#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cbh s GLN 2 N 0.00 3.24 0.62 -0.78 2.00 -0.68 -4.92 119.66 119.15 2cbh s GLN 2 Ca 0.00 -0.58 0.08 0.00 -2.00 0.00 0.00 55.36 52.86 2cbh s GLN 2 Cb 0.00 -2.90 0.11 0.00 0.80 0.00 0.00 33.01 31.01 2cbh s GLN 2 CO 0.00 0.57 0.86 -1.54 -0.50 0.00 0.00 175.29 174.68 2cbh s SER 3 N -2.71 4.87 0.57 6.67 1.04 -1.26 0.39 113.70 123.27 2cbh s SER 3 Ca 0.33 -0.84 -0.20 0.00 0.48 0.00 0.00 55.95 55.71 2cbh s SER 3 Cb -0.12 0.41 -0.05 0.00 0.10 0.00 0.00 66.02 66.36 2cbh s SER 3 CO 0.26 -1.53 1.21 1.57 0.98 0.00 0.00 173.24 175.73 2cbh n HIS 4 N -2.41 1.74 -1.87 5.02 -0.00 -1.26 -1.16 115.22 115.28 2cbh n HIS 4 Ca 0.17 0.44 -0.19 0.00 -0.00 0.00 0.00 57.72 58.14 2cbh n HIS 4 Cb 0.62 -2.28 -0.05 0.00 -0.00 0.00 0.00 29.99 28.28 2cbh n HIS 4 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 2cbh n TYR 5 N -1.31 -0.47 -3.92 1.57 4.01 0.30 -4.93 117.16 112.41 2cbh n TYR 5 Ca 0.12 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.61 2cbh n TYR 5 Cb 0.45 -3.44 -0.03 0.00 -0.31 0.00 0.00 39.34 36.02 2cbh n TYR 5 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2cbh s GLY 6 N -2.40 1.60 -0.47 2.72 0.00 -0.31 -4.66 107.32 103.80 2cbh s GLY 6 Ca 0.00 -1.06 -0.26 0.00 0.00 0.00 0.00 44.72 43.40 2cbh s GLY 6 CO 0.00 -1.06 0.98 1.62 0.00 0.00 0.00 173.10 174.64 2cbh s GLN 7 N -3.42 3.58 0.06 2.90 0.74 -1.26 0.15 119.66 122.40 2cbh s GLN 7 Ca 0.35 0.26 0.22 0.00 0.05 0.00 0.00 55.36 56.24 2cbh s GLN 7 Cb -0.11 -3.92 -0.20 0.00 1.10 0.00 0.00 33.01 29.88 2cbh s GLN 7 CO 0.29 -1.26 0.71 0.00 -0.55 0.00 0.00 175.29 174.47 2cbh n GLY 9 N 1.24 4.12 0.00 0.00 0.00 -1.04 -3.88 105.19 105.63 2cbh n GLY 9 Ca -0.02 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.29 2cbh n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cbh n GLY 10 N 0.00 1.91 3.46 -0.02 0.00 -1.26 -2.51 105.19 106.78 2cbh n GLY 10 Ca 0.00 -1.30 -0.38 0.00 0.00 0.00 0.00 46.02 44.34 2cbh n GLY 10 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2cbh n ILE 11 N 2.53 2.15 0.00 -0.61 5.41 -1.23 -0.63 119.36 126.98 2cbh n ILE 11 Ca 0.00 -0.50 0.00 0.00 1.00 0.00 0.00 62.75 63.25 2cbh n ILE 11 Cb 0.00 -0.65 0.00 0.00 -0.71 0.00 0.00 39.64 38.28 2cbh n ILE 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2cbh n GLY 12 N 1.80 2.89 3.78 7.39 0.00 -1.26 -4.68 105.19 115.11 2cbh n GLY 12 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 2cbh n GLY 12 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2cbh s TYR 13 N -2.23 2.69 -0.35 1.61 5.04 0.19 -4.99 117.35 119.31 2cbh s TYR 13 Ca 0.00 1.54 0.15 0.00 -2.44 0.00 0.00 