#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cxr s THR 2 N 0.00 5.48 0.09 12.58 2.01 -1.26 -4.64 115.64 129.90 1cxr s THR 2 Ca 0.00 0.09 0.07 0.00 0.31 0.00 0.00 61.69 62.16 1cxr s THR 2 Cb 0.00 -3.45 -0.04 0.00 0.01 0.00 0.00 72.50 69.02 1cxr s THR 2 CO 0.00 0.52 -0.11 0.00 -0.69 0.00 0.00 174.62 174.34 1cxr h PRO 5 N 2.95 0.00 -3.64 0.00 0.13 -1.95 -3.45 132.00 126.04 1cxr h PRO 5 Ca -0.35 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.59 1cxr h PRO 5 Cb 1.18 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 32.06 1cxr h PRO 5 CO 0.61 0.02 -0.62 -1.12 -0.23 0.00 0.00 178.00 176.65 1cxr s SER 6 N -5.96 0.01 0.52 1.44 0.01 -1.26 -5.02 113.70 103.44 1cxr s SER 6 Ca 0.04 -0.05 0.19 0.00 1.31 0.00 0.00 55.95 57.44 1cxr s SER 6 Cb 0.07 0.15 1.35 0.00 0.21 0.00 0.00 66.02 67.80 1cxr s SER 6 CO 0.61 -0.14 2.14 0.16 0.41 0.00 0.00 173.24 176.42 1cxr h ILE 7 N 4.82 0.90 0.05 1.44 3.07 -1.99 -0.44 117.51 125.36 1cxr h ILE 7 Ca -0.27 -0.14 -0.00 0.00 1.55 0.00 0.00 64.86 66.00 1cxr h ILE 7 Cb 1.20 1.08 0.00 0.00 -0.27 0.00 0.00 36.82 38.83 1cxr h ILE 7 CO 0.44 0.04 -0.02 0.58 -1.05 0.00 0.00 178.15 178.14 1cxr h VAL 8 N 0.00 1.13 0.00 0.16 2.07 -1.98 0.73 116.25 118.36 1cxr h VAL 8 Ca -0.00 -0.58 -0.04 0.00 0.82 0.00 0.00 66.70 66.91 1cxr h VAL 8 Cb 0.07 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 1cxr h VAL 8 CO 0.01 0.15 -0.17 0.00 0.02 0.00 0.00 177.57 177.57 1cxr h ALA 9 N 0.62 1.64 -0.35 1.67 0.00 -1.70 -0.66 119.26 120.48 1cxr h ALA 9 Ca -0.01 -0.16 -0.16 0.00 0.00 0.00 0.00 54.91 54.58 1cxr h ALA 9 Cb 0.29 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1cxr h ALA 9 CO 0.01 0.22 -0.42 -0.09 0.00 0.00 0.00 179.25 178.97 1cxr h ARG 10 N 0.00 0.91 0.00 0.00 2.43 -0.67 -2.81 114.38 114.24 1cxr h ARG 10 Ca -0.00 -0.51 -0.07 0.00 -0.81 0.00 0.00 59.98 58.59 1cxr h ARG 10 Cb 0.32 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 1cxr h ARG 10 CO 0.02 1.16 -0.33 0.66 -1.51 0.00 0.00 179.97 179.97 1cxr h SER 11 N 0.72 0.00 1.13 -3.80 4.64 -0.10 -2.21 113.55 113.93 1cxr h SER 11 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1cxr h SER 11 Cb 1.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 1cxr h SER 11 CO 0.10 0.33 0.00 0.78 -0.87 0.00 0.00 176.83 177.17 1cxr h ASN 12 N 0.00 0.00 0.02 4.97 2.35 -0.90 -2.14 115.58 119.88 1cxr h ASN 12 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1cxr h ASN 12 Cb 0.86 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.23 1cxr h ASN 12 CO 0.04 0.00 -0.04 0.33 -1.65 0.00 0.00 177.43 176.12 1cxr n PHE 13 N -2.66 0.00 