#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 1.29 -0.23 2.28 1.01 -1.26 -5.10 121.20 119.19 2pta s ILE 5 Ca 0.00 -2.00 -0.02 0.00 0.00 0.00 0.00 60.65 58.63 2pta s ILE 5 Cb 0.00 -2.39 0.02 0.00 0.01 0.00 0.00 42.46 40.10 2pta s ILE 5 CO 0.00 0.00 -0.08 -0.55 0.00 0.00 0.00 174.94 174.31 2pta s SER 6 N -3.80 4.13 -0.26 3.58 0.15 -1.26 -4.46 113.70 111.77 2pta s SER 6 Ca 0.15 -0.76 -0.04 0.00 0.70 0.00 0.00 55.95 56.00 2pta s SER 6 Cb 0.04 -1.65 0.14 0.00 -1.71 0.00 0.00 66.02 62.85 2pta s SER 6 CO 0.08 -0.09 0.51 0.00 1.20 0.00 0.00 173.24 174.94 2pta h THR 8 N 6.08 0.00 -2.08 0.00 1.35 -1.97 -3.42 112.91 112.87 2pta h THR 8 Ca -0.20 -0.69 -0.56 0.00 -0.55 0.00 0.00 66.41 64.41 2pta h THR 8 Cb 1.14 1.47 -0.13 0.00 -1.73 0.00 0.00 68.15 68.90 2pta h THR 8 CO 0.21 0.00 -0.58 0.20 -0.25 0.00 0.00 175.52 175.09 2pta s ASN 9 N -4.96 3.19 0.20 5.36 -0.87 -1.26 -4.99 114.94 111.62 2pta s ASN 9 Ca 0.07 -1.44 0.11 0.00 -1.57 0.00 0.00 52.86 50.02 2pta s ASN 9 Cb 0.10 -0.07 0.01 0.00 -0.02 0.00 0.00 41.25 41.27 2pta s ASN 9 CO 0.68 -0.61 1.40 1.55 -2.57 0.00 0.00 177.10 177.56 2pta h PRO 10 N 1.86 0.00 -0.92 -0.60 0.13 -1.91 -3.28 132.00 127.28 2pta h PRO 10 Ca -0.42 0.00 0.27 0.00 -0.87 0.00 0.00 66.00 64.98 2pta h PRO 10 Cb 1.25 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.35 2pta h PRO 10 CO 0.73 0.77 0.94 0.87 -0.23 0.00 0.00 178.00 181.08 2pta h LYS 11 N 0.00 0.00 0.01 0.86 1.57 -1.96 0.61 116.57 117.66 2pta h LYS 11 Ca -0.01 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.62 2pta h LYS 11 Cb 1.51 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.83 2pta h LYS 11 CO 0.10 0.00 -0.60 1.96 -0.57 0.00 0.00 179.45 180.34 2pta h GLN 12 N 0.00 0.39 0.00 3.15 1.08 -1.96 -3.15 115.11 114.62 2pta h GLN 12 Ca 0.44 -0.43 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2pta h GLN 12 Cb 2.32 0.13 0.00 0.00 -0.05 0.00 0.00 27.48 29.87 2pta h GLN 12 CO -0.00 1.10 0.00 0.00 -0.95 0.00 0.00 178.83 178.98 2pta h TYR 14 N 0.00 -0.59 0.03 0.00 -1.99 -0.84 -1.35 116.97 112.23 2pta h TYR 14 Ca 0.00 -0.01 -0.19 0.00 2.00 0.00 0.00 58.73 60.52 2pta h TYR 14 Cb 0.38 0.19 0.02 0.00 2.00 0.00 0.00 36.73 39.32 2pta h TYR 14 CO 0.00 -0.27 -0.77 -1.00 -0.00 0.00 0.00 178.16 176.12 2pta h PRO 15 N -0.91 0.48 -0.60 4.88 0.13 -1.67 -2.03 132.00 132.28 2pta h PRO 15 Ca -0.06 -0.55 0.04 0.00 -0.87 0.00 