#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eme s SER 2 N 0.00 7.21 -0.06 1.61 0.01 -1.26 -4.91 113.70 116.30 2eme s SER 2 Ca 0.00 1.74 -0.03 0.00 1.31 0.00 0.00 55.95 58.97 2eme s SER 2 Cb 0.00 -2.57 -0.03 0.00 0.21 0.00 0.00 66.02 63.64 2eme s SER 2 CO 0.00 -0.42 -0.08 -0.24 0.41 0.00 0.00 173.24 172.91 2eme n SER 3 N 4.46 0.45 -4.32 2.44 2.88 -1.26 -5.02 113.62 113.25 2eme n SER 3 Ca 0.08 0.08 -0.33 0.00 -1.33 0.00 0.00 58.87 57.37 2eme n SER 3 Cb 0.48 -0.18 -0.15 0.00 -0.75 0.00 0.00 64.21 63.61 2eme n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2eme s GLY 4 N -5.07 1.52 -0.23 0.46 0.00 -1.26 -5.10 107.32 97.64 2eme s GLY 4 Ca -0.08 -0.99 -0.26 0.00 0.00 0.00 0.00 44.72 43.39 2eme s GLY 4 CO 0.10 -0.03 0.83 -1.35 0.00 0.00 0.00 173.10 172.65 2eme s SER 5 N 0.67 -0.62 0.16 1.64 1.04 -1.26 -5.18 113.70 110.16 2eme s SER 5 Ca -0.07 1.08 -0.09 0.00 0.48 0.00 0.00 55.95 57.36 2eme s SER 5 Cb -0.15 1.06 -0.01 0.00 0.10 0.00 0.00 66.02 67.02 2eme s SER 5 CO 0.02 -0.28 0.29 -0.44 0.98 0.00 0.00 173.24 173.81 2eme s SER 6 N -0.02 0.03 -0.68 7.02 0.01 -1.26 -5.12 113.70 113.69 2eme s SER 6 Ca -0.01 -0.85 -0.04 0.00 1.31 0.00 0.00 55.95 56.36 2eme s SER 6 Cb -0.04 0.44 0.17 0.00 0.21 0.00 0.00 66.02 66.81 2eme s SER 6 CO 0.00 -0.90 0.51 -0.83 0.41 0.00 0.00 173.24 172.43 2eme s GLY 7 N -2.96 2.58 -0.04 3.44 0.00 -1.26 -5.04 107.32 104.04 2eme s GLY 7 Ca 0.17 -3.34 -0.05 0.00 0.00 0.00 0.00 44.72 41.50 2eme s GLY 7 CO -0.00 1.13 0.13 -0.45 0.00 0.00 0.00 173.10 173.90 2eme s SER 8 N 0.74 -0.12 0.00 1.64 0.15 -1.26 -5.06 113.70 109.80 2eme s SER 8 Ca 0.18 0.22 0.00 0.00 0.70 0.00 0.00 55.95 57.06 2eme s SER 8 Cb -0.18 0.26 0.00 0.00 -1.71 0.00 0.00 66.02 64.39 2eme s SER 8 CO -0.05 -0.06 0.00 0.61 1.20 0.00 0.00 173.24 174.94 2eme n GLY 9 N 2.92 -0.66 3.91 9.45 0.00 -1.26 -5.13 105.19 114.42 2eme n GLY 9 Ca -0.13 -0.71 -0.25 0.00 0.00 0.00 0.00 46.02 44.93 2eme n GLY 9 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2eme s GLU 10 N -0.30 2.27 0.04 1.61 -1.05 -1.26 -5.15 118.70 114.86 2eme s GLU 10 Ca 0.00 -1.96 0.03 0.00 -0.15 0.00 0.00 54.97 52.89 2eme s GLU 10 Cb 0.00 -2.17 -0.02 0.00 -0.44 0.00 0.00 34.13 31.50 2eme s GLU 10 CO 0.00 -0.62 -0.09 0.15 0.95 0.00 0.00 175.26 175.66 2eme s LYS 11 N -4.31 0.57 0.04 -4.83 -0.14 -1.26 -4.98 119.74 104.83 2eme s LYS 11 Ca 0.38 -0.74 -0.20 0.00 -1.36 0.00 0.00 55.97 54.05 2eme s LYS 11 Cb -0.03 -0.38 -0.14 0.00 -1.68 0.00 0.00 37.83 35.60 2eme s LYS 11 CO 0.23 0.08 1.35 -1.00 -0.76 0.00 0.00 175.35 175.24 2eme h PRO 12 N 4.60 0.36 -6.98 -1.68 0.13 -1.86 -3.45 132.00 123.12 2eme h PRO 12 Ca -0.36 -0.19 -0.45 0.00 -0.87 0.00 0.00 66.00 64.13 2eme h PRO 12 Cb 1.20 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 2eme h PRO 12 CO 0.41 0.75 0.30 0.71 -0.23 0.00 0.00 178.00 179.94 2eme s TYR 13 N -4.30 3.37 -0.22 1.56 2.02 -0.93 -4.98 117.35 113.88 2eme s TYR 13 Ca -0.14 1.57 -0.12 0.00 -0.37 0.00 0.00 57.07 58.01 2eme s TYR 13 Cb 0.05 -2.81 0.07 0.00 -0.40 0.00 0.00 41.96 38.88 2eme s TYR 13 CO 0.76 -0.03 0.53 0.08 -1.57 0.00 0.00 175.55 175.32 2eme s VAL 14 N -2.07 -0.09 -1.27 0.71 1.01 -1.26 -1.64 120.40 115.79 2eme s VAL 14 Ca 0.59 0.06 -0.19 0.00 0.00 0.00 0.00 61.98 62.44 2eme s VAL 14 Cb -0.10 -0.79 0.02 0.00 0.00 0.00 0.00 36.38 35.51 2eme s VAL 14 CO 0.15 0.02 1.84 0.00 0.00 0.00 0.00 175.10 177.12 2eme n ASP 16 N 9.33 0.07 -0.04 0.00 9.92 -1.26 0.16 116.55 134.73 2eme n ASP 16 Ca 0.49 1.08 -0.08 0.00 -0.53 0.00 0.00 54.79 55.75 2eme n ASP 16 Cb 0.45 -0.54 -0.05 0.00 -0.64 0.00 0.00 41.12 40.34 2eme n ASP 16 CO 0.00 0.00 0.00 0.22 0.13 0.00 0.00 177.20 177.55 2eme h TYR 17 N 0.00 -0.92 0.00 1.24 5.03 -1.97 -3.34 116.97 117.01 2eme h TYR 17 Ca 0.89 0.04 -0.43 0.00 2.58 0.00 0.00 58.73 61.81 2eme h TYR 17 Cb 3.34 0.42 -0.07 0.00 1.55 0.00 0.00 36.73 41.97 2eme h TYR 17 CO -0.00 -0.29 -2.49 0.00 -1.32 0.00 0.00 178.16 174.06 2eme n GLY 19 N 1.76 1.32 3.97 0.00 0.00 0.12 -5.04 105.19 107.33 2eme n GLY 19 Ca -0.50 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.31 2eme n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2eme s LYS 20 N 0.00 2.80 0.17 1.61 2.20 -1.24 -4.64 119.74 120.64 2eme s LYS 20 Ca 0.00 -0.78 0.11 0.00 -0.36 0.00 0.00 55.97 54.94 2eme s LYS 20 Cb 0.00 -2.58 -0.04 0.00 -1.51 0.00 0.00 37.83 33.70 2eme s LYS 20 CO 0.00 -0.43 -0.22 0.00 -0.36 0.00 0.00 175.35 174.34 2eme s ALA 21 N -2.58 2.58 -0.19 3.13 