#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 3.53 0.50 -2.82 2.00 -0.58 -4.91 119.66 117.38 2cbh s GLN 2 Ca 0.00 0.07 0.04 0.00 -2.00 0.00 0.00 55.36 53.47 2cbh s GLN 2 Cb 0.00 -2.45 0.09 0.00 0.80 0.00 0.00 33.01 31.45 2cbh s GLN 2 CO 0.00 -0.11 0.68 0.43 -0.50 0.00 0.00 175.29 175.79 2cbh n SER 3 N -2.12 1.35 -4.70 6.67 7.64 -1.26 -0.87 113.62 120.32 2cbh n SER 3 Ca -0.01 -2.04 -0.42 0.00 1.01 0.00 0.00 58.87 57.41 2cbh n SER 3 Cb 0.55 -0.40 -0.03 0.00 -1.01 0.00 0.00 64.21 63.32 2cbh n SER 3 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 2cbh s HIS 4 N -2.01 3.09 -0.01 1.43 2.46 -1.26 -2.00 115.29 116.99 2cbh s HIS 4 Ca 0.49 0.93 0.00 0.00 0.47 0.00 0.00 55.06 56.94 2cbh s HIS 4 Cb -0.03 -3.65 0.00 0.00 -0.13 0.00 0.00 32.58 28.77 2cbh s HIS 4 CO 0.31 -2.31 0.00 0.66 -2.47 0.00 0.00 174.74 170.94 2cbh n TYR 5 N 4.56 0.00 -3.72 3.88 4.01 0.15 -5.00 117.16 121.04 2cbh n TYR 5 Ca 0.12 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.59 2cbh n TYR 5 Cb 0.43 -0.43 -0.03 0.00 -0.31 0.00 0.00 39.34 39.00 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 -2.83 1.80 -0.36 2.72 0.00 -0.84 -4.67 107.32 103.14 2cbh s GLY 6 Ca 0.00 -0.84 -0.29 0.00 0.00 0.00 0.00 44.72 43.59 2cbh s GLY 6 CO 0.00 -0.80 1.16 1.62 0.00 0.00 0.00 173.10 175.08 2cbh s GLN 7 N -3.30 3.93 -0.01 2.90 0.74 -1.26 -0.82 119.66 121.84 2cbh s GLN 7 Ca 0.38 0.99 0.22 0.00 0.05 0.00 0.00 55.36 57.00 2cbh s GLN 7 Cb -0.11 -3.82 -0.30 0.00 1.10 0.00 0.00 33.01 29.87 2cbh s GLN 7 CO 0.29 -1.09 0.55 0.00 -0.55 0.00 0.00 175.29 174.49 2cbh n GLY 9 N 1.27 3.44 0.00 0.00 0.00 -1.14 -4.11 105.19 104.65 2cbh n GLY 9 Ca -0.03 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.69 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 2.93 3.69 -0.02 0.00 -1.26 -1.05 105.19 109.48 2cbh n GLY 10 Ca 0.00 -1.68 -0.35 0.00 0.00 0.00 0.00 46.02 43.99 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 0.39 2.95 0.00 -0.61 5.41 -1.25 -2.15 119.36 124.09 2cbh n ILE 11 Ca 0.00 -0.31 0.00 0.00 1.00 0.00 0.00 62.75 63.44 2cbh n ILE 11 Cb 0.00 -1.26 0.00 0.00 -0.71 0.00 0.00 39.64 37.67 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 0.74 2.82 3.88 7.39 0.00 -1.26 -4.69 105.19 114.06 2cbh n GLY 12 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.42 3.44 0.00 1.61 5.04 -0.91 -4.97 117.35 119.13 2cbh s TYR 13 Ca 0.00 0.96 0.00 0.00 -2.44 0.00 0.00 57.07 55.59 2cbh s TYR 13 