#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 -2.30 0.51 2.12 0.00 -1.26 -1.78 120.51 117.80 1bjc n ALA 2 Ca 0.00 -0.94 -0.03 0.00 0.00 0.00 0.00 53.44 52.47 1bjc n ALA 2 Cb 0.00 -2.14 0.02 0.00 0.00 0.00 0.00 19.45 17.33 1bjc n ALA 2 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1bjc n GLU 3 N 1.51 1.17 -3.97 0.00 2.13 -1.26 -4.80 120.64 115.41 1bjc n GLU 3 Ca 0.05 -0.40 -0.32 0.00 0.66 0.00 0.00 57.16 57.15 1bjc n GLU 3 Cb 0.67 -1.16 -0.02 0.00 0.27 0.00 0.00 31.44 31.20 1bjc n GLU 3 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 1bjc n PHE 4 N 0.41 -1.77 -2.04 4.31 3.72 -1.26 -4.73 117.46 116.10 1bjc n PHE 4 Ca 0.08 0.70 -0.01 0.00 -0.05 0.00 0.00 57.45 58.17 1bjc n PHE 4 Cb 0.64 -2.89 -0.01 0.00 -0.94 0.00 0.00 39.48 36.28 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 -4.18 0.00 0.00 -1.08 -4.01 -1.26 -4.92 116.66 101.21 1bjc n ARG 5 Ca 0.06 -0.57 0.00 0.00 -1.04 0.00 0.00 57.85 56.30 1bjc n ARG 5 Cb 0.50 -0.06 0.00 0.00 -3.04 0.00 0.00 32.46 29.86 1bjc n ARG 5 CO 0.00 0.00 0.00 -2.39 -3.04 0.00 0.00 177.63 172.20 1bjc n HIS 6 N 0.04 -0.16 -3.59 2.89 1.44 -1.26 -5.06 115.22 109.52 1bjc n HIS 6 Ca -0.04 0.00 -0.25 0.00 -2.01 0.00 0.00 57.72 55.43 1bjc n HIS 6 Cb 0.63 0.03 0.03 0.00 0.12 0.00 0.00 29.99 30.80 1bjc n HIS 6 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 1bjc n ASP 7 N -1.66 -5.70 0.28 4.39 9.92 -1.26 -4.91 116.55 117.61 1bjc n ASP 7 Ca 0.00 -0.84 -0.16 0.00 -0.53 0.00 0.00 54.79 53.26 1bjc n ASP 7 Cb 0.00 -3.38 -0.08 0.00 -0.64 0.00 0.00 41.12 37.02 1bjc n ASP 7 CO 0.00 0.00 0.00 -1.28 0.13 0.00 0.00 177.20 176.05 1bjc h SER 8 N -1.15 -0.74 -6.59 -2.24 0.87 -1.87 -3.47 113.55 98.37 1bjc h SER 8 Ca -0.54 0.04 -0.52 0.00 -1.23 0.00 0.00 61.79 59.55 1bjc h SER 8 Cb 1.30 0.22 -0.08 0.00 -0.44 0.00 0.00 62.40 63.40 1bjc h SER 8 CO 0.43 -0.46 -0.89 0.61 -0.53 0.00 0.00 176.83 175.98 1bjc n GLY 9 N -1.43 -0.22 5.08 5.77 0.00 -0.74 -4.68 105.19 108.97 1bjc n GLY 9 Ca -0.11 0.15 0.02 0.00 0.00 0.00 0.00 46.02 46.08 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 -4.43 -1.78 -2.95 1.61 0.18 -1.26 -4.87 117.16 103.65 1bjc n TYR 10 Ca -0.29 0.22 -0.04 0.00 1.88 0.00 0.00 57.90 59.67 1bjc n TYR 10 Cb 0.68 -0.32 -0.01 0.00 -0.38 0.00 0.00 39.34 39.30 1bjc n TYR 10 CO 0.00 0.00 0.00 -1.83 -2.08 0.00 0.00 176.86 172.95 1bjc s GLU 11 N -0.45 0.97 0.46 -3.48 -1.05 -1.26 -4.97 118.70 108.92 1bjc s GLU 11 Ca 0.00 -0.88 0.25 0.00 -0.15 0.00 0.00 54.97 54.20 1bjc s GLU 11 Cb 0.00 -0.11 1.04 0.00 -0.44 0.00 0.00 34.13 34.63 1bjc s GLU 11 CO 0.00 -1.29 1.88 0.28 0.95 0.00 0.00 175.26 177.08 1bjc h VAL 12 N 4.98 0.50 -0.52 1.83 2.07 -1.99 -3.46 116.25 119.66 1bjc h VAL 12 Ca 0.07 -0.98 -0.23 0.00 0.82 0.00 0.00 66.70 66.38 1bjc h VAL 12 Cb 1.12 1.68 -0.09 0.00 -1.52 0.00 0.00 31.29 32.48 1bjc h VAL 12 CO 0.06 0.19 -0.20 1.57 0.02 0.00 0.00 177.57 179.21 1bjc n HIS 13 N -3.39 0.00 -3.56 1.57 -0.00 -1.26 -4.91 115.22 103.66 1bjc n HIS 13 Ca -0.00 0.00 -0.12 0.00 0.46 0.00 0.00 57.72 58.05 1bjc n HIS 13 Cb 0.39 -2.51 -0.05 0.00 -0.12 0.00 0.00 29.99 27.70 1bjc n HIS 13 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 1bjc s HIS 14 N -2.10 -0.45 -0.97 1.57 2.46 -1.26 -4.96 115.29 109.58 1bjc s HIS 14 Ca 0.00 0.74 0.00 0.00 0.47 0.00 0.00 55.06 56.27 1bjc s HIS 14 Cb 0.00 0.44 0.00 0.00 -0.13 0.00 0.00 32.58 32.89 1bjc s HIS 14 CO 0.00 -0.43 0.00 1.04 -2.47 0.00 0.00 174.74 