#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 -1.12 0.00 2.24 0.00 -1.26 -5.00 121.76 116.62 1bjc s ALA 2 Ca 0.00 0.87 0.00 0.00 0.00 0.00 0.00 51.96 52.83 1bjc s ALA 2 Cb 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 23.12 22.90 1bjc s ALA 2 CO 0.00 -0.27 0.58 -0.85 0.00 0.00 0.00 175.76 175.22 1bjc n GLU 3 N 1.71 0.00 -0.32 0.00 -0.00 -1.26 -4.92 120.64 115.86 1bjc n GLU 3 Ca -0.18 -0.45 -0.03 0.00 -0.00 0.00 0.00 57.16 56.50 1bjc n GLU 3 Cb 0.56 0.32 0.01 0.00 -0.00 0.00 0.00 31.44 32.34 1bjc n GLU 3 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 1bjc n PHE 4 N 0.00 0.28 -2.06 -1.84 3.72 -1.26 -4.42 117.46 111.88 1bjc n PHE 4 Ca -0.13 -0.87 -0.40 0.00 -0.05 0.00 0.00 57.45 56.01 1bjc n PHE 4 Cb 0.49 -0.43 -0.02 0.00 -0.94 0.00 0.00 39.48 38.58 1bjc n PHE 4 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 1bjc n ARG 5 N 0.77 2.53 -0.72 -1.08 0.63 -1.26 -4.33 116.66 113.21 1bjc n ARG 5 Ca 0.05 -2.74 -0.02 0.00 -0.92 0.00 0.00 57.85 54.22 1bjc n ARG 5 Cb 0.56 -3.42 -0.01 0.00 0.45 0.00 0.00 32.46 30.05 1bjc n ARG 5 CO 0.00 0.00 0.00 1.58 -2.51 0.00 0.00 177.63 176.70 1bjc n HIS 6 N 9.01 -0.09 -2.31 -0.14 -0.00 -1.26 -1.20 115.22 119.24 1bjc n HIS 6 Ca 0.49 0.00 -0.19 0.00 -0.00 0.00 0.00 57.72 58.02 1bjc n HIS 6 Cb 0.44 -1.55 -0.01 0.00 -0.00 0.00 0.00 29.99 28.86 1bjc n HIS 6 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.34 172.87 1bjc n ASP 7 N 0.53 -5.52 0.11 0.26 2.03 -1.26 -4.86 116.55 107.84 1bjc n ASP 7 Ca -0.02 0.02 -0.03 0.00 0.52 0.00 0.00 54.79 55.28 1bjc n ASP 7 Cb 0.30 -4.57 0.18 0.00 -0.72 0.00 0.00 41.12 36.31 1bjc n ASP 7 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1bjc h SER 8 N 0.00 0.18 0.00 1.67 4.64 -1.49 -3.42 113.55 115.13 1bjc h SER 8 Ca -0.45 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 60.78 1bjc h SER 8 Cb 1.33 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1bjc h SER 8 CO 0.54 0.68 0.00 0.61 -0.87 0.00 0.00 176.83 177.79 1bjc n GLY 9 N 0.08 -1.66 0.00 -0.77 0.00 -1.26 -5.17 105.19 96.41 1bjc n GLY 9 Ca -0.02 1.01 0.00 0.00 0.00 0.00 0.00 46.02 47.01 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 0.00 -1.80 -3.26 1.61 4.11 -1.26 -4.96 117.16 111.61 1bjc n TYR 10 Ca 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 57.90 57.94 1bjc n TYR 10 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 39.34 39.31 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 -1.54 0.22 -0.06 -3.48 2.12 -1.26 -5.06 118.70 109.64 1bjc s GLU 11 Ca 0.00 0.47 -0.20 0.00 0.36 0.00 0.00 54.97 55.60 1bjc s GLU 11 Cb 0.00 0.28 -0.15 0.00 0.26 0.00 0.00 34.13 34.52 1bjc s GLU 11 CO 0.00 -0.15 0.83 0.28 -0.54 0.00 0.00 175.26 175.68 1bjc h VAL 12 N 5.38 0.83 0.00 3.70 2.07 -1.98 -3.46 116.25 122.79 1bjc h VAL 12 Ca -0.15 -1.16 0.00 0.00 0.82 0.00 0.00 66.70 66.21 1bjc h VAL 12 Cb 1.14 1.41 0.00 0.00 -1.52 0.00 0.00 31.29 32.32 1bjc h VAL 12 CO 0.01 0.22 0.00 1.57 0.02 0.00 0.00 177.57 179.39 1bjc n HIS 13 N -4.91 -0.64 -3.45 1.57 -0.00 -1.26 -5.09 115.22 101.44 1bjc n HIS 13 Ca -0.07 0.03 -0.04 0.00 0.46 0.00 0.00 57.72 58.09 1bjc n HIS 13 Cb 0.26 0.18 -0.06 0.00 -0.12 0.00 0.00 29.99 30.25 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 -2.00 -1.12 -0.06 1.57 3.76 -1.26 -5.02 115.29 111.15 1bjc s HIS 14 Ca 0.00 1.57 0.09 0.00 -0.15 0.00 0.00 55.06 56.57 1bjc s HIS 14 Cb 0.00 0.40 0.14 0.00 1.11 0.00 0.00 32.58 34.23 1bjc s HIS 14 CO 0.00 -0.68 1.04 1.04 -0.85 0.00 0.00 174.74 175.29 1bjc n GLN 15 N 5.41 1.70 0.27 1.40 6.02 -1.26 -4.68 117.38 126.23 1bjc n GLN 15 Ca -0.06 -1.91 0.15 0.00 -0.01 0.00 0.00 57.00 55.17 1bjc n GLN 15 Cb 0.50 -1.16 0.68 0.00 1.02 0.00 0.00 30.24 31.28 1bjc n GLN 15 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1bjc h PHE 16 N 0.00 0.00 -0.34 1.08 -0.00 -1.98 -1.25 116.94 114.45 1bjc h PHE 16 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 57.97 57.93 1bjc h PHE 16 Cb 0.86 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.79 1bjc h PHE 16 CO 0.01 0.08 0.05 -0.07 -0.00 0.00 0.00 178.31 178.37 1bjc h LEU 17 N 0.00 0.55 -0.16 2.10 4.07 -1.99 -0.18 115.31 119.70 1bjc h LEU 17 Ca -0.00 -0.27 -0.05 0.00 0.08 0.00 0.00 57.88 57.64 1bjc h LEU 17 Cb 0.51 -0.15 -0.00 0.00 1.08 0.00 0.00 40.66 42.09 1bjc h LEU 17 CO 0.01 0.68 -0.09 0.58 -1.08 0.00 0.00 178.44 178.53 1bjc h VAL 18 N 0.40 1.32 -0.66 1.22 2.07 -1.77 -0.61 116.25 118.23 1bjc h VAL 18 Ca 0.10 -1.16 0.17 0.00 0.82 0.00 0.00 66.70 66.63 1bjc h VAL 18 Cb 0.36 1.74 -0.03 0.00 -1.52 0.00 0.00 31.29 31.84 1bjc h VAL 18 CO 0.01 0.34 0.46 0.15 0.02 0.00 0.00 177.57 178.55 1bjc h PHE 19 N 0.01 0.12 0.00 1.57 3.57 -1.02 -0.46 116.94 120.74 1bjc h PHE 19 Ca 0.03 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.54 1bjc h PHE 19 Cb 0.58 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.28 1bjc h PHE 19 CO 0.07 0.04 -0.00 0.74 -2.23 0.00 0.00 178.31 176.93 1bjc h PHE 20 N 0.10 -0.00 0.00 0.41 -1.00 -0.69 -3.23 116.94 112.54 1bjc h PHE 20 Ca 0.32 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.10 1bjc h PHE 20 Cb 1.11 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.67 1bjc h PHE 20 CO -0.00 0.86 0.08 0.00 -1.61 0.00 0.00 178.31 177.64 1bjc n ALA 21 N -2.55 0.89 1.21 2.45 0.00 -0.23 -0.43 120.51 121.85 1bjc n ALA 21 Ca -0.10 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.47 1bjc n ALA 21 Cb 0.42 -0.80 0.28 0.00 0.00 0.00 0.00 19.45 19.35 1bjc n ALA 21 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1bjc n GLU 22 N -1.29 1.31 0.00 0.00 1.02 -0.92 -3.54 120.64 117.22 1bjc n GLU 22 Ca 0.00 -0.91 0.00 0.00 -0.02 0.00 0.00 57.16 56.23 1bjc n GLU 22 Cb 0.08 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 30.02 1bjc n GLU 22 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1bjc n ASP 23 N -0.05 0.00 0.07 1.62 5.75 -0.28 -4.83 116.55 118.84 1bjc n ASP 23 Ca 0.13 0.00 -0.20 0.00 -0.01 0.00 0.00 54.79 54.72 1bjc n ASP 23 Cb 0.41 0.00 -0.11 0.00 -1.03 0.00 0.00 41.12 40.40 1bjc n ASP 23 CO 0.00 0.00 0.00 0.58 -0.11 0.00 0.00 177.20 177.67 1bjc h VAL 24 N 0.00 1.32 0.00 2.12 2.07 -0.98 -3.48 116.25 117.30 1bjc h VAL 24 Ca 0.00 -2.44 0.00 0.00 0.82 0.00 0.00 66.70 65.08 1bjc h VAL 24 Cb 0.00 2.57 0.00 0.00 -1.52 0.00 0.00 31.29 32.34 1bjc h VAL 24 CO 0.00 0.74 0.00 0.61 0.02 0.00 0.00 177.57 178.94 1bjc n GLY 25 N 1.23 2.98 2.62 2.17 0.00 -1.23 -4.66 105.19 108.30 1bjc n GLY 25 Ca -0.11 -0.61 -0.07 0.00 0.00 0.00 0.00 46.02 45.23 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 0.80 -4.80 0.26 1.61 7.64 -1.26 -4.79 113.62 113.07 1bjc n SER 26 Ca 0.00 0.18 0.13 0.00 1.01 0.00 0.00 58.87 60.19 1bjc n SER 26 Cb 0.00 -3.45 0.67 0.00 -1.01 0.00 0.00 64.21 60.42 1bjc n SER 26 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 1bjc h ASN 27 N 0.00 0.00 0.00 6.43 2.35 -1.95 -3.51 115.58 118.90 1bjc h ASN 27 Ca -0.15 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.60 1bjc h ASN 27 Cb 0.95 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.32 1bjc h ASN 27 CO 0.22 0.13 0.00 2.29 -1.65 0.00 0.00 177.43 178.42