#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 1.37 0.36 -0.78 1.11 -0.70 -4.88 119.66 116.14 2cbh s GLN 2 Ca 0.00 -1.71 0.05 0.00 0.01 0.00 0.00 55.36 53.71 2cbh s GLN 2 Cb 0.00 -0.60 0.06 0.00 -1.01 0.00 0.00 33.01 31.46 2cbh s GLN 2 CO 0.00 -0.13 0.50 -1.13 0.01 0.00 0.00 175.29 174.54 2cbh n SER 3 N -0.45 1.16 -4.77 5.90 3.41 -1.26 0.17 113.62 117.79 2cbh n SER 3 Ca -0.04 -1.86 -0.37 0.00 -0.26 0.00 0.00 58.87 56.34 2cbh n SER 3 Cb 0.64 -0.28 0.00 0.00 -0.26 0.00 0.00 64.21 64.32 2cbh n SER 3 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 2cbh s HIS 4 N -1.24 2.70 -1.53 7.33 2.46 -1.26 -1.90 115.29 121.86 2cbh s HIS 4 Ca 0.37 1.51 0.00 0.00 0.47 0.00 0.00 55.06 57.41 2cbh s HIS 4 Cb -0.03 -3.43 0.00 0.00 -0.13 0.00 0.00 32.58 29.00 2cbh s HIS 4 CO 0.23 -1.78 0.00 0.66 -2.47 0.00 0.00 174.74 171.39 2cbh n TYR 5 N -0.84 -0.84 -3.73 3.88 4.01 0.71 -4.93 117.16 115.42 2cbh n TYR 5 Ca 0.09 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.49 2cbh n TYR 5 Cb 0.48 -3.18 -0.05 0.00 -0.31 0.00 0.00 39.34 36.29 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 -2.17 2.26 -0.27 2.72 0.00 -0.80 -4.64 107.32 104.42 2cbh s GLY 6 Ca 0.00 -0.57 -0.29 0.00 0.00 0.00 0.00 44.72 43.86 2cbh s GLY 6 CO 0.00 -0.41 1.22 1.62 0.00 0.00 0.00 173.10 175.53 2cbh s GLN 7 N -1.98 4.05 -0.02 2.90 0.74 -1.26 0.43 119.66 124.53 2cbh s GLN 7 Ca 0.31 1.31 0.16 0.00 0.05 0.00 0.00 55.36 57.19 2cbh s GLN 7 Cb -0.13 -3.80 -0.23 0.00 1.10 0.00 0.00 33.01 29.95 2cbh s GLN 7 CO 0.19 -0.93 0.44 0.00 -0.55 0.00 0.00 175.29 174.43 2cbh n GLY 9 N 1.53 3.12 0.00 0.00 0.00 -1.12 -3.99 105.19 104.73 2cbh n GLY 9 Ca -0.01 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.72 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 3.30 3.44 -0.02 0.00 -1.26 -1.67 105.19 108.98 2cbh n GLY 10 Ca 0.00 -1.41 -0.40 0.00 0.00 0.00 0.00 46.02 44.20 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 0.68 1.73 0.00 -0.61 5.41 -1.25 0.09 119.36 125.41 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 -0.53 0.00 0.00 -0.71 0.00 0.00 39.64 38.40 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 1.85 2.76 3.59 7.39 0.00 -1.26 -4.79 105.19 114.73 2cbh n GLY 12 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.57 2.89 -0.76 1.61 5.04 0.11 -4.92 117.35 118.76 2cbh s TYR 13 Ca 0.00 0.60 0.02 0.00 -2.44 0.00 0.00 57.07 55.26 2cbh s TYR 13 Cb 0.00 -4.16 0.34 0.00 0.35 0.00 0.00 41.96 