#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 3.55 -4.08 -0.78 0.00 -0.32 -4.93 117.38 110.82 2cbh n GLN 2 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 57.00 56.91 2cbh n GLN 2 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 30.24 30.15 2cbh n GLN 2 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.06 175.94 2cbh s SER 3 N -0.06 0.28 0.21 1.69 0.01 -1.26 -3.34 113.70 111.22 2cbh s SER 3 Ca 0.00 -1.06 -0.30 0.00 1.31 0.00 0.00 55.95 55.89 2cbh s SER 3 Cb 0.00 0.31 -0.15 0.00 0.21 0.00 0.00 66.02 66.38 2cbh s SER 3 CO 0.00 -0.73 0.98 1.57 0.41 0.00 0.00 173.24 175.47 2cbh n HIS 4 N -0.07 0.93 -2.82 2.43 -0.00 -1.26 0.13 115.22 114.55 2cbh n HIS 4 Ca -0.08 0.76 -0.20 0.00 -0.00 0.00 0.00 57.72 58.20 2cbh n HIS 4 Cb 0.63 -2.20 0.02 0.00 -0.00 0.00 0.00 29.99 28.44 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 0.74 -1.58 -3.96 1.57 4.01 0.34 -4.98 117.16 113.30 2cbh n TYR 5 Ca 0.14 0.38 -0.31 0.00 -0.16 0.00 0.00 57.90 57.95 2cbh n TYR 5 Cb 0.27 -4.02 -0.05 0.00 -0.31 0.00 0.00 39.34 35.23 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 -2.64 2.13 -0.66 2.72 0.00 0.34 -4.77 107.32 104.44 2cbh s GLY 6 Ca 0.22 -0.90 -0.27 0.00 0.00 0.00 0.00 44.72 43.77 2cbh s GLY 6 CO 0.27 -0.88 1.18 1.62 0.00 0.00 0.00 173.10 175.29 2cbh s GLN 7 N -2.47 3.30 0.08 2.90 0.74 -1.26 -0.88 119.66 122.07 2cbh s GLN 7 Ca 0.33 -0.16 0.17 0.00 0.05 0.00 0.00 55.36 55.75 2cbh s GLN 7 Cb -0.13 -4.12 -0.12 0.00 1.10 0.00 0.00 33.01 29.75 2cbh s GLN 7 CO 0.26 -1.89 0.86 0.00 -0.55 0.00 0.00 175.29 173.97 2cbh n GLY 9 N 1.37 2.06 0.00 0.00 0.00 -1.14 -3.96 105.19 103.51 2cbh n GLY 9 Ca -0.08 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.54 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 -0.36 3.99 3.39 -0.02 0.00 -1.26 0.14 105.19 111.07 2cbh n GLY 10 Ca -0.02 -1.24 -0.40 0.00 0.00 0.00 0.00 46.02 44.36 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 -0.19 1.38 0.00 -0.61 5.41 -1.22 -0.33 119.36 123.80 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 -0.39 0.00 0.00 -0.71 0.00 0.00 39.64 38.54 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 2.02 2.94 3.75 7.39 0.00 -1.26 -4.65 105.19 115.37 2cbh n GLY 12 Ca 0.11 0.00 -0.40 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 -1.70 3.96 -0.00 1.61 5.04 0.55 -4.93 117.35 121.88 2cbh s TYR 13 Ca 0.00 1.88 0.00 0.00 -2.44 0.00 0.00 57.07 56.51 