0.22 1.19 7.35 -0.83 -3.85 117.46 118.88 1cxr n PHE 13 Ca 0.02 0.00 0.05 0.00 -0.76 0.00 0.00 57.45 56.76 1cxr n PHE 13 Cb 0.33 -0.02 0.48 0.00 0.35 0.00 0.00 39.48 40.63 1cxr n PHE 13 CO 0.00 0.00 0.00 -0.91 -0.76 0.00 0.00 176.76 175.09 1cxr h ASN 14 N 2.18 0.00 1.22 -2.13 2.35 -1.42 0.39 115.58 118.18 1cxr h ASN 14 Ca 0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 1cxr h ASN 14 Cb 0.50 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.87 1cxr h ASN 14 CO 0.00 0.21 -0.04 -0.37 -1.65 0.00 0.00 177.43 175.59 1cxr h VAL 15 N 0.00 0.09 0.16 2.81 -1.51 -1.77 0.13 116.25 116.16 1cxr h VAL 15 Ca -0.00 -0.72 -0.32 0.00 -1.23 0.00 0.00 66.70 64.43 1cxr h VAL 15 Cb 0.38 1.66 0.01 0.00 -2.13 0.00 0.00 31.29 31.21 1cxr h VAL 15 CO 0.03 0.04 -1.51 0.00 -1.23 0.00 0.00 177.57 174.89 1cxr h ARG 17 N 0.09 0.34 -7.35 0.00 2.47 -0.99 -3.37 114.38 105.58 1cxr h ARG 17 Ca -0.25 -0.26 -0.51 0.00 -1.26 0.00 0.00 59.98 57.70 1cxr h ARG 17 Cb 2.06 0.05 0.08 0.00 -1.65 0.00 0.00 29.97 30.51 1cxr h ARG 17 CO 0.20 0.90 0.39 -0.51 0.56 0.00 0.00 179.97 181.51 1cxr s LEU 18 N -8.73 3.17 0.00 3.04 1.02 0.42 -4.93 118.68 112.67 1cxr s LEU 18 Ca -0.14 1.53 0.24 0.00 0.02 0.00 0.00 54.13 55.77 1cxr s LEU 18 Cb 0.04 -4.48 1.31 0.00 0.02 0.00 0.00 46.19 43.08 1cxr s LEU 18 CO 0.77 -1.19 1.78 -0.81 0.02 0.00 0.00 176.35 176.92 1cxr n PRO 19 N -2.96 0.57 -0.32 1.29 -0.04 -1.26 -3.59 135.00 128.68 1cxr n PRO 19 Ca 0.07 0.03 0.12 0.00 -0.04 0.00 0.00 63.50 63.68 1cxr n PRO 19 Cb 0.54 -1.50 0.29 0.00 -0.04 0.00 0.00 33.50 32.79 1cxr n PRO 19 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1cxr h GLY 20 N 3.76 1.60 0.00 0.55 0.00 -1.91 -3.41 103.07 103.65 1cxr h GLY 20 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.07 1cxr h GLY 20 CO 0.00 -0.15 0.00 2.41 0.00 0.00 0.00 176.54 178.80 1cxr n THR 21 N -4.91 0.00 -4.00 4.70 -1.04 -1.11 -5.04 114.28 102.88 1cxr n THR 21 Ca 0.21 0.00 -0.37 0.00 -2.04 0.00 0.00 64.05 61.85 1cxr n THR 21 Cb 0.58 -0.16 0.02 0.00 -1.82 0.00 0.00 70.33 68.94 1cxr n THR 21 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1cxr n SER 22 N -1.51 -3.25 -0.06 8.00 2.88 -0.32 -4.85 113.62 114.52 1cxr n SER 22 Ca 0.00 -1.03 -0.20 0.00 -1.33 0.00 0.00 58.87 56.31 1cxr n SER 22 Cb 0.00 -1.25 -0.13 0.00 -0.75 0.00 0.00 64.21 62.09 1cxr n SER 22 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1cxr h GLU 23 N -1.41 0.07 0.00 -1.46 5.08 -1.89 -3.50 114.58 111.46 1cxr h GLU 23 Ca -0.57 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 57.67 1cxr h GLU 23 Cb 1.11 