#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bbx h SER 2 N 0.00 0.00 -5.24 1.61 0.02 -2.10 -3.45 113.55 104.39 2bbx h SER 2 Ca 0.00 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.87 2bbx h SER 2 Cb 0.00 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 62.43 2bbx h SER 2 CO 0.00 0.00 -0.22 0.00 -1.14 0.00 0.00 176.83 175.47 2bbx s ALA 3 N -3.62 -0.16 0.95 3.77 0.00 -1.26 -5.18 121.76 116.26 2bbx s ALA 3 Ca 0.01 -0.81 -0.11 0.00 0.00 0.00 0.00 51.96 51.05 2bbx s ALA 3 Cb 0.09 0.95 0.16 0.00 0.00 0.00 0.00 23.12 24.32 2bbx s ALA 3 CO 0.46 -0.73 1.10 -1.12 0.00 0.00 0.00 175.76 175.47 2bbx s SER 4 N -2.98 2.80 -0.04 0.00 0.01 -1.26 -5.02 113.70 107.22 2bbx s SER 4 Ca 0.18 1.84 0.05 0.00 1.31 0.00 0.00 55.95 59.33 2bbx s SER 4 Cb 0.02 -2.42 0.08 0.00 0.21 0.00 0.00 66.02 63.91 2bbx s SER 4 CO 0.03 -3.12 0.97 0.00 0.41 0.00 0.00 173.24 171.52 2bbx n GLY 6 N -0.64 0.52 3.13 0.00 0.00 -1.26 -1.13 105.19 105.81 2bbx n GLY 6 Ca 0.04 -2.23 -0.09 0.00 0.00 0.00 0.00 46.02 43.74 2bbx n GLY 6 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2bbx s VAL 7 N -0.58 0.37 0.80 1.61 -7.23 -1.26 -5.06 120.40 109.05 2bbx s VAL 7 Ca 0.00 -1.87 -0.12 0.00 -1.81 0.00 0.00 61.98 58.18 2bbx s VAL 7 Cb 0.00 -1.69 0.07 0.00 0.56 0.00 0.00 36.38 35.32 2bbx s VAL 7 CO 0.00 -0.84 1.10 0.26 -0.31 0.00 0.00 175.10 175.31 2bbx s TRP 8 N -3.84 2.84 0.00 2.82 0.52 -1.26 -4.60 118.94 115.43 2bbx s TRP 8 Ca 0.12 1.11 0.00 0.00 0.02 0.00 0.00 56.10 57.36 2bbx s TRP 8 Cb 0.07 -3.15 0.00 0.00 -1.15 0.00 0.00 33.47 29.24 2bbx s TRP 8 CO -0.06 -1.78 0.00 -3.47 0.02 0.00 0.00 176.95 171.66 2bbx n ASP 9 N -3.43 0.00 -4.76 2.95 2.03 -1.22 -5.05 116.55 107.08 2bbx n ASP 9 Ca 0.07 -0.83 -0.38 0.00 0.52 0.00 0.00 54.79 54.17 2bbx n ASP 9 Cb 0.57 0.00 0.02 0.00 -0.72 0.00 0.00 41.12 40.98 2bbx n ASP 9 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 2bbx s GLU 10 N -1.16 3.46 0.94 -0.67 2.02 -1.26 -4.95 118.70 117.08 2bbx s GLU 10 Ca 0.00 2.07 -0.12 0.00 0.02 0.00 0.00 54.97 56.94 2bbx s GLU 10 Cb 0.00 -2.37 0.16 0.00 0.10 0.00 0.00 34.13 32.02 2bbx s GLU 10 CO 0.00 -0.89 1.09 -1.58 0.02 0.00 0.00 175.26 173.90 2bbx s TRP 11 N -1.38 2.17 0.36 1.61 0.52 -1.26 -4.76 118.94 116.20 2bbx s TRP 11 Ca 0.67 1.19 0.08 0.00 0.02 0.00 0.00 56.10 58.07 2bbx s TRP 11 Cb -0.36 -3.19 -0.05 0.00 -1.15 0.00 0.00 33.47 28.71 2bbx s TRP 11 CO 0.44 -2.65 0.07 -1.54 0.02 0.00 0.00 176.95 173.28 2bbx s SER 12 N -3.35 4.26 0.79 2.95 1.04 -0.94 -5.03 113.70 113.43 2bbx s SER 12 Ca 0.64 -1.03 -0.11 0.00 0.48 0.00 0.00 55.95 55.94 2bbx s SER 12 Cb -0.19 -0.52 0.07 0.00 0.10 0.00 0.00 66.02 65.48 2bbx s SER 12 CO 0.58 -0.34 1.09 -2.16 0.98 0.00 0.00 173.24 173.38 2bbx s PRO 13 N -3.77 2.11 0.69 4.02 0.04 -1.26 -4.46 135.00 132.37 2bbx s PRO 13 Ca 0.37 1.02 -0.14 0.00 0.04 0.00 0.00 61.00 62.28 2bbx s PRO 13 Cb 0.02 -1.89 0.02 0.00 0.04 0.00 0.00 34.50 32.68 2bbx s PRO 13 CO 0.20 -1.70 1.11 0.00 0.04 0.00 0.00 177.00 176.65 2bbx h SER 15 N -0.23 0.00 -5.43 0.00 4.64 -1.30 -3.45 113.55 107.78 2bbx h SER 15 Ca -0.46 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 60.68 2bbx h SER 15 Cb 1.25 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.19 2bbx h SER 15 CO 0.53 0.00 -0.58 0.68 -0.87 0.00 0.00 176.83 176.59 2bbx s VAL 16 N -3.73 0.07 -0.40 0.95 -7.23 -1.26 -4.99 120.40 103.80 2bbx s VAL 16 Ca -0.01 -1.84 -0.00 0.00 -1.81 0.00 0.00 61.98 58.32 2bbx s VAL 16 Cb 0.10 -2.12 0.35 0.00 0.56 0.00 0.00 36.38 35.27 2bbx s VAL 16 CO 0.38 -0.32 1.89 0.35 -0.31 0.00 0.00 175.10 177.09 2bbx n THR 17 N -0.16 2.90 -3.81 5.32 -2.24 -1.26 -4.88 114.28 110.15 2bbx n THR 17 Ca -0.04 -1.86 -0.09 0.00 -2.27 0.00 0.00 64.05 59.79 2bbx n THR 17 Cb 0.64 -1.06 -0.04 0.00 -2.10 0.00 0.00 70.33 67.77 2bbx n THR 17 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bbx n GLY 19 N -0.34 2.32 1.25 0.00 0.00 -1.02 -4.03 105.19 103.37 2bbx n GLY 19 Ca -0.08 -0.52 0.04 0.00 0.00 0.00 0.00 46.02 45.46 2bbx n GLY 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2bbx n LYS 20 N 2.17 0.33 -0.42 1.61 5.02 -1.26 -4.85 118.16 120.77 2bbx n LYS 20 Ca 0.19 -2.21 0.00 0.00 -2.02 0.00 0.00 58.31 54.27 2bbx n LYS 20 Cb 0.57 -0.36 0.00 0.00 -0.02 0.00 0.00 35.03 35.21 2bbx n LYS 20 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2bbx n GLY 21 N 0.13 3.54 3.20 0.72 0.00 -1.26 -4.95 105.19 106.57 2bbx n GLY 21 Ca 0.08 -1.09 -0.13 0.00 0.00 0.00 0.00 46.02 44.88 2bbx n GLY 21 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bbx s THR 22 N -2.34 0.97 0.25 2.61 -4.23 -1.26 -1.33 115.64 110.30 2bbx s THR 22 Ca 0.00 -1.86 0.05 0.00 -1.18 0.00 0.00 61.69 58.70 2bbx s THR 22 Cb 0.00 -1.61 -0.05 0.00 1.34 0.00 0.00 72.50 72.17 2bbx s THR 22 CO 0.00 -0.70 -0.04 0.00 -0.54 0.00 0.00 174.62 173.34 2bbx s ARG 23 N -3.39 1.41 0.18 3.99 1.70 -0.19 -0.76 118.95 121.90 2bbx s ARG 23 Ca 0.11 -1.71 -0.03 0.00 -0.47 0.00 0.00 55.73 53.63 2bbx s ARG 23 Cb 0.01 -0.86 -0.03 0.00 -0.57 0.00 0.00 34.95 33.50 2bbx s ARG 23 CO -0.01 -0.02 0.16 -1.54 -1.08 0.00 0.00 175.30 172.81 2bbx s SER 24 N -3.36 0.16 0.05 -2.89 1.04 -1.26 -1.87 113.70 105.57 2bbx s SER 24 Ca 0.28 -1.25 -0.22 0.00 0.48 0.00 0.00 55.95 55.24 2bbx s SER 24 Cb 0.04 0.38 0.05 0.00 0.10 0.00 0.00 66.02 66.60 2bbx s SER 24 CO 0.09 -0.85 0.52 0.00 0.98 0.00 0.00 173.24 173.99 2bbx s ARG 25 N -4.10 1.04 0.35 4.02 1.70 -1.16 -2.21 118.95 118.59 2bbx s ARG 25 Ca 0.31 -0.25 0.08 0.00 -0.47 0.00 0.00 55.73 55.40 2bbx s ARG 25 Cb 0.06 0.47 -0.04 0.00 -0.57 0.00 