#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bjc n ALA 2 N 0.00 -2.66 0.50 -1.67 0.00 -1.26 -4.85 120.51 110.57 1bjc n ALA 2 Ca 0.00 0.25 -0.03 0.00 0.00 0.00 0.00 53.44 53.66 1bjc n ALA 2 Cb 0.00 -1.93 0.06 0.00 0.00 0.00 0.00 19.45 17.59 1bjc n ALA 2 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1bjc n GLU 3 N -1.39 1.51 -0.23 0.00 4.71 -1.26 -4.25 120.64 119.73 1bjc n GLU 3 Ca -0.08 -0.72 -0.03 0.00 -0.01 0.00 0.00 57.16 56.32 1bjc n GLU 3 Cb 0.58 -1.41 0.05 0.00 -1.01 0.00 0.00 31.44 29.65 1bjc n GLU 3 CO 0.00 0.00 0.00 1.19 0.09 0.00 0.00 177.13 178.41 1bjc n PHE 4 N 0.12 0.55 -2.04 -0.32 3.72 -1.26 -1.74 117.46 116.50 1bjc n PHE 4 Ca 0.12 -0.57 -0.03 0.00 -0.05 0.00 0.00 57.45 56.92 1bjc n PHE 4 Cb 0.68 -0.32 -0.03 0.00 -0.94 0.00 0.00 39.48 38.86 1bjc n PHE 4 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 176.76 179.60 1bjc n ARG 5 N 0.16 0.00 0.00 -1.08 -4.01 -1.26 -4.90 116.66 105.57 1bjc n ARG 5 Ca 0.10 -0.66 0.00 0.00 -1.04 0.00 0.00 57.85 56.25 1bjc n ARG 5 Cb 0.64 0.19 0.00 0.00 -3.04 0.00 0.00 32.46 30.25 1bjc n ARG 5 CO 0.00 0.00 0.00 0.72 -3.04 0.00 0.00 177.63 175.31 1bjc n HIS 6 N 0.04 -0.06 -3.37 2.89 8.25 -0.71 -5.01 115.22 117.24 1bjc n HIS 6 Ca -0.12 0.01 -0.20 0.00 -0.26 0.00 0.00 57.72 57.16 1bjc n HIS 6 Cb 0.65 0.35 0.06 0.00 1.12 0.00 0.00 29.99 32.17 1bjc n HIS 6 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1bjc n ASP 7 N -2.68 -6.30 -3.06 0.41 2.03 -0.74 -1.61 116.55 104.59 1bjc n ASP 7 Ca 0.00 -0.79 -0.22 0.00 0.52 0.00 0.00 54.79 54.30 1bjc n ASP 7 Cb 0.15 -4.70 0.01 0.00 -0.72 0.00 0.00 41.12 35.86 1bjc n ASP 7 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1bjc n SER 8 N -3.06 -5.02 0.00 1.67 2.88 -1.26 -0.76 113.62 108.07 1bjc n SER 8 Ca -0.08 -0.26 0.00 0.00 -1.33 0.00 0.00 58.87 57.20 1bjc n SER 8 Cb 0.61 -4.11 0.00 0.00 -0.75 0.00 0.00 64.21 59.96 1bjc n SER 8 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1bjc n GLY 9 N -1.30 2.49 0.00 0.46 0.00 -0.64 -4.84 105.19 101.36 1bjc n GLY 9 Ca -0.09 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.40 1bjc n GLY 9 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1bjc n TYR 10 N 0.00 0.00 -3.51 1.61 4.19 0.06 -4.83 117.16 114.68 1bjc n TYR 10 Ca 0.00 0.00 -0.00 0.00 3.31 0.00 0.00 57.90 61.21 1bjc n TYR 10 Cb 0.00 0.00 -0.04 0.00 0.49 0.00 0.00 39.34 39.79 1bjc n TYR 10 CO 0.00 0.00 0.00 -2.00 0.91 0.00 0.00 176.86 175.77 1bjc s GLU 11 N -2.00 0.40 0.10 2.98 -6.30 -1.25 -4.95 118.70 107.67 1bjc s GLU 11 Ca 0.00 0.95 0.00 0.00 -2.50 0.00 0.00 54.97 53.42 1bjc s GLU 11 Cb 0.00 0.50 0.00 0.00 0.00 0.00 0.00 34.13 34.63 1bjc s GLU 11 CO 0.00 -0.13 0.00 0.28 0.02 0.00 0.00 175.26 175.43 1bjc n VAL 12 N 4.91 0.90 0.00 3.70 0.31 -1.26 -5.02 118.33 121.87 1bjc n VAL 12 Ca -0.12 0.30 0.00 0.00 -0.01 0.00 0.00 64.34 64.51 1bjc n VAL 12 Cb 0.53 -1.47 0.00 0.00 -0.91 0.00 0.00 33.84 31.98 1bjc n VAL 12 CO 0.00 0.00 0.00 1.57 -1.32 0.00 0.00 176.83 177.08 1bjc n HIS 13 N -3.39 0.00 -3.65 3.52 -0.00 -1.26 -4.73 115.22 105.71 1bjc n HIS 13 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 57.72 57.65 1bjc n HIS 13 Cb 0.09 0.00 -0.02 0.00 -0.00 0.00 0.00 29.99 30.06 1bjc n HIS 13 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 1bjc s HIS 14 N 0.00 -0.26 -1.15 1.57 3.76 -1.26 -5.02 115.29 112.93 1bjc s HIS 14 Ca 0.00 -0.00 0.00 0.00 -0.15 0.00 0.00 55.06 54.91 1bjc s HIS 14 Cb 0.00 0.61 0.00 0.00 1.11 0.00 0.00 32.58 34.30 1bjc s HIS 14 CO 0.00 -0.80 0.46 1.04 -0.85 0.00 0.00 174.74 174.59 1bjc n GLN 15 N -0.39 