38.49 2cbh s TYR 13 CO 0.00 -1.15 1.34 -1.13 -1.34 0.00 0.00 175.55 173.27 2cbh n SER 14 N 7.45 5.75 -3.50 4.32 3.41 -1.26 -4.83 113.62 124.96 2cbh n SER 14 Ca 0.09 -3.70 -0.21 0.00 -0.26 0.00 0.00 58.87 54.79 2cbh n SER 14 Cb 0.49 -0.81 -0.08 0.00 -0.26 0.00 0.00 64.21 63.54 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 -2.56 2.44 0.60 5.00 0.00 -1.26 -5.13 107.32 106.41 2cbh s GLY 15 Ca 0.45 -1.87 -0.19 0.00 0.00 0.00 0.00 44.72 43.11 2cbh s GLY 15 CO -0.15 -1.56 1.28 -4.14 0.00 0.00 0.00 173.10 168.53 2cbh s PRO 16 N -3.48 2.85 -0.00 2.90 0.02 -1.26 -4.94 135.00 131.09 2cbh s PRO 16 Ca 0.37 2.02 0.10 0.00 0.02 0.00 0.00 61.00 63.51 2cbh s PRO 16 Cb 0.02 -1.98 -0.12 0.00 0.02 0.00 0.00 34.50 32.44 2cbh s PRO 16 CO 0.25 -1.35 0.37 0.25 -0.33 0.00 0.00 177.00 176.19 2cbh n THR 17 N -1.56 0.00 -2.43 0.99 -2.24 -1.26 -4.58 114.28 103.20 2cbh n THR 17 Ca 0.14 -0.26 -0.43 0.00 -2.27 0.00 0.00 64.05 61.23 2cbh n THR 17 Cb 0.48 0.81 -0.02 0.00 -2.10 0.00 0.00 70.33 69.49 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 -2.14 3.97 0.69 2.28 1.01 -1.26 -4.78 120.40 120.16 2cbh s VAL 18 Ca 0.02 0.95 -0.13 0.00 0.00 0.00 0.00 61.98 62.82 2cbh s VAL 18 Cb 0.07 -4.38 0.01 0.00 0.00 0.00 0.00 36.38 32.09 2cbh s VAL 18 CO 0.41 -0.93 1.09 0.00 0.00 0.00 0.00 175.10 175.68 2cbh n ALA 20 N -2.76 -0.82 -1.39 0.00 0.00 0.45 -4.55 120.51 111.43 2cbh n ALA 20 Ca 0.10 -0.15 -0.37 0.00 0.00 0.00 0.00 53.44 53.02 2cbh n ALA 20 Cb 0.52 -1.96 0.07 0.00 0.00 0.00 0.00 19.45 18.08 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 -0.62 -0.32 0.00 0.00 3.41 -1.26 -2.02 113.62 112.80 2cbh n SER 21 Ca 0.12 0.67 0.00 0.00 -0.26 0.00 0.00 58.87 59.40 2cbh n SER 21 Cb 0.49 -1.30 0.00 0.00 -0.26 0.00 0.00 64.21 63.14 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 1.45 2.73 3.75 5.00 0.00 -1.26 -5.00 105.19 111.86 2cbh n GLY 22 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 2cbh n GLY 22 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2cbh n THR 23 N -2.00 0.00 -3.90 2.61 -2.24 -0.86 -5.05 114.28 102.84 2cbh n THR 23 Ca 0.00 -2.49 -0.09 0.00 -2.27 0.00 0.00 64.05 59.20 2cbh n THR 23 Cb 0.00 0.53 -0.07 0.00 -2.10 0.00 0.00 70.33 68.69 2cbh n THR 23 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2cbh s THR 24 N -2.92 0.09 0.04 4.28 -4.23 -1.24 -4.83 115.64 106.83 2cbh s THR 24 Ca 0.02 -1.26 -0.19 0.00 -1.18 0.00 0.00 61.69 59.08 2cbh s THR 24 Cb 0.00 -1.63 -0.06 0.00 1.34 0.00 0.00 72.50 72.14 2cbh s THR 24 CO 0.01 -0.41 0.55 0.00 -0.54 0.00 0.00 174.62 174.24 2cbh s GLN 26 N -0.81 0.94 -0.11 0.00 -0.21 0.99 -4.89 119.66 115.55 2cbh s GLN 26 Ca 0.29 -0.84 -0.29 0.00 0.02 0.00 0.00 55.36 54.53 2cbh s GLN 26 Cb -0.19 -2.22 -0.06 0.00 1.00 0.00 0.00 33.01 31.54 2cbh s GLN 26 CO 0.18 -0.77 2.04 0.08 -2.12 0.00 0.00 175.29 174.70 2cbh s VAL 27 N 1.63 3.10 -0.12 1.09 1.01 -1.26 -1.78 120.40 124.06 2cbh s VAL 27 Ca 0.02 0.11 -0.24 0.00 0.00 0.00 0.00 61.98 61.87 2cbh s VAL 27 Cb -0.18 -3.10 -0.21 0.00 0.00 0.00 0.00 36.38 32.89 2cbh s VAL 27 CO -0.14 -0.04 0.68 0.25 0.00 0.00 0.00 175.10 175.85 2cbh h LEU 28 N 12.82 -0.01 -8.05 3.92 5.85 -1.01 -3.48 115.31 125.35 2cbh h LEU 28 Ca -0.44 -0.78 -0.00 0.00 0.84 0.00 0.00 57.88 57.50 2cbh h LEU 28 Cb 1.23 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.23 2cbh h LEU 28 CO 0.96 0.86 0.20 0.54 -0.34 0.00 0.00 178.44 180.66 2cbh s ASN 29 N -6.05 -0.05 0.00 1.25 2.20 -0.75 -5.00 114.94 106.55 2cbh s ASN 29 Ca -0.15 -0.95 0.00 0.00 -0.94 0.00 0.00 52.86 50.82 2cbh s ASN 29 Cb -0.02 0.78 0.00 0.00 -2.00 0.00 0.00 41.25 40.00 2cbh s ASN 29 CO 0.57 -1.50 0.21 -2.65 -2.94 0.00 0.00 177.10 170.79 2cbh n PRO 30 N -0.50 0.28 -0.01 3.55 -0.02 -1.26 -1.59 135.00 135.45 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 -1.25 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 0.60 0.00 -3.64 6.00 4.01 -1.26 -3.80 117.16 119.07 2cbh n TYR 31 Ca 0.00 0.00 -0.05 0.00 -0.16 0.00 0.00 57.90 57.69 2cbh n TYR 31 Cb 0.10 0.09 -0.07 0.00 -0.31 0.00 0.00 39.34 39.16 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 -0.49 -0.13 -0.72 5.04 -0.62 -4.26 117.35 116.17 2cbh s TYR 32 Ca 0.00 1.06 -0.03 0.00 -2.44 0.00 0.00 57.07 55.65 2cbh s TYR 32 Cb 0.00 0.35 0.05 0.00 0.35 0.00 0.00 41.96 42.71 2cbh s TYR 32 CO 0.00 -0.24 0.06 -1.12 -1.34 0.00 0.00 175.55 172.91 2cbh s SER 33 N 0.83 2.09 0.52 4.32 0.01 -0.67 -0.31 113.70 120.49 2cbh s SER 33 Ca -0.03 -0.43 -0.04 0.00 1.31 0.00 0.00 55.95 56.76 2cbh s SER 33 Cb -0.04 -0.33 -0.01 0.00 0.21 0.00 0.00 66.02 65.85 2cbh s SER 33 CO -0.12 -0.29 0.80 -1.58 0.41 0.00 0.00 173.24 172.46 2cbh s GLN 34 N 2.06 3.11 -0.30 12.44 0.74 -0.73 -0.75 119.66 136.22 2cbh s GLN 34 Ca 0.02 -0.10 -0.07 0.00 0.05 0.00 0.00 55.36 55.26 2cbh s GLN 34 Cb -0.15 -2.38 0.01 0.00 1.10 0.00 0.00 33.01 31.58 2cbh s GLN 34 CO -0.07 -0.45 0.10 0.00 -0.55 0.00 0.00 175.29 174.32