#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cbh n GLN 2 N 0.00 0.79 -4.53 -0.78 -0.06 -0.41 -4.93 117.38 107.46 2cbh n GLN 2 Ca 0.00 -2.54 -0.25 0.00 -2.00 0.00 0.00 57.00 52.21 2cbh n GLN 2 Cb 0.00 1.19 -0.09 0.00 -4.06 0.00 0.00 30.24 27.28 2cbh n GLN 2 CO 0.00 0.00 0.00 -1.54 -0.20 0.00 0.00 177.06 175.32 2cbh s SER 3 N -2.87 2.88 0.23 1.69 1.04 -1.26 -2.52 113.70 112.89 2cbh s SER 3 Ca 0.11 -1.55 -0.32 0.00 0.48 0.00 0.00 55.95 54.67 2cbh s SER 3 Cb 0.01 0.25 -0.13 0.00 0.10 0.00 0.00 66.02 66.25 2cbh s SER 3 CO 0.08 -0.78 1.45 1.57 0.98 0.00 0.00 173.24 176.53 2cbh n HIS 4 N -0.88 2.23 -0.48 5.02 -0.00 -1.26 0.10 115.22 119.95 2cbh n HIS 4 Ca -0.06 0.40 0.00 0.00 -0.00 0.00 0.00 57.72 58.05 2cbh n HIS 4 Cb 0.66 -2.48 0.00 0.00 -0.00 0.00 0.00 29.99 28.17 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 2.14 0.00 -1.52 1.57 4.01 0.14 -4.94 117.16 118.55 2cbh n TYR 5 Ca 0.12 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.51 2cbh n TYR 5 Cb 0.31 -0.71 0.09 0.00 -0.31 0.00 0.00 39.34 38.72 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 -2.00 2.52 -0.42 2.72 0.00 0.29 -4.16 107.32 106.26 2cbh s GLY 6 Ca 0.00 1.00 -0.26 0.00 0.00 0.00 0.00 44.72 45.47 2cbh s GLY 6 CO 0.00 1.42 0.93 1.62 0.00 0.00 0.00 173.10 177.07 2cbh s GLN 7 N -3.73 3.67 -0.07 2.90 0.74 -1.26 -0.12 119.66 121.79 2cbh s GLN 7 Ca 0.77 0.35 0.04 0.00 0.05 0.00 0.00 55.36 56.57 2cbh s GLN 7 Cb -0.32 -3.87 -0.25 0.00 1.10 0.00 0.00 33.01 29.67 2cbh s GLN 7 CO 0.43 -1.10 0.57 0.00 -0.55 0.00 0.00 175.29 174.64 2cbh n GLY 9 N 1.74 4.37 0.00 0.00 0.00 -1.14 -3.80 105.19 106.35 2cbh n GLY 9 Ca -0.23 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 44.79 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 2.74 3.75 -0.02 0.00 -1.26 -1.85 105.19 108.55 2cbh n GLY 10 Ca 0.00 -1.79 -0.38 0.00 0.00 0.00 0.00 46.02 43.85 2cbh n GLY 10 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2cbh s ILE 11 N -2.25 2.10 0.00 -0.61 1.01 -1.26 -1.94 121.20 118.25 2cbh s ILE 11 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 60.65 60.72 2cbh s ILE 11 Cb 0.00 -3.04 0.00 0.00 0.01 0.00 0.00 42.46 39.43 2cbh s ILE 11 CO 0.00 -0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.55 2cbh n GLY 12 N 0.74 2.69 3.65 6.18 0.00 -1.26 -4.73 105.19 112.44 2cbh n GLY 12 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 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 -3.10 3.29 -0.70 1.61 5.04 -0.82 -4.95 117.35 117.73 2cbh s TYR 13 Ca 0.00 1.23 0.03 0.00 -2.44 0.00 0.00 57.07 