#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dwv s SER 2 N 0.00 2.39 -0.02 1.61 0.01 -1.26 -5.08 113.70 111.35 2dwv s SER 2 Ca 0.00 1.30 -0.03 0.00 1.31 0.00 0.00 55.95 58.52 2dwv s SER 2 Cb 0.00 -1.99 0.00 0.00 0.21 0.00 0.00 66.02 64.25 2dwv s SER 2 CO 0.00 -3.29 0.08 -0.94 0.41 0.00 0.00 173.24 169.50 2dwv s SER 3 N -3.26 -0.03 0.00 2.44 1.04 -1.26 -5.10 113.70 107.53 2dwv s SER 3 Ca 0.66 0.02 0.00 0.00 0.48 0.00 0.00 55.95 57.10 2dwv s SER 3 Cb -0.20 0.18 0.00 0.00 0.10 0.00 0.00 66.02 66.10 2dwv s SER 3 CO 0.59 -0.13 0.00 0.61 0.98 0.00 0.00 173.24 175.29 2dwv n GLY 4 N 2.54 2.08 3.77 7.32 0.00 -1.26 -5.17 105.19 114.47 2dwv n GLY 4 Ca -0.16 -1.48 -0.04 0.00 0.00 0.00 0.00 46.02 44.34 2dwv n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dwv s SER 5 N 0.00 -0.17 0.29 1.61 1.04 -1.26 -5.19 113.70 110.01 2dwv s SER 5 Ca 0.00 -0.45 -0.13 0.00 0.48 0.00 0.00 55.95 55.85 2dwv s SER 5 Cb 0.00 0.52 0.01 0.00 0.10 0.00 0.00 66.02 66.65 2dwv s SER 5 CO 0.00 -0.96 0.56 -0.55 0.98 0.00 0.00 173.24 173.27 2dwv s SER 6 N -2.96 0.04 0.28 7.02 0.15 -1.26 -5.20 113.70 111.77 2dwv s SER 6 Ca 0.13 -0.99 0.03 0.00 0.70 0.00 0.00 55.95 55.82 2dwv s SER 6 Cb -0.02 0.66 -0.01 0.00 -1.71 0.00 0.00 66.02 64.94 2dwv s SER 6 CO 0.03 -1.27 0.10 0.61 1.20 0.00 0.00 173.24 173.91 2dwv n GLY 7 N -0.44 3.51 0.13 9.45 0.00 -1.26 -5.07 105.19 111.51 2dwv n GLY 7 Ca -0.02 -2.05 -0.11 0.00 0.00 0.00 0.00 46.02 43.84 2dwv n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dwv h PRO 8 N 0.00 0.35 -3.26 1.61 0.13 -2.11 -3.47 132.00 125.25 2dwv h PRO 8 Ca -0.22 -0.08 -0.07 0.00 -0.87 0.00 0.00 66.00 64.77 2dwv h PRO 8 Cb 0.83 -0.05 -0.02 0.00 0.13 0.00 0.00 31.00 31.89 2dwv h PRO 8 CO 0.34 0.45 0.16 -0.48 -0.23 0.00 0.00 178.00 178.24 2dwv s LEU 9 N -9.72 0.21 0.34 1.56 0.05 -1.26 -5.20 118.68 104.67 2dwv s LEU 9 Ca -0.14 -1.18 0.05 0.00 0.05 0.00 0.00 54.13 52.92 2dwv s LEU 9 Cb 0.07 2.51 -0.07 0.00 -2.05 0.00 0.00 46.19 46.66 2dwv s LEU 9 CO 0.72 -1.57 0.04 -1.61 -0.55 0.00 0.00 176.35 173.38 2dwv s GLU 10 N -2.64 1.72 -0.32 1.48 8.01 -1.26 -5.09 118.70 120.60 2dwv s GLU 10 Ca 0.19 -1.95 0.14 0.00 0.01 0.00 0.00 54.97 53.35 2dwv s GLU 10 Cb -0.04 -1.07 0.47 0.00 -4.31 0.00 0.00 34.13 29.17 2dwv s GLU 10 CO 0.13 -0.14 1.10 2.89 0.01 0.00 0.00 175.26 179.25 2dwv n ARG 11 N -0.75 2.49 -3.50 1.61 1.85 -1.26 -5.08 116.66 112.02 2dwv n ARG 11 Ca -0.03 -3.85 -0.21 0.00 -1.00 0.00 0.00 57.85 52.76 2dwv n ARG 11 Cb 0.66 -1.85 -0.02 0.00 -1.05 