#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bjc s ALA 2 N 0.00 -1.97 -0.42 -1.67 0.00 -1.26 -5.03 121.76 111.41 1bjc s ALA 2 Ca 0.00 1.79 0.02 0.00 0.00 0.00 0.00 51.96 53.77 1bjc s ALA 2 Cb 0.00 -1.24 0.51 0.00 0.00 0.00 0.00 23.12 22.38 1bjc s ALA 2 CO 0.00 -0.25 1.83 -0.85 0.00 0.00 0.00 175.76 176.49 1bjc n GLU 3 N 1.77 2.13 -2.92 0.00 0.28 -1.26 -4.28 120.64 116.36 1bjc n GLU 3 Ca -0.12 -2.54 -0.13 0.00 -0.16 0.00 0.00 57.16 54.21 1bjc n GLU 3 Cb 0.56 -2.00 0.03 0.00 1.43 0.00 0.00 31.44 31.47 1bjc n GLU 3 CO 0.00 0.00 0.00 1.97 -0.16 0.00 0.00 177.13 178.94 1bjc n PHE 4 N -0.77 -1.81 -2.13 -1.84 -1.74 -1.26 -4.88 117.46 103.03 1bjc n PHE 4 Ca 0.50 -2.71 -0.04 0.00 -0.56 0.00 0.00 57.45 54.64 1bjc n PHE 4 Cb 1.26 0.81 -0.01 0.00 1.52 0.00 0.00 39.48 43.06 1bjc n PHE 4 CO 0.00 0.00 0.00 2.89 -0.56 0.00 0.00 176.76 179.09 1bjc n ARG 5 N 0.69 0.34 -1.14 3.97 -4.01 -1.26 -4.97 116.66 110.28 1bjc n ARG 5 Ca 0.14 -0.85 -0.09 0.00 -1.04 0.00 0.00 57.85 56.01 1bjc n ARG 5 Cb 0.66 0.45 -0.04 0.00 -3.04 0.00 0.00 32.46 30.49 1bjc n ARG 5 CO 0.00 0.00 0.00 1.58 -3.04 0.00 0.00 177.63 176.17 1bjc n HIS 6 N -0.39 -0.33 -2.75 2.89 -0.00 -1.26 -1.67 115.22 111.71 1bjc n HIS 6 Ca -0.20 0.00 -0.17 0.00 -0.00 0.00 0.00 57.72 57.35 1bjc n HIS 6 Cb 0.67 -2.12 -0.00 0.00 -0.00 0.00 0.00 29.99 28.54 1bjc n HIS 6 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.34 176.09 1bjc n ASP 7 N -0.05 -4.28 -1.05 0.26 8.00 -1.26 -1.17 116.55 117.00 1bjc n ASP 7 Ca -0.09 -0.03 -0.12 0.00 0.71 0.00 0.00 54.79 55.27 1bjc n ASP 7 Cb 0.36 -3.57 -0.05 0.00 -0.02 0.00 0.00 41.12 37.83 1bjc n ASP 7 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1bjc n SER 8 N -2.03 -4.48 -1.67 -2.24 7.64 -0.67 -3.69 113.62 106.47 1bjc n SER 8 Ca -0.12 0.29 -0.00 0.00 1.01 0.00 0.00 58.87 60.05 1bjc n SER 8 Cb 0.60 -3.64 0.00 0.00 -1.01 0.00 0.00 64.21 60.16 1bjc n SER 8 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1bjc n GLY 9 N 0.01 -2.74 1.75 0.23 0.00 -0.32 -5.06 105.19 99.07 1bjc n GLY 9 Ca -0.12 -0.12 -0.16 0.00 0.00 0.00 0.00 46.02 45.62 1bjc n GLY 9 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1bjc n TYR 10 N 0.02 -3.24 -3.20 1.61 4.11 -1.24 -5.08 117.16 110.14 1bjc n TYR 10 Ca 0.00 -0.48 0.04 0.00 -0.00 0.00 0.00 57.90 57.47 1bjc n TYR 10 Cb 0.01 -0.62 -0.02 0.00 -0.00 0.00 0.00 39.34 