2cbh s TYR 13 Cb 0.00 -2.97 0.00 0.00 0.35 0.00 0.00 41.96 39.34 2cbh s TYR 13 CO 0.00 0.44 0.72 -1.13 -1.34 0.00 0.00 175.55 174.24 2cbh n SER 14 N 1.64 0.85 -4.49 4.32 3.41 -1.26 -4.90 113.62 113.19 2cbh n SER 14 Ca -0.02 -1.44 -0.26 0.00 -0.26 0.00 0.00 58.87 56.90 2cbh n SER 14 Cb 0.47 -0.00 0.14 0.00 -0.26 0.00 0.00 64.21 64.55 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 -0.44 1.77 0.72 5.00 0.00 -1.26 -5.05 107.32 108.06 2cbh s GLY 15 Ca 0.00 -1.55 -0.14 0.00 0.00 0.00 0.00 44.72 43.03 2cbh s GLY 15 CO 0.00 -0.91 1.16 2.56 0.00 0.00 0.00 173.10 175.90 2cbh s PRO 16 N -5.40 2.31 -0.31 2.90 0.04 -1.26 -4.94 135.00 128.32 2cbh s PRO 16 Ca 0.69 1.57 0.08 0.00 0.04 0.00 0.00 61.00 63.38 2cbh s PRO 16 Cb -0.05 -1.87 0.52 0.00 0.04 0.00 0.00 34.50 33.14 2cbh s PRO 16 CO 0.47 -1.67 1.51 0.25 0.04 0.00 0.00 177.00 177.61 2cbh n THR 17 N -2.77 2.63 -3.78 1.26 -2.24 -1.25 -4.63 114.28 103.50 2cbh n THR 17 Ca 0.12 -2.71 -0.37 0.00 -2.27 0.00 0.00 64.05 58.82 2cbh n THR 17 Cb 0.51 -0.35 -0.13 0.00 -2.10 0.00 0.00 70.33 68.27 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 -3.29 3.72 0.38 2.28 1.01 -1.26 -4.90 120.40 118.34 2cbh s VAL 18 Ca 0.46 -1.03 -0.24 0.00 0.00 0.00 0.00 61.98 61.16 2cbh s VAL 18 Cb 0.42 -3.05 -0.10 0.00 0.00 0.00 0.00 36.38 33.65 2cbh s VAL 18 CO 0.01 -0.09 1.00 0.00 0.00 0.00 0.00 175.10 176.02 2cbh n ALA 20 N 0.09 -1.85 -1.56 0.00 0.00 -1.21 -4.70 120.51 111.27 2cbh n ALA 20 Ca 0.04 0.23 -0.44 0.00 0.00 0.00 0.00 53.44 53.27 2cbh n ALA 20 Cb 0.50 -1.72 -0.01 0.00 0.00 0.00 0.00 19.45 18.22 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 1.58 0.80 0.00 0.00 7.64 -1.26 -1.57 113.62 120.81 2cbh n SER 21 Ca 0.12 1.13 0.00 0.00 1.01 0.00 0.00 58.87 61.13 2cbh n SER 21 Cb 0.36 -1.24 0.00 0.00 -1.01 0.00 0.00 64.21 62.32 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 1.36 3.03 3.81 0.23 0.00 -1.26 -5.03 105.19 107.32 2cbh n GLY 22 Ca 0.11 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.91 2.51 0.04 2.61 -4.23 -0.61 -5.07 115.64 107.97 2cbh s THR 23 Ca 0.00 -1.51 -0.00 0.00 -1.18 0.00 0.00 61.69 58.99 2cbh s THR 23 Cb 0.00 -3.00 -0.03 0.00 1.34 0.00 0.00 72.50 70.81 2cbh s THR 23 CO 0.00 -0.00 -0.04 0.42 -0.54 0.00 0.00 174.62 174.46 2cbh s THR 24 N -2.53 0.22 0.34 3.99 -4.23 -1.15 -4.76 115.64 107.52 2cbh s THR 24 Ca 0.45 -1.36 -0.27 0.00 -1.18 0.00 0.00 61.69 59.33 2cbh s THR 24 Cb 