#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 -2.64 -1.02 2.24 0.00 -1.26 -4.85 120.51 112.98 1bjc n ALA 2 Ca 0.00 0.22 -0.15 0.00 0.00 0.00 0.00 53.44 53.51 1bjc n ALA 2 Cb 0.00 -1.89 -0.05 0.00 0.00 0.00 0.00 19.45 17.51 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 -1.52 1.87 -0.30 0.00 4.71 -1.26 -2.79 120.64 121.36 1bjc n GLU 3 Ca -0.03 -1.33 0.00 0.00 -0.01 0.00 0.00 57.16 55.79 1bjc n GLU 3 Cb 0.53 -1.75 0.00 0.00 -1.01 0.00 0.00 31.44 29.21 1bjc n GLU 3 CO 0.00 0.00 0.00 1.97 0.09 0.00 0.00 177.13 179.19 1bjc n PHE 4 N 1.31 0.00 -2.57 -0.32 1.16 -1.26 -5.01 117.46 110.77 1bjc n PHE 4 Ca 0.33 0.00 -0.43 0.00 -1.87 0.00 0.00 57.45 55.48 1bjc n PHE 4 Cb 0.65 0.20 0.00 0.00 -1.61 0.00 0.00 39.48 38.72 1bjc n PHE 4 CO 0.00 0.00 0.00 -2.13 -1.87 0.00 0.00 176.76 172.76 1bjc n ARG 5 N 0.00 3.21 -2.51 3.97 0.63 -1.12 -4.27 116.66 116.58 1bjc n ARG 5 Ca 0.00 -3.33 -0.03 0.00 -0.92 0.00 0.00 57.85 53.57 1bjc n ARG 5 Cb 0.36 -3.39 0.00 0.00 0.45 0.00 0.00 32.46 29.88 1bjc n ARG 5 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 1bjc n HIS 6 N 7.64 -2.32 0.62 -0.14 8.25 -1.26 -4.88 115.22 123.13 1bjc n HIS 6 Ca 0.47 0.92 -0.03 0.00 -0.26 0.00 0.00 57.72 58.81 1bjc n HIS 6 Cb 0.45 -3.33 0.02 0.00 1.12 0.00 0.00 29.99 28.25 1bjc n HIS 6 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 1bjc n ASP 7 N -0.82 3.25 0.00 0.41 5.75 -1.26 -4.76 116.55 119.11 1bjc n ASP 7 Ca 0.05 -2.25 0.00 0.00 -0.01 0.00 0.00 54.79 52.58 1bjc n ASP 7 Cb 0.39 -0.58 0.00 0.00 -1.03 0.00 0.00 41.12 39.90 1bjc n ASP 7 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1bjc n SER 8 N 0.32 -4.77 0.00 -1.12 7.64 -1.26 -4.45 113.62 109.98 1bjc n SER 8 Ca 0.08 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.96 1bjc n SER 8 Cb 0.66 -2.83 0.00 0.00 -1.01 0.00 0.00 64.21 61.02 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 -0.02 -1.32 3.50 0.23 0.00 -1.26 -5.17 105.19 101.15 1bjc n GLY 9 Ca 0.00 0.72 -0.10 0.00 0.00 0.00 0.00 46.02 46.64 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 1.15 -0.43 -0.30 1.61 5.04 -1.26 -5.02 117.35 118.14 1bjc s TYR 10 Ca 0.00 0.21 -0.02 0.00 -2.44 0.00 0.00 57.07 54.82 1bjc s TYR 10 Cb 0.00 0.57 0.19 0.00 0.35 0.00 0.00 41.96 43.07 1bjc s TYR 10 CO 0.00 -0.80 0.72 -2.00 -1.34 0.00 0.00 175.55 172.13 1bjc s GLU 11 N -3.57 0.46 -0.15 4.97 2.56 -1.26 -5.01 118.70 116.71 1bjc s GLU 11 Ca 0.04 0.70 -0.12 0.00 0.00 0.00 0.00 54.97 55.59 1bjc s GLU 11 Cb -0.01 0.38 -0.08 0.00 2.00 0.00 0.00 34.13 36.41 1bjc s GLU 11 CO -0.09 -0.61 0.02 0.28 -0.56 0.00 0.00 175.26 174.30 1bjc h VAL 12 N 5.75 0.34 0.00 3.70 2.07 -2.02 -3.48 116.25 122.62 1bjc h VAL 12 Ca -0.15 -1.36 0.00 0.00 0.82 0.00 0.00 66.70 66.01 1bjc h VAL 12 Cb 1.17 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 31.70 1bjc h VAL 12 CO 0.14 0.12 0.00 0.00 0.02 0.00 0.00 177.57 177.84 1bjc n HIS 13 N -4.61 0.00 -3.85 1.57 1.44 -1.26 -5.05 115.22 103.47 1bjc n HIS 13 Ca -0.11 0.00 -0.34 0.00 -2.01 0.00 0.00 57.72 55.25 1bjc n HIS 13 Cb 0.32 0.00 0.02 0.00 0.12 0.00 0.00 29.99 30.45 1bjc n HIS 13 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 1bjc n HIS 14 N -0.03 -1.71 0.80 -1.40 8.25 -1.26 -4.83 115.22 115.03 1bjc n HIS 14 Ca 0.00 0.41 -0.01 0.00 -0.26 0.00 0.00 57.72 57.85 1bjc n HIS 14 Cb 0.00 -3.31 0.02 0.00 1.12 0.00 0.00 29.99 27.83 1bjc n HIS 14 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1bjc n GLN 15 N -4.46 1.19 -0.27 -0.41 -0.00 -1.26 -4.33 117.38 107.84 1bjc n GLN 