#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 -1.68 -2.33 1.97 0.00 -1.26 -4.96 118.16 109.90 1iva n LYS 2 Ca 0.00 1.55 -0.00 0.00 0.00 0.00 0.00 58.31 59.86 1iva n LYS 2 Cb 0.00 -1.70 0.00 0.00 0.00 0.00 0.00 35.03 33.33 1iva n LYS 2 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1iva n LYS 3 N 0.58 -2.32 -0.95 1.64 5.02 -1.26 -4.96 118.16 115.91 1iva n LYS 3 Ca 0.00 2.03 0.09 0.00 -2.02 0.00 0.00 58.31 58.40 1iva n LYS 3 Cb 0.00 -4.01 -0.03 0.00 -0.02 0.00 0.00 35.03 30.96 1iva n LYS 3 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1iva s ILE 5 N -3.13 4.88 -1.13 0.00 -1.09 -1.05 -4.82 121.20 114.87 1iva s ILE 5 Ca 0.00 -0.91 -0.07 0.00 -2.23 0.00 0.00 60.65 57.45 1iva s ILE 5 Cb 0.00 -3.79 0.27 0.00 -1.58 0.00 0.00 42.46 37.36 1iva s ILE 5 CO 0.00 -0.36 1.46 0.00 -1.23 0.00 0.00 174.94 174.81 1iva n ALA 6 N 5.08 4.93 -3.40 9.38 0.00 -1.26 -1.40 120.51 133.85 1iva n ALA 6 Ca -0.11 -4.67 0.02 0.00 0.00 0.00 0.00 53.44 48.68 1iva n ALA 6 Cb 0.45 -2.51 -0.05 0.00 0.00 0.00 0.00 19.45 17.34 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 -1.72 0.11 0.01 0.00 2.20 -1.26 -5.04 119.74 114.03 1iva s LYS 7 Ca 0.33 0.23 -0.30 0.00 -0.36 0.00 0.00 55.97 55.87 1iva s LYS 7 Cb 0.02 0.10 -0.04 0.00 -1.51 0.00 0.00 37.83 36.40 1iva s LYS 7 CO 0.04 -0.03 1.18 -0.51 -0.36 0.00 0.00 175.35 175.67 1iva s ASP 8 N 1.75 7.09 -0.47 1.43 1.01 -1.26 -2.83 116.67 123.39 1iva s ASP 8 Ca -0.03 1.90 -0.00 0.00 0.71 0.00 0.00 52.55 55.12 1iva s ASP 8 Cb -0.02 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.34 1iva s ASP 8 CO -0.14 -0.50 0.00 -1.22 0.21 0.00 0.00 175.17 173.52 1iva n TYR 9 N 4.47 -0.27 -3.54 4.23 4.01 0.10 -4.90 117.16 121.27 1iva n TYR 9 Ca 0.10 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.47 1iva n TYR 9 Cb 0.47 -1.79 -0.07 0.00 -0.31 0.00 0.00 39.34 37.64 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 -2.75 2.23 -0.84 2.72 0.00 -1.13 -4.33 107.32 103.22 1iva s GLY 10 Ca 0.00 -0.43 -0.21 0.00 0.00 0.00 0.00 44.72 44.08 1iva s GLY 10 CO 0.00 0.39 1.98 0.54 0.00 0.00 0.00 173.10 176.00 1iva n ARG 11 N 3.38 0.15 -2.49 2.90 5.12 -1.26 -1.27 116.66 123.19 1iva n ARG 11 Ca -0.12 -1.18 -0.23 0.00 -1.93 0.00 0.00 57.85 54.39 1iva n ARG 11 Cb 0.52 -3.25 0.08 0.00 -1.16 0.00 0.00 32.46 28.65 1iva n ARG 11 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1iva s LYS 13 N -5.06 0.35 -0.41 0.00 2.36 -1.26 -3.90 119.74 111.81 1iva s LYS 13 Ca 0.62 0.77 -0.29 0.00 -2.55 0.00 0.00 55.97 54.52 1iva s LYS 13 Cb -0.08 -0.01 0.02 0.00 -1.05 0.00 0.00 37.83 36.70 1iva s LYS 13 CO 0.43 -0.17 1.28 -1.58 1.55 0.00 0.00 175.35 176.86 1iva s TRP 14 N 1.51 2.63 0.00 4.03 0.51 -1.26 -2.75 118.94 123.61 1iva s TRP 14 Ca -0.09 0.74 0.00 0.00 -2.12 0.00 0.00 56.10 54.64 1iva s TRP 14 Cb -0.09 -4.27 0.00 0.00 -0.81 0.00 0.00 33.47 28.30 1iva s TRP 14 CO -0.12 -1.63 0.00 0.41 -0.51 0.00 0.00 176.95 175.10 1iva n GLY 15 N 4.82 1.49 0.00 0.98 0.00 -1.26 -5.10 105.19 106.12 1iva n GLY 15 Ca 0.14 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.63 5.39 3.76 -0.02 0.00 -1.11 -5.13 105.19 107.44 1iva n GLY 16 Ca 0.00 -0.77 -0.41 0.00 0.00 0.00 0.00 46.02 44.84 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 1.68 2.41 0.39 2.61 2.01 -1.26 -5.04 115.64 118.43 1iva s THR 17 Ca 0.00 0.37 -0.06 0.00 0.31 0.00 0.00 61.69 62.30 1iva s THR 17 Cb 0.00 -3.24 0.10 0.00 0.01 0.00 0.00 72.50 69.37 1iva s THR 17 CO 0.00 0.07 0.30 -0.81 -0.69 0.00 0.00 174.62 173.50 1iva n PRO 18 N 1.54 -2.01 -3.97 4.92 -0.04 -1.26 -4.54 135.00 129.64 1iva n PRO 18 Ca 0.04 -0.49 -0.31 0.00 -0.04 0.00 0.00 63.50 62.70 1iva n PRO 18 Cb 0.40 -0.51 -0.05 0.00 -0.04 0.00 0.00 33.50 33.30 1iva n PRO 18 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1iva s ARG 21 N -2.52 0.84 0.00 0.00 1.70 -1.24 -4.75 118.95 112.98 1iva s ARG 21 Ca -0.21 -1.71 0.00 0.00 -0.47 0.00 0.00 55.73 53.34 1iva s ARG 21 Cb 0.03 -1.60 0.00 0.00 -0.57 0.00 0.00 34.95 32.81 1iva s ARG 21 CO 0.31 -1.24 0.00 0.41 -1.08 0.00 0.00 175.30 173.70 1iva n GLY 22 N 3.59 1.68 3.30 3.88 0.00 -1.25 -4.24 105.19 112.15 1iva n GLY 22 Ca 0.16 -1.09 -0.18 0.00 0.00 0.00 0.00 46.02 44.90 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 -2.82 1.62 0.00 1.61 1.70 -0.77 -4.52 118.95 115.77 1iva s ARG 23 Ca 0.00 -1.93 0.00 0.00 -0.47 0.00 0.00 55.73 53.33 1iva s ARG 23 Cb 0.00 0.14 0.00 0.00 -0.57 0.00 0.00 34.95 34.52 1iva s ARG 23 CO 0.00 -0.54 0.00 0.41 -1.08 0.00 0.00 175.30 174.09 1iva n GLY 24 N -0.57 0.45 2.95 3.88 0.00 -1.26 -3.57 105.19 107.07 1iva n GLY 24 Ca 0.04 -0.96 -0.36 0.00 0.00 0.00 0.00 46.02 44.74 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 -1.94 4.80 0.28 0.00 -1.09 -1.25 -4.75 121.20 117.25 1iva s ILE 26 Ca 0.31 0.93 0.07 0.00 -2.23 0.00 0.00 60.65 59.73 