N 0.00 6.50 -4.03 1.61 2.88 -1.26 -4.85 113.62 114.47 2emi n SER 5 Ca 0.00 -3.77 -0.33 0.00 -1.33 0.00 0.00 58.87 53.44 2emi n SER 5 Cb 0.00 -0.71 -0.09 0.00 -0.75 0.00 0.00 64.21 62.66 2emi n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2emi s SER 6 N -2.58 5.49 0.00 -3.46 0.15 -1.26 -4.65 113.70 107.40 2emi s SER 6 Ca 0.58 -3.70 0.00 0.00 0.70 0.00 0.00 55.95 53.53 2emi s SER 6 Cb 0.46 -1.80 0.00 0.00 -1.71 0.00 0.00 66.02 62.97 2emi s SER 6 CO -0.00 -0.16 0.00 0.61 1.20 0.00 0.00 173.24 174.89 2emi n GLY 7 N 2.29 0.00 2.91 9.45 0.00 -1.26 -5.12 105.19 113.46 2emi n GLY 7 Ca 0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 2emi n GLY 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2emi s THR 8 N 0.00 2.26 0.00 2.61 -4.23 -1.26 -4.98 115.64 110.04 2emi s THR 8 Ca 0.00 -2.95 0.00 0.00 -1.18 0.00 0.00 61.69 57.56 2emi s THR 8 Cb 0.00 -2.59 0.00 0.00 1.34 0.00 0.00 72.50 71.25 2emi s THR 8 CO 0.00 -0.78 0.00 0.61 -0.54 0.00 0.00 174.62 173.91 2emi n GLY 9 N 3.45 1.34 3.33 3.99 0.00 -1.26 -4.98 105.19 111.06 2emi n GLY 9 Ca 0.05 -1.01 0.02 0.00 0.00 0.00 0.00 46.02 45.09 2emi n GLY 9 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2emi s GLU 10 N 0.00 0.19 0.87 1.61 2.56 -1.26 -5.16 118.70 117.52 2emi s GLU 10 Ca 0.00 0.48 -0.17 0.00 0.00 0.00 0.00 54.97 55.29 2emi s GLU 10 Cb 0.00 0.28 -0.11 0.00 2.00 0.00 0.00 34.13 36.30 2emi s GLU 10 CO 0.00 -0.07 -0.38 0.54 -0.56 0.00 0.00 175.26 174.80 2emi n ARG 11 N 4.77 -0.01 -3.98 4.30 3.00 -1.26 -5.01 116.66 118.47 2emi n ARG 11 Ca -0.08 0.01 -0.08 0.00 -0.01 0.00 0.00 57.85 57.69 2emi n ARG 11 Cb 0.54 -1.20 -0.09 0.00 0.00 0.00 0.00 32.46 31.71 2emi n ARG 11 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.63 174.25 2emi s HIS 12 N -2.05 0.34 -0.47 -1.55 -3.43 -1.26 -5.04 115.29 101.83 2emi s HIS 12 Ca 0.48 -0.81 -0.14 0.00 -0.80 0.00 0.00 55.06 53.80 2emi s HIS 12 Cb -0.26 -0.23 0.08 0.00 -1.43 0.00 0.00 32.58 30.74 2emi s HIS 12 CO 0.75 -0.44 0.37 0.71 -2.00 0.00 0.00 174.74 174.14 2emi s TYR 13 N -3.71 3.27 -0.04 0.38 1.51 -1.09 -4.94 117.35 112.74 2emi s TYR 13 Ca 0.04 -1.13 -0.01 0.00 -1.01 0.00 0.00 57.07 54.97 2emi s TYR 13 Cb 0.05 -3.19 -0.04 0.00 -0.11 0.00 0.00 41.96 38.68 2emi s TYR 13 CO -0.10 -0.84 0.04 -1.83 -1.11 0.00 0.00 175.55 171.72 2emi s GLU 14 N 1.58 3.00 0.74 -0.62 -1.05 -1.26 -1.85 118.70 119.25 2emi s GLU 14 Ca 0.04 -0.47 -0.15 0.00 -0.15 0.00 0.00 54.97 54.24 2emi s GLU 14 Cb -0.25 -2.82 0.02 0.00 -0.44 0.00 0.00 34.13 30.64 2emi s GLU 14 CO 0.05 0.67 0.96 0.00 0.95 0.00 0.00 175.26 177.89 2emi n SER 16 N -1.84 0.56 -0.07 0.00 2.88 -1.26 -3.71 113.62 110.17 2emi n SER 16 Ca 0.13 -0.78 -0.08 0.00 -1.33 0.00 0.00 58.87 56.81 2emi n SER 16 Cb 0.50 0.97 -0.04 0.00 -0.75 0.00 0.00 64.21 64.88 2emi n SER 16 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 2emi h GLU 17 N 0.07 0.00 0.04 -1.46 4.39 -1.97 -3.43 114.58 112.22 2emi h GLU 17 Ca 0.00 0.00 -0.35 0.00 0.34 0.00 0.00 59.36 59.35 2emi h GLU 17 Cb 0.27 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.87 2emi h GLU 17 CO 0.00 0.30 -1.94 0.00 -1.16 0.00 0.00 179.01 176.21 2emi n GLY 19 N 1.69 1.65 3.78 0.00 0.00 -1.24 -5.09 105.19 105.98 2emi n GLY 19 Ca -0.39 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.31 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 -0.04 2.61 0.02 1.61 2.20 -1.26 -4.71 119.74 120.17 2emi s LYS 20 Ca 0.00 1.21 0.08 0.00 -0.36 0.00 0.00 55.97 56.91 2emi s LYS 20 Cb 0.00 -1.94 -0.03 0.00 -1.51 0.00 0.00 37.83 34.36 2emi s LYS 20 CO 0.00 -1.37 -0.25 0.00 -0.36 0.00 0.00 175.35 173.37 2emi s ALA 21 N -2.71 2.27 0.12 3.13 0.00 -1.26 0.14 121.76 123.45 2emi s ALA 21 Ca 0.63 -1.20 0.03 0.00 0.00 0.00 0.00 51.96 51.41 2emi s ALA 21 Cb -0.18 -0.54 -0.04 0.00 0.00 0.00 0.00 23.12 22.36 2emi s ALA 21 CO 0.50 0.54 -0.07 -0.06 0.00 0.00 0.00 175.76 176.67 2emi s PHE 22 N -0.74 1.05 -0.08 0.00 0.40 -0.77 -4.94 117.98 112.89 2emi s PHE 22 Ca 0.11 -0.88 -0.13 0.00 -0.60 0.00 0.00 56.93 55.43 2emi s PHE 22 Cb -0.10 -0.58 -0.29 0.00 0.51 0.00 0.00 43.02 42.56 2emi s PHE 22 CO 0.01 -0.09 0.60 0.97 0.70 0.00 0.00 175.22 177.41 2emi h ILE 23 N 2.87 0.97 -3.17 0.64 6.09 -1.97 -2.87 117.51 120.07 2emi h ILE 23 Ca -0.36 -2.45 -0.63 0.00 -1.37 0.00 0.00 64.86 60.05 2emi h ILE 23 Cb 1.18 2.73 -0.11 0.00 0.47 0.00 0.00 36.82 41.09 2emi h ILE 23 CO 0.64 0.79 -0.65 -1.10 -3.07 0.00 0.00 178.15 174.75 2emi s GLN 24 N -2.53 2.54 -0.02 2.19 -0.21 -1.26 -4.54 119.66 115.84 2emi s GLN 24 Ca -0.18 -0.91 -0.25 0.00 0.02 0.00 0.00 55.36 54.04 2emi s GLN 24 Cb 0.05 -2.50 -0.19 0.00 1.00 0.00 0.00 33.01 31.37 2emi s GLN 24 CO 0.81 0.51 1.24 -0.22 -2.12 0.00 0.00 175.29 175.51 2emi h LYS 25 N 3.15 -0.09 -0.57 2.91 1.63 -1.91 -2.96 116.57 118.73 2emi h LYS 25 Ca -0.48 0.01 0.10 0.00 -0.85 0.00 0.00 60.65 59.43 2emi h LYS 25 Cb 1.18 0.02 -0.07 0.00 -0.60 0.00 0.00 32.23 32.75 2emi h LYS 25 CO 0.60 0.35 0.17 0.77 -3.45 0.00 0.00 179.45 177.88 2emi h SER 26 N -0.55 0.12 -1.00 4.20 0.02 -1.99 -0.81 113.55 113.54 2emi h SER 26 Ca -0.01 0.09 0.10 0.00 -0.84 0.00 0.00 61.79 61.13 2emi h SER 26 Cb 0.47 0.09 -0.08 0.00 0.14 0.00 0.00 62.40 63.03 2emi h SER 26 CO 