0.00 34.95 34.87 2bbx s ARG 25 CO 0.08 -0.38 0.13 0.15 -1.08 0.00 0.00 175.30 174.20 2bbx s LYS 26 N -2.51 2.32 0.14 3.89 1.02 -1.26 -2.60 119.74 120.74 2bbx s LYS 26 Ca -0.05 -1.60 -0.14 0.00 0.02 0.00 0.00 55.97 54.20 2bbx s LYS 26 Cb -0.01 -2.13 0.02 0.00 -0.52 0.00 0.00 37.83 35.19 2bbx s LYS 26 CO -0.02 0.09 0.36 -0.98 -0.92 0.00 0.00 175.35 173.88 2bbx s ARG 27 N -3.84 1.10 -1.15 1.68 1.70 -0.74 -3.42 118.95 114.27 2bbx s ARG 27 Ca 0.38 -0.86 -0.12 0.00 -0.47 0.00 0.00 55.73 54.65 2bbx s ARG 27 Cb -0.02 0.44 0.22 0.00 -0.57 0.00 0.00 34.95 35.02 2bbx s ARG 27 CO 0.22 -0.42 1.27 -1.21 -1.08 0.00 0.00 175.30 174.09 2bbx s GLU 28 N -3.86 4.11 0.24 3.89 0.41 -1.26 -4.81 118.70 117.42 2bbx s GLU 28 Ca 0.07 -2.82 -0.31 0.00 -0.41 0.00 0.00 54.97 51.50 2bbx s GLU 28 Cb 0.02 -4.83 -0.14 0.00 -1.78 0.00 0.00 34.13 27.40 2bbx s GLU 28 CO -0.08 -1.54 1.26 0.44 -0.49 0.00 0.00 175.26 174.85 2bbx n ILE 29 N 3.83 1.21 0.19 -1.63 -5.35 -1.26 -4.85 119.36 111.50 2bbx n ILE 29 Ca 0.30 -0.30 0.08 0.00 -0.27 0.00 0.00 62.75 62.56 2bbx n ILE 29 Cb 0.42 -1.23 0.26 0.00 -1.74 0.00 0.00 39.64 37.34 2bbx n ILE 29 CO 0.00 0.00 0.00 -0.07 -1.76 0.00 0.00 176.55 174.72 2bbx h LEU 30 N 3.44 0.00 -7.86 7.28 3.38 -1.51 -3.46 115.31 116.57 2bbx h LEU 30 Ca -0.44 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.38 2bbx h LEU 30 Cb 1.31 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.86 2bbx h LEU 30 CO 0.70 0.29 -0.57 -1.00 0.09 0.00 0.00 178.44 177.96 2bbx s HIS 31 N -3.32 0.15 0.34 1.13 3.76 -1.26 -5.10 115.29 110.99 2bbx s HIS 31 Ca 0.03 -0.35 -0.29 0.00 -0.15 0.00 0.00 55.06 54.30 2bbx s HIS 31 Cb 0.08 -0.12 -0.11 0.00 1.11 0.00 0.00 32.58 33.55 2bbx s HIS 31 CO 0.68 -0.27 1.40 -2.00 -0.85 0.00 0.00 174.74 173.70 2bbx s GLU 32 N -1.69 4.24 0.00 1.40 2.12 -1.26 -3.47 118.70 120.04 2bbx s GLU 32 Ca -0.13 2.39 0.00 0.00 0.36 0.00 0.00 54.97 57.59 2bbx s GLU 32 Cb -0.07 -3.03 0.00 0.00 0.26 0.00 0.00 34.13 31.29 2bbx s GLU 32 CO -0.01 -0.37 0.00 0.41 -0.54 0.00 0.00 175.26 174.76 2bbx n GLY 33 N 0.80 3.34 3.76 -1.50 0.00 -1.26 -5.08 105.19 105.26 2bbx n GLY 33 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 2bbx n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bbx s THR 35 N -1.62 2.93 0.00 0.00 2.01 -1.26 -4.94 115.64 112.76 2bbx s THR 35 Ca 0.73 0.70 0.00 0.00 0.31 0.00 0.00 61.69 63.44 2bbx s THR 35 Cb -0.29 -3.45 0.00 0.00 0.01 0.00 0.00 72.50 68.77 2bbx s THR 35 CO 0.32 0.07 0.42 -1.54 -0.69 0.00 0.00 174.62 173.21 2bbx n SER 36 N 3.40 0.85 -3.70 3.53 3.41 -1.26 -4.87 113.62 114.98 2bbx n SER 36 Ca 0.10 -0.93 -0.13 0.00 -0.26 0.00 0.00 58.87 57.65 2bbx n SER 36 Cb 0.41 0.13 -0.09 0.00 -0.26 0.00 0.00 64.21 64.40 2bbx n SER 36 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2bbx