0.00 -1.26 -1.02 121.76 122.42 2eme s ALA 21 Ca 0.53 -1.54 -0.16 0.00 0.00 0.00 0.00 51.96 50.79 2eme s ALA 21 Cb -0.10 -0.44 0.05 0.00 0.00 0.00 0.00 23.12 22.63 2eme s ALA 21 CO 0.37 0.48 0.50 -0.06 0.00 0.00 0.00 175.76 177.05 2eme s PHE 22 N -1.47 -0.59 0.13 0.00 0.40 -0.65 -4.94 117.98 110.85 2eme s PHE 22 Ca 0.20 1.38 -0.01 0.00 -0.60 0.00 0.00 56.93 57.90 2eme s PHE 22 Cb -0.09 0.23 -0.12 0.00 0.51 0.00 0.00 43.02 43.54 2eme s PHE 22 CO 0.10 -0.29 1.28 0.78 0.70 0.00 0.00 175.22 177.79 2eme h GLY 23 N 5.74 0.28 -1.96 4.36 0.00 -1.94 -2.47 103.07 107.08 2eme h GLY 23 Ca -0.29 -0.56 -0.51 0.00 0.00 0.00 0.00 47.33 45.96 2eme h GLY 23 CO 0.21 0.49 -0.37 1.08 0.00 0.00 0.00 176.54 177.95 2eme s LEU 24 N -7.35 3.25 -0.15 3.11 1.02 -1.26 -4.73 118.68 112.57 2eme s LEU 24 Ca -0.03 -0.86 -0.22 0.00 0.02 0.00 0.00 54.13 53.03 2eme s LEU 24 Cb 0.09 -1.84 -0.20 0.00 0.02 0.00 0.00 46.19 44.26 2eme s LEU 24 CO 0.85 -0.73 0.51 0.77 0.02 0.00 0.00 176.35 177.77 2eme h SER 25 N 1.00 0.00 -0.79 2.29 4.64 -2.01 -3.30 113.55 115.39 2eme h SER 25 Ca -0.40 -0.72 0.11 0.00 -0.47 0.00 0.00 61.79 60.31 2eme h SER 25 Cb 1.27 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.28 2eme h SER 25 CO 0.58 1.00 0.41 0.00 -0.87 0.00 0.00 176.83 177.96 2eme h ALA 26 N -0.28 1.13 -0.99 5.18 0.00 -1.99 -0.67 119.26 121.63 2eme h ALA 26 Ca -0.06 0.06 0.12 0.00 0.00 0.00 0.00 54.91 55.03 2eme h ALA 26 Cb 0.88 -0.06 -0.09 0.00 0.00 0.00 0.00 17.79 18.53 2eme h ALA 26 CO -0.04 -0.02 0.62 0.93 0.00 0.00 0.00 179.25 180.74 2eme h GLU 27 N 0.66 0.94 -0.03 0.00 5.08 -1.99 0.21 114.58 119.45 2eme h GLU 27 Ca 0.40 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.70 2eme h GLU 27 Cb 0.46 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 2eme h GLU 27 CO -0.30 0.62 -0.02 1.25 -1.00 0.00 0.00 179.01 179.57 2eme h LEU 28 N 0.97 0.06 -0.85 1.33 5.85 -1.23 -2.09 115.31 119.35 2eme h LEU 28 Ca 0.50 -0.45 0.02 0.00 0.84 0.00 0.00 57.88 58.79 2eme h LEU 28 Cb 0.51 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.47 2eme h LEU 28 CO -0.27 0.50 0.56 0.58 -0.34 0.00 0.00 178.44 179.46 2eme h VAL 29 N -0.37 1.17 0.00 1.05 2.07 -0.75 -1.11 116.25 118.31 2eme h VAL 29 Ca 0.01 -0.38 -0.05 0.00 0.82 0.00 0.00 66.70 67.10 2eme h VAL 29 Cb 0.48 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 2eme h VAL 29 CO 0.01 0.20 -0.23 0.03 0.02 0.00 0.00 177.57 177.60 2eme h ARG 30 N 1.11 0.00 -0.01 1.57 -0.00 -0.61 -3.09 114.38 113.35 2eme h ARG 30 Ca 0.33 0.00 -0.02 0.00 -0.50 0.00 0.00 59.98 59.79 2eme h ARG 30 Cb -0.06 0.00 0.00 0.00 0.00 0.00 0.00 29.97 29.91 2eme h ARG 30 CO -0.09 0.23 -0.06 1.25 0.00 0.00 0.00 179.97 181.30 2eme h HIS 31 N 0.00 0.08 0.00 3.04 -0.00 -0.50 -3.09 115.15 114.68 2eme h HIS 31 Ca -0.00 -0.04 0.00 0.00 -0.00 0.00 0.00 60.37 60.33 2eme h HIS 31 Cb 0.57 -0.01 0.00 0.00 -0.00 0.00 0.00 27.41 27.96 2eme h HIS 31 CO 0.00 0.72 0.31 1.96 -0.00 0.00 0.00 177.93 180.92 2eme h GLN 32 N -0.59 0.00 -0.93 5.26 4.20 -1.26 -1.16 115.11 120.64 2eme h GLN 32 Ca -0.00 0.00 0.17 0.00 0.06 0.00 0.00 58.65 58.88 2eme h GLN 32 Cb 0.73 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 28.43 2eme h GLN 32 CO 0.01 0.00 0.59 0.00 -0.67 0.00 0.00 178.83 178.77 2eme h ARG 33 N 0.00 0.60 0.00 1.46 2.47 -1.57 0.52 114.38 117.86 2eme h ARG 33 Ca 0.00 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.68 2eme h ARG 33 Cb 0.61 -0.14 0.00 0.00 -1.65 0.00 0.00 29.97 28.79 2eme h ARG 33 CO 0.00 0.40 0.00 -0.84 0.56 0.00 0.00 179.97 180.09 2eme h ILE 34 N 0.62 0.00 0.00 2.04 -2.65 -1.43 -1.51 117.51 114.58 2eme h ILE 34 Ca 0.49 -0.23 -0.05 0.00 1.03 0.00 0.00 64.86 66.10 2eme h ILE 34 Cb 0.91 1.11 -0.01 0.00 -2.05 0.00 0.00 36.82 36.79 2eme h ILE 34 CO -0.24 0.00 -0.56 0.45 0.03 0.00 0.00 178.15 177.83 2eme h HIS 35 N 0.00 0.00 -3.60 0.16 3.86 -0.15 -3.43 115.15 111.99 2eme h HIS 35 Ca 0.00 0.00 -0.71 0.00 -1.16 0.00 0.00 60.37 58.50 2eme h HIS 35 Cb 0.25 0.00 -0.25 0.00 1.06 0.00 0.00 27.41 28.47 2eme h HIS 35 CO 0.00 0.19 -0.53 0.95 0.86 0.00 0.00 177.93 179.41 2eme s THR 36 N -3.16 4.47 0.00 2.45 -4.23 -0.57 -4.90 115.64 109.71 2eme s THR 36 Ca 0.03 -0.90 0.00 0.00 -1.18 0.00 0.00 61.69 59.64 2eme s THR 36 Cb 0.07 -3.50 0.00 0.00 1.34 0.00 0.00 72.50 70.41 2eme s THR 36 CO 0.74 -0.23 0.00 0.61 -0.54 0.00 0.00 174.62 175.20 2eme n GLY 37 N 4.97 0.39 3.96 3.99 0.00 -1.26 -4.92 105.19 112.32 2eme n GLY 37 Ca -0.12 -1.20 -0.20 0.00 