0.00 0.00 32.46 30.21 2dwv n ARG 11 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 2dwv s GLU 12 N -3.54 2.51 0.00 2.89 0.41 -1.26 -5.15 118.70 114.56 2dwv s GLU 12 Ca 0.38 -1.58 0.00 0.00 -0.41 0.00 0.00 54.97 53.36 2dwv s GLU 12 Cb 0.39 -2.40 0.00 0.00 -1.78 0.00 0.00 34.13 30.34 2dwv s GLU 12 CO -0.03 -0.31 0.00 0.41 -0.49 0.00 0.00 175.26 174.83 2dwv n GLY 13 N -1.67 4.08 3.09 -1.39 0.00 -1.26 -5.20 105.19 102.84 2dwv n GLY 13 Ca 0.04 -1.35 -0.09 0.00 0.00 0.00 0.00 46.02 44.63 2dwv n GLY 13 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dwv s LEU 14 N 0.00 2.44 0.77 0.99 1.43 -1.26 -5.09 118.68 117.96 2dwv s LEU 14 Ca 0.00 -0.90 -0.11 0.00 -1.03 0.00 0.00 54.13 52.09 2dwv s LEU 14 Cb 0.00 0.09 0.05 0.00 0.03 0.00 0.00 46.19 46.36 2dwv s LEU 14 CO 0.00 -0.49 1.09 -2.16 0.23 0.00 0.00 176.35 175.01 2dwv s PRO 15 N -3.39 2.29 0.22 1.29 0.04 -1.26 -4.94 135.00 129.25 2dwv s PRO 15 Ca 0.04 0.72 -0.31 0.00 0.04 0.00 0.00 61.00 61.50 2dwv s PRO 15 Cb 0.03 -1.93 -0.10 0.00 0.04 0.00 0.00 34.50 32.54 2dwv s PRO 15 CO -0.07 -1.50 1.51 -1.25 0.04 0.00 0.00 177.00 175.74 2dwv s PRO 16 N -5.13 4.23 0.00 0.56 0.04 -1.26 -1.92 135.00 131.52 2dwv s PRO 16 Ca 0.60 2.36 0.00 0.00 0.04 0.00 0.00 61.00 64.00 2dwv s PRO 16 Cb -0.14 -3.11 0.00 0.00 0.04 0.00 0.00 34.50 31.28 2dwv s PRO 16 CO 0.54 -0.52 0.00 0.41 0.04 0.00 0.00 177.00 177.47 2dwv n GLY 17 N 2.79 1.79 3.73 0.56 0.00 -1.26 -5.03 105.19 107.77 2dwv n GLY 17 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 2dwv n GLY 17 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2dwv s TRP 18 N -2.47 3.21 0.10 1.61 0.52 -0.81 -1.50 118.94 119.59 2dwv s TRP 18 Ca 0.00 0.20 0.02 0.00 0.02 0.00 0.00 56.10 56.33 2dwv s TRP 18 Cb 0.00 -1.76 -0.04 0.00 -1.15 0.00 0.00 33.47 30.52 2dwv s TRP 18 CO 0.00 0.51 -0.06 -2.00 0.02 0.00 0.00 176.95 175.42 2dwv s GLU 19 N -1.28 0.84 -0.17 4.98 2.56 -1.16 -4.66 118.70 119.80 2dwv s GLU 19 Ca 0.17 -1.34 0.01 0.00 0.00 0.00 0.00 54.97 53.82 2dwv s GLU 19 Cb -0.12 -0.19 0.02 0.00 2.00 0.00 0.00 34.13 35.84 2dwv s GLU 19 CO 0.07 -0.03 -0.20 0.50 -0.56 0.00 0.00 175.26 175.05 2dwv s ARG 20 N -3.84 2.95 0.08 4.30 3.52 -1.26 -3.18 118.95 121.52 2dwv s ARG 20 Ca 0.12 -0.82 0.04 0.00 -0.13 0.00 0.00 55.73 54.95 2dwv s ARG 20 Cb 0.05 -2.52 -0.04 0.00 -1.56 0.00 0.00 34.95 30.88 2dwv s ARG 20 CO -0.05 -0.18 0.01 0.08 -0.81 0.00 0.00 175.30 174.35 2dwv s VAL 21 N 1.24 4.11 0.05 7.11 1.01 0.18 -4.98 120.40 129.11 2dwv s VAL 21 Ca 0.03 -0.93 0.04 0.00 0.00 0.00 0.00 61.98 61.12 2dwv s VAL 21 Cb -0.13 -2.96 -0.02 0.00 0.00 0.00 0.00 36.38 33.26 2dwv s VAL 21 CO -0.11 0.13 -0.12 -1.83 0.00 0.00 0.00 175.10 173.17 2dwv s GLU 22 N -2.28 0.73 0.02 2.72 -1.05 -1.26 -1.05 118.70 116.53 2dwv s GLU 22 Ca 0.26 -0.80 -0.28 0.00 -0.15 0.00 0.00 54.97 54.00 2dwv s GLU 22 Cb -0.12 -0.67 0.07 0.00 -0.44 0.00 0.00 34.13 32.98 2dwv s GLU 22 CO 0.19 0.15 0.68 0.45 0.95 0.00 0.00 175.26 177.68 2dwv s SER 23 N -1.45 -0.60 0.12 0.83 0.15 0.70 -4.95 113.70 108.50 2dwv s SER 23 Ca -0.03 0.42 0.08 0.00 0.70 0.00 0.00 55.95 57.12 2dwv s SER 23 Cb -0.09 0.54 -0.20 0.00 -1.71 0.00 0.00 66.02 64.56 2dwv s SER 23 CO 0.01 -0.72 1.26 0.28 1.20 0.00 0.00 173.24 175.28 2dwv h SER 24 N 2.59 0.00 1.25 5.45 0.02 -2.02 0.94 113.55 121.77 2dwv h SER 24 Ca -0.29 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.51 2dwv h SER 24 Cb 1.20 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.72 2dwv h SER 24 CO 0.38 0.98 -0.76 -0.08 -1.14 0.00 0.00 176.83 176.21 2dwv h GLU 25 N 0.00 0.00 0.00 3.45 4.57 -2.06 -3.40 114.58 117.14 2dwv h GLU 25 Ca -0.02 0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 58.11 2dwv h GLU 25 Cb 1.76 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 30.34 2dwv h GLU 25 CO 0.12 0.69 -1.20 1.19 -1.18 0.00 0.00 179.01 178.63 2dwv n PHE 26 N -3.26 0.00 0.00 0.92 3.72 -1.24 -5.12 117.46 112.48 2dwv n PHE 26 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2dwv n PHE 26 Cb 0.83 -0.14 0.00 0.00 -0.94 0.00 0.00 39.48 39.23 2dwv n PHE 26 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dwv n GLY 27 N 3.24 1.23 2.75 1.37 0.00 0.32 -4.92 105.19 109.19 2dwv n GLY 27 Ca -0.06 -1.01 -0.16 0.00 0.00 0.00 0.00 46.02 44.79 2dwv n GLY 27 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dwv s THR 28 N 0.00 -0.08 0.22 2.61 2.01 -1.26 -0.21 115.64 118.92 2dwv s THR 28 Ca 0.00 0.28 -0.00 0.00 0.31 0.00 0.00 61.69 62.28 2dwv s THR 28 Cb 0.00 -0.11 -0.04 0.00 0.01 0.00 0.00 72.50 72.35 2dwv s THR 28 CO 0.00 0.12 0.12 -0.72 -0.69 0.00 0.00 174.62 173.45 2dwv s TYR 29 N 1.42 1.27 0.06 4.92 1.13 -0.21 -4.79 117.35 121.14 2dwv s TYR 29 Ca -0.05 -1.33 0.05 0.00 -1.41 0.00 0.00 57.07 54.34 2dwv s TYR 29 Cb -0.13 -0.65 -0.03 0.00 -1.10 0.00 0.00 41.96 40.05 2dwv s TYR 29 CO -0.03 -0.56 -0.14 0.71 -2.51 0.00 0.00 175.55 173.02 2dwv s TYR 30 N -4.05 1.24 -0.01 -3.49 1.51 0.21 -0.65 117.35 112.12 2dwv s TYR 30 Ca 0.39 -0.42 0.02 0.00 -1.01 0.00 0.00 57.07 56.05 2dwv s TYR 30 