55.89 2cbh s TYR 13 Cb 0.00 -3.24 0.35 0.00 0.35 0.00 0.00 41.96 39.42 2cbh s TYR 13 CO 0.00 -0.50 1.30 -1.13 -1.34 0.00 0.00 175.55 173.88 2cbh n SER 14 N 6.26 5.55 -3.00 4.32 3.41 -1.26 -4.90 113.62 123.99 2cbh n SER 14 Ca 0.09 -3.71 -0.16 0.00 -0.26 0.00 0.00 58.87 54.83 2cbh n SER 14 Cb 0.47 -0.75 -0.05 0.00 -0.26 0.00 0.00 64.21 63.62 2cbh n SER 14 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cbh n GLY 15 N -0.26 2.44 3.76 5.00 0.00 -1.26 -5.15 105.19 109.72 2cbh n GLY 15 Ca 0.38 -1.71 -0.32 0.00 0.00 0.00 0.00 46.02 44.37 2cbh n GLY 15 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cbh s PRO 16 N -2.96 2.50 -0.05 1.61 0.04 -1.26 -4.96 135.00 129.91 2cbh s PRO 16 Ca 0.32 1.32 0.09 0.00 0.04 0.00 0.00 61.00 62.77 2cbh s PRO 16 Cb 0.00 -1.92 0.22 0.00 0.04 0.00 0.00 34.50 32.85 2cbh s PRO 16 CO 0.23 -1.48 1.17 0.25 0.04 0.00 0.00 177.00 177.21 2cbh n THR 17 N -2.93 1.36 -2.79 1.26 -2.24 -1.25 -4.67 114.28 103.02 2cbh n THR 17 Ca 0.10 -1.36 -0.43 0.00 -2.27 0.00 0.00 64.05 60.09 2cbh n THR 17 Cb 0.52 0.25 -0.04 0.00 -2.10 0.00 0.00 70.33 68.97 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 -1.62 4.44 0.45 2.28 1.01 -1.26 -4.79 120.40 120.92 2cbh s VAL 18 Ca 0.19 0.84 -0.21 0.00 0.00 0.00 0.00 61.98 62.80 2cbh s VAL 18 Cb 0.14 -4.45 -0.09 0.00 0.00 0.00 0.00 36.38 31.97 2cbh s VAL 18 CO 0.07 -0.85 1.00 0.00 0.00 0.00 0.00 175.10 175.32 2cbh n ALA 20 N -0.74 -2.81 -1.60 0.00 0.00 -1.05 -4.74 120.51 109.58 2cbh n ALA 20 Ca 0.08 -0.39 -0.41 0.00 0.00 0.00 0.00 53.44 52.72 2cbh n ALA 20 Cb 0.53 -1.63 0.02 0.00 0.00 0.00 0.00 19.45 18.36 2cbh n ALA 20 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2cbh n SER 21 N 0.65 1.02 0.00 0.00 3.41 -1.26 -1.80 113.62 115.64 2cbh n SER 21 Ca 0.06 0.99 0.00 0.00 -0.26 0.00 0.00 58.87 59.66 2cbh n SER 21 Cb 0.52 -1.34 0.00 0.00 -0.26 0.00 0.00 64.21 63.13 2cbh n SER 21 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cbh n GLY 22 N 1.24 2.97 3.90 5.00 0.00 -1.26 -4.99 105.19 112.05 2cbh n GLY 22 Ca 0.10 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.62 2.24 0.22 2.61 -4.23 -0.74 -5.07 115.64 109.05 2cbh s THR 23 Ca 0.00 -1.37 -0.07 0.00 -1.18 0.00 0.00 61.69 59.07 2cbh s THR 23 Cb 0.00 -2.61 -0.02 0.00 1.34 0.00 0.00 72.50 71.20 2cbh s THR 23 CO 0.00 0.00 0.30 0.42 -0.54 0.00 0.00 174.62 174.80 2cbh s THR 24 N -2.60 0.00 0.12 3.99 -4.23 0.14 -4.74 115.64 108.31 2cbh s THR 24 Ca 0.44 -1.72 -0.20 0.00 -1.18 0.00 0.00 61.69 59.03 2cbh s THR 24 Cb -0.03 -2.36 -0.07 0.00 1.34 0.00 0.00 72.50 71.38 