172.88 1bjc n GLN 15 N 0.71 -1.71 0.24 2.88 6.02 -1.26 -4.79 117.38 119.47 1bjc n GLN 15 Ca -0.13 0.54 0.09 0.00 -0.01 0.00 0.00 57.00 57.50 1bjc n GLN 15 Cb 0.58 -4.90 0.59 0.00 1.02 0.00 0.00 30.24 27.53 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 -0.12 1.08 -0.00 -1.96 -0.28 116.94 115.66 1bjc h PHE 16 Ca -0.22 0.00 -0.15 0.00 -0.00 0.00 0.00 57.97 57.60 1bjc h PHE 16 Cb 0.87 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.81 1bjc h PHE 16 CO 0.47 0.19 -0.58 -0.07 -0.00 0.00 0.00 178.31 178.33 1bjc h LEU 17 N 0.00 0.43 -0.16 2.10 3.38 -1.97 -1.52 115.31 117.57 1bjc h LEU 17 Ca -0.00 -0.24 -0.09 0.00 0.09 0.00 0.00 57.88 57.64 1bjc h LEU 17 Cb 0.45 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 1bjc h LEU 17 CO 0.03 0.91 -0.25 0.58 0.09 0.00 0.00 178.44 179.80 1bjc h VAL 18 N 0.29 1.35 0.00 1.22 2.07 -1.62 0.32 116.25 119.88 1bjc h VAL 18 Ca -0.00 -1.47 -0.01 0.00 0.82 0.00 0.00 66.70 66.04 1bjc h VAL 18 Cb 1.10 1.93 -0.00 0.00 -1.52 0.00 0.00 31.29 32.80 1bjc h VAL 18 CO 0.10 0.44 -0.03 0.15 0.02 0.00 0.00 177.57 178.25 1bjc h PHE 19 N 0.07 0.00 0.00 1.57 3.57 -0.94 0.82 116.94 122.03 1bjc h PHE 19 Ca 0.01 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1bjc h PHE 19 Cb 0.82 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.56 1bjc h PHE 19 CO 0.09 0.03 -1.43 0.34 -2.23 0.00 0.00 178.31 175.11 1bjc n PHE 20 N -3.30 0.54 -0.00 0.41 7.35 -0.59 -4.01 117.46 117.87 1bjc n PHE 20 Ca -0.02 0.16 -0.00 0.00 -0.76 0.00 0.00 57.45 56.82 1bjc n PHE 20 Cb 0.16 -0.75 -0.00 0.00 0.35 0.00 0.00 39.48 39.23 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 -2.20 1.55 -0.30 3.13 0.00 0.11 -4.27 120.51 118.53 1bjc n ALA 21 Ca -0.02 -0.14 0.19 0.00 0.00 0.00 0.00 53.44 53.47 1bjc n ALA 21 Cb 0.56 0.01 0.46 0.00 0.00 0.00 0.00 19.45 20.48 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 -0.03 0.48 -0.64 0.00 4.81 0.38 0.97 114.58 120.54 1bjc h GLU 22 Ca 0.00 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1bjc h GLU 22 Cb 0.03 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.31 1bjc h GLU 22 CO 0.00 0.31 0.00 -3.47 -0.73 0.00 0.00 179.01 175.12 1bjc n ASP 23 N -4.61 4.42 0.00 1.04 -0.08 -0.83 -4.47 116.55 112.00 1bjc n ASP 23 Ca 0.23 -2.51 0.00 0.00 -1.51 0.00 0.00 54.79 51.00 1bjc n ASP 23 Cb 0.74 -0.57 0.00 0.00 2.34 0.00 0.00 41.12 43.62 1bjc n ASP 23 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 1bjc n VAL 24 N 0.81 0.00 0.00 5.18 0.31 -0.20 -4.90 118.33 119.53 1bjc n VAL 24 Ca 0.23 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.56 1bjc n VAL 24 Cb 0.87 -0.01 0.00 0.00 -0.91 0.00 0.00 33.84 33.78 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 0.86 1.19 0.00 2.92 0.00 0.16 -1.70 105.19 108.62 1bjc n GLY 25 Ca 0.00 0.42 0.00 0.00 0.00 0.00 0.00 46.02 46.44 1bjc n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1bjc n SER 26 N 3.47 0.00 -0.03 1.61 3.41 -1.26 -4.90 113.62 115.93 1bjc n SER 26 Ca 0.00 -1.00 0.08 0.00 -0.26 0.00 0.00 58.87 57.69 1bjc n SER 26 Cb 0.00 0.00 0.48 0.00 -0.26 0.00 0.00 64.21 64.43 1bjc n SER 26 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 1bjc h ASN 27 N 0.00 0.39 0.00 4.04 -1.24 -1.75 -3.56 115.58 113.46 1bjc h ASN 27 Ca 0.00 -0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1bjc h ASN 27 Cb 0.88 -0.08 0.00 0.00 0.73 0.00 0.00 38.32 39.85 1bjc h ASN 27 CO 0.00 0.26 0.00 2.29 -1.29 0.00 0.00 177.43 178.69