#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pta s ILE 5 N 0.00 0.06 -0.22 1.09 1.01 -1.26 -5.08 121.20 116.80 2pta s ILE 5 Ca 0.00 -1.91 0.00 0.00 0.00 0.00 0.00 60.65 58.74 2pta s ILE 5 Cb 0.00 -2.22 0.06 0.00 0.01 0.00 0.00 42.46 40.31 2pta s ILE 5 CO 0.00 -0.26 -0.05 -0.55 0.00 0.00 0.00 174.94 174.07 2pta s SER 6 N -3.09 3.67 -0.17 3.58 0.15 -1.26 -4.42 113.70 112.15 2pta s SER 6 Ca 0.30 -1.09 -0.02 0.00 0.70 0.00 0.00 55.95 55.84 2pta s SER 6 Cb 0.07 -1.12 0.05 0.00 -1.71 0.00 0.00 66.02 63.31 2pta s SER 6 CO 0.06 -0.23 -0.01 0.00 1.20 0.00 0.00 173.24 174.26 2pta h THR 8 N 6.47 0.24 -2.86 0.00 1.03 -1.97 -3.31 112.91 112.51 2pta h THR 8 Ca -0.19 -0.73 -0.47 0.00 -0.01 0.00 0.00 66.41 65.01 2pta h THR 8 Cb 1.11 1.59 -0.14 0.00 -1.07 0.00 0.00 68.15 69.64 2pta h THR 8 CO 0.35 0.09 -0.61 0.20 -0.01 0.00 0.00 175.52 175.54 2pta s ASN 9 N -5.90 2.36 0.25 0.00 0.01 -1.26 -4.90 114.94 105.50 2pta s ASN 9 Ca 0.01 -1.36 0.13 0.00 -0.71 0.00 0.00 52.86 50.92 2pta s ASN 9 Cb 0.10 -0.08 0.12 0.00 0.41 0.00 0.00 41.25 41.79 2pta s ASN 9 CO 0.58 -0.59 1.46 1.55 -1.51 0.00 0.00 177.10 178.59 2pta h PRO 10 N 2.14 0.00 -0.04 -0.60 0.13 -1.91 -3.26 132.00 128.46 2pta h PRO 10 Ca -0.41 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.74 2pta h PRO 10 Cb 1.24 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.37 2pta h PRO 10 CO 0.69 0.65 0.44 0.87 -0.23 0.00 0.00 178.00 180.42 2pta h LYS 11 N 0.00 0.00 0.11 0.86 1.57 -1.97 0.14 116.57 117.28 2pta h LYS 11 Ca -0.01 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.51 2pta h LYS 11 Cb 1.39 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.70 2pta h LYS 11 CO 0.08 0.00 -1.35 1.96 -0.57 0.00 0.00 179.45 179.58 2pta h GLN 12 N 0.00 0.24 0.00 3.15 4.20 -1.96 -3.32 115.11 117.41 2pta h GLN 12 Ca 0.02 -0.41 0.00 0.00 0.06 0.00 0.00 58.65 58.32 2pta h GLN 12 Cb 0.90 0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.83 2pta h GLN 12 CO -0.00 1.19 0.00 0.00 -0.67 0.00 0.00 178.83 179.35 2pta h TYR 14 N 0.00 -0.24 -0.03 0.00 -1.99 -0.90 -2.63 116.97 111.19 2pta h TYR 14 Ca 0.00 -0.01 -0.14 0.00 2.00 0.00 0.00 58.73 60.58 2pta h TYR 14 Cb 0.46 0.08 0.01 0.00 2.00 0.00 0.00 36.73 39.28 2pta h TYR 14 CO 0.00 0.16 -0.54 -1.00 -0.00 0.00 0.00 178.16 176.78 2pta h PRO 15 N -0.73 0.42 -0.91 4.88 0.13 -1.69 -2.07 132.00 132.04 2pta h PRO 15 Ca -0.03 -0.41 0.15 0.00 -0.87 0.00 0.00 66.00 64.84 2pta h PRO 15 Cb 0.50 0.11 -0.09 0.00 0.13 0.00 0.00 31.00 