#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iva n LYS 2 N 0.00 -2.13 -2.89 -1.58 0.00 -1.26 -4.83 118.16 105.48 1iva n LYS 2 Ca 0.00 1.87 -0.03 0.00 0.00 0.00 0.00 58.31 60.15 1iva n LYS 2 Cb 0.00 -2.94 0.00 0.00 0.00 0.00 0.00 35.03 32.10 1iva n LYS 2 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1iva n LYS 3 N 0.76 -1.69 -1.04 1.64 4.81 -1.26 -4.89 118.16 116.49 1iva n LYS 3 Ca -0.18 1.70 0.11 0.00 -0.87 0.00 0.00 58.31 59.07 1iva n LYS 3 Cb 0.28 -5.51 -0.04 0.00 0.02 0.00 0.00 35.03 29.79 1iva n LYS 3 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1iva s ILE 5 N -3.00 1.87 -0.83 0.00 1.01 -1.26 -3.25 121.20 115.74 1iva s ILE 5 Ca 0.00 -0.83 -0.02 0.00 0.00 0.00 0.00 60.65 59.79 1iva s ILE 5 Cb 0.00 -1.70 0.27 0.00 0.01 0.00 0.00 42.46 41.05 1iva s ILE 5 CO 0.00 0.51 2.17 0.00 0.00 0.00 0.00 174.94 177.62 1iva n ALA 6 N 4.53 6.46 -4.69 9.38 0.00 -1.26 -1.30 120.51 133.62 1iva n ALA 6 Ca -0.19 -3.98 -0.31 0.00 0.00 0.00 0.00 53.44 48.95 1iva n ALA 6 Cb 0.50 -2.10 -0.07 0.00 0.00 0.00 0.00 19.45 17.78 1iva n ALA 6 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1iva n LYS 7 N -0.05 0.72 -4.92 0.00 -0.00 -1.26 -4.98 118.16 107.68 1iva n LYS 7 Ca 0.52 -3.65 -0.33 0.00 -0.00 0.00 0.00 58.31 54.85 1iva n LYS 7 Cb 0.30 1.24 -0.14 0.00 -0.00 0.00 0.00 35.03 36.43 1iva n LYS 7 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 1iva s ASP 8 N -3.73 3.88 -0.64 -5.58 2.15 -1.26 -4.36 116.67 107.13 1iva s ASP 8 Ca 0.06 -0.28 -0.02 0.00 0.43 0.00 0.00 52.55 52.73 1iva s ASP 8 Cb 0.00 -1.06 0.00 0.00 -0.30 0.00 0.00 42.92 41.56 1iva s ASP 8 CO 0.04 0.28 0.29 -1.22 -0.17 0.00 0.00 175.17 174.39 1iva n TYR 9 N 2.75 -0.88 -4.71 -5.34 4.02 -0.40 -4.92 117.16 107.68 1iva n TYR 9 Ca -0.17 0.25 -0.33 0.00 -0.01 0.00 0.00 57.90 57.64 1iva n TYR 9 Cb 0.52 -2.51 -0.16 0.00 -0.02 0.00 0.00 39.34 37.17 1iva n TYR 9 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 1iva s GLY 10 N -2.91 1.39 0.00 2.72 0.00 -1.26 -4.33 107.32 102.94 1iva s GLY 10 Ca 0.14 -1.06 0.00 0.00 0.00 0.00 0.00 44.72 43.81 1iva s GLY 10 CO 0.18 -0.06 0.00 0.54 0.00 0.00 0.00 173.10 173.76 1iva n ARG 11 N 3.97 0.00 -2.40 2.90 3.00 -1.22 -1.99 116.66 120.93 1iva n ARG 11 Ca -0.20 0.00 -0.19 0.00 -0.01 0.00 0.00 57.85 57.45 1iva n ARG 11 Cb 0.52 0.00 0.09 0.00 0.00 0.00 0.00 32.46 33.07 1iva n ARG 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1iva s LYS 13 N -4.66 0.98 -0.30 0.00 0.00 -1.26 -4.49 