#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 -1.90 -2.46 1.64 4.76 -1.26 -4.89 118.16 114.05 1iva n LYS 2 Ca 0.00 1.71 -0.06 0.00 -2.87 0.00 0.00 58.31 57.09 1iva n LYS 2 Cb 0.00 -2.35 0.01 0.00 -1.84 0.00 0.00 35.03 30.85 1iva n LYS 2 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1iva n LYS 3 N 0.68 -1.70 -2.41 1.97 4.76 -1.26 -4.98 118.16 115.22 1iva n LYS 3 Ca -0.08 1.66 -0.04 0.00 -2.87 0.00 0.00 58.31 56.98 1iva n LYS 3 Cb 0.13 -4.48 -0.01 0.00 -1.84 0.00 0.00 35.03 28.83 1iva n LYS 3 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1iva s ILE 5 N -2.10 4.59 -1.11 0.00 1.01 -1.26 -4.90 121.20 117.42 1iva s ILE 5 Ca 0.06 -0.90 -0.05 0.00 0.00 0.00 0.00 60.65 59.76 1iva s ILE 5 Cb 0.00 -3.58 0.28 0.00 0.01 0.00 0.00 42.46 39.17 1iva s ILE 5 CO 0.04 -0.27 1.57 0.00 0.00 0.00 0.00 174.94 176.29 1iva n ALA 6 N 5.00 5.27 -3.54 9.38 0.00 -1.26 -2.58 120.51 132.78 1iva n ALA 6 Ca -0.12 -4.71 -0.01 0.00 0.00 0.00 0.00 53.44 48.60 1iva n ALA 6 Cb 0.46 -2.46 -0.05 0.00 0.00 0.00 0.00 19.45 17.41 1iva n ALA 6 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1iva s LYS 7 N -2.31 0.44 -0.17 0.00 2.20 -1.26 -5.11 119.74 113.53 1iva s LYS 7 Ca 0.33 1.02 -0.29 0.00 -0.36 0.00 0.00 55.97 56.67 1iva s LYS 7 Cb 0.06 0.51 -0.01 0.00 -1.51 0.00 0.00 37.83 36.89 1iva s LYS 7 CO 0.08 -0.14 1.23 -0.51 -0.36 0.00 0.00 175.35 175.65 1iva s ASP 8 N 2.38 6.97 -0.19 1.43 1.11 -1.26 -2.77 116.67 124.34 1iva s ASP 8 Ca -0.05 1.66 0.00 0.00 0.18 0.00 0.00 52.55 54.33 1iva s ASP 8 Cb -0.08 -2.54 0.00 0.00 1.07 0.00 0.00 42.92 41.37 1iva s ASP 8 CO -0.18 -0.74 0.00 -1.22 1.18 0.00 0.00 175.17 174.22 1iva n TYR 9 N 6.47 -0.09 -3.46 4.23 4.01 -0.04 -4.88 117.16 123.41 1iva n TYR 9 Ca 0.13 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.48 1iva n TYR 9 Cb 0.45 -1.25 -0.10 0.00 -0.31 0.00 0.00 39.34 38.13 1iva n TYR 9 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1iva s GLY 10 N -2.91 1.91 -0.02 2.72 0.00 -1.11 -4.26 107.32 103.64 1iva s GLY 10 Ca 0.00 -1.14 -0.00 0.00 0.00 0.00 0.00 44.72 43.58 1iva s GLY 10 CO 0.00 0.89 0.17 -2.13 0.00 0.00 0.00 173.10 172.02 1iva n ARG 11 N 5.26 0.00 -2.01 2.90 3.00 -1.26 -1.46 116.66 123.09 1iva n ARG 11 Ca -0.11 0.00 -0.24 0.00 -0.00 0.00 0.00 57.85 57.50 1iva n ARG 11 Cb 0.50 -0.14 0.15 0.00 0.00 0.00 0.00 32.46 32.97 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 -5.31 0.68 -0.59 0.00 2.20 -1.26 -4.49 119.74 110.98 1iva s LYS 13 Ca 0.65 -0.68 -0.19 0.00 -0.36 0.00 0.00 55.97 55.39 1iva s LYS 13 Cb -0.02 0.28 0.10 0.00 -1.51 0.00 0.00 37.83 36.68 1iva s LYS 13 CO 0.45 -0.19 0.69 -1.58 -0.36 0.00 0.00 175.35 174.36 1iva s TRP 14 N -2.66 3.01 0.00 4.03 0.51 -1.26 -3.96 118.94 118.60 1iva s TRP 14 Ca -0.04 -0.97 0.00 0.00 -2.12 0.00 0.00 56.10 52.97 1iva s TRP 14 Cb -0.01 -4.00 0.00 0.00 -0.81 0.00 0.00 33.47 28.66 1iva s TRP 14 CO -0.04 -1.28 0.00 0.41 -0.51 0.00 0.00 176.95 175.53 1iva n GLY 15 N 5.28 0.66 0.00 0.98 0.00 -1.26 -5.13 105.19 105.72 1iva n GLY 15 Ca -0.10 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.12 4.60 3.73 -0.02 0.00 -1.25 -5.14 105.19 106.99 1iva n GLY 16 Ca 0.00 -0.62 -0.42 0.00 0.00 0.00 0.00 46.02 44.98 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 0.63 2.49 0.32 2.61 2.01 -1.26 -4.96 115.64 117.48 1iva s THR 17 Ca 0.00 0.38 0.08 0.00 0.31 0.00 0.00 61.69 62.46 1iva s THR 17 Cb 0.00 -3.24 0.31 0.00 0.01 0.00 0.00 72.50 69.58 1iva s THR 17 CO 0.00 0.05 1.80 1.55 -0.69 0.00 0.00 174.62 177.32 1iva h PRO 18 N 5.89 0.70 0.00 4.92 0.13 -1.94 -3.44 132.00 138.26 1iva h PRO 18 Ca -0.44 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1iva h PRO 18 Cb 1.21 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1iva h PRO 18 CO 0.85 0.47 0.00 0.00 -0.23 0.00 0.00 178.00 179.09 1iva s ARG 21 N -1.50 1.82 -0.32 0.00 1.81 -1.26 -2.92 118.95 116.58 1iva s ARG 21 Ca -0.04 -2.81 -0.01 0.00 -1.72 0.00 0.00 55.73 51.15 1iva s ARG 21 Cb 0.01 -2.63 -0.01 0.00 -0.45 0.00 0.00 34.95 31.87 1iva s ARG 21 CO 0.06 -1.31 0.30 0.41 -0.68 0.00 0.00 175.30 174.07 1iva n GLY 22 N 2.39 -0.42 3.08 -3.53 0.00 -1.26 -5.01 105.19 100.45 1iva n GLY 22 Ca 0.23 0.06 -0.08 0.00 0.00 0.00 0.00 46.02 46.22 1iva n GLY 22 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1iva s ARG 23 N -3.17 0.56 0.00 1.61 0.52 -1.26 -3.87 118.95 113.34 1iva s ARG 23 Ca 0.06 -0.94 0.00 0.00 -0.52 0.00 0.00 55.73 54.33 1iva s ARG 23 Cb -0.01 0.20 0.00 0.00 0.52 0.00 0.00 34.95 35.67 1iva s ARG 23 CO 0.29 -0.12 0.00 0.41 0.02 0.00 0.00 175.30 175.90 1iva n GLY 24 N 0.60 0.68 0.00 -3.53 0.00 -0.94 -4.79 105.19 97.20 1iva n GLY 24 Ca -0.18 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.70 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 1.93 0.45 0.00 -1.09 -0.82 -4.91 121.20 116.76 1iva s ILE 26 Ca 0.00 -0.99 0.05 0.00 -2.23 0.00 0.00 60.65 57.48 