#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cnr s THR 2 N 0.00 4.82 -0.01 1.09 2.01 -1.26 -0.48 115.64 121.81 1cnr s THR 2 Ca 0.00 -0.20 0.03 0.00 0.31 0.00 0.00 61.69 61.83 1cnr s THR 2 Cb 0.00 -3.13 -0.01 0.00 0.01 0.00 0.00 72.50 69.37 1cnr s THR 2 CO 0.00 0.49 -0.10 0.00 -0.69 0.00 0.00 174.62 174.32 1cnr h PRO 5 N 4.39 0.00 -3.17 0.00 0.13 -1.80 -0.29 132.00 131.26 1cnr h PRO 5 Ca -0.45 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.69 1cnr h PRO 5 Cb 1.17 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.22 1cnr h PRO 5 CO 0.41 0.00 0.12 -1.54 -0.23 0.00 0.00 178.00 176.76 1cnr s SER 6 N -5.76 -0.30 0.13 1.44 1.04 -1.26 -4.66 113.70 104.33 1cnr s SER 6 Ca 0.05 -0.48 -0.18 0.00 0.48 0.00 0.00 55.95 55.83 1cnr s SER 6 Cb 0.07 0.64 -0.03 0.00 0.10 0.00 0.00 66.02 66.80 1cnr s SER 6 CO 0.61 -1.15 1.74 0.40 0.98 0.00 0.00 173.24 175.82 1cnr h ILE 7 N 2.10 1.12 -0.31 -1.02 1.08 -1.96 -1.95 117.51 116.57 1cnr h ILE 7 Ca -0.26 -0.31 -0.07 0.00 -0.39 0.00 0.00 64.86 63.83 1cnr h ILE 7 Cb 1.27 0.77 -0.02 0.00 -3.07 0.00 0.00 36.82 35.77 1cnr h ILE 7 CO 0.32 0.12 -0.11 0.58 -0.69 0.00 0.00 178.15 178.37 1cnr h VAL 8 N 0.38 1.23 -0.57 1.67 2.07 -1.99 0.74 116.25 119.78 1cnr h VAL 8 Ca 0.11 -1.01 0.01 0.00 0.82 0.00 0.00 66.70 66.63 1cnr h VAL 8 Cb 0.04 1.12 -0.03 0.00 -1.52 0.00 0.00 31.29 30.90 1cnr h VAL 8 CO -0.02 0.33 0.38 0.00 0.02 0.00 0.00 177.57 178.28 1cnr h ALA 9 N 1.41 0.73 -0.76 1.67 0.00 -1.80 0.12 119.26 120.62 1cnr h ALA 9 Ca 0.09 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1cnr h ALA 9 Cb 0.48 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 1cnr h ALA 9 CO 0.03 0.15 0.42 -0.09 0.00 0.00 0.00 179.25 179.76 1cnr h ARG 10 N 0.77 1.06 -0.70 0.00 9.65 -0.58 0.69 114.38 125.27 1cnr h ARG 10 Ca 0.21 -0.12 -0.04 0.00 -1.10 0.00 0.00 59.98 58.93 1cnr h ARG 10 Cb -0.07 -0.21 -0.03 0.00 -1.39 0.00 0.00 29.97 28.27 1cnr h ARG 10 CO -0.05 0.79 0.29 0.77 2.80 0.00 0.00 179.97 184.56 1cnr h SER 11 N 1.06 0.97 -0.15 -3.80 0.02 -0.33 0.33 113.55 111.64 1cnr h SER 11 Ca 0.27 -0.17 -0.11 0.00 -0.84 0.00 0.00 61.79 60.94 1cnr h SER 11 Cb 0.04 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.31 1cnr h SER 11 CO -0.04 0.87 -0.25 0.78 -1.14 0.00 0.00 176.83 177.04 1cnr h ASN 12 N 1.00 0.62 -0.29 3.07 2.35 -0.55 -2.03 115.58 119.75 1cnr h ASN 12 Ca 0.24 -0.22 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 1cnr h ASN 12 Cb 0.20 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.39 1cnr h ASN 12 CO -0.02 0.86 0.19 0.15 -1.65 0.00 0.00 177.43 176.96 1cnr h PHE 13 N 0.54 0.36 -0.31 1.19 3.04 -0.19 -0.69 116.94 120.88 1cnr h PHE 13 Ca 0.07 0.01 -0.07 0.00 3.98 0.00 0.00 57.97 61.96 1cnr h PHE 13 Cb 0.72 -0.12 -0.02 0.00 2.56 0.00 0.00 35.95 39.09 1cnr h PHE 13 CO 0.03 0.22 -0.11 -0.91 -2.02 0.00 0.00 178.31 175.52 1cnr h ASN 14 N 0.39 0.50 -0.31 0.41 2.35 -0.70 -0.30 115.58 117.92 1cnr h ASN 14 Ca 0.11 -0.13 -0.05 0.00 -0.55 0.00 0.00 56.30 55.68 1cnr h ASN 14 Cb -0.04 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.19 1cnr h ASN 14 CO -0.03 0.65 -0.02 0.58 -1.65 0.00 0.00 177.43 176.96 1cnr h VAL 15 N 0.48 1.26 -0.94 2.81 2.07 -1.20 -2.88 116.25 117.86 1cnr h VAL 15 Ca 0.09 -1.00 0.19 0.00 0.82 0.00 0.00 66.70 66.80 1cnr h VAL 15 Cb 0.48 1.30 -0.08 0.00 -1.52 0.00 0.00 31.29 31.47 1cnr h VAL 15 CO 0.03 0.32 0.60 0.00 0.02 0.00 0.00 177.57 178.54 1cnr h ARG 17 N 0.58 0.00 -0.66 0.00 2.47 -0.86 -3.33 114.38 112.57 1cnr h ARG 17 Ca 0.50 0.00 0.10 0.00 -1.26 0.00 0.00 59.98 59.32 1cnr h ARG 17 Cb 1.00 0.00 -0.07 0.00 -1.65 0.00 0.00 29.97 29.25 1cnr h ARG 17 CO -0.24 0.00 0.28 -0.07 0.56 0.00 0.00 179.97 180.50 1cnr h LEU 18 N 0.00 0.32 0.00 3.04 3.38 -1.12 0.17 115.31 121.10 1cnr h LEU 18 Ca 0.00 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1cnr h LEU 18 Cb 0.80 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.59 1cnr h LEU 18 CO 0.00 0.18 0.00 -0.81 0.09 0.00 0.00 178.44 177.90 1cnr n PRO 19 N -4.95 0.30 0.00 1.13 -0.04 -1.26 -4.88 135.00 125.31 1cnr n PRO 19 Ca 0.10 0.07 0.00 0.00 -0.04 0.00 0.00 63.50 63.63 1cnr n PRO 19 Cb 0.29 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.25 1cnr n PRO 19 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1cnr n GLY 20 N 0.72 0.95 3.57 0.55 0.00 0.60 -5.07 105.19 106.51 1cnr n GLY 20 Ca 0.10 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.64 1cnr n GLY 20 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1cnr n THR 21 N -1.63 0.95 -1.57 2.61 -1.04 -1.25 -4.88 114.28 107.47 1cnr n THR 21 Ca 0.00 -0.24 -0.43 0.00 -2.04 0.00 0.00 64.05 61.35 1cnr n THR 21 Cb 0.00 -0.79 0.00 0.00 -1.82 0.00 0.00 70.33 67.72 1cnr n THR 21 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1cnr n PRO 22 N 1.68 1.18 -0.26 -2.82 -0.02 -1.26 -4.72 135.00 128.78 1cnr n PRO 22 Ca 0.15 0.42 0.08 0.00 -2.02 0.00 0.00 63.50 62.14 1cnr n PRO 22 Cb 0.24 -1.87 0.33 0.00 -0.02 0.00 0.00 33.50 32.19 1cnr n PRO 22 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1cnr h GLU 23 N 1.53 0.78 -0.68 -0.52 5.08 -1.99 -1.38 114.58 117.40 1cnr h GLU 23 Ca -0.42 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 57.88 1cnr h GLU 23 Cb 1.35 