Cb 0.00 -2.36 0.00 0.00 0.35 0.00 0.00 41.96 39.95 2cbh s TYR 13 CO 0.00 0.06 0.45 -1.13 -1.34 0.00 0.00 175.55 173.59 2cbh n SER 14 N -0.84 0.00 -2.69 4.32 3.41 -1.26 -4.97 113.62 111.59 2cbh n SER 14 Ca 0.01 -1.19 -0.07 0.00 -0.26 0.00 0.00 58.87 57.37 2cbh n SER 14 Cb 0.54 -0.04 0.04 0.00 -0.26 0.00 0.00 64.21 64.48 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 0.00 0.48 3.69 5.00 0.00 -1.26 -5.06 105.19 108.04 2cbh n GLY 15 Ca 0.00 -1.94 -0.31 0.00 0.00 0.00 0.00 46.02 43.77 2cbh n GLY 15 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2cbh s PRO 16 N -3.23 1.23 -0.11 1.61 0.02 -1.26 -4.97 135.00 128.29 2cbh s PRO 16 Ca 0.19 1.42 0.16 0.00 0.02 0.00 0.00 61.00 62.79 2cbh s PRO 16 Cb -0.01 -1.76 0.36 0.00 0.02 0.00 0.00 34.50 33.11 2cbh s PRO 16 CO 0.13 -2.44 1.17 0.25 -0.33 0.00 0.00 177.00 175.77 2cbh n THR 17 N -4.10 1.18 -3.76 0.99 -2.24 -1.26 -4.68 114.28 100.42 2cbh n THR 17 Ca 0.11 -2.01 -0.36 0.00 -2.27 0.00 0.00 64.05 59.52 2cbh n THR 17 Cb 0.52 0.26 -0.12 0.00 -2.10 0.00 0.00 70.33 68.89 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 -1.74 4.39 0.34 2.28 1.01 -1.26 -4.93 120.40 120.48 2cbh s VAL 18 Ca 0.32 -0.15 -0.25 0.00 0.00 0.00 0.00 61.98 61.90 2cbh s VAL 18 Cb 0.33 -3.05 -0.10 0.00 0.00 0.00 0.00 36.38 33.55 2cbh s VAL 18 CO -0.08 0.34 0.93 0.00 0.00 0.00 0.00 175.10 176.29 2cbh n ALA 20 N 0.33 -0.58 -1.57 0.00 0.00 -0.05 -4.78 120.51 113.87 2cbh n ALA 20 Ca 0.03 0.18 -0.43 0.00 0.00 0.00 0.00 53.44 53.21 2cbh n ALA 20 Cb 0.51 -1.95 -0.01 0.00 0.00 0.00 0.00 19.45 18.01 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 0.71 0.96 0.00 0.00 7.64 -1.26 -2.06 113.62 119.62 2cbh n SER 21 Ca 0.11 1.11 0.00 0.00 1.01 0.00 0.00 58.87 61.10 2cbh n SER 21 Cb 0.40 -1.28 0.00 0.00 -1.01 0.00 0.00 64.21 62.33 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 1.30 2.89 1.37 0.23 0.00 -1.26 -5.04 105.19 104.68 2cbh n GLY 22 Ca 0.10 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.55 0.00 -3.81 2.61 -2.24 -0.87 -5.06 114.28 104.36 2cbh n THR 23 Ca 0.00 -0.74 -0.10 0.00 -2.27 0.00 0.00 64.05 60.94 2cbh n THR 23 Cb 0.00 -0.53 -0.07 0.00 -2.10 0.00 0.00 70.33 67.63 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 -0.69 0.11 0.05 4.28 -4.23 0.36 -4.90 115.64 110.62 2cbh s THR 24 Ca 0.15 -0.92 -0.23 0.00 -1.18 0.00 0.00 61.69 59.52 2cbh s THR 24 Cb -0.01 -1.11 -0.06 0.00 1.34 0.00 0.00 72.50 72.66 2cbh s THR 