1iva s ILE 26 Cb 0.00 -1.64 0.05 0.00 -1.58 0.00 0.00 42.46 39.28 1iva s ILE 26 CO 0.00 0.54 0.39 0.00 -1.23 0.00 0.00 174.94 174.64 1iva n SER 28 N -1.99 0.38 -3.68 0.00 2.88 -1.26 -4.88 113.62 105.07 1iva n SER 28 Ca 0.01 -1.35 -0.41 0.00 -1.33 0.00 0.00 58.87 55.79 1iva n SER 28 Cb 0.50 -0.25 0.00 0.00 -0.75 0.00 0.00 64.21 63.71 1iva n SER 28 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1iva n ILE 29 N -2.04 5.22 0.00 2.46 -6.64 -1.26 -3.98 119.36 113.13 1iva n ILE 29 Ca 0.06 -4.91 0.00 0.00 -1.77 0.00 0.00 62.75 56.13 1iva n ILE 29 Cb 0.20 -2.04 0.00 0.00 -1.44 0.00 0.00 39.64 36.36 1iva n ILE 29 CO 0.00 0.00 0.00 0.80 -1.77 0.00 0.00 176.55 175.58 1iva n MET 30 N 1.82 0.00 -0.93 6.28 1.56 -1.26 -5.00 117.12 119.59 1iva n MET 30 Ca 0.49 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.92 1iva n MET 30 Cb 0.29 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.66 1iva n MET 30 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1iva n GLY 31 N 0.00 0.44 3.06 -5.12 0.00 -1.26 -5.03 105.19 97.28 1iva n GLY 31 Ca 0.00 -0.83 -0.32 0.00 0.00 0.00 0.00 46.02 44.87 1iva n GLY 31 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1iva s THR 32 N -2.00 1.95 0.00 2.61 -4.23 -1.26 -4.95 115.64 107.75 1iva s THR 32 Ca 0.00 -1.22 0.00 0.00 -1.18 0.00 0.00 61.69 59.29 1iva s THR 32 Cb 0.00 -1.96 0.00 0.00 1.34 0.00 0.00 72.50 71.88 1iva s THR 32 CO 0.00 0.19 0.00 -0.46 -0.54 0.00 0.00 174.62 173.81 1iva n ASN 33 N 4.57 0.00 -2.95 3.99 0.23 -1.26 -4.60 115.26 115.24 1iva n ASN 33 Ca -0.16 0.00 -0.14 0.00 -0.53 0.00 0.00 54.58 53.75 1iva n ASN 33 Cb 0.46 0.00 0.11 0.00 -2.08 0.00 0.00 39.78 38.27 1iva n ASN 33 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1iva s GLU 35 N -4.26 0.40 -0.85 0.00 -1.05 -0.75 -4.02 118.70 108.16 1iva s GLU 35 Ca 0.34 0.53 -0.23 0.00 -0.15 0.00 0.00 54.97 55.46 1iva s GLU 35 Cb -0.02 0.17 0.07 0.00 -0.44 0.00 0.00 34.13 33.91 1iva s GLU 35 CO 0.25 -0.06 1.21 0.00 0.95 0.00 0.00 175.26 177.62 1iva n LYS 37 N 8.09 2.19 -0.31 0.00 4.81 -1.26 -0.86 118.16 130.83 1iva n LYS 37 Ca 0.16 0.80 0.04 0.00 -0.87 0.00 0.00 58.31 58.44 1iva n LYS 37 Cb 0.49 -2.61 0.12 0.00 0.02 0.00 0.00 35.03 33.04 1iva n LYS 37 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 1iva h PRO 38 N 7.63 0.00 -2.32 1.64 0.11 -1.89 -2.51 132.00 134.66 1iva h PRO 38 Ca -0.47 -0.00 -0.34 0.00 0.11 0.00 0.00 66.00 65.31 1iva h PRO 38 Cb 1.26 -0.00 -0.35 0.00 0.11 0.00 0.00 31.00 32.02 1iva h PRO 38 CO 0.92 0.00 -0.64 -0.98 -0.21 0.00 0.00 178.00 177.09 1iva s ARG 39 N -6.25 0.27 0.00 1.05 1.70 -1.25 -4.47 118.95 110.00 1iva s ARG 39 Ca -0.15 -0.04 0.00 0.00 -0.47 0.00 0.00 55.73 55.08 1iva s ARG 39 Cb 0.24 -0.88 0.00 0.00 -0.57 0.00 0.00 34.95 33.74 1iva s ARG 39 CO 0.77 -0.89 0.00 -0.11 -1.08 0.00 0.00 175.30 173.99 1iva n LEU 40 N 5.31 0.00 -0.71 -1.89 7.94 -1.25 -4.35 117.00 122.05 1iva n LEU 40 Ca -0.04 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.86 1iva n LEU 40 Cb 0.47 -0.22 0.00 0.00 0.53 0.00 0.00 43.42 44.20 1iva n LEU 40 CO 0.04 -0.28 0.32 2.30 -1.11 0.00 0.00 177.39 178.65 1iva n ILE 41 N -2.02 0.38 -0.02 1.96 -5.35 -1.26 -2.04 119.36 111.01 1iva n ILE 41 Ca 0.00 0.00 -0.05 0.00 -0.27 0.00 0.00 62.75 62.43 1iva n ILE 41 Cb 0.00 -0.66 -0.02 0.00 -1.74 0.00 0.00 39.64 37.23 1iva n ILE 41 CO 0.00 0.00 0.00 0.23 -1.76 0.00 0.00 176.55 175.02 1iva n MET 42 N 0.26 0.10 0.00 6.28 2.81 -1.26 -4.56 117.12 120.75 1iva n MET 42 Ca 0.00 0.04 0.08 0.00 -1.81 0.00 0.00 57.70 56.01 1iva n MET 42 Cb 0.32 -0.66 0.46 0.00 -0.71 0.00 0.00 33.22 32.62 1iva n MET 42 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1iva n GLU 43 N -3.23 0.46 -3.14 0.03 -0.58 -1.21 -4.17 120.64 108.80 1iva n GLU 43 Ca -0.09 0.02 -0.10 0.00 -0.42 0.00 0.00 57.16 56.57 1iva n GLU 43 Cb 0.54 -1.50 -0.04 0.00 -0.57 0.00 0.00 31.44 29.87 1iva n GLU 43 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1iva s GLY 44 N -2.07 -0.53 0.00 0.62 0.00 -0.87 -4.77 107.32 99.71 1iva s GLY 44 Ca 0.23 -0.75 0.00 0.00 0.00 0.00 0.00 44.72 44.19 1iva s GLY 44 CO 0.19 3.16 0.01 1.47 0.00 0.00 0.00 173.10 177.93 1iva n LEU 45 N 3.64 0.01 0.00 0.66 -0.00 -1.26 -4.51 117.00 115.54 1iva n LEU 45 Ca 0.16 -0.20 0.00 0.00 -0.00 0.00 0.00 56.01 55.98 1iva n LEU 45 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.94 1iva n LEU 45 CO 0.03 0.00 0.00 0.61 -0.00 0.00 0.00 177.39 178.04 1iva n GLY 46 N 0.37 -0.48 0.14 1.47 0.00 -1.26 -4.91 105.19 100.52 1iva n GLY 46 Ca 0.00 0.20 -0.09 0.00 0.00 0.00 0.00 46.02 46.12 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 0.34 0.00 0.99 -0.00 -1.99 -3.54 115.31 111.11 1iva h LEU 47 Ca 0.00 -0.26 0.00 0.00 -0.00 0.00 0.00 57.88 57.62 1iva h LEU 47 Cb 0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 40.66 40.56 1iva h LEU 47 CO 0.00 1.04 0.00 0.00 -0.00 0.00 0.00 178.44 179.48