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 30.39 1cnr h GLU 23 CO 0.57 0.51 0.38 0.00 -1.00 0.00 0.00 179.01 179.47 1cnr h ALA 24 N 1.58 1.37 -0.13 3.43 0.00 -1.99 0.21 119.26 123.73 1cnr h ALA 24 Ca 0.40 -0.10 -0.22 0.00 0.00 0.00 0.00 54.91 54.99 1cnr h ALA 24 Cb 0.46 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 17.98 1cnr h ALA 24 CO -0.16 0.52 -0.78 -0.07 0.00 0.00 0.00 179.25 178.75 1cnr h LEU 25 N 0.95 0.82 -1.41 0.00 3.38 -1.69 -2.53 115.31 114.83 1cnr h LEU 25 Ca 0.24 -0.54 -0.05 0.00 0.09 0.00 0.00 57.88 57.62 1cnr h LEU 25 Cb 0.02 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1cnr h LEU 25 CO -0.04 1.33 -0.19 0.00 0.09 0.00 0.00 178.44 179.63 1cnr h ALA 27 N 1.67 -0.54 0.00 0.00 0.00 -0.48 -1.93 119.26 117.98 1cnr h ALA 27 Ca 0.03 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 1cnr h ALA 27 Cb 0.42 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1cnr h ALA 27 CO 0.03 -0.73 -0.21 1.79 0.00 0.00 0.00 179.25 180.13 1cnr h THR 28 N -0.69 0.83 -0.06 0.00 1.35 -1.34 0.23 112.91 113.23 1cnr h THR 28 Ca -0.06 -0.82 -0.10 0.00 -0.55 0.00 0.00 66.41 64.88 1cnr h THR 28 Cb 0.49 1.49 -0.01 0.00 -1.73 0.00 0.00 68.15 68.39 1cnr h THR 28 CO 0.09 0.21 -0.43 0.22 -0.25 0.00 0.00 175.52 175.36 1cnr h TYR 29 N 0.00 0.15 0.00 4.73 3.20 -1.06 -3.35 116.97 120.63 1cnr h TYR 29 Ca -0.00 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.83 1cnr h TYR 29 Cb 0.47 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.71 1cnr h TYR 29 CO 0.00 0.54 -1.17 0.25 -1.64 0.00 0.00 178.16 176.13 1cnr n THR 30 N -4.02 0.00 -0.30 1.81 -2.24 -0.74 -5.00 114.28 103.80 1cnr n THR 30 Ca -0.02 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 1cnr n THR 30 Cb 0.47 0.46 0.00 0.00 -2.10 0.00 0.00 70.33 69.17 1cnr n THR 30 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1cnr n GLY 31 N 1.81 1.18 3.63 3.38 0.00 0.77 -4.79 105.19 111.16 1cnr n GLY 31 Ca -0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 1cnr n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cnr s ILE 33 N -2.79 0.57 -0.19 0.00 -4.36 0.34 -4.40 121.20 110.37 1cnr s ILE 33 Ca 0.66 -1.60 -0.05 0.00 -0.26 0.00 0.00 60.65 59.39 1cnr s ILE 33 Cb -0.21 -1.26 -0.03 0.00 1.25 0.00 0.00 42.46 42.22 1cnr s ILE 33 CO 0.60 -0.71 0.01 -0.63 0.24 0.00 0.00 174.94 174.44 1cnr s ILE 34 N -2.84 4.13 0.18 8.37 -1.09 -1.26 -1.05 121.20 127.64 1cnr s ILE 34 Ca 0.03 -0.26 0.11 0.00 -2.23 0.00 0.00 60.65 58.30 1cnr s ILE 34 Cb -0.00 -2.86 -0.04 0.00 -1.58 0.00 0.00 42.46 37.98 1cnr s ILE 34 CO -0.03 0.45 -0.23 0.27 -1.23 0.00 0.00 174.94 