24 CO 0.10 -0.51 0.68 0.00 -0.54 0.00 0.00 174.62 174.35 2cbh s GLN 26 N -0.41 0.46 -0.03 0.00 -0.21 0.65 -4.91 119.66 115.20 2cbh s GLN 26 Ca 0.34 0.16 -0.30 0.00 0.02 0.00 0.00 55.36 55.58 2cbh s GLN 26 Cb -0.20 -0.85 -0.07 0.00 1.00 0.00 0.00 33.01 32.89 2cbh s GLN 26 CO 0.21 -0.30 1.91 0.08 -2.12 0.00 0.00 175.29 175.07 2cbh s VAL 27 N 1.95 3.18 -0.13 1.09 1.01 -1.26 -0.99 120.40 125.24 2cbh s VAL 27 Ca 0.04 0.21 -0.11 0.00 0.00 0.00 0.00 61.98 62.13 2cbh s VAL 27 Cb -0.12 -3.15 -0.08 0.00 0.00 0.00 0.00 36.38 33.02 2cbh s VAL 27 CO -0.05 -0.03 0.12 0.25 0.00 0.00 0.00 175.10 175.39 2cbh h LEU 28 N 11.16 0.00 -8.35 3.92 7.12 -1.05 -3.46 115.31 124.64 2cbh h LEU 28 Ca -0.45 -0.25 -0.13 0.00 0.13 0.00 0.00 57.88 57.18 2cbh h LEU 28 Cb 1.22 0.00 -0.10 0.00 -0.53 0.00 0.00 40.66 41.25 2cbh h LEU 28 CO 0.95 0.80 -0.22 0.54 -0.13 0.00 0.00 178.44 180.38 2cbh s ASN 29 N -5.90 0.13 0.00 1.25 2.20 -0.25 -4.99 114.94 107.38 2cbh s ASN 29 Ca -0.12 -1.12 0.00 0.00 -0.94 0.00 0.00 52.86 50.69 2cbh s ASN 29 Cb 0.01 0.57 0.00 0.00 -2.00 0.00 0.00 41.25 39.82 2cbh s ASN 29 CO 0.27 -1.12 0.38 -2.65 -2.94 0.00 0.00 177.10 171.03 2cbh n PRO 30 N -0.39 0.45 -0.25 3.55 -0.02 -1.26 -1.75 135.00 135.33 2cbh n PRO 30 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.47 2cbh n PRO 30 Cb 0.63 -1.26 0.00 0.00 -0.02 0.00 0.00 33.50 32.85 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 -3.52 6.00 4.01 -1.26 -3.93 117.16 119.05 2cbh n TYR 31 Ca 0.00 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.75 2cbh n TYR 31 Cb 0.19 0.14 -0.05 0.00 -0.31 0.00 0.00 39.34 39.30 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 -0.36 -0.21 -0.72 5.04 -0.72 -4.50 117.35 115.87 2cbh s TYR 32 Ca 0.00 0.69 0.00 0.00 -2.44 0.00 0.00 57.07 55.32 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 -0.18 -0.05 -1.12 -1.34 0.00 0.00 175.55 172.86 2cbh s SER 33 N 1.59 3.54 0.33 4.32 0.01 -0.21 -0.41 113.70 122.87 2cbh s SER 33 Ca -0.06 -1.02 -0.16 0.00 1.31 0.00 0.00 55.95 56.02 2cbh s SER 33 Cb -0.03 -1.09 -0.09 0.00 0.21 0.00 0.00 66.02 65.02 2cbh s SER 33 CO -0.14 -0.22 0.77 -1.58 0.41 0.00 0.00 173.24 172.48 2cbh s GLN 34 N 1.48 4.06 -0.46 12.44 2.00 -0.16 -0.40 119.66 138.61 2cbh s GLN 34 Ca -0.04 0.76 -0.16 0.00 -2.00 0.00 0.00 55.36 53.93 2cbh s GLN 34 Cb -0.18 -2.43 0.06 0.00 0.80 0.00 0.00 33.01 31.27 2cbh s GLN 34 CO -0.07 0.15 0.39 0.00 -0.50 0.00 0.00 175.29 175.26