2cbh s THR 24 CO 0.27 0.00 0.64 0.00 -0.54 0.00 0.00 174.62 174.98 2cbh s GLN 26 N -1.30 0.06 -0.22 0.00 -0.21 -0.01 -4.90 119.66 113.08 2cbh s GLN 26 Ca 0.33 0.20 -0.28 0.00 0.02 0.00 0.00 55.36 55.63 2cbh s GLN 26 Cb -0.20 -1.13 -0.04 0.00 1.00 0.00 0.00 33.01 32.64 2cbh s GLN 26 CO 0.21 -0.53 2.04 0.08 -2.12 0.00 0.00 175.29 174.97 2cbh s VAL 27 N 2.22 3.18 -0.02 1.09 1.01 -1.26 -1.29 120.40 125.33 2cbh s VAL 27 Ca 0.04 0.19 -0.25 0.00 0.00 0.00 0.00 61.98 61.96 2cbh s VAL 27 Cb -0.14 -3.22 -0.20 0.00 0.00 0.00 0.00 36.38 32.82 2cbh s VAL 27 CO -0.08 -0.13 1.23 0.25 0.00 0.00 0.00 175.10 176.38 2cbh h LEU 28 N 14.01 0.10 -7.92 3.92 5.85 -0.76 -3.47 115.31 127.04 2cbh h LEU 28 Ca -0.39 -0.54 0.08 0.00 0.84 0.00 0.00 57.88 57.87 2cbh h LEU 28 Cb 1.21 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 42.18 2cbh h LEU 28 CO 0.98 0.62 0.38 0.54 -0.34 0.00 0.00 178.44 180.62 2cbh s ASN 29 N -5.87 -0.09 0.00 1.25 2.20 -0.81 -5.00 114.94 106.62 2cbh s ASN 29 Ca -0.16 -0.77 0.00 0.00 -0.94 0.00 0.00 52.86 50.99 2cbh s ASN 29 Cb 0.02 0.67 0.00 0.00 -2.00 0.00 0.00 41.25 39.94 2cbh s ASN 29 CO 0.70 -1.30 0.28 -2.65 -2.94 0.00 0.00 177.10 171.19 2cbh n PRO 30 N -0.54 0.30 -0.19 3.55 -0.02 -1.26 -1.62 135.00 135.22 2cbh n PRO 30 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.42 2cbh n PRO 30 Cb 0.60 -1.33 0.00 0.00 -0.02 0.00 0.00 33.50 32.75 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 0.80 0.00 -3.65 6.00 4.02 -1.26 -4.32 117.16 118.75 2cbh n TYR 31 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 57.88 2cbh n TYR 31 Cb 0.14 0.13 -0.07 0.00 -0.02 0.00 0.00 39.34 39.53 2cbh n TYR 31 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 176.86 175.38 2cbh s TYR 32 N 0.00 -0.22 -0.22 -0.72 5.04 -0.64 -4.31 117.35 116.28 2cbh s TYR 32 Ca 0.00 0.48 -0.02 0.00 -2.44 0.00 0.00 57.07 55.09 2cbh s TYR 32 Cb 0.00 0.27 0.06 0.00 0.35 0.00 0.00 41.96 42.64 2cbh s TYR 32 CO 0.00 -0.11 0.01 -1.12 -1.34 0.00 0.00 175.55 172.99 2cbh s SER 33 N 0.73 3.31 0.36 4.32 0.01 -0.77 -0.00 113.70 121.66 2cbh s SER 33 Ca -0.03 -1.01 -0.11 0.00 1.31 0.00 0.00 55.95 56.11 2cbh s SER 33 Cb -0.04 -0.80 -0.07 0.00 0.21 0.00 0.00 66.02 65.32 2cbh s SER 33 CO -0.12 -0.29 0.73 -1.58 0.41 0.00 0.00 173.24 172.39 2cbh s GLN 34 N 1.69 3.83 -0.34 12.44 0.74 -0.41 -1.06 119.66 136.55 2cbh s GLN 34 Ca -0.01 0.48 -0.15 0.00 0.05 0.00 0.00 55.36 55.72 2cbh s GLN 34 Cb -0.18 -2.44 -0.01 0.00 1.10 0.00 0.00 33.01 31.48 2cbh s GLN 34 CO -0.09 0.06 0.35 0.00 -0.55 0.00 0.00 175.29 175.06