174.16 1cnr s ILE 35 N 0.74 2.22 0.08 2.92 -4.36 0.36 -4.96 121.20 118.20 1cnr s ILE 35 Ca 0.01 -1.97 0.17 0.00 -0.26 0.00 0.00 60.65 58.60 1cnr s ILE 35 Cb -0.14 -2.04 0.09 0.00 1.25 0.00 0.00 42.46 41.62 1cnr s ILE 35 CO 0.02 -0.13 1.62 1.55 0.24 0.00 0.00 174.94 178.24 1cnr h PRO 36 N 3.31 0.00 0.00 0.37 0.13 -2.00 0.70 132.00 134.51 1cnr h PRO 36 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1cnr h PRO 36 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1cnr h PRO 36 CO 0.47 0.46 0.00 0.41 -0.23 0.00 0.00 178.00 179.11 1cnr n GLY 37 N 0.59 -0.13 0.00 1.56 0.00 -1.26 -4.48 105.19 101.46 1cnr n GLY 37 Ca 0.00 -1.77 0.00 0.00 0.00 0.00 0.00 46.02 44.25 1cnr n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cnr n ALA 38 N -3.00 2.07 -3.70 4.61 0.00 -1.26 -2.23 120.51 116.99 1cnr n ALA 38 Ca 0.00 -0.60 -0.38 0.00 0.00 0.00 0.00 53.44 52.47 1cnr n ALA 38 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 1cnr n ALA 38 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1cnr s THR 39 N -0.28 3.63 0.29 0.00 2.01 -1.26 -5.01 115.64 115.01 1cnr s THR 39 Ca 0.00 -2.18 -0.29 0.00 0.31 0.00 0.00 61.69 59.53 1cnr s THR 39 Cb 0.00 -3.44 -0.10 0.00 0.01 0.00 0.00 72.50 68.98 1cnr s THR 39 CO 0.00 -0.76 1.17 0.00 -0.69 0.00 0.00 174.62 174.34 1cnr s PRO 41 N -1.44 1.72 0.55 0.00 0.04 -1.26 -4.89 135.00 129.71 1cnr s PRO 41 Ca 0.46 0.69 0.29 0.00 0.04 0.00 0.00 61.00 62.49 1cnr s PRO 41 Cb -0.34 -1.87 1.60 0.00 0.04 0.00 0.00 34.50 33.92 1cnr s PRO 41 CO 0.44 -1.89 2.13 0.78 0.04 0.00 0.00 177.00 178.50 1cnr h GLY 42 N -1.29 0.00 -0.67 0.56 0.00 -1.99 -0.50 103.07 99.18 1cnr h GLY 42 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 1cnr h GLY 42 CO 0.58 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.21 1cnr n ASP 43 N -3.62 1.67 -3.02 0.19 5.75 -1.26 -3.95 116.55 112.31 1cnr n ASP 43 Ca -0.02 -1.59 -0.22 0.00 -0.01 0.00 0.00 54.79 52.96 1cnr n ASP 43 Cb 0.20 -0.03 -0.03 0.00 -1.03 0.00 0.00 41.12 40.23 1cnr n ASP 43 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 1cnr n TYR 44 N 0.31 1.96 1.19 2.11 4.02 -0.20 -4.53 117.16 122.01 1cnr n TYR 44 Ca 0.18 -3.79 0.13 0.00 -0.01 0.00 0.00 57.90 54.41 1cnr n TYR 44 Cb 0.37 -0.43 0.46 0.00 -0.02 0.00 0.00 39.34 39.72 1cnr n TYR 44 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1cnr n ALA 45 N 0.01 2.99 0.40 -0.72 0.00 -1.03 -3.82 120.51 118.34 1cnr n ALA 45 Ca 0.27 -0.29 0.05 0.00 0.00 0.00 0.00 53.44 53.47 1cnr n ALA 45 Cb 0.56 -1.25 0.04 0.00 0.00 0.00 0.00 19.45 18.80 1cnr n ALA 45 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59