s GLU 37 N -0.13 0.58 0.24 4.33 2.12 -1.26 -1.80 118.70 122.77 2bbx s GLU 37 Ca 0.00 0.72 0.00 0.00 0.36 0.00 0.00 54.97 56.05 2bbx s GLU 37 Cb 0.00 0.26 -0.03 0.00 0.26 0.00 0.00 34.13 34.61 2bbx s GLU 37 CO 0.00 -0.08 0.19 0.96 -0.54 0.00 0.00 175.26 175.79 2bbx s ILE 38 N 0.39 0.00 0.07 -3.70 -5.25 -1.07 -5.04 121.20 106.59 2bbx s ILE 38 Ca -0.01 -1.96 -0.02 0.00 -0.99 0.00 0.00 60.65 57.67 2bbx s ILE 38 Cb -0.04 -2.49 -0.03 0.00 2.95 0.00 0.00 42.46 42.85 2bbx s ILE 38 CO -0.01 0.00 0.02 -1.10 -1.79 0.00 0.00 174.94 172.06 2bbx s GLN 39 N -3.96 0.68 0.12 0.37 -0.21 -1.26 -3.01 119.66 112.38 2bbx s GLN 39 Ca 0.38 -1.20 -0.13 0.00 0.02 0.00 0.00 55.36 54.43 2bbx s GLN 39 Cb 0.05 0.24 0.02 0.00 1.00 0.00 0.00 33.01 34.32 2bbx s GLN 39 CO 0.16 -0.15 0.33 -1.83 -2.12 0.00 0.00 175.29 171.67 2bbx s GLU 40 N -3.92 1.01 0.41 2.91 -1.05 -0.78 -5.00 118.70 112.27 2bbx s GLU 40 Ca 0.09 -0.82 -0.25 0.00 -0.15 0.00 0.00 54.97 53.84 2bbx s GLU 40 Cb 0.07 0.43 -0.08 0.00 -0.44 0.00 0.00 34.13 34.11 2bbx s GLU 40 CO -0.09 -0.37 1.24 -0.65 0.95 0.00 0.00 175.26 176.33 2bbx s GLN 41 N -3.83 3.97 0.47 -4.83 -0.21 -1.26 -1.02 119.66 112.95 2bbx s GLN 41 Ca 0.04 1.99 0.08 0.00 0.02 0.00 0.00 55.36 57.50 2bbx s GLN 41 Cb 0.03 -2.69 0.03 0.00 1.00 0.00 0.00 33.01 31.37 2bbx s GLN 41 CO -0.11 -0.44 0.57 0.00 -2.12 0.00 0.00 175.29 173.20 2bbx n GLU 43 N -1.88 1.09 -1.73 0.00 1.02 -1.26 -4.44 120.64 113.44 2bbx n GLU 43 Ca 0.08 -2.94 -0.42 0.00 -0.02 0.00 0.00 57.16 53.86 2bbx n GLU 43 Cb 0.61 -1.01 -0.01 0.00 -0.02 0.00 0.00 31.44 31.01 2bbx n GLU 43 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2bbx n GLU 44 N -0.19 2.46 -1.52 3.49 -0.58 -1.26 -4.71 120.64 118.34 2bbx n GLU 44 Ca 0.07 0.87 -0.29 0.00 -0.42 0.00 0.00 57.16 57.39 2bbx n GLU 44 Cb 0.93 -2.57 0.14 0.00 -0.57 0.00 0.00 31.44 29.37 2bbx n GLU 44 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 2bbx s GLU 45 N -1.27 1.05 -1.30 3.49 0.41 -1.26 -2.44 118.70 117.38 2bbx s GLU 45 Ca 0.60 0.27 -0.20 0.00 -0.41 0.00 0.00 54.97 55.22 2bbx s GLU 45 Cb -0.53 -1.83 0.02 0.00 -1.78 0.00 0.00 34.13 30.01 2bbx s GLU 45 CO 0.56 -2.26 0.51 2.89 -0.49 0.00 0.00 175.26 176.48 2bbx n ARG 46 N -3.80 -0.94 -1.37 1.61 1.85 -1.26 -4.52 116.66 108.23 2bbx n ARG 46 Ca 0.07 0.18 -0.42 0.00 -1.00 0.00 0.00 57.85 56.68 2bbx n ARG 46 Cb 0.59 -3.28 -0.00 0.00 -1.05 0.00 0.00 32.46 28.72 2bbx n ARG 46 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2bbx n PRO 48 N 1.03 0.68 0.00 0.00 -0.02 -1.26 -5.05 135.00 130.38 2bbx n PRO 48 Ca 0.12 0.27 0.06 0.00 -2.02 0.00 0.00 63.50 61.93 2bbx n PRO 48 Cb 0.38 -1.93 0.36 0.00 -0.02 0.00 0.00 33.50 32.29 2bbx n PRO 48 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13