119.74 110.01 1iva s LYS 13 Ca 0.57 -0.22 -0.26 0.00 0.00 0.00 0.00 55.97 56.05 1iva s LYS 13 Cb -0.03 0.45 0.01 0.00 0.00 0.00 0.00 37.83 38.25 1iva s LYS 13 CO 0.37 -0.34 0.94 -1.58 0.00 0.00 0.00 175.35 174.74 1iva s TRP 14 N -2.26 3.21 -0.05 1.78 0.51 -1.26 -2.97 118.94 117.90 1iva s TRP 14 Ca -0.06 1.08 -0.00 0.00 -2.12 0.00 0.00 56.10 55.00 1iva s TRP 14 Cb -0.01 -3.40 0.00 0.00 -0.81 0.00 0.00 33.47 29.25 1iva s TRP 14 CO -0.00 -0.62 0.05 0.41 -0.51 0.00 0.00 176.95 176.27 1iva n GLY 15 N 3.91 0.88 0.00 0.98 0.00 -1.26 -5.07 105.19 104.63 1iva n GLY 15 Ca 0.08 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.45 1iva n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iva n GLY 16 N -0.58 4.21 3.73 -0.02 0.00 -1.16 -5.09 105.19 106.28 1iva n GLY 16 Ca 0.00 -1.77 -0.42 0.00 0.00 0.00 0.00 46.02 43.83 1iva n GLY 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1iva s THR 17 N 2.91 2.57 0.40 2.61 2.01 -1.26 -4.95 115.64 119.93 1iva s THR 17 Ca 0.00 0.43 0.20 0.00 0.31 0.00 0.00 61.69 62.63 1iva s THR 17 Cb 0.00 -3.28 0.40 0.00 0.01 0.00 0.00 72.50 69.64 1iva s THR 17 CO 0.00 0.05 1.75 1.55 -0.69 0.00 0.00 174.62 177.28 1iva h PRO 18 N 6.14 0.33 0.00 4.92 0.13 -1.94 -3.47 132.00 138.12 1iva h PRO 18 Ca -0.44 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1iva h PRO 18 Cb 1.21 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1iva h PRO 18 CO 0.87 0.22 0.00 0.00 -0.23 0.00 0.00 178.00 178.86 1iva n ARG 21 N -4.63 1.96 0.00 0.00 1.85 -1.25 -4.86 116.66 109.73 1iva n ARG 21 Ca -0.10 -4.31 0.00 0.00 -1.00 0.00 0.00 57.85 52.44 1iva n ARG 21 Cb 0.30 -2.05 0.00 0.00 -1.05 0.00 0.00 32.46 29.66 1iva n ARG 21 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1iva n GLY 22 N 1.26 0.72 3.97 2.89 0.00 -1.26 -4.39 105.19 108.38 1iva n GLY 22 Ca 0.27 -0.65 -0.24 0.00 0.00 0.00 0.00 46.02 45.39 1iva n GLY 22 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1iva s ARG 23 N -0.29 1.95 0.00 1.61 1.70 -1.26 -4.11 118.95 118.55 1iva s ARG 23 Ca 0.00 -0.81 0.00 0.00 -0.47 0.00 0.00 55.73 54.45 1iva s ARG 23 Cb 0.00 -2.31 0.00 0.00 -0.57 0.00 0.00 34.95 32.07 1iva s ARG 23 CO 0.00 -1.27 0.00 0.41 -1.08 0.00 0.00 175.30 173.36 1iva n GLY 24 N -2.78 -1.61 0.45 3.88 0.00 -1.17 -0.66 105.19 103.31 1iva n GLY 24 Ca 0.12 0.66 0.00 0.00 0.00 0.00 0.00 46.02 46.79 1iva n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iva s ILE 26 N 0.00 2.09 0.02 0.00 -1.09 -1.16 -4.85 121.20 