#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pqr n GLY 4 N -0.02 0.61 0.07 0.00 0.00 -1.24 -4.92 105.19 99.69 1pqr n GLY 4 Ca 0.00 -2.12 0.03 0.00 0.00 0.00 0.00 46.02 43.93 1pqr n GLY 4 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1pqr n PRO 5 N 0.00 0.05 -1.95 1.61 -0.02 -1.26 -2.09 135.00 131.35 1pqr n PRO 5 Ca 0.00 0.45 -0.40 0.00 -2.02 0.00 0.00 63.50 61.53 1pqr n PRO 5 Cb 0.00 -1.83 -0.01 0.00 -0.02 0.00 0.00 33.50 31.64 1pqr n PRO 5 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1pqr n TYR 6 N -1.68 2.60 -2.52 6.00 4.01 -1.26 -4.93 117.16 119.37 1pqr n TYR 6 Ca -0.00 -2.85 -0.07 0.00 -0.16 0.00 0.00 57.90 54.82 1pqr n TYR 6 Cb 0.19 -1.91 0.04 0.00 -0.31 0.00 0.00 39.34 37.36 1pqr n TYR 6 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1pqr n ASN 8 N 2.03 2.61 0.00 7.72 3.02 -1.26 -4.73 115.26 124.65 1pqr n ASN 8 Ca 0.63 -2.63 0.00 0.00 -0.03 0.00 0.00 54.58 52.55 1pqr n ASN 8 Cb 0.25 -0.43 0.00 0.00 -0.61 0.00 0.00 39.78 38.99 1pqr n ASN 8 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1pqr n ALA 9 N -0.59 0.00 1.03 5.41 0.00 -1.26 -4.80 120.51 120.30 1pqr n ALA 9 Ca 0.19 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.75 1pqr n ALA 9 Cb 0.87 0.00 0.29 0.00 0.00 0.00 0.00 19.45 20.61 1pqr n ALA 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pqr n ALA 10 N -3.00 3.41 -2.59 0.00 0.00 -1.26 -4.96 120.51 112.11 1pqr n ALA 10 Ca 0.00 -0.34 -0.42 0.00 0.00 0.00 0.00 53.44 52.69 1pqr n ALA 10 Cb 0.00 -1.15 -0.06 0.00 0.00 0.00 0.00 19.45 18.25 1pqr n ALA 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pqr n HIS 12 N 6.19 0.00 -0.30 0.00 -0.00 -0.89 -4.18 115.22 116.04 1pqr n HIS 12 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.74 1pqr n HIS 12 Cb 0.48 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.47 1pqr n HIS 12 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1pqr h GLY 15 N 4.19 0.00 -0.78 0.00 0.00 -1.95 -3.48 103.07 101.05 1pqr h GLY 15 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 47.33 46.88 1pqr h GLY 15 CO 0.00 0.00 0.29 0.00 0.00 0.00 0.00 176.54 176.83 1pqr n LYS 17 N -3.93 0.00 -3.64 0.00 5.02 -1.26 -4.96 118.16 109.39 1pqr n LYS 17 Ca 0.09 0.15 -0.36 0.00 -2.02 0.00 0.00 58.31 56.17 1pqr n LYS 17 Cb 0.59 -0.64 -0.06 0.00 -0.02 0.00 0.00 35.03 34.90 1pqr n LYS 17 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1pqr s VAL 18 N -0.31 5.19 0.00 -0.18 -7.23 -1.26 -4.86 120.40 111.75 1pqr s VAL 18 Ca 0.00 0.50 0.00 0.00 -1.81 0.00 0.00 61.98 60.67 1pqr s VAL 18 Cb 0.00 -3.61 0.00 0.00 0.56 0.00 0.00 36.38 33.33 1pqr s VAL 18 CO 0.00 0.48 0.00 0.61 -0.31 0.00 0.00 175.10 175.88 1pqr n GLY 19 N 1.49 -1.31 0.00 2.32 0.00 -1.26 -5.06 105.19 101.37 1pqr n GLY 19 Ca -0.13 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.59 1pqr n GLY 19 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1pqr n ARG 20 N -0.19 0.00 0.00 1.61 0.00 -1.26 -4.87 116.66 111.95 1pqr n ARG 20 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1pqr n ARG 20 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 32.46 32.46 1pqr n ARG 20 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.63 180.11 1pqr n TYR 23 N 0.00 0.00 0.10 2.89 0.18 -1.26 -4.66 117.16 114.42 1pqr n TYR 23 Ca 0.00 0.00 0.02 0.00 1.88 0.00 0.00 57.90 59.80 1pqr n TYR 23 Cb 0.00 0.00 -0.01 0.00 -0.38 0.00 0.00 39.34 38.95 1pqr n TYR 23 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1pqr h ASP 25 N 0.00 0.00 -0.17 0.00 3.58 -1.98 -3.46 116.42 114.39 1pqr h ASP 25 Ca -0.05 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.37 1pqr h ASP 25 Cb 1.43 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.47 1pqr h ASP 25 CO 0.06 0.89 -0.01 -0.09 -2.88 0.00 0.00 179.24 177.20 1pqr h ARG 26 N 0.00 0.31 0.00 0.28 2.43 -1.98 -3.54 114.38 111.88 1pqr h ARG 26 Ca -0.23 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 58.84 1pqr h ARG 26 Cb 1.88 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 31.40 1pqr h ARG 26 CO 0.07 0.53 0.00 0.45 -1.51 0.00 0.00 179.97 179.52 1pqr n SER 28 N -4.72 -1.11 0.00 -3.80 2.88 -1.26 -4.93 113.62 100.69 1pqr n SER 28 Ca -0.05 0.31 0.00 0.00 -1.33 0.00 0.00 58.87 57.80 1pqr n SER 28 Cb 0.23 1.25 0.00 0.00 -0.75 0.00 0.00 64.21 64.94 1pqr n SER 28 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1pqr n GLY 29 N -0.34 -1.90 0.55 0.46 0.00 -1.26 -5.22 105.19 97.48 1pqr n GLY 29 Ca 0.00 0.83 0.14 0.00 0.00 0.00 0.00 46.02 46.98 1pqr n GLY 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93