0.00 66.00 64.56 2pta h PRO 15 Cb 0.59 0.16 -0.04 0.00 0.13 0.00 0.00 31.00 31.84 2pta h PRO 15 CO 0.11 1.19 0.34 1.25 -0.23 0.00 0.00 178.00 180.66 2pta h HIS 16 N 0.00 0.64 -0.00 1.56 -0.00 -1.60 -2.08 115.15 113.68 2pta h HIS 16 Ca -0.10 0.02 -0.18 0.00 -0.00 0.00 0.00 60.37 60.11 2pta h HIS 16 Cb 1.48 -0.20 -0.02 0.00 -0.00 0.00 0.00 27.41 28.67 2pta h HIS 16 CO 0.14 0.34 -0.82 0.00 -0.00 0.00 0.00 177.93 177.59 2pta n LYS 18 N -3.62 0.14 -0.03 0.00 4.81 -0.76 -1.08 118.16 117.61 2pta n LYS 18 Ca -0.02 0.64 0.03 0.00 -0.87 0.00 0.00 58.31 58.09 2pta n LYS 18 Cb 0.77 -1.98 -0.13 0.00 0.02 0.00 0.00 35.03 33.72 2pta n LYS 18 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2pta n LYS 19 N -2.26 0.85 -0.00 1.64 5.02 -1.11 -2.47 118.16 119.83 2pta n LYS 19 Ca -0.01 -0.10 -0.17 0.00 -2.02 0.00 0.00 58.31 56.01 2pta n LYS 19 Cb 0.06 -1.39 -0.11 0.00 -0.02 0.00 0.00 35.03 33.57 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 0.37 0.00 1.97 4.39 -0.94 -3.39 114.58 116.98 2pta h GLU 20 Ca -0.15 -0.39 0.00 0.00 0.34 0.00 0.00 59.36 59.16 2pta h GLU 20 Cb 1.17 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.93 2pta h GLU 20 CO 0.01 1.07 0.00 -2.37 -1.16 0.00 0.00 179.01 176.56 2pta n THR 21 N -4.27 0.10 0.00 1.13 5.66 -0.73 -4.79 114.28 111.38 2pta n THR 21 Ca -0.10 -0.19 0.00 0.00 -3.05 0.00 0.00 64.05 60.71 2pta n THR 21 Cb 0.64 1.41 0.00 0.00 -1.55 0.00 0.00 70.33 70.83 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 -0.05 2.94 3.66 1.09 0.00 -1.03 -4.88 105.19 106.91 2pta n GLY 22 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.59 3.36 -0.40 1.61 2.02 -1.25 -4.55 117.35 116.56 2pta s TYR 23 Ca 0.00 0.88 0.26 0.00 -0.37 0.00 0.00 57.07 57.83 2pta s TYR 23 Cb 0.00 -2.77 0.66 0.00 -0.40 0.00 0.00 41.96 39.45 2pta s TYR 23 CO 0.00 -0.17 1.72 -1.00 -1.57 0.00 0.00 175.55 174.53 2pta h PRO 24 N 7.52 0.00 -6.34 -1.71 0.13 -1.80 -3.17 132.00 126.64 2pta h PRO 24 Ca -0.31 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.24 2pta h PRO 24 Cb 1.14 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.30 2pta h PRO 24 CO 0.76 0.00 1.13 0.09 -0.23 0.00 0.00 178.00 179.75 2pta n ASN 25 N -2.88 3.72 -2.93 1.44 3.02 -1.26 -3.84 115.26 112.53 2pta n ASN 25 Ca 0.04 0.96 -0.05 0.00 -0.03 0.00 0.00 54.58 55.49 2pta n ASN 25 Cb 0.45 -1.44 0.02 0.00 -0.61 0.00 0.00 39.78 38.20 2pta n ASN 25 