57.07 56.32 2cbh s TYR 13 Cb 0.00 -3.18 0.42 0.00 0.35 0.00 0.00 41.96 39.55 2cbh s TYR 13 CO 0.00 -1.56 0.96 -1.13 -1.34 0.00 0.00 175.55 172.47 2cbh n SER 14 N -2.03 0.69 -3.75 4.32 3.41 -1.26 -5.00 113.62 110.00 2cbh n SER 14 Ca 0.10 -2.80 -0.14 0.00 -0.26 0.00 0.00 58.87 55.77 2cbh n SER 14 Cb 0.52 -0.24 -0.08 0.00 -0.26 0.00 0.00 64.21 64.15 2cbh n SER 14 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2cbh s GLY 15 N -2.63 1.60 1.02 5.00 0.00 -1.26 -5.15 107.32 105.91 2cbh s GLY 15 Ca 0.29 -1.67 -0.13 0.00 0.00 0.00 0.00 44.72 43.21 2cbh s GLY 15 CO -0.01 -1.25 0.67 -1.05 0.00 0.00 0.00 173.10 171.47 2cbh n PRO 16 N -0.44 -1.04 -0.13 2.90 -0.02 -1.26 -4.92 135.00 130.09 2cbh n PRO 16 Ca 0.03 -0.26 0.04 0.00 -2.02 0.00 0.00 63.50 61.28 2cbh n PRO 16 Cb 0.64 -2.04 0.05 0.00 -0.02 0.00 0.00 33.50 32.12 2cbh n PRO 16 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2cbh n THR 17 N -4.24 0.95 -3.14 3.45 -2.24 -1.25 -4.60 114.28 103.21 2cbh n THR 17 Ca 0.06 -1.08 -0.41 0.00 -2.27 0.00 0.00 64.05 60.35 2cbh n THR 17 Cb 0.55 0.32 -0.07 0.00 -2.10 0.00 0.00 70.33 69.03 2cbh n THR 17 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2cbh s VAL 18 N -1.30 4.93 0.00 2.28 1.01 -1.26 -4.87 120.40 121.19 2cbh s VAL 18 Ca 0.11 0.63 -0.30 0.00 0.00 0.00 0.00 61.98 62.42 2cbh s VAL 18 Cb 0.10 -4.03 -0.03 0.00 0.00 0.00 0.00 36.38 32.42 2cbh s VAL 18 CO 0.01 -0.24 0.98 0.00 0.00 0.00 0.00 175.10 175.85 2cbh n ALA 20 N 3.87 -3.15 -1.33 0.00 0.00 0.16 -4.68 120.51 115.39 2cbh n ALA 20 Ca 0.06 0.56 -0.44 0.00 0.00 0.00 0.00 53.44 53.62 2cbh n ALA 20 Cb 0.51 -1.77 -0.01 0.00 0.00 0.00 0.00 19.45 18.18 2cbh n ALA 20 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2cbh n SER 21 N 1.69 -2.40 0.00 0.00 7.64 -1.26 -2.20 113.62 117.10 2cbh n SER 21 Ca 0.19 0.90 0.00 0.00 1.01 0.00 0.00 58.87 60.97 2cbh n SER 21 Cb 0.13 -0.90 0.00 0.00 -1.01 0.00 0.00 64.21 62.42 2cbh n SER 21 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2cbh n GLY 22 N 2.24 2.94 3.67 0.23 0.00 -1.26 -5.04 105.19 107.96 2cbh n GLY 22 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 2cbh n GLY 22 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2cbh s THR 23 N -2.71 1.12 0.21 2.61 -4.23 -0.93 -5.05 115.64 106.65 2cbh s THR 23 Ca 0.00 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 58.52 2cbh s THR 23 Cb 0.00 -2.33 -0.05 0.00 1.34 0.00 0.00 72.50 71.46 2cbh s THR 23 CO 0.00 0.00 0.07 0.42 -0.54 0.00 0.00 174.62 174.57 2cbh s THR 24 N -2.96 0.44 -0.50 3.99 -4.23 -1.25 -4.83 115.64 106.30 2cbh s THR 24 Ca 0.15 -1.98 -0.19 0.00 -1.18 0.00 0.00 61.69 