116.21 1iva s ILE 26 Ca 0.00 -1.19 0.01 0.00 -2.23 0.00 0.00 60.65 57.25 1iva s ILE 26 Cb 0.00 -1.75 -0.01 0.00 -1.58 0.00 0.00 42.46 39.12 1iva s ILE 26 CO 0.00 0.52 -0.05 0.00 -1.23 0.00 0.00 174.94 174.17 1iva n SER 28 N 2.25 0.00 -0.30 0.00 3.41 -1.26 -3.35 113.62 114.36 1iva n SER 28 Ca -0.18 0.00 0.30 0.00 -0.26 0.00 0.00 58.87 58.73 1iva n SER 28 Cb 0.57 0.00 0.55 0.00 -0.26 0.00 0.00 64.21 65.07 1iva n SER 28 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1iva n ILE 29 N 0.00 -0.40 0.00 -1.33 -0.00 -1.26 -2.73 119.36 113.65 1iva n ILE 29 Ca 0.00 1.91 0.00 0.00 -0.00 0.00 0.00 62.75 64.66 1iva n ILE 29 Cb 0.00 -3.11 0.00 0.00 -0.00 0.00 0.00 39.64 36.53 1iva n ILE 29 CO 0.00 0.00 0.00 0.80 -0.00 0.00 0.00 176.55 177.35 1iva n MET 30 N -5.13 2.52 -0.30 0.38 1.56 -1.23 -4.91 117.12 110.01 1iva n MET 30 Ca 0.36 0.00 0.08 0.00 -0.27 0.00 0.00 57.70 57.87 1iva n MET 30 Cb 1.21 -0.41 0.19 0.00 2.15 0.00 0.00 33.22 36.36 1iva n MET 30 CO 0.00 0.00 0.00 0.78 -0.73 0.00 0.00 175.97 176.02 1iva h GLY 31 N 0.00 0.93 -4.51 -5.12 0.00 -1.68 -3.47 103.07 89.23 1iva h GLY 31 Ca 0.00 0.18 0.01 0.00 0.00 0.00 0.00 47.33 47.51 1iva h GLY 31 CO 0.00 -0.38 -1.23 -1.30 0.00 0.00 0.00 176.54 173.63 1iva n THR 32 N -5.46-10.66 -3.21 4.70 -2.24 -1.10 -4.43 114.28 91.88 1iva n THR 32 Ca 0.17 2.16 -0.01 0.00 -2.27 0.00 0.00 64.05 64.10 1iva n THR 32 Cb 0.57 -5.85 -0.00 0.00 -2.10 0.00 0.00 70.33 62.95 1iva n THR 32 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1iva n ASN 33 N 1.31 -0.03 -0.72 3.42 6.94 -1.26 -4.58 115.26 120.34 1iva n ASN 33 Ca -0.33 -0.02 0.07 0.00 -0.02 0.00 0.00 54.58 54.28 1iva n ASN 33 Cb 0.51 -0.03 -0.02 0.00 -2.36 0.00 0.00 39.78 37.87 1iva n ASN 33 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1iva s GLU 35 N -2.47 0.82 -1.23 0.00 0.41 -0.94 -3.38 118.70 111.91 1iva s GLU 35 Ca 0.00 0.81 -0.17 0.00 -0.41 0.00 0.00 54.97 55.20 1iva s GLU 35 Cb 0.00 0.40 0.10 0.00 -1.78 0.00 0.00 34.13 32.85 1iva s GLU 35 CO 0.00 -0.13 1.59 0.00 -0.49 0.00 0.00 175.26 176.23 1iva s LYS 37 N 3.42 4.24 0.22 0.00 2.20 -1.26 -1.27 119.74 127.29 1iva s LYS 37 Ca 0.49 2.25 -0.28 0.00 -0.36 0.00 0.00 55.97 58.06 1iva s LYS 37 Cb 0.01 -3.40 -0.16 0.00 -1.51 0.00 0.00 37.83 32.77 1iva s LYS 37 CO 0.03 -0.62 0.65 -2.30 -0.36 0.00 0.00 175.35 172.74 1iva n PRO 38 N 4.78 0.35 -0.71 4.03 -0.01 -1.26 -3.50 135.00 138.67 1iva n PRO 38 Ca 0.14 0.12 0.00 0.00 -0.01 0.00 0.00 63.50 63.75 