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2pta n ALA 26 N 6.62 -2.14 -2.71 5.41 0.00 -1.26 -1.98 120.51 124.45 2pta n ALA 26 Ca 0.21 -1.06 -0.09 0.00 0.00 0.00 0.00 53.44 52.51 2pta n ALA 26 Cb 0.34 0.71 -0.10 0.00 0.00 0.00 0.00 19.45 20.40 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 -2.06 0.49 0.04 0.00 1.02 -0.94 -4.93 119.74 113.35 2pta s LYS 27 Ca 0.18 -0.78 0.04 0.00 0.02 0.00 0.00 55.97 55.44 2pta s LYS 27 Cb -0.04 0.18 -0.04 0.00 -0.52 0.00 0.00 37.83 37.42 2pta s LYS 27 CO 0.08 -0.10 -0.07 0.00 -0.92 0.00 0.00 175.35 174.33 2pta s MET 29 N -1.68 0.37 -1.33 0.00 -1.94 -0.35 -4.88 119.30 109.48 2pta s MET 29 Ca 0.19 -0.66 -0.10 0.00 -1.71 0.00 0.00 55.69 53.41 2pta s MET 29 Cb -0.11 -1.00 0.01 0.00 2.01 0.00 0.00 34.83 35.74 2pta s MET 29 CO 0.10 -1.09 0.20 0.27 -0.01 0.00 0.00 175.02 174.49 2pta n ASN 30 N 4.85 -0.59 0.00 3.03 0.23 -1.26 -0.24 115.26 121.29 2pta n ASN 30 Ca 0.01 -1.19 0.00 0.00 -0.53 0.00 0.00 54.58 52.88 2pta n ASN 30 Cb 0.42 -1.46 0.00 0.00 -2.08 0.00 0.00 39.78 36.67 2pta n ASN 30 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 2pta n ARG 31 N -4.45 0.00 -3.65 -3.83 5.12 -1.26 -5.04 116.66 103.55 2pta n ARG 31 Ca -0.24 0.01 -0.29 0.00 -1.93 0.00 0.00 57.85 55.39 2pta n ARG 31 Cb 0.60 -2.92 -0.14 0.00 -1.16 0.00 0.00 32.46 28.84 2pta n ARG 31 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2pta s LYS 32 N -3.47 0.68 0.34 5.56 1.02 0.67 -4.18 119.74 120.36 2pta s LYS 32 Ca 0.00 -1.17 -0.17 0.00 0.02 0.00 0.00 55.97 54.65 2pta s LYS 32 Cb 0.00 -1.78 -0.09 0.00 -0.52 0.00 0.00 37.83 35.44 2pta s LYS 32 CO 0.00 -1.06 0.80 0.00 -0.92 0.00 0.00 175.35 174.17 2pta s LYS 34 N -2.86 0.27 0.68 0.00 2.20 -0.82 -4.99 119.74 114.21 2pta s LYS 34 Ca 0.54 0.58 -0.11 0.00 -0.36 0.00 0.00 55.97 56.62 2pta s LYS 34 Cb -0.11 -0.43 -0.01 0.00 -1.51 0.00 0.00 37.83 35.77 2pta s LYS 34 CO 0.17 -0.51 1.06 0.00 -0.36 0.00 0.00 175.35 175.71 2pta n PHE 36 N -2.98 2.18 0.00 0.00 3.72 -0.84 -4.71 117.46 114.83 2pta n PHE 36 Ca 0.07 -2.13 0.00 0.00 -0.05 0.00 0.00 57.45 55.34 2pta n PHE 36 Cb 0.55 -1.29 0.00 0.00 -0.94 0.00 0.00 39.48 37.79 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 0.24 -2.30 3.87 1.37 0.00 -1.26 -5.06 105.19 102.05 2pta n GLY 37 Ca 0.50 0.82 0.00 0.00 0.00 0.00 0.00 46.02 47.35 2pta n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86