Cb 0.07 -0.71 -0.00 0.00 -0.11 0.00 0.00 41.96 41.21 2dwv s TYR 30 CO 0.13 0.05 -0.07 0.08 -1.11 0.00 0.00 175.55 174.63 2dwv s VAL 31 N -1.12 0.57 -0.31 0.71 1.01 -1.19 -0.74 120.40 119.33 2dwv s VAL 31 Ca -0.00 -0.30 -0.10 0.00 0.00 0.00 0.00 61.98 61.57 2dwv s VAL 31 Cb -0.09 -0.48 -0.01 0.00 0.00 0.00 0.00 36.38 35.79 2dwv s VAL 31 CO 0.02 0.16 0.17 -0.62 0.00 0.00 0.00 175.10 174.83 2dwv s ASP 32 N -0.14 5.65 0.40 3.32 2.15 -0.33 -3.00 116.67 124.72 2dwv s ASP 32 Ca 0.02 -0.45 0.28 0.00 0.43 0.00 0.00 52.55 52.83 2dwv s ASP 32 Cb -0.03 -2.03 1.06 0.00 -0.30 0.00 0.00 42.92 41.62 2dwv s ASP 32 CO -0.00 -0.18 1.83 0.45 -0.17 0.00 0.00 175.17 177.09 2dwv h HIS 33 N 8.37 0.00 0.05 -5.34 3.86 -1.58 0.33 115.15 120.84 2dwv h HIS 33 Ca -0.32 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 58.88 2dwv h HIS 33 Cb 1.15 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.62 2dwv h HIS 33 CO 0.65 0.00 -0.03 1.15 0.86 0.00 0.00 177.93 180.57 2dwv h THR 34 N 0.00 1.27 -0.18 2.45 2.02 -1.94 -3.34 112.91 113.19 2dwv h THR 34 Ca 0.00 -1.23 0.00 0.00 0.77 0.00 0.00 66.41 65.95 2dwv h THR 34 Cb 0.54 2.06 0.00 0.00 -1.74 0.00 0.00 68.15 69.01 2dwv h THR 34 CO 0.00 0.30 0.00 0.59 0.37 0.00 0.00 175.52 176.78 2dwv n ASN 35 N -4.86 2.44 -3.95 4.18 3.02 -1.24 -4.99 115.26 109.85 2dwv n ASN 35 Ca -0.09 -1.73 -0.30 0.00 -0.03 0.00 0.00 54.58 52.44 2dwv n ASN 35 Cb 0.28 -0.11 0.01 0.00 -0.61 0.00 0.00 39.78 39.35 2dwv n ASN 35 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2dwv n LYS 36 N 0.60 -4.92 -4.09 3.52 4.76 0.09 -4.99 118.16 113.14 2dwv n LYS 36 Ca 0.09 0.55 -0.25 0.00 -2.87 0.00 0.00 58.31 55.83 2dwv n LYS 36 Cb 0.36 -5.33 -0.05 0.00 -1.84 0.00 0.00 35.03 28.16 2dwv n LYS 36 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2dwv s ARG 37 N -6.61 2.91 0.08 1.97 0.52 -1.15 -4.93 118.95 111.73 2dwv s ARG 37 Ca 0.57 -0.92 0.07 0.00 -0.52 0.00 0.00 55.73 54.93 2dwv s ARG 37 Cb -0.29 -2.62 -0.03 0.00 0.52 0.00 0.00 34.95 32.52 2dwv s ARG 37 CO 0.85 0.46 -0.19 0.00 0.02 0.00 0.00 175.30 176.44 2dwv s ALA 38 N -1.86 1.63 0.25 2.13 0.00 -1.26 -1.19 121.76 121.46 2dwv s ALA 38 Ca 0.31 -1.12 -0.22 0.00 0.00 0.00 0.00 51.96 50.94 2dwv s ALA 38 Cb -0.09 -0.24 0.03 0.00 0.00 0.00 0.00 23.12 22.81 2dwv s ALA 38 CO 0.24 0.33 0.72 1.14 0.00 0.00 0.00 175.76 178.18 2dwv s GLN 39 N -1.61 1.67 -0.12 0.00 -2.07 0.08 -4.99 119.66 112.61 2dwv s GLN 39 Ca 0.05 -0.88 0.16 0.00 -1.82 0.00 0.00 55.36 52.87 2dwv s GLN 39 Cb -0.09 0.59 0.61 