38.71 1bjc n TYR 10 CO 0.00 0.00 0.00 -2.00 -0.00 0.00 0.00 176.86 174.86 1bjc s GLU 11 N -4.20 0.17 0.22 -3.48 2.12 -1.26 -5.02 118.70 107.25 1bjc s GLU 11 Ca 0.36 0.35 0.01 0.00 0.36 0.00 0.00 54.97 56.05 1bjc s GLU 11 Cb -0.05 0.20 0.22 0.00 0.26 0.00 0.00 34.13 34.76 1bjc s GLU 11 CO 0.29 -0.15 1.55 0.28 -0.54 0.00 0.00 175.26 176.69 1bjc h VAL 12 N 5.30 1.35 0.00 3.70 2.07 -2.05 -3.46 116.25 123.15 1bjc h VAL 12 Ca -0.14 -1.85 0.00 0.00 0.82 0.00 0.00 66.70 65.54 1bjc h VAL 12 Cb 1.16 1.86 0.00 0.00 -1.52 0.00 0.00 31.29 32.79 1bjc h VAL 12 CO -0.05 0.56 0.00 1.57 0.02 0.00 0.00 177.57 179.66 1bjc n HIS 13 N -3.93 0.00 -3.37 1.57 -0.00 -1.26 -4.77 115.22 103.46 1bjc n HIS 13 Ca -0.03 0.00 -0.17 0.00 0.46 0.00 0.00 57.72 57.99 1bjc n HIS 13 Cb 0.59 -0.35 -0.08 0.00 -0.12 0.00 0.00 29.99 30.03 1bjc n HIS 13 CO 0.00 0.00 0.00 -1.01 0.46 0.00 0.00 176.34 175.79 1bjc s HIS 14 N -0.59 -0.35 -0.00 1.57 3.76 -1.26 -4.94 115.29 113.47 1bjc s HIS 14 Ca 0.00 -0.61 0.00 0.00 -0.15 0.00 0.00 55.06 54.30 1bjc s HIS 14 Cb 0.00 -0.43 0.00 0.00 1.11 0.00 0.00 32.58 33.27 1bjc s HIS 14 CO 0.00 -0.95 0.61 0.00 -0.85 0.00 0.00 174.74 173.54 1bjc n GLN 15 N 4.59 0.38 0.30 1.40 -0.00 -1.26 -4.80 117.38 117.98 1bjc n GLN 15 Ca 0.07 -0.68 0.17 0.00 -0.00 0.00 0.00 57.00 56.56 1bjc n GLN 15 Cb 0.45 -0.57 0.91 0.00 -0.00 0.00 0.00 30.24 31.03 1bjc n GLN 15 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.06 177.33 1bjc h PHE 16 N 0.00 0.00 -0.29 2.61 -0.00 -1.98 0.24 116.94 117.52 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 0.97 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.91 1bjc h PHE 16 CO 0.01 0.04 -0.04 -0.07 -0.00 0.00 0.00 178.31 178.25 1bjc h LEU 17 N 0.00 0.53 -0.13 2.10 4.07 -1.99 -1.76 115.31 118.14 1bjc h LEU 17 Ca -0.00 -0.34 -0.05 0.00 0.08 0.00 0.00 57.88 57.57 1bjc h LEU 17 Cb 0.21 -0.14 -0.00 0.00 1.08 0.00 0.00 40.66 41.80 1bjc h LEU 17 CO 0.01 0.74 -0.10 0.58 -1.08 0.00 0.00 178.44 178.59 1bjc h VAL 18 N 0.31 1.34 -0.87 1.22 2.07 -1.59 -0.33 116.25 118.40 1bjc h VAL 18 Ca 0.08 -1.21 0.25 0.00 0.82 0.00 0.00 66.70 66.63 1bjc h VAL 18 Cb 0.49 1.87 -0.03 0.00 -1.52 0.00 0.00 31.29 32.09 1bjc h VAL 18 CO 0.02 0.35 0.64 0.15 0.02 0.00 0.00 177.57 178.75 1bjc h PHE 19 N -0.08 0.00 0.00 1.57 3.04 -0.87 0.15 116.94 120.74 1bjc h PHE 19 Ca 0.02 0.00 -0.09 0.00 3.98 