58.48 2cbh s THR 24 Cb 0.03 -2.40 0.05 0.00 1.34 0.00 0.00 72.50 71.53 2cbh s THR 24 CO 0.08 -0.19 0.63 0.00 -0.54 0.00 0.00 174.62 174.60 2cbh s GLN 26 N 2.69 3.26 -0.60 0.00 -1.52 -0.17 -4.98 119.66 118.34 2cbh s GLN 26 Ca 0.17 -0.42 -0.26 0.00 -1.95 0.00 0.00 55.36 52.91 2cbh s GLN 26 Cb -0.18 -2.88 0.04 0.00 -0.22 0.00 0.00 33.01 29.77 2cbh s GLN 26 CO 0.13 0.56 1.07 0.08 -0.25 0.00 0.00 175.29 176.88 2cbh s VAL 27 N -0.48 4.17 0.05 1.09 1.01 -1.26 -1.02 120.40 123.96 2cbh s VAL 27 Ca 0.09 0.39 -0.32 0.00 0.00 0.00 0.00 61.98 62.14 2cbh s VAL 27 Cb -0.12 -4.67 -0.18 0.00 0.00 0.00 0.00 36.38 31.40 2cbh s VAL 27 CO 0.02 -1.34 1.46 0.25 0.00 0.00 0.00 175.10 175.49 2cbh h LEU 28 N 11.62 -0.82 -8.49 3.92 5.85 -1.17 -3.47 115.31 122.75 2cbh h LEU 28 Ca -0.26 0.01 -0.22 0.00 0.84 0.00 0.00 57.88 58.25 2cbh h LEU 28 Cb 1.06 0.21 -0.11 0.00 0.37 0.00 0.00 40.66 42.20 2cbh h LEU 28 CO 1.16 -0.52 -0.33 0.20 -0.34 0.00 0.00 178.44 178.61 2cbh s ASN 29 N -4.40 0.45 0.00 1.25 0.01 -0.81 -4.99 114.94 106.45 2cbh s ASN 29 Ca -0.17 -1.31 0.00 0.00 -0.71 0.00 0.00 52.86 50.67 2cbh s ASN 29 Cb 0.02 0.55 0.00 0.00 0.41 0.00 0.00 41.25 42.23 2cbh s ASN 29 CO 0.56 -1.09 0.32 -2.65 -1.51 0.00 0.00 177.10 172.73 2cbh n PRO 30 N -0.43 0.47 0.00 -0.60 -0.02 -1.26 -1.67 135.00 131.49 2cbh n PRO 30 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 2cbh n PRO 30 Cb 0.63 -1.25 0.00 0.00 -0.02 0.00 0.00 33.50 32.86 2cbh n PRO 30 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2cbh n TYR 31 N 0.44 0.00 -3.26 6.00 4.01 -1.26 -3.52 117.16 119.57 2cbh n TYR 31 Ca 0.00 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.77 2cbh n TYR 31 Cb 0.16 0.05 -0.02 0.00 -0.31 0.00 0.00 39.34 39.22 2cbh n TYR 31 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 2cbh s TYR 32 N 0.00 -1.26 -0.25 -0.72 5.04 -0.67 -4.27 117.35 115.21 2cbh s TYR 32 Ca 0.00 1.55 -0.01 0.00 -2.44 0.00 0.00 57.07 56.17 2cbh s TYR 32 Cb 0.00 0.52 0.03 0.00 0.35 0.00 0.00 41.96 42.86 2cbh s TYR 32 CO 0.00 -0.67 -0.07 -1.12 -1.34 0.00 0.00 175.55 172.35 2cbh s SER 33 N 2.84 4.34 0.47 4.32 0.01 -1.04 -0.56 113.70 124.08 2cbh s SER 33 Ca 0.10 -0.96 0.02 0.00 1.31 0.00 0.00 55.95 56.41 2cbh s SER 33 Cb -0.13 -1.65 0.01 0.00 0.21 0.00 0.00 66.02 64.46 2cbh s SER 33 CO -0.18 -0.14 0.67 -1.58 0.41 0.00 0.00 173.24 172.42 2cbh s GLN 34 N 1.29 2.87 -0.43 12.44 0.74 -0.19 -0.63 119.66 135.75 2cbh s GLN 34 Ca -0.01 -0.72 -0.15 0.00 0.05 0.00 0.00 55.36 54.53 2cbh s GLN 34 Cb -0.17 -2.58 0.04 0.00 1.10 0.00 0.00 33.01 31.39 2cbh s GLN 34 CO -0.05 -0.39 0.32 0.00 -0.55 0.00 0.00 175.29 174.63