15 Ca -0.14 -0.29 0.07 0.00 -0.00 0.00 0.00 57.00 56.64 1bjc n GLN 15 Cb 0.60 -1.24 0.31 0.00 -0.00 0.00 0.00 30.24 29.91 1bjc n GLN 15 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.06 177.41 1bjc h PHE 16 N 0.18 0.92 -0.83 2.61 3.57 -2.00 0.12 116.94 121.52 1bjc h PHE 16 Ca 0.04 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.57 1bjc h PHE 16 Cb 1.03 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 39.43 1bjc h PHE 16 CO 0.14 0.43 0.51 -0.07 -2.23 0.00 0.00 178.31 177.08 1bjc h LEU 17 N 0.86 0.99 -0.36 0.59 4.07 -1.99 -2.10 115.31 117.37 1bjc h LEU 17 Ca 0.40 -0.06 -0.09 0.00 0.08 0.00 0.00 57.88 58.21 1bjc h LEU 17 Cb 0.41 -0.25 -0.01 0.00 1.08 0.00 0.00 40.66 41.89 1bjc h LEU 17 CO -0.17 0.76 -0.14 0.58 -1.08 0.00 0.00 178.44 178.39 1bjc h VAL 18 N 1.13 1.28 -0.96 1.22 2.07 -1.21 -0.36 116.25 119.43 1bjc h VAL 18 Ca 0.30 -1.25 0.22 0.00 0.82 0.00 0.00 66.70 66.79 1bjc h VAL 18 Cb -0.06 1.33 -0.12 0.00 -1.52 0.00 0.00 31.29 30.93 1bjc h VAL 18 CO -0.06 0.41 0.52 0.15 0.02 0.00 0.00 177.57 178.62 1bjc h PHE 19 N 0.52 0.90 -0.00 1.57 3.57 -0.21 0.40 116.94 123.69 1bjc h PHE 19 Ca 0.08 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.58 1bjc h PHE 19 Cb 0.67 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 39.17 1bjc h PHE 19 CO 0.06 0.06 -0.16 0.74 -2.23 0.00 0.00 178.31 176.78 1bjc h PHE 20 N 0.55 0.16 -0.87 0.41 0.04 -1.24 -3.32 116.94 112.67 1bjc h PHE 20 Ca 0.60 -0.09 0.22 0.00 2.80 0.00 0.00 57.97 61.50 1bjc h PHE 20 Cb 1.09 -0.02 -0.15 0.00 2.20 0.00 0.00 35.95 39.07 1bjc h PHE 20 CO -0.05 0.88 0.07 0.00 -0.60 0.00 0.00 178.31 178.62 1bjc h ALA 21 N 0.24 1.04 0.00 2.45 0.00 0.81 0.88 119.26 124.69 1bjc h ALA 21 Ca -0.02 0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1bjc h ALA 21 Cb 0.93 0.45 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1bjc h ALA 21 CO 0.03 -0.48 0.27 0.39 0.00 0.00 0.00 179.25 179.46 1bjc n GLU 22 N -5.36 0.09 -1.39 0.00 -0.58 -0.43 -1.58 120.64 111.39 1bjc n GLU 22 Ca 0.19 0.58 -0.01 0.00 -0.42 0.00 0.00 57.16 57.50 1bjc n GLU 22 Cb 0.62 -2.08 -0.01 0.00 -0.57 0.00 0.00 31.44 29.40 1bjc n GLU 22 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1bjc n ASP 23 N -2.07 0.13 0.00 1.62 2.03 0.17 -4.86 116.55 113.56 1bjc n ASP 23 Ca -0.01 -2.01 0.00 0.00 0.52 0.00 0.00 54.79 53.29 1bjc n ASP 23 Cb 0.29 -0.03 0.00 0.00 -0.72 0.00 0.00 41.12 40.66 1bjc n ASP 23 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1bjc n VAL 24 N 0.19 0.00 -2.12 5.18 0.31 -0.39 -4.94 118.33 116.56 1bjc n VAL 24 Ca -0.09 0.00 -0.37 0.00 -0.01 0.00 0.00 64.34 63.88 1bjc n VAL 24 Cb 0.94 -0.36 -0.03 0.00 -0.91 0.00 0.00 33.84 33.48 1bjc n VAL 24 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1bjc n GLY 25 N 1.58 2.08 0.24 2.92 0.00 -0.71 -4.72 105.19 106.58 1bjc n GLY 25 Ca 0.00 -1.12 0.16 0.00 0.00 0.00 0.00 46.02 45.06 1bjc n GLY 25 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1bjc h SER 26 N 8.37 0.00 0.00 1.61 0.02 -1.92 -3.46 113.55 118.17 1bjc h SER 26 Ca 0.36 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.31 1bjc h SER 26 Cb 0.85 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.39 1bjc h SER 26 CO 1.46 0.00 0.00 -3.20 -1.14 0.00 0.00 176.83 173.95 1bjc n ASN 27 N -2.82 -1.50 0.00 3.07 2.85 -1.26 -5.26 115.26 110.34 1bjc n ASN 27 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 1bjc n ASN 27 Cb 0.24 -2.01 0.00 0.00 1.24 0.00 0.00 39.78 39.25 1bjc n ASN 27 CO 0.00 0.00 0.00 2.29 -2.11 0.00 0.00 177.26 177.44