0.00 -1.09 0.00 0.00 33.01 33.03 2dwv s GLN 39 CO 0.03 -0.76 1.53 0.66 -1.32 0.00 0.00 175.29 175.43 2dwv n TYR 40 N -0.45 1.24 -4.35 9.60 4.01 -1.26 -0.61 117.16 125.33 2dwv n TYR 40 Ca -0.06 -0.67 -0.27 0.00 -0.16 0.00 0.00 57.90 56.74 2dwv n TYR 40 Cb 0.60 -0.25 -0.11 0.00 -0.31 0.00 0.00 39.34 39.27 2dwv n TYR 40 CO 0.00 0.00 0.00 -0.98 -0.46 0.00 0.00 176.86 175.42 2dwv s ARG 41 N -2.03 1.78 0.23 -0.72 1.70 -1.26 -4.95 118.95 113.69 2dwv s ARG 41 Ca 0.44 -1.38 -0.30 0.00 -0.47 0.00 0.00 55.73 54.02 2dwv s ARG 41 Cb 0.31 -2.01 -0.09 0.00 -0.57 0.00 0.00 34.95 32.59 2dwv s ARG 41 CO 0.18 0.42 1.23 -1.58 -1.08 0.00 0.00 175.30 174.47 2dwv s HIS 42 N -1.64 3.35 -0.12 5.89 5.65 -1.26 -4.72 115.29 122.43 2dwv s HIS 42 Ca 0.22 1.42 -0.29 0.00 0.25 0.00 0.00 55.06 56.66 2dwv s HIS 42 Cb -0.08 -3.49 -0.04 0.00 -1.18 0.00 0.00 32.58 27.78 2dwv s HIS 42 CO 0.12 -1.38 1.65 -1.25 -0.65 0.00 0.00 174.74 173.23 2dwv s PRO 43 N -0.69 4.02 -0.57 2.88 0.04 -1.26 -4.91 135.00 134.51 2dwv s PRO 43 Ca 0.52 1.99 0.04 0.00 0.04 0.00 0.00 61.00 63.59 2dwv s PRO 43 Cb -0.35 -4.01 0.38 0.00 0.04 0.00 0.00 34.50 30.56 2dwv s PRO 43 CO 0.41 -1.03 1.20 0.45 0.04 0.00 0.00 177.00 178.06 2dwv n SER 44 N 7.71 5.11 0.00 6.66 2.88 -1.26 -4.97 113.62 129.75 2dwv n SER 44 Ca 0.18 -3.72 0.00 0.00 -1.33 0.00 0.00 58.87 54.00 2dwv n SER 44 Cb 0.44 -0.61 0.00 0.00 -0.75 0.00 0.00 64.21 63.29 2dwv n SER 44 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dwv n GLY 45 N -0.38 1.46 3.73 0.46 0.00 -1.26 -5.16 105.19 104.04 2dwv n GLY 45 Ca 0.38 -0.82 -0.31 0.00 0.00 0.00 0.00 46.02 45.27 2dwv n GLY 45 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dwv s PRO 46 N -2.00 1.73 -0.36 1.61 0.04 -1.26 -4.99 135.00 129.77 2dwv s PRO 46 Ca 0.00 1.23 -0.24 0.00 0.04 0.00 0.00 61.00 62.03 2dwv s PRO 46 Cb 0.00 -1.83 0.01 0.00 0.04 0.00 0.00 34.50 32.72 2dwv s PRO 46 CO 0.00 -2.03 0.84 -1.12 0.04 0.00 0.00 177.00 174.73 2dwv s SER 47 N -3.18 6.61 0.00 6.66 0.01 -1.26 -4.68 113.70 117.86 2dwv s SER 47 Ca 0.63 0.46 0.00 0.00 1.31 0.00 0.00 55.95 58.35 2dwv s SER 47 Cb -0.19 -2.42 0.00 0.00 0.21 0.00 0.00 66.02 63.62 2dwv s SER 47 CO 0.57 -0.77 0.00 -0.24 0.41 0.00 0.00 173.24 173.21 2dwv n SER 48 N 6.54 0.00 0.00 2.44 2.88 -1.26 -5.21 113.62 119.01 2dwv n SER 48 Ca 0.05 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.59 2dwv n SER 48 Cb 0.48 0.21 0.00 0.00 -0.75 0.00 0.00 64.21 64.16 2dwv n SER 48 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42