#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 1.26 -4.36 -2.82 3.00 -0.77 -4.95 117.38 108.74 2cbh n GLN 2 Ca 0.00 -0.06 -0.21 0.00 -0.01 0.00 0.00 57.00 56.72 2cbh n GLN 2 Cb 0.00 0.03 -0.08 0.00 0.00 0.00 0.00 30.24 30.18 2cbh n GLN 2 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 2cbh s SER 3 N -1.04 1.93 0.25 1.08 1.04 -1.26 -2.81 113.70 112.89 2cbh s SER 3 Ca 0.00 -1.69 -0.31 0.00 0.48 0.00 0.00 55.95 54.43 2cbh s SER 3 Cb 0.00 0.51 -0.12 0.00 0.10 0.00 0.00 66.02 66.52 2cbh s SER 3 CO 0.00 -0.99 1.67 1.57 0.98 0.00 0.00 173.24 176.48 2cbh n HIS 4 N -0.69 2.82 -1.92 5.02 -0.00 -1.26 -0.56 115.22 118.63 2cbh n HIS 4 Ca 0.02 0.13 -0.13 0.00 0.46 0.00 0.00 57.72 58.20 2cbh n HIS 4 Cb 0.64 -2.65 -0.02 0.00 -0.12 0.00 0.00 29.99 27.84 2cbh n HIS 4 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 2cbh n TYR 5 N 3.16 -0.38 -4.03 1.57 4.01 -0.30 -4.97 117.16 116.22 2cbh n TYR 5 Ca 0.13 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.59 2cbh n TYR 5 Cb 0.36 -2.62 -0.05 0.00 -0.31 0.00 0.00 39.34 36.72 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 -2.59 1.81 -0.53 2.72 0.00 0.28 -4.77 107.32 104.24 2cbh s GLY 6 Ca 0.00 -1.10 -0.29 0.00 0.00 0.00 0.00 44.72 43.33 2cbh s GLY 6 CO 0.00 -1.10 1.16 1.62 0.00 0.00 0.00 173.10 174.78 2cbh s GLN 7 N -2.96 3.62 -0.00 2.90 0.74 -1.26 -1.60 119.66 121.09 2cbh s GLN 7 Ca 0.32 0.41 0.21 0.00 0.05 0.00 0.00 55.36 56.35 2cbh s GLN 7 Cb -0.11 -3.96 -0.25 0.00 1.10 0.00 0.00 33.01 29.79 2cbh s GLN 7 CO 0.25 -1.52 0.55 0.00 -0.55 0.00 0.00 175.29 174.02 2cbh n GLY 9 N 1.32 4.31 0.00 0.00 0.00 -1.12 -3.82 105.19 105.88 2cbh n GLY 9 Ca -0.07 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 44.98 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 2.54 3.74 -0.02 0.00 -1.26 -2.11 105.19 108.08 2cbh n GLY 10 Ca 0.00 -1.65 -0.37 0.00 0.00 0.00 0.00 46.02 44.00 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 -1.48 2.07 0.00 -0.61 1.01 -1.26 -1.53 121.20 119.41 2cbh s ILE 11 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 60.65 60.69 2cbh s ILE 11 Cb 0.00 -3.02 0.00 0.00 0.01 0.00 0.00 42.46 39.45 2cbh s ILE 11 CO 0.00 -0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.54 2cbh n GLY 12 N 0.81 2.98 3.66 6.18 0.00 -1.26 -4.69 105.19 112.89 2cbh n GLY 12 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.55 3.19 -0.68 1.61 5.04 -0.58 -4.94 117.35 118.44 2cbh s TYR 13 Ca 0.00 1.31 0.03 0.00 -2.44 0.00 0.00 57.07 55.98 