1iva n PRO 38 Cb 0.41 -1.22 0.00 0.00 -0.01 0.00 0.00 33.50 32.68 1iva n PRO 38 CO 0.00 0.00 0.00 2.89 -0.01 0.00 0.00 175.50 178.38 1iva n ARG 39 N 0.93 0.00 -3.69 -0.52 0.00 -1.03 -4.77 116.66 107.58 1iva n ARG 39 Ca 0.16 0.00 -0.39 0.00 -0.00 0.00 0.00 57.85 57.62 1iva n ARG 39 Cb 0.27 0.00 -0.12 0.00 -0.00 0.00 0.00 32.46 32.61 1iva n ARG 39 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 1iva s LEU 40 N 0.00 4.29 0.00 2.89 2.96 0.17 -4.93 118.68 124.05 1iva s LEU 40 Ca 0.00 -0.88 0.00 0.00 -0.22 0.00 0.00 54.13 53.03 1iva s LEU 40 Cb 0.00 -1.94 0.00 0.00 0.50 0.00 0.00 46.19 44.75 1iva s LEU 40 CO 0.00 -0.29 0.00 -0.38 -1.32 0.00 0.00 176.35 174.36 1iva n ILE 41 N 4.91 0.00 1.00 6.68 2.08 -1.26 -4.26 119.36 128.51 1iva n ILE 41 Ca -0.13 0.00 0.10 0.00 0.56 0.00 0.00 62.75 63.28 1iva n ILE 41 Cb 0.47 -0.34 -0.09 0.00 -0.75 0.00 0.00 39.64 38.93 1iva n ILE 41 CO 0.00 0.00 0.00 0.80 0.56 0.00 0.00 176.55 177.91 1iva n MET 42 N -0.31 0.00 0.00 0.38 1.56 -1.26 -3.81 117.12 113.69 1iva n MET 42 Ca 0.00 -0.00 0.04 0.00 -0.27 0.00 0.00 57.70 57.46 1iva n MET 42 Cb 0.00 -1.50 0.20 0.00 2.15 0.00 0.00 33.22 34.07 1iva n MET 42 CO 0.00 0.00 0.00 0.39 -0.73 0.00 0.00 175.97 175.63 1iva n GLU 43 N -1.49 0.20 0.00 2.12 1.02 -1.26 -4.65 120.64 116.57 1iva n GLU 43 Ca 0.04 0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.22 1iva n GLU 43 Cb 0.33 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.25 1iva n GLU 43 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1iva n GLY 44 N -0.58 -2.05 0.29 0.62 0.00 -1.26 -5.10 105.19 97.11 1iva n GLY 44 Ca 0.05 0.62 0.00 0.00 0.00 0.00 0.00 46.02 46.69 1iva n GLY 44 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1iva n LEU 45 N -1.31 0.00 0.00 0.99 4.32 -1.26 -5.09 117.00 114.64 1iva n LEU 45 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1iva n LEU 45 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1iva n LEU 45 CO 0.00 -0.08 0.00 0.61 -1.22 0.00 0.00 177.39 176.70 1iva n GLY 46 N 1.99 -1.37 0.09 -0.72 0.00 -1.25 -4.61 105.19 99.32 1iva n GLY 46 Ca 0.00 0.55 -0.12 0.00 0.00 0.00 0.00 46.02 46.45 1iva n GLY 46 CO 0.00 0.00 0.00 0.17 0.00 0.00 0.00 173.32 173.49 1iva h LEU 47 N 0.00 0.15 -1.83 0.99 8.10 -1.81 -3.10 115.31 117.81 1iva h LEU 47 Ca 0.00 -0.23 0.00 0.00 0.11 0.00 0.00 57.88 57.76 1iva h LEU 47 Cb 0.00 -0.05 0.00 0.00 -0.44 0.00 0.00 40.66 40.17 1iva h LEU 47 CO 0.00 1.19 0.00 0.00 -4.11 0.00 0.00 178.44 175.52