0.00 0.00 0.00 46.02 44.50 2eme n GLY 37 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2eme s GLU 38 N 0.00 2.54 -0.66 1.61 2.02 -1.26 -5.09 118.70 117.86 2eme s GLU 38 Ca 0.00 -1.53 0.05 0.00 0.02 0.00 0.00 54.97 53.51 2eme s GLU 38 Cb 0.00 -2.53 0.16 0.00 0.10 0.00 0.00 34.13 31.86 2eme s GLU 38 CO 0.00 -0.44 0.44 0.15 0.02 0.00 0.00 175.26 175.43 2eme s LYS 39 N -4.35 2.34 0.05 1.61 3.01 -1.26 -4.74 119.74 116.41 2eme s LYS 39 Ca 0.52 -3.17 -0.19 0.00 -1.01 0.00 0.00 55.97 52.12 2eme s LYS 39 Cb -0.06 -3.40 -0.13 0.00 -1.01 0.00 0.00 37.83 33.23 2eme s LYS 39 CO 0.31 -1.24 1.36 -1.00 0.51 0.00 0.00 175.35 175.30 2eme h PRO 40 N 5.67 0.43 -3.29 -1.68 0.13 -1.98 -3.45 132.00 127.83 2eme h PRO 40 Ca 0.09 -0.23 -0.20 0.00 -0.87 0.00 0.00 66.00 64.79 2eme h PRO 40 Cb 0.79 0.01 -0.28 0.00 0.13 0.00 0.00 31.00 31.64 2eme h PRO 40 CO 0.71 0.79 -0.55 -1.12 -0.23 0.00 0.00 178.00 177.61 2eme s SER 41 N -6.22 -0.16 0.25 1.44 0.01 -1.26 -5.15 113.70 102.61 2eme s SER 41 Ca -0.14 0.33 -0.18 0.00 1.31 0.00 0.00 55.95 57.28 2eme s SER 41 Cb 0.06 0.29 -0.08 0.00 0.21 0.00 0.00 66.02 66.50 2eme s SER 41 CO 0.77 -0.09 0.72 -0.83 0.41 0.00 0.00 173.24 174.22 2eme s GLY 42 N 0.49 2.53 -0.20 3.44 0.00 -1.26 -5.01 107.32 107.30 2eme s GLY 42 Ca -0.03 0.12 -0.29 0.00 0.00 0.00 0.00 44.72 44.51 2eme s GLY 42 CO -0.02 0.43 1.60 2.56 0.00 0.00 0.00 173.10 177.66 2eme s PRO 43 N -2.27 3.86 -0.22 2.90 0.04 -1.26 -4.89 135.00 133.17 2eme s PRO 43 Ca 0.46 1.72 -0.10 0.00 0.04 0.00 0.00 61.00 63.11 2eme s PRO 43 Cb -0.15 -4.01 -0.18 0.00 0.04 0.00 0.00 34.50 30.20 2eme s PRO 43 CO 0.20 -1.21 -0.02 -1.13 0.04 0.00 0.00 177.00 174.88 2eme n SER 44 N 8.20 1.98 0.00 6.66 3.41 -1.26 -4.60 113.62 128.01 2eme n SER 44 Ca 0.18 0.21 -0.11 0.00 -0.26 0.00 0.00 58.87 58.90 2eme n SER 44 Cb 0.45 -0.77 -0.09 0.00 -0.26 0.00 0.00 64.21 63.55 2eme n SER 44 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2eme h SER 45 N -0.50 -0.09 0.00 4.04 0.87 -2.00 -3.54 113.55 112.33 2eme h SER 45 Ca -0.52 -0.50 0.00 0.00 -1.23 0.00 0.00 61.79 59.53 2eme h SER 45 Cb 1.71 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.69 2eme h SER 45 CO -0.17 0.56 0.00 0.61 -0.53 0.00 0.00 176.83 177.30