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1cxr h GLU 23 CO 0.41 1.06 0.00 0.00 -1.00 0.00 0.00 179.01 179.47 1cxr n ALA 24 N -3.08 0.00 -1.96 3.43 0.00 -1.26 -5.09 120.51 112.55 1cxr n ALA 24 Ca -0.25 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 52.79 1cxr n ALA 24 Cb 0.70 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.12 1cxr n ALA 24 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1cxr s ILE 25 N -2.51 3.37 -2.31 0.00 1.01 -1.26 -4.77 121.20 114.74 1cxr s ILE 25 Ca 0.00 0.31 0.28 0.00 0.00 0.00 0.00 60.65 61.24 1cxr s ILE 25 Cb 0.00 -3.68 0.48 0.00 0.01 0.00 0.00 42.46 39.27 1cxr s ILE 25 CO 0.00 -0.56 1.70 0.00 0.00 0.00 0.00 174.94 176.09 1cxr h ALA 27 N 4.18 1.26 0.00 0.00 0.00 -1.87 0.99 119.26 123.83 1cxr h ALA 27 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1cxr h ALA 27 Cb 0.50 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1cxr h ALA 27 CO 0.00 0.29 -0.65 1.15 0.00 0.00 0.00 179.25 180.03 1cxr h THR 28 N 0.00 0.00 0.04 0.00 2.02 -1.83 0.32 112.91 113.47 1cxr h THR 28 Ca -0.00 -0.59 -0.31 0.00 0.77 0.00 0.00 66.41 66.27 1cxr h THR 28 Cb 0.54 1.18 -0.04 0.00 -1.74 0.00 0.00 68.15 68.09 1cxr h THR 28 CO 0.03 0.00 -1.79 -1.22 0.37 0.00 0.00 175.52 172.91 1cxr n TYR 29 N -2.24 1.11 -0.10 3.16 4.02 -0.58 -4.35 117.16 118.17 1cxr n TYR 29 Ca 0.03 0.34 -0.11 0.00 -0.01 0.00 0.00 57.90 58.15 1cxr n TYR 29 Cb 0.46 -1.18 -0.15 0.00 -0.02 0.00 0.00 39.34 38.44 1cxr n TYR 29 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 176.86 173.48 1cxr n THR 30 N -3.19 1.40 -0.21 -0.72 5.66 0.24 -5.01 114.28 112.45 1cxr n THR 30 Ca -0.21 -0.81 0.00 0.00 -3.05 0.00 0.00 64.05 59.97 1cxr n THR 30 Cb 1.05 -0.60 0.00 0.00 -1.55 0.00 0.00 70.33 69.23 1cxr n THR 30 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1cxr n GLY 31 N 1.83 1.44 3.96 1.09 0.00 0.63 -4.90 105.19 109.24 1cxr n GLY 31 Ca -0.35 -0.07 -0.24 0.00 0.00 0.00 0.00 46.02 45.36 1cxr n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cxr s ILE 33 N -3.07 1.88 0.02 0.00 -4.36 -0.69 -4.66 121.20 110.32 1cxr s ILE 33 Ca 0.62 -1.72 -0.02 0.00 -0.26 0.00 0.00 60.65 59.27 1cxr s ILE 33 Cb -0.09 -1.75 -0.04 0.00 1.25 0.00 0.00 42.46 41.83 1cxr s ILE 33 CO 0.43 -0.11 0.20 -0.63 0.24 0.00 0.00 174.94 175.06 1cxr s ILE 34 N -1.44 5.41 -0.01 8.37 1.01 -1.26 -3.68 121.20 129.60 1cxr s ILE 34 Ca 0.11 -0.25 -0.03 0.00 0.00 0.00 0.00 60.65 60.48 1cxr s ILE 34 Cb -0.09 -3.58 -0.04 0.00 0.01 0.00 0.00 42.46 38.76 1cxr s ILE 34 CO 0.06 0.24 0.18 0.27 0.00 0.00 0.00 174.94 175.69 1cxr s ILE 35 N -1.41 5.44 -0.94 2.92 -4.36 -1.26 -4.87 