0.81 0.25 1.40 1.13 -1.26 -3.72 117.38 115.59 1bjc n GLN 15 Ca -0.08 0.00 0.12 0.00 -1.94 0.00 0.00 57.00 55.10 1bjc n GLN 15 Cb 0.61 -1.34 0.65 0.00 0.11 0.00 0.00 30.24 30.28 1bjc n GLN 15 CO 0.00 0.00 0.00 0.27 -1.44 0.00 0.00 177.06 175.89 1bjc h PHE 16 N 0.16 0.00 -0.44 1.08 -0.00 -1.95 -0.37 116.94 115.42 1bjc h PHE 16 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 57.97 57.91 1bjc h PHE 16 Cb 0.34 0.00 -0.02 0.00 -0.00 0.00 0.00 35.95 36.27 1bjc h PHE 16 CO 0.00 0.15 0.06 -0.07 -0.00 0.00 0.00 178.31 178.45 1bjc h LEU 17 N 0.00 0.71 -0.17 2.10 3.38 -1.88 -1.58 115.31 117.88 1bjc h LEU 17 Ca -0.00 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 57.66 1bjc h LEU 17 Cb 0.43 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1bjc h LEU 17 CO 0.02 0.81 -0.03 0.58 0.09 0.00 0.00 178.44 179.91 1bjc h VAL 18 N 0.60 1.28 0.00 1.22 2.07 -1.61 0.21 116.25 120.02 1bjc h VAL 18 Ca 0.13 -0.97 0.00 0.00 0.82 0.00 0.00 66.70 66.69 1bjc h VAL 18 Cb 0.41 1.58 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 1bjc h VAL 18 CO 0.01 0.29 0.00 0.33 0.02 0.00 0.00 177.57 178.22 1bjc n PHE 19 N -4.69 0.00 -1.14 1.57 7.35 -0.24 -0.43 117.46 119.88 1bjc n PHE 19 Ca -0.05 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.64 1bjc n PHE 19 Cb 0.25 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.08 1bjc n PHE 19 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1bjc n PHE 20 N -0.86 0.00 0.00 -5.13 7.35 -0.62 -4.81 117.46 113.39 1bjc n PHE 20 Ca 0.05 -0.02 0.00 0.00 -0.76 0.00 0.00 57.45 56.72 1bjc n PHE 20 Cb 0.02 -0.01 0.00 0.00 0.35 0.00 0.00 39.48 39.84 1bjc n PHE 20 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1bjc n ALA 21 N -0.02 0.85 -0.04 3.13 0.00 0.66 -4.48 120.51 120.61 1bjc n ALA 21 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 1bjc n ALA 21 Cb 0.53 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.90 1bjc n ALA 21 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1bjc h GLU 22 N 0.00 0.56 0.13 0.00 4.81 -0.90 0.23 114.58 119.42 1bjc h GLU 22 Ca 0.00 -0.41 -0.22 0.00 -0.13 0.00 0.00 59.36 58.60 1bjc h GLU 22 Cb 0.00 0.07 0.01 0.00 0.63 0.00 0.00 28.75 29.46 1bjc h GLU 22 CO 0.00 1.03 -1.03 0.38 -0.73 0.00 0.00 179.01 178.66 1bjc h ASP 23 N 0.20 0.42 0.46 1.04 2.03 -1.85 -3.39 116.42 115.33 1bjc h ASP 23 Ca -0.01 -0.91 -0.02 0.00 -0.73 0.00 0.00 57.03 55.36 1bjc h ASP 23 Cb 1.07 -0.14 0.00 0.00 -0.83 0.00 0.00 39.33 39.44 1bjc h ASP 23 CO 0.10 1.47 -0.22 0.58 -1.03 0.00 0.00 179.24 180.14 1bjc h VAL 24 N -0.37 0.13 -1.43 4.15 2.07 -1.78 -3.46 116.25 115.56 1bjc h VAL 24 Ca -0.20 -0.57 0.00 0.00 0.82 0.00 0.00 66.70 66.75 1bjc h VAL 24 Cb 1.67 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.65 1bjc h VAL 24 CO 0.11 0.03 0.00 0.61 0.02 0.00 0.00 177.57 178.34 1bjc n GLY 25 N 0.09 -0.48 2.77 2.17 0.00 0.82 -4.42 105.19 106.14 1bjc n GLY 25 Ca -0.08 -1.69 -0.09 0.00 0.00 0.00 0.00 46.02 44.16 1bjc n GLY 25 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1bjc n SER 26 N -0.53 -5.54 0.17 1.61 7.64 -1.25 -4.65 113.62 111.08 1bjc n SER 26 Ca 0.00 0.22 0.12 0.00 1.01 0.00 0.00 58.87 60.23 1bjc n SER 26 Cb 0.00 -3.97 0.66 0.00 -1.01 0.00 0.00 64.21 59.90 1bjc n SER 26 CO 0.00 0.00 0.00 -1.13 -3.01 0.00 0.00 175.04 170.90 1bjc h ASN 27 N 0.00 0.00 0.00 6.43 -0.73 -1.86 -3.51 115.58 115.91 1bjc h ASN 27 Ca -0.19 0.00 0.00 0.00 1.87 0.00 0.00 56.30 57.98 1bjc h ASN 27 Cb 1.12 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.71 1bjc h ASN 27 CO 0.27 0.00 0.00 2.29 -0.37 0.00 0.00 177.43 179.62