0.02 0.08 0.64 0.74 -1.14 0.00 0.00 176.83 177.16 2emi h THR 27 N 0.33 0.97 -0.37 -2.27 2.02 -1.99 -1.82 112.91 109.79 2emi h THR 27 Ca 0.29 -0.36 -0.01 0.00 0.77 0.00 0.00 66.41 67.10 2emi h THR 27 Cb 0.39 -0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 66.61 2emi h THR 27 CO -0.33 0.19 0.19 0.25 0.37 0.00 0.00 175.52 176.19 2emi h LEU 28 N 1.05 0.47 -0.66 2.58 5.85 -0.99 -2.84 115.31 120.77 2emi h LEU 28 Ca 0.48 -0.11 0.11 0.00 0.84 0.00 0.00 57.88 59.20 2emi h LEU 28 Cb 0.40 -0.12 -0.08 0.00 0.37 0.00 0.00 40.66 41.22 2emi h LEU 28 CO -0.24 0.45 0.24 0.28 -0.34 0.00 0.00 178.44 178.83 2emi h SER 29 N 0.46 0.21 -0.42 1.25 0.02 -0.84 0.28 113.55 114.51 2emi h SER 29 Ca 0.13 0.10 0.12 0.00 -0.84 0.00 0.00 61.79 61.29 2emi h SER 29 Cb 0.09 0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.70 2emi h SER 29 CO -0.02 0.10 0.38 0.24 -1.14 0.00 0.00 176.83 176.40 2emi h MET 30 N 0.40 0.00 0.00 3.45 2.86 -1.24 -2.51 114.93 117.89 2emi h MET 30 Ca 0.35 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.88 2emi h MET 30 Cb 0.48 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.13 2emi h MET 30 CO -0.36 0.00 -0.87 1.58 1.06 0.00 0.00 176.91 178.32 2emi n HIS 31 N -3.98 0.97 -0.69 -0.22 -0.00 0.72 -4.15 115.22 107.87 2emi n HIS 31 Ca 0.07 0.42 0.52 0.00 -0.00 0.00 0.00 57.72 58.74 2emi n HIS 31 Cb 0.57 -0.93 0.81 0.00 -0.00 0.00 0.00 29.99 30.43 2emi n HIS 31 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.34 177.38 2emi n GLN 32 N -4.53 -0.00 -0.24 1.57 1.13 0.35 0.57 117.38 116.22 2emi n GLN 32 Ca -0.19 1.09 0.05 0.00 -1.94 0.00 0.00 57.00 56.00 2emi n GLN 32 Cb 0.46 -2.49 0.17 0.00 0.11 0.00 0.00 30.24 28.49 2emi n GLN 32 CO 0.00 0.00 0.00 0.07 -1.44 0.00 0.00 177.06 175.69 2emi h ARG 33 N 0.00 0.27 -1.40 -1.09 0.11 -1.62 0.18 114.38 110.83 2emi h ARG 33 Ca 0.93 -0.02 0.41 0.00 0.10 0.00 0.00 59.98 61.41 2emi h ARG 33 Cb 3.70 -0.06 -0.07 0.00 1.11 0.00 0.00 29.97 34.64 2emi h ARG 33 CO -0.05 0.18 0.98 -0.84 0.10 0.00 0.00 179.97 180.35 2emi h ILE 34 N 0.28 0.27 0.01 0.08 3.07 -0.12 1.32 117.51 122.42 2emi h ILE 34 Ca 0.39 -0.02 -0.22 0.00 1.55 0.00 0.00 64.86 66.56 2emi h ILE 34 Cb 0.65 0.20 -0.03 0.00 -0.27 0.00 0.00 36.82 37.38 2emi h ILE 34 CO -0.48 0.01 -1.06 0.45 -1.05 0.00 0.00 178.15 176.02 2emi h HIS 35 N 0.06 0.05 -2.12 0.16 3.86 -0.81 -3.45 115.15 112.90 2emi h HIS 35 Ca 0.71 -0.04 -0.60 0.00 -1.16 0.00 0.00 60.37 59.28 2emi h HIS 35 Cb 2.63 -0.00 0.03 0.00 1.06 0.00 0.00 27.41 31.13 2emi h HIS 35 CO -0.00 1.03 1.01 0.54 0.86 0.00 0.00 177.93 181.37 2emi n ARG 36 N -3.36 2.21 