0.00 -0.89 -0.09 0.00 1.34 0.00 0.00 72.50 72.85 2cbh s THR 24 CO 0.25 -0.72 1.06 0.00 -0.54 0.00 0.00 174.62 174.67 2cbh s GLN 26 N -1.99 0.17 0.11 0.00 -0.21 0.82 -4.89 119.66 113.67 2cbh s GLN 26 Ca 0.51 -0.06 -0.36 0.00 0.02 0.00 0.00 55.36 55.48 2cbh s GLN 26 Cb -0.26 -1.29 -0.16 0.00 1.00 0.00 0.00 33.01 32.29 2cbh s GLN 26 CO 0.33 -0.78 1.29 0.28 -2.12 0.00 0.00 175.29 174.29 2cbh n VAL 27 N 5.29 0.26 -0.13 1.09 0.31 -1.26 -1.54 118.33 122.34 2cbh n VAL 27 Ca -0.06 -0.06 -0.27 0.00 -0.01 0.00 0.00 64.34 63.94 2cbh n VAL 27 Cb 0.48 -0.84 -0.10 0.00 -0.91 0.00 0.00 33.84 32.47 2cbh n VAL 27 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 2cbh n LEU 28 N 2.39 1.96 -3.83 7.52 -0.00 -0.07 -4.77 117.00 120.20 2cbh n LEU 28 Ca 0.17 0.27 -0.06 0.00 -0.00 0.00 0.00 56.01 56.40 2cbh n LEU 28 Cb 0.21 -0.78 -0.02 0.00 -0.00 0.00 0.00 43.42 42.83 2cbh n LEU 28 CO 0.62 0.58 0.56 0.54 -0.00 0.00 0.00 177.39 179.69 2cbh s ASN 29 N -7.26 -0.22 0.00 1.96 2.20 0.50 -4.99 114.94 107.14 2cbh s ASN 29 Ca -0.36 -0.57 0.00 0.00 -0.94 0.00 0.00 52.86 50.99 2cbh s ASN 29 Cb 0.14 0.66 0.00 0.00 -2.00 0.00 0.00 41.25 40.04 2cbh s ASN 29 CO 0.47 -1.22 0.29 -2.65 -2.94 0.00 0.00 177.10 171.06 2cbh n PRO 30 N -0.47 0.39 -0.32 3.55 -0.02 -1.26 -1.41 135.00 135.46 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 32.82 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 0.56 0.00 -3.65 6.00 4.02 -1.26 -3.42 117.16 119.41 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 0.15 0.16 -0.06 0.00 -0.02 0.00 0.00 39.34 39.56 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 -0.24 -0.14 -0.72 5.04 -0.50 -4.37 117.35 116.42 2cbh s TYR 32 Ca 0.00 0.50 -0.03 0.00 -2.44 0.00 0.00 57.07 55.11 2cbh s TYR 32 Cb 0.00 0.22 0.05 0.00 0.35 0.00 0.00 41.96 42.58 2cbh s TYR 32 CO 0.00 -0.12 0.03 -1.12 -1.34 0.00 0.00 175.55 173.00 2cbh s SER 33 N 0.90 2.30 0.14 4.32 0.01 0.37 -0.37 113.70 121.37 2cbh s SER 33 Ca -0.05 -0.50 -0.06 0.00 1.31 0.00 0.00 55.95 56.65 2cbh s SER 33 Cb -0.03 -0.48 -0.06 0.00 0.21 0.00 0.00 66.02 65.66 2cbh s SER 33 CO -0.12 -0.27 0.40 -1.58 0.41 0.00 0.00 173.24 172.08 2cbh s GLN 34 N 1.95 3.67 -0.23 12.44 2.00 -0.59 0.04 119.66 138.93 2cbh s GLN 34 Ca 0.02 0.01 -0.08 0.00 -2.00 0.00 0.00 55.36 53.31 2cbh s GLN 34 Cb -0.15 -2.85 -0.03 0.00 0.80 0.00 0.00 33.01 30.78 2cbh s GLN 34 CO -0.07 0.47 0.08 0.00 -0.50 0.00 0.00 175.29 175.27