2cbh s TYR 13 Cb 0.00 -3.35 0.35 0.00 0.35 0.00 0.00 41.96 39.31 2cbh s TYR 13 CO 0.00 -0.91 1.22 -1.13 -1.34 0.00 0.00 175.55 173.40 2cbh n SER 14 N 6.21 5.32 -4.08 4.32 3.41 -1.26 -4.90 113.62 122.64 2cbh n SER 14 Ca 0.12 -3.70 -0.11 0.00 -0.26 0.00 0.00 58.87 54.92 2cbh n SER 14 Cb 0.46 -0.71 -0.08 0.00 -0.26 0.00 0.00 64.21 63.62 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 -2.89 1.17 0.74 5.00 0.00 -1.26 -5.14 107.32 104.94 2cbh s GLY 15 Ca 0.47 -1.44 -0.15 0.00 0.00 0.00 0.00 44.72 43.60 2cbh s GLY 15 CO -0.16 -1.14 1.02 -1.55 0.00 0.00 0.00 173.10 171.28 2cbh n PRO 16 N -0.33 0.47 -1.07 2.90 -0.04 -1.26 -4.92 135.00 130.75 2cbh n PRO 16 Ca 0.01 0.22 -0.04 0.00 -0.04 0.00 0.00 63.50 63.65 2cbh n PRO 16 Cb 0.64 -2.28 0.15 0.00 -0.04 0.00 0.00 33.50 31.97 2cbh n PRO 16 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2cbh n THR 17 N -2.64 2.34 -3.61 0.52 -2.24 -1.25 -4.69 114.28 102.71 2cbh n THR 17 Ca 0.13 -3.54 -0.40 0.00 -2.27 0.00 0.00 64.05 57.97 2cbh n THR 17 Cb 0.50 -0.54 -0.10 0.00 -2.10 0.00 0.00 70.33 68.08 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 -3.69 4.35 0.35 2.28 1.01 -1.26 -4.92 120.40 118.52 2cbh s VAL 18 Ca 0.43 -1.18 -0.26 0.00 0.00 0.00 0.00 61.98 60.97 2cbh s VAL 18 Cb 0.39 -3.56 -0.09 0.00 0.00 0.00 0.00 36.38 33.11 2cbh s VAL 18 CO -0.03 -0.39 1.07 0.00 0.00 0.00 0.00 175.10 175.75 2cbh n ALA 20 N 0.43 -1.77 -0.78 0.00 0.00 -1.12 -4.77 120.51 112.50 2cbh n ALA 20 Ca 0.03 0.05 -0.33 0.00 0.00 0.00 0.00 53.44 53.19 2cbh n ALA 20 Cb 0.48 -1.70 0.13 0.00 0.00 0.00 0.00 19.45 18.35 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 1.30 -1.90 0.00 0.00 7.64 -1.26 -2.21 113.62 117.19 2cbh n SER 21 Ca 0.11 0.31 0.00 0.00 1.01 0.00 0.00 58.87 60.30 2cbh n SER 21 Cb 0.44 -1.22 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 1.41 2.99 3.44 0.23 0.00 -1.26 -4.97 105.19 107.04 2cbh n GLY 22 Ca 0.07 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.87 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 -1.64 1.85 0.20 2.61 -4.23 -0.94 -5.07 115.64 108.42 2cbh s THR 23 Ca 0.00 -2.18 0.07 0.00 -1.18 0.00 0.00 61.69 58.39 2cbh s THR 23 Cb 0.00 -2.41 -0.05 0.00 1.34 0.00 0.00 72.50 71.38 2cbh s THR 23 CO 0.00 -0.33 -0.12 0.42 -0.54 0.00 0.00 174.62 174.05 2cbh s THR 24 N -2.88 1.55 -0.29 3.99 -4.23 -1.26 -4.75 115.64 107.76 2cbh s THR 24 Ca 0.29 -2.16 -0.22 0.00 -1.18 0.00 0.00 61.69 58.42 2cbh s THR 24 Cb 0.02 -2.05 -0.01 0.00 1.34 0.00 0.00 