1iva s ILE 26 Cb 0.00 -3.76 -0.03 0.00 -1.58 0.00 0.00 42.46 37.09 1iva s ILE 26 CO -0.05 0.25 0.24 0.00 -1.23 0.00 0.00 174.94 174.15 1iva n SER 28 N -1.26 0.00 -2.27 0.00 2.88 -1.26 -4.88 113.62 106.83 1iva n SER 28 Ca -0.06 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.44 1iva n SER 28 Cb 0.58 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 64.06 1iva n SER 28 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 1iva n ILE 29 N -0.60 -4.95 0.00 2.46 -0.00 -1.26 -4.48 119.36 110.54 1iva n ILE 29 Ca 0.00 -0.41 0.00 0.00 -0.00 0.00 0.00 62.75 62.34 1iva n ILE 29 Cb 0.00 -4.81 0.00 0.00 -0.00 0.00 0.00 39.64 34.83 1iva n ILE 29 CO 0.00 0.00 0.00 0.23 -0.00 0.00 0.00 176.55 176.78 1iva n MET 30 N -1.91 0.00 -3.31 0.38 2.81 -1.26 -4.99 117.12 108.84 1iva n MET 30 Ca -0.02 0.00 -0.16 0.00 -1.81 0.00 0.00 57.70 55.71 1iva n MET 30 Cb 0.53 0.00 0.08 0.00 -0.71 0.00 0.00 33.22 33.12 1iva n MET 30 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1iva n GLY 31 N 0.00 -0.29 3.37 3.03 0.00 -1.26 -4.98 105.19 105.05 1iva n GLY 31 Ca 0.00 0.06 -0.45 0.00 0.00 0.00 0.00 46.02 45.63 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 -3.31 5.13 -1.30 2.61 -4.23 -1.26 -4.91 115.64 108.37 1iva s THR 32 Ca 0.12 -1.14 -0.10 0.00 -1.18 0.00 0.00 61.69 59.39 1iva s THR 32 Cb -0.05 -4.27 0.15 0.00 1.34 0.00 0.00 72.50 69.67 1iva s THR 32 CO 0.64 -0.77 1.90 -0.46 -0.54 0.00 0.00 174.62 175.39 1iva n ASN 33 N 5.47 4.90 0.00 3.99 6.94 -1.26 -4.26 115.26 131.05 1iva n ASN 33 Ca -0.12 -3.06 0.00 0.00 -0.02 0.00 0.00 54.58 51.38 1iva n ASN 33 Cb 0.42 -1.52 0.00 0.00 -2.36 0.00 0.00 39.78 36.33 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 -1.88 0.50 -1.03 0.00 2.02 -1.09 -3.22 118.70 114.01 1iva s GLU 35 Ca 0.00 0.29 -0.17 0.00 0.02 0.00 0.00 54.97 55.11 1iva s GLU 35 Cb 0.00 0.24 0.15 0.00 0.10 0.00 0.00 34.13 34.61 1iva s GLU 35 CO 0.00 -0.09 1.23 0.00 0.02 0.00 0.00 175.26 176.42 1iva n LYS 37 N 6.15 0.46 0.00 0.00 4.01 -0.23 -0.72 118.16 127.83 1iva n LYS 37 Ca 0.28 0.17 0.00 0.00 -0.51 0.00 0.00 58.31 58.25 1iva n LYS 37 Cb 0.47 -1.41 0.00 0.00 -0.51 0.00 0.00 35.03 33.58 1iva n LYS 37 CO 0.00 0.00 0.00 -0.35 -1.11 0.00 0.00 177.40 175.94 1iva n PRO 38 N 0.73 0.00 -3.06 1.97 -0.04 -1.26 -1.85 135.00 131.48 1iva n PRO 38 Ca 0.12 0.33 -0.00 0.00 -0.04 0.00 0.00 63.50 63.91 1iva n PRO 38 Cb 0.39 -1.30 -0.00 0.00 -0.04 0.00 0.00 33.50 32.54 1iva n PRO 38 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1iva n ARG 39 N -1.50 -1.37 -3.11 0.54 1.85 -1.26 -4.10 116.66 107.71 1iva n ARG 39 Ca 0.00 1.32 -0.44 0.00 -1.00 0.00 0.00 57.85 57.73 1iva n ARG 39 Cb 0.00 -1.10 -0.06 0.00 -1.05 0.00 0.00 32.46 30.25 1iva n ARG 39 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 177.63 176.45 1iva s LEU 40 N -0.17 4.84 -0.50 2.89 0.20 -1.26 -4.63 118.68 120.05 1iva s LEU 40 Ca -0.02 -0.84 0.08 0.00 0.69 0.00 0.00 54.13 54.05 1iva s LEU 40 Cb 0.00 -2.50 0.29 0.00 -0.43 0.00 0.00 46.19 43.54 1iva s LEU 40 CO 0.05 -0.95 0.71 0.00 -0.29 0.00 0.00 176.35 175.87 1iva n ILE 41 N 5.70 1.00 -1.00 6.68 0.13 -1.26 -4.86 119.36 125.76 1iva n ILE 41 Ca -0.05 -4.77 -0.00 0.00 -1.10 0.00 0.00 62.75 56.83 1iva n ILE 41 Cb 0.46 -1.58 -0.00 0.00 -0.84 0.00 0.00 39.64 37.68 1iva n ILE 41 CO 0.00 0.00 0.00 1.15 2.80 0.00 0.00 176.55 180.50 1iva n MET 42 N 0.73 -1.59 0.00 9.51 0.00 -1.26 -4.94 117.12 119.56 1iva n MET 42 Ca 0.26 0.40 0.16 0.00 0.00 0.00 0.00 57.70 58.52 1iva n MET 42 Cb 0.49 -4.60 0.88 0.00 0.00 0.00 0.00 33.22 30.00 1iva n MET 42 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 1iva n GLU 43 N 0.17 0.87 -0.11 3.17 1.02 -1.26 -2.27 120.64 122.23 1iva n GLU 43 Ca -0.00 -0.03 -0.20 0.00 -0.02 0.00 0.00 57.16 56.90 1iva n GLU 43 Cb 0.40 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 30.24 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 1.08 -0.61 2.60 0.62 0.00 -1.26 -3.87 105.19 103.75 1iva n GLY 44 Ca 0.21 -0.14 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 1iva n GLY 44 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1iva s LEU 45 N -7.77 1.60 0.00 0.99 2.34 -1.25 -4.74 118.68 109.85 1iva s LEU 45 Ca -0.32 -2.02 0.00 0.00 0.06 0.00 0.00 54.13 51.85 1iva s LEU 45 Cb 0.09 -0.65 0.00 0.00 -0.56 0.00 0.00 46.19 45.07 1iva s LEU 45 CO 0.46 -0.34 0.00 0.61 -1.06 0.00 0.00 176.35 176.02 1iva n GLY 46 N 4.30 -1.91 0.13 -3.48 0.00 -1.12 -4.88 105.19 98.23 1iva n GLY 46 Ca 0.05 0.70 -0.11 0.00 0.00 0.00 0.00 46.02 46.66 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 0.37 0.00 0.99 8.10 -1.81 -3.50 115.31 119.46 1iva h LEU 47 Ca 0.00 -0.31 0.00 0.00 0.11 0.00 0.00 57.88 57.68 1iva h LEU 47 Cb 0.00 -0.11 0.00 0.00 -0.44 0.00 0.00 40.66 40.11 1iva h LEU 47 CO 0.00 1.13 0.00 0.00 -4.11 0.00 0.00 178.44 175.46