#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 -0.11 -0.07 -1.67 0.00 -1.26 -5.03 121.76 113.62 1bjc s ALA 2 Ca 0.00 0.38 0.10 0.00 0.00 0.00 0.00 51.96 52.44 1bjc s ALA 2 Cb 0.00 -0.26 0.15 0.00 0.00 0.00 0.00 23.12 23.01 1bjc s ALA 2 CO 0.00 -0.10 1.04 0.39 0.00 0.00 0.00 175.76 177.10 1bjc n GLU 3 N 3.79 1.12 -2.83 0.00 1.02 -1.26 -4.83 120.64 117.66 1bjc n GLU 3 Ca -0.22 -1.87 -0.36 0.00 -0.02 0.00 0.00 57.16 54.69 1bjc n GLU 3 Cb 0.54 -1.10 -0.01 0.00 -0.02 0.00 0.00 31.44 30.85 1bjc n GLU 3 CO 0.00 0.00 0.00 1.97 1.18 0.00 0.00 177.13 180.28 1bjc n PHE 4 N -0.83 3.12 -2.71 -0.32 -1.74 -1.26 -4.37 117.46 109.35 1bjc n PHE 4 Ca 0.08 -3.08 -0.05 0.00 -0.56 0.00 0.00 57.45 53.85 1bjc n PHE 4 Cb 0.59 -0.96 0.08 0.00 1.52 0.00 0.00 39.48 40.71 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 0.14 1.33 -3.52 3.97 1.85 -1.26 -5.00 116.66 114.17 1bjc n ARG 5 Ca 0.38 -2.41 -0.25 0.00 -1.00 0.00 0.00 57.85 54.57 1bjc n ARG 5 Cb 0.32 -0.58 0.05 0.00 -1.05 0.00 0.00 32.46 31.20 1bjc n ARG 5 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 1bjc n HIS 6 N -0.67 -2.11 -1.79 2.89 8.25 -1.26 -4.85 115.22 115.68 1bjc n HIS 6 Ca -0.01 0.60 -0.42 0.00 -0.26 0.00 0.00 57.72 57.63 1bjc n HIS 6 Cb 0.84 -3.70 -0.00 0.00 1.12 0.00 0.00 29.99 28.24 1bjc n HIS 6 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1bjc n ASP 7 N -2.88 3.89 -0.21 0.41 9.92 -1.26 -4.71 116.55 121.71 1bjc n ASP 7 Ca -0.09 -2.84 -0.03 0.00 -0.53 0.00 0.00 54.79 51.31 1bjc n ASP 7 Cb 0.60 -1.63 0.17 0.00 -0.64 0.00 0.00 41.12 39.62 1bjc n ASP 7 CO 0.00 0.00 0.00 0.77 0.13 0.00 0.00 177.20 178.10 1bjc h SER 8 N 6.33 0.90 0.00 -2.24 4.64 -1.96 -3.39 113.55 117.83 1bjc h SER 8 Ca 0.54 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.76 1bjc h SER 8 Cb 0.67 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1bjc h SER 8 CO 1.84 0.78 0.00 0.61 -0.87 0.00 0.00 176.83 179.19 1bjc n GLY 9 N -1.05 1.68 3.53 -0.77 0.00 -1.26 -5.10 105.19 102.22 1bjc n GLY 9 Ca 0.06 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.01 1bjc n GLY 9 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1bjc s TYR 10 N 0.00 -0.31 0.00 1.61 6.14 -1.26 -5.15 117.35 118.38 1bjc s TYR 10 Ca 0.00 0.17 0.00 0.00 0.64 0.00 0.00 57.07 57.88 1bjc s TYR 10 Cb 0.00 0.54 0.00 0.00 0.42 0.00 0.00 41.96 42.92 1bjc s TYR 10 CO 0.00 -0.53 0.00 -1.91 0.64 0.00 0.00 175.55 173.75 1bjc n GLU 11 N -0.25 0.00 -0.08 4.97 0.00 -1.26 -5.09 120.64 118.94 1bjc n GLU 11 Ca -0.08 0.00 -0.13 0.00 0.00 0.00 0.00 57.16 56.96 1bjc n GLU 11 Cb 0.61 0.00 -0.09 0.00 0.00 0.00 0.00 31.44 31.96 1bjc n GLU 11 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 1bjc h VAL 12 N 0.00 1.06 0.00 6.31 2.07 -2.01 -3.46 116.25 120.22 1bjc h VAL 12 Ca 0.00 -1.92 0.00 0.00 0.82 0.00 0.00 66.70 65.60 1bjc h VAL 12 Cb 0.00 2.13 0.00 0.00 -1.52 0.00 0.00 31.29 31.90 1bjc h VAL 12 CO 0.00 0.36 0.00 1.41 0.02 0.00 0.00 177.57 179.36 1bjc n HIS 13 N -4.59 0.00 -3.80 1.57 8.25 -1.26 -5.02 115.22 110.37 1bjc n HIS 13 Ca -0.14 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.03 1bjc n HIS 13 Cb 0.42 0.02 0.01 0.00 1.12 0.00 0.00 29.99 31.57 1bjc n HIS 13 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 1bjc n HIS 14 N 0.00 -1.93 -1.98 4.41 -0.00 -1.26 -4.68 115.22 109.78 1bjc n HIS 14 Ca 0.00 0.61 0.00 0.00 -0.00 0.00 0.00 57.72 58.33 1bjc n HIS 14 Cb 0.10 -2.95 0.00 0.00 -0.00 0.00 0.00 29.99 27.14 1bjc n HIS 14 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1bjc n GLN 15 N -3.38 0.00 -0.02 1.57 -0.00 -1.26 -4.91 117.38 109.38 1bjc n GLN 15 Ca -0.21 0.00 -0.15 0.00 -0.00 0.00 0.00 57.00 56.63 1bjc n GLN 15 Cb 0.63 0.00 -0.11 0.00 -0.00 0.00 0.00 30.24 30.76 1bjc n GLN 15 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.06 177.80 1bjc h PHE 16 N 0.00 0.30 -0.26 2.61 0.04 -1.99 -1.16 116.94 116.48 1bjc h PHE 16 Ca 0.00 -0.16 -0.04 0.00 2.80 0.00 0.00 57.97 60.57 1bjc h PHE 16 Cb 0.91 -0.04 -0.01 0.00 2.20 0.00 0.00 35.95 39.01 1bjc h PHE 16 CO 0.00 0.95 -0.01 -0.07 -0.60 0.00 0.00 178.31 178.59 1bjc h LEU 17 N -0.43 0.36 -0.47 1.54 3.38 -1.97 -0.57 115.31 117.13 1bjc h LEU 17 Ca -0.03 -0.06 -0.16 0.00 0.09 0.00 0.00 57.88 57.72 1bjc h LEU 17 Cb 1.03 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.68 1bjc h LEU 17 CO 0.06 0.42 -0.50 0.58 0.09 0.00 0.00 178.44 179.09 1bjc h VAL 18 N 0.37 1.30 -0.32 1.22 2.07 -1.89 -1.31 116.25 117.70 1bjc h VAL 18 Ca 0.08 -1.71 -0.04 0.00 0.82 0.00 0.00 66.70 65.86 1bjc h VAL 18 Cb 0.27 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 1bjc h VAL 18 CO 0.01 0.54 0.06 0.15 0.02 0.00 0.00 177.57 178.35 1bjc h PHE 19 N 0.54 0.55 0.00 1.57 3.57 -0.21 0.11 116.94 123.07 1bjc h PHE 19 Ca 0.02 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.45 1bjc h PHE 19 Cb 1.06 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.65 1bjc h PHE 19 CO 0.05 0.59 0.00 0.34 -2.23 0.00 0.00 178.31 177.06 1bjc n PHE 20 N -4.62 0.45 -0.11 0.41 7.35 -0.32 -1.60 117.46 119.02 1bjc n PHE 20 Ca -0.02 0.20 -0.22 0.00 -0.76 0.00 0.00 57.45 56.66 1bjc n PHE 20 Cb 0.21 -0.83 -0.12 0.00 0.35 0.00 0.00 39.48 39.09 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 -1.66 1.25 0.10 3.13 0.00 -0.27 -3.56 120.51 119.50 1bjc n ALA 21 Ca 0.01 -0.99 -0.05 0.00 0.00 0.00 0.00 53.44 52.41 1bjc n ALA 21 Cb 0.11 -0.17 0.06 0.00 0.00 0.00 0.00 19.45 19.44 1bjc n ALA 21 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 1bjc h GLU 22 N -0.28 0.10 0.00 0.00 -0.00 -0.71 -0.26 114.58 113.44 1bjc h GLU 22 Ca -0.57 -0.10 -0.02 0.00 -0.00 0.00 0.00 59.36 58.68 1bjc h GLU 22 Cb 1.82 0.02 -0.00 0.00 -0.00 0.00 0.00 28.75 30.59 1bjc h GLU 22 CO -0.15 0.82 -0.21 -0.44 -0.00 0.00 0.00 179.01 179.03 1bjc h ASP 23 N 0.06 0.00 0.68 3.06 3.32 -1.53 -3.41 116.42 118.61 1bjc h ASP 23 Ca -0.02 -0.19 -0.03 0.00 0.02 0.00 0.00 57.03 56.80 1bjc h ASP 23 Cb 1.34 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.90 1bjc h ASP 23 CO 0.11 0.71 -0.33 0.58 -1.72 0.00 0.00 179.24 178.59 1bjc h VAL 24 N -1.00 0.01 -3.98 -1.35 2.07 -1.70 -3.43 116.25 106.87 1bjc h VAL 24 Ca -0.03 -0.33 -0.47 0.00 0.82 0.00 0.00 66.70 66.70 1bjc h VAL 24 Cb 0.37 0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.15 1bjc h VAL 24 CO -0.02 0.00 0.37 -0.83 0.02 0.00 0.00 177.57 177.12 1bjc s GLY 25 N -2.50 2.64 0.00 2.17 0.00 -0.11 -4.85 107.32 104.68 1bjc s GLY 25 Ca -0.13 0.56 0.00 0.00 0.00 0.00 0.00 44.72 45.15 1bjc s GLY 25 CO 0.41 0.95 0.00 -1.14 0.00 0.00 0.00 173.10 173.31 1bjc n SER 26 N -0.12 0.00 -2.03 1.64 3.41 -1.26 -4.17 113.62 111.09 1bjc n SER 26 Ca 0.05 0.00 -0.17 0.00 -0.26 0.00 0.00 58.87 58.49 1bjc n SER 26 Cb 0.51 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.45 1bjc n SER 26 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1bjc n ASN 27 N -1.28 6.23 0.00 4.04 5.15 -1.26 -5.18 115.26 122.96 1bjc n ASN 27 Ca 0.00 -2.98 0.06 0.00 -0.60 0.00 0.00 54.58 51.06 1bjc n ASN 27 Cb 0.00 -1.15 0.37 0.00 -0.53 0.00 0.00 39.78 38.47 1bjc n ASN 27 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95