72.50 71.81 2cbh s THR 24 CO 0.12 -0.59 0.72 0.00 -0.54 0.00 0.00 174.62 174.33 2cbh s GLN 26 N 2.77 2.90 0.15 0.00 -0.21 0.10 -4.95 119.66 120.42 2cbh s GLN 26 Ca 0.29 -0.93 -0.33 0.00 0.02 0.00 0.00 55.36 54.41 2cbh s GLN 26 Cb -0.15 -2.95 -0.13 0.00 1.00 0.00 0.00 33.01 30.78 2cbh s GLN 26 CO 0.11 -0.36 1.64 0.28 -2.12 0.00 0.00 175.29 174.84 2cbh n VAL 27 N 4.68 0.06 -0.09 1.09 0.31 -1.26 -1.50 118.33 121.62 2cbh n VAL 27 Ca -0.17 -0.01 -0.18 0.00 -0.01 0.00 0.00 64.34 63.97 2cbh n VAL 27 Cb 0.48 -1.66 -0.10 0.00 -0.91 0.00 0.00 33.84 31.64 2cbh n VAL 27 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 2cbh h LEU 28 N 6.43 0.00 -8.10 7.52 7.12 -0.49 -3.45 115.31 124.34 2cbh h LEU 28 Ca -0.45 -0.55 -0.04 0.00 0.13 0.00 0.00 57.88 56.97 2cbh h LEU 28 Cb 1.25 0.00 -0.03 0.00 -0.53 0.00 0.00 40.66 41.35 2cbh h LEU 28 CO 0.91 1.27 0.16 0.20 -0.13 0.00 0.00 178.44 180.84 2cbh s ASN 29 N -6.55 0.08 0.00 1.25 0.01 -0.06 -4.97 114.94 104.69 2cbh s ASN 29 Ca -0.24 -1.07 0.00 0.00 -0.71 0.00 0.00 52.86 50.84 2cbh s ASN 29 Cb 0.03 0.77 0.00 0.00 0.41 0.00 0.00 41.25 42.47 2cbh s ASN 29 CO 0.55 -1.51 0.30 -2.65 -1.51 0.00 0.00 177.10 172.29 2cbh n PRO 30 N -0.51 0.41 -0.02 -0.60 -0.02 -1.26 -1.76 135.00 131.25 2cbh n PRO 30 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 2cbh n PRO 30 Cb 0.60 -1.25 0.00 0.00 -0.02 0.00 0.00 33.50 32.83 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 0.52 0.00 -3.57 6.00 4.02 -1.26 -4.00 117.16 118.88 2cbh n TYR 31 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 2cbh n TYR 31 Cb 0.15 0.08 -0.06 0.00 -0.02 0.00 0.00 39.34 39.49 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 -0.36 -0.18 -0.72 5.04 -0.72 -4.36 117.35 116.04 2cbh s TYR 32 Ca 0.00 0.69 0.00 0.00 -2.44 0.00 0.00 57.07 55.33 2cbh s TYR 32 Cb 0.00 0.22 0.04 0.00 0.35 0.00 0.00 41.96 42.56 2cbh s TYR 32 CO 0.00 -0.18 -0.10 -1.12 -1.34 0.00 0.00 175.55 172.81 2cbh s SER 33 N 1.45 3.16 0.21 4.32 0.01 -0.90 0.28 113.70 122.24 2cbh s SER 33 Ca -0.07 -0.77 0.04 0.00 1.31 0.00 0.00 55.95 56.46 2cbh s SER 33 Cb -0.03 -1.16 -0.03 0.00 0.21 0.00 0.00 66.02 65.01 2cbh s SER 33 CO -0.14 -0.14 0.33 -1.58 0.41 0.00 0.00 173.24 172.12 2cbh s GLN 34 N 1.46 3.41 -0.25 12.44 0.74 -0.56 -0.92 119.66 135.99 2cbh s GLN 34 Ca 0.00 -0.72 -0.12 0.00 0.05 0.00 0.00 55.36 54.56 2cbh s GLN 34 Cb -0.15 -2.90 -0.05 0.00 1.10 0.00 0.00 33.01 31.01 2cbh s GLN 34 CO -0.08 0.46 0.24 0.00 -0.55 0.00 0.00 175.29 175.36