0.00 0.00 57.97 61.88 1bjc h PHE 19 Cb 0.60 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 39.10 1bjc h PHE 19 CO 0.08 0.00 -0.52 0.35 -2.02 0.00 0.00 178.31 176.20 1bjc h PHE 20 N 0.00 0.00 -0.74 0.41 3.57 -1.05 -3.34 116.94 115.78 1bjc h PHE 20 Ca 0.41 0.00 0.17 0.00 3.53 0.00 0.00 57.97 62.08 1bjc h PHE 20 Cb 1.69 0.00 -0.13 0.00 2.79 0.00 0.00 35.95 40.30 1bjc h PHE 20 CO 0.00 1.12 -0.03 0.00 -2.23 0.00 0.00 178.31 177.17 1bjc h ALA 21 N -0.27 0.72 -0.82 2.41 0.00 0.77 0.13 119.26 122.21 1bjc h ALA 21 Ca -0.14 0.25 0.08 0.00 0.00 0.00 0.00 54.91 55.09 1bjc h ALA 21 Cb 1.06 0.44 -0.05 0.00 0.00 0.00 0.00 17.79 19.24 1bjc h ALA 21 CO -0.09 -0.42 0.53 0.93 0.00 0.00 0.00 179.25 180.20 1bjc h GLU 22 N 0.08 0.82 -0.00 0.00 3.07 -1.37 0.29 114.58 117.47 1bjc h GLU 22 Ca 0.40 -0.05 -0.09 0.00 -0.50 0.00 0.00 59.36 59.11 1bjc h GLU 22 Cb 0.68 -0.19 0.01 0.00 -0.84 0.00 0.00 28.75 28.42 1bjc h GLU 22 CO -0.68 0.54 -0.37 0.22 -1.40 0.00 0.00 179.01 177.33 1bjc h ASP 23 N 0.84 0.32 -0.03 1.42 3.58 -0.97 -2.61 116.42 118.97 1bjc h ASP 23 Ca 0.36 -0.77 0.03 0.00 0.42 0.00 0.00 57.03 57.07 1bjc h ASP 23 Cb 0.31 -0.10 -0.04 0.00 1.72 0.00 0.00 39.33 41.22 1bjc h ASP 23 CO -0.13 1.05 -0.18 0.58 -2.88 0.00 0.00 179.24 177.68 1bjc h VAL 24 N -0.38 0.55 0.00 2.25 2.07 -0.49 -3.43 116.25 116.83 1bjc h VAL 24 Ca -0.05 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.47 1bjc h VAL 24 Cb 1.11 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 31.43 1bjc h VAL 24 CO 0.07 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.27 1bjc n GLY 25 N -1.32 -2.08 0.48 2.17 0.00 0.05 -4.96 105.19 99.53 1bjc n GLY 25 Ca -0.04 1.00 0.34 0.00 0.00 0.00 0.00 46.02 47.31 1bjc n GLY 25 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1bjc h SER 26 N 0.00 0.24 0.00 1.61 0.87 -1.22 -3.19 113.55 111.86 1bjc h SER 26 Ca 0.00 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 1bjc h SER 26 Cb 0.00 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.01 1bjc h SER 26 CO 0.00 -0.05 -0.11 0.59 -0.53 0.00 0.00 176.83 176.74 1bjc n ASN 27 N -4.50 0.55 0.00 6.23 4.13 -1.26 -4.92 115.26 115.48 1bjc n ASN 27 Ca 0.32 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.58 1bjc n ASN 27 Cb 1.27 0.07 0.00 0.00 -1.54 0.00 0.00 39.78 39.59 1bjc n ASN 27 CO 0.00 0.00 0.00 2.29 0.28 0.00 0.00 177.26 179.83