121.20 116.72 1cxr s ILE 35 Ca 0.31 -0.15 -0.07 0.00 -0.26 0.00 0.00 60.65 60.48 1cxr s ILE 35 Cb -0.13 -3.54 -0.10 0.00 1.25 0.00 0.00 42.46 39.95 1cxr s ILE 35 CO 0.23 0.33 2.56 -0.81 0.24 0.00 0.00 174.94 177.48 1cxr n PRO 36 N 0.96 2.48 -4.14 0.37 -0.04 -1.26 -4.53 135.00 128.84 1cxr n PRO 36 Ca -0.11 -1.54 -0.31 0.00 -0.04 0.00 0.00 63.50 61.51 1cxr n PRO 36 Cb 0.53 -2.43 -0.04 0.00 -0.04 0.00 0.00 33.50 31.51 1cxr n PRO 36 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1cxr n GLY 37 N 3.45 -0.27 0.00 0.55 0.00 -1.26 -4.70 105.19 102.96 1cxr n GLY 37 Ca 0.53 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.70 1cxr n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cxr n ALA 38 N -4.42 0.10 -2.25 4.61 0.00 -1.26 -5.17 120.51 112.12 1cxr n ALA 38 Ca -0.19 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.18 1cxr n ALA 38 Cb 0.62 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.97 1cxr n ALA 38 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1cxr s THR 39 N 0.36 0.20 0.52 0.00 2.01 -1.26 -5.02 115.64 112.44 1cxr s THR 39 Ca 0.00 -1.65 -0.23 0.00 0.31 0.00 0.00 61.69 60.13 1cxr s THR 39 Cb 0.00 -1.29 -0.06 0.00 0.01 0.00 0.00 72.50 71.16 1cxr s THR 39 CO 0.00 -0.91 1.34 0.00 -0.69 0.00 0.00 174.62 174.36 1cxr n PRO 41 N -0.73 -1.22 -1.09 0.00 -0.04 -1.26 -4.83 135.00 125.82 1cxr n PRO 41 Ca 0.09 -0.81 -0.17 0.00 -0.04 0.00 0.00 63.50 62.57 1cxr n PRO 41 Cb 0.43 -0.64 -0.14 0.00 -0.04 0.00 0.00 33.50 33.12 1cxr n PRO 41 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1cxr n GLY 42 N 0.37 3.31 0.57 0.55 0.00 -1.26 -3.93 105.19 104.80 1cxr n GLY 42 Ca 0.07 -1.31 -0.04 0.00 0.00 0.00 0.00 46.02 44.73 1cxr n GLY 42 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1cxr n ASP 43 N 2.53 1.49 0.00 1.61 10.43 -1.26 -4.97 116.55 126.38 1cxr n ASP 43 Ca 0.49 0.23 0.00 0.00 2.57 0.00 0.00 54.79 58.08 1cxr n ASP 43 Cb 0.78 -0.53 0.00 0.00 1.84 0.00 0.00 41.12 43.21 1cxr n ASP 43 CO 0.00 0.00 0.00 -1.22 -1.07 0.00 0.00 177.20 174.91 1cxr n TYR 44 N -3.94 0.00 -3.77 1.24 4.01 -1.26 -5.04 117.16 108.40 1cxr n TYR 44 Ca -0.07 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.40 1cxr n TYR 44 Cb 0.25 0.02 0.02 0.00 -0.31 0.00 0.00 39.34 39.32 1cxr n TYR 44 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1cxr n ALA 45 N -2.97 -2.25 1.00 -0.72 0.00 -1.25 -5.09 120.51 109.22 1cxr n ALA 45 Ca 0.00 -0.23 0.12 0.00 0.00 0.00 0.00 53.44 53.33 1cxr n ALA 45 Cb 0.48 -2.79 0.10 0.00 0.00 0.00 0.00 19.45 17.24 1cxr n ALA 45 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79