31.65 2pta h PRO 15 CO 0.04 1.07 0.51 1.25 -0.23 0.00 0.00 178.00 180.64 2pta h HIS 16 N -0.07 0.90 0.00 1.56 2.76 -1.61 0.13 115.15 118.83 2pta h HIS 16 Ca -0.06 0.03 -0.17 0.00 -2.20 0.00 0.00 60.37 57.97 2pta h HIS 16 Cb 1.23 -0.27 -0.02 0.00 1.55 0.00 0.00 27.41 29.90 2pta h HIS 16 CO 0.14 0.25 -0.82 0.00 -1.30 0.00 0.00 177.93 176.20 2pta h LYS 18 N 0.02 0.00 0.00 0.00 3.64 0.02 -1.80 116.57 118.44 2pta h LYS 18 Ca -0.01 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.29 2pta h LYS 18 Cb 1.44 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.25 2pta h LYS 18 CO 0.11 0.00 -1.27 1.63 -2.27 0.00 0.00 179.45 177.65 2pta n LYS 19 N -3.07 3.02 0.07 1.90 5.02 -1.17 -3.35 118.16 120.59 2pta n LYS 19 Ca 0.03 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.19 2pta n LYS 19 Cb 0.62 -1.10 -0.07 0.00 -0.02 0.00 0.00 35.03 34.46 2pta n LYS 19 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2pta h GLU 20 N 0.00 -0.11 -0.06 1.97 4.39 -0.60 -3.24 114.58 116.94 2pta h GLU 20 Ca -0.11 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.60 2pta h GLU 20 Cb 1.23 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.91 2pta h GLU 20 CO 0.00 -0.08 0.00 -2.37 -1.16 0.00 0.00 179.01 175.41 2pta n THR 21 N -5.15 0.30 0.00 1.13 5.66 -0.84 -4.96 114.28 110.43 2pta n THR 21 Ca -0.07 -0.65 0.00 0.00 -3.05 0.00 0.00 64.05 60.27 2pta n THR 21 Cb 0.08 0.93 0.00 0.00 -1.55 0.00 0.00 70.33 69.79 2pta n THR 21 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2pta n GLY 22 N 0.21 3.01 3.47 1.09 0.00 -1.11 -4.78 105.19 107.07 2pta n GLY 22 Ca 0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 2pta n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2pta s TYR 23 N -1.74 3.00 -0.79 1.61 1.51 -1.22 -4.70 117.35 115.04 2pta s TYR 23 Ca 0.00 -0.38 0.26 0.00 -1.01 0.00 0.00 57.07 55.93 2pta s TYR 23 Cb 0.00 -1.97 0.94 0.00 -0.11 0.00 0.00 41.96 40.81 2pta s TYR 23 CO 0.00 -0.11 1.79 -0.35 -1.11 0.00 0.00 175.55 175.77 2pta n PRO 24 N 3.70 0.16 -1.76 -1.71 -0.04 -1.26 -3.09 135.00 131.00 2pta n PRO 24 Ca -0.17 0.19 -0.19 0.00 -0.04 0.00 0.00 63.50 63.29 2pta n PRO 24 Cb 0.52 -1.71 -0.07 0.00 -0.04 0.00 0.00 33.50 32.20 2pta n PRO 24 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 2pta s ASN 25 N -3.97 4.30 0.00 3.54 2.47 -1.26 -4.44 114.94 115.57 2pta s ASN 25 Ca 0.10 -0.45 0.00 0.00 0.42 0.00 0.00 52.86 52.93 2pta s ASN 25 Cb 0.13 -2.56 0.00 0.00 -1.45 0.00 0.00 41.25 37.37 2pta s ASN 25 CO 0.53 -3.59 0.00 0.00 -3.72 0.00 0.00 177.10 170.31 2pta n ALA 26 N 17.04 0.00 -3.28 1.71 0.00 -1.26 -3.20 120.51 131.52 2pta n ALA 26 Ca 0.44 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.74 2pta n ALA 26 Cb 0.45 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.83 2pta n ALA 26 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2pta s LYS 27 N -0.72 0.85 -0.71 0.00 1.02 -0.85 -4.90 119.74 114.43 2pta s LYS 27 Ca 0.00 -0.14 -0.08 0.00 0.02 0.00 0.00 55.97 55.77 2pta s LYS 27 Cb 0.00 0.38 0.19 0.00 -0.52 0.00 0.00 37.83 37.88 2pta s LYS 27 CO 0.00 -0.26 0.59 0.00 -0.92 0.00 0.00 175.35 174.75 2pta s MET 29 N 0.09 3.74 -1.50 0.00 -1.94 -0.59 -3.83 119.30 115.27 2pta s MET 29 Ca 0.17 1.22 -0.09 0.00 -1.71 0.00 0.00 55.69 55.28 2pta s MET 29 Cb -0.16 -3.97 0.09 0.00 2.01 0.00 0.00 34.83 32.79 2pta s MET 29 CO -0.06 -1.35 0.22 0.27 -0.01 0.00 0.00 175.02 174.09 2pta n ASN 30 N 8.33 -0.15 -0.76 3.03 6.94 -1.26 0.42 115.26 131.81 2pta n ASN 30 Ca 0.16 -1.13 -0.02 0.00 -0.02 0.00 0.00 54.58 53.58 2pta n ASN 30 Cb 0.47 -1.42 0.01 0.00 -2.36 0.00 0.00 39.78 36.47 2pta n ASN 30 CO 0.00 0.00 0.00 -1.14 -1.03 0.00 0.00 177.26 175.09 2pta n ARG 31 N -3.99 -0.60 -3.56 -3.83 0.63 -1.25 -4.96 116.66 99.10 2pta n ARG 31 Ca -0.13 0.06 -0.29 0.00 -0.92 0.00 0.00 57.85 56.57 2pta n ARG 31 Cb 0.53 -2.76 -0.15 0.00 0.45 0.00 0.00 32.46 30.54 2pta n ARG 31 CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 2pta s LYS 32 N -5.04 0.24 0.22 -0.14 1.02 0.17 -3.87 119.74 112.34 2pta s LYS 32 Ca 0.04 -0.57 -0.32 0.00 0.02 0.00 0.00 55.97 55.14 2pta s LYS 32 Cb -0.02 -1.27 -0.12 0.00 -0.52 0.00 0.00 37.83 35.90 2pta s LYS 32 CO 0.06 -1.00 1.66 0.00 -0.92 0.00 0.00 175.35 175.14 2pta s LYS 34 N 0.67 0.06 0.80 0.00 2.20 -0.39 -4.92 119.74 118.16 2pta s LYS 34 Ca 0.73 0.01 -0.12 0.00 -0.36 0.00 0.00 55.97 56.23 2pta s LYS 34 Cb -0.53 -1.61 0.07 0.00 -1.51 0.00 0.00 37.83 34.25 2pta s LYS 34 CO 0.38 -0.63 1.11 0.00 -0.36 0.00 0.00 175.35 175.85 2pta n PHE 36 N -3.41 2.38 -1.59 0.00 3.72 -1.19 -4.76 117.46 112.62 2pta n PHE 36 Ca 0.07 -2.83 -0.02 0.00 -0.05 0.00 0.00 57.45 54.63 2pta n PHE 36 Cb 0.58 -0.22 -0.02 0.00 -0.94 0.00 0.00 39.48 38.88 2pta n PHE 36 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2pta n GLY 37 N -0.37 0.24 0.19 1.37 0.00 -1.26 -5.04 105.19 100.32 2pta n GLY 37 Ca 0.27 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.44 2pta n GLY 37 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19