0.00 2.45 5.12 0.45 -4.72 116.66 118.81 2emi n ARG 36 Ca -0.02 0.80 0.00 0.00 -1.93 0.00 0.00 57.85 56.71 2emi n ARG 36 Cb 0.95 -2.63 0.00 0.00 -1.16 0.00 0.00 32.46 29.62 2emi n ARG 36 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2emi n GLY 37 N 4.11 -0.29 3.91 -0.13 0.00 -1.26 -5.02 105.19 106.51 2emi n GLY 37 Ca 0.21 -0.81 -0.29 0.00 0.00 0.00 0.00 46.02 45.13 2emi n GLY 37 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2emi s GLU 38 N -2.00 3.58 0.18 1.61 4.04 -1.26 -5.11 118.70 119.73 2emi s GLU 38 Ca 0.00 -0.17 0.08 0.00 0.04 0.00 0.00 54.97 54.92 2emi s GLU 38 Cb 0.00 -2.79 -0.04 0.00 0.02 0.00 0.00 34.13 31.32 2emi s GLU 38 CO 0.00 0.37 -0.16 0.15 -1.84 0.00 0.00 175.26 173.78 2emi s LYS 39 N -3.18 1.26 0.75 -4.83 -0.14 -1.26 -5.14 119.74 107.19 2emi s LYS 39 Ca 0.41 -1.46 -0.12 0.00 -1.36 0.00 0.00 55.97 53.44 2emi s LYS 39 Cb -0.11 -1.17 0.04 0.00 -1.68 0.00 0.00 37.83 34.91 2emi s LYS 39 CO 0.28 0.22 1.10 -1.25 -0.76 0.00 0.00 175.35 174.93 2emi s PRO 40 N -3.16 2.38 0.10 -1.68 0.04 -1.26 -4.97 135.00 126.45 2emi s PRO 40 Ca 0.18 1.22 -0.34 0.00 0.04 0.00 0.00 61.00 62.10 2emi s PRO 40 Cb -0.03 -1.91 -0.14 0.00 0.04 0.00 0.00 34.50 32.46 2emi s PRO 40 CO 0.06 -1.56 1.57 1.03 0.04 0.00 0.00 177.00 178.15 2emi h SER 41 N -0.86 -1.35 0.00 6.66 0.87 -2.02 -3.48 113.55 113.37 2emi h SER 41 Ca -0.44 0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.25 2emi h SER 41 Cb 1.23 0.48 0.00 0.00 -0.44 0.00 0.00 62.40 63.67 2emi h SER 41 CO 0.52 -0.58 0.00 0.61 -0.53 0.00 0.00 176.83 176.85 2emi n GLY 42 N -1.51 3.02 0.00 5.77 0.00 -1.26 -4.91 105.19 106.30 2emi n GLY 42 Ca -0.10 -0.56 0.06 0.00 0.00 0.00 0.00 46.02 45.42 2emi n GLY 42 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2emi n PRO 43 N 0.00 0.49 -0.92 1.61 -0.04 -1.26 -4.86 135.00 130.02 2emi n PRO 43 Ca 0.00 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.03 2emi n PRO 43 Cb 0.00 -1.36 -0.09 0.00 -0.04 0.00 0.00 33.50 32.02 2emi n PRO 43 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2emi n SER 44 N -0.86 0.53 -4.29 3.54 7.64 -1.26 -4.84 113.62 114.09 2emi n SER 44 Ca 0.08 0.48 -0.45 0.00 1.01 0.00 0.00 58.87 59.99 2emi n SER 44 Cb 0.04 -0.66 -0.05 0.00 -1.01 0.00 0.00 64.21 62.53 2emi n SER 44 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2emi s SER 45 N 4.48 6.19 0.00 6.43 1.04 -1.26 -5.17 113.70 125.41 2emi s SER 45 Ca 0.88 -2.06 0.00 0.00 0.48 0.00 0.00 55.95 55.25 2emi s SER 45 Cb -1.08 -2.16 0.00 0.00 0.10 0.00 0.00 66.02 62.88 2emi s SER 45 CO 0.47 -0.75 0.00 0.61 0.98 0.00 0.00 173.24 174.56