#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iyt n ALA 2 N 0.00 0.00 -3.89 2.12 0.00 -1.26 -5.06 120.51 112.42 1iyt n ALA 2 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 1iyt n ALA 2 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.46 1iyt n ALA 2 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1iyt n GLU 3 N -3.09 0.99 0.00 0.00 1.02 -1.26 -4.74 120.64 113.57 1iyt n GLU 3 Ca 0.00 -2.47 0.00 0.00 -0.02 0.00 0.00 57.16 54.67 1iyt n GLU 3 Cb 0.00 2.79 0.00 0.00 -0.02 0.00 0.00 31.44 34.21 1iyt n GLU 3 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1iyt n PHE 4 N -0.56 0.00 0.00 -0.32 7.35 -1.26 -3.88 117.46 118.79 1iyt n PHE 4 Ca -0.05 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.64 1iyt n PHE 4 Cb 0.60 -0.62 0.00 0.00 0.35 0.00 0.00 39.48 39.81 1iyt n PHE 4 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1iyt n ARG 5 N -1.83 0.00 -0.17 -4.13 1.74 -1.26 -4.60 116.66 106.41 1iyt n ARG 5 Ca 0.00 0.00 0.11 0.00 -0.77 0.00 0.00 57.85 57.19 1iyt n ARG 5 Cb 0.00 -0.32 0.44 0.00 -1.02 0.00 0.00 32.46 31.56 1iyt n ARG 5 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1iyt h HIS 6 N 0.00 0.61 0.00 -1.55 2.76 -1.85 0.69 115.15 115.80 1iyt h HIS 6 Ca 0.00 0.02 -0.31 0.00 -2.20 0.00 0.00 60.37 57.88 1iyt h HIS 6 Cb 0.46 -0.20 -0.05 0.00 1.55 0.00 0.00 27.41 29.18 1iyt h HIS 6 CO 0.00 0.27 -1.97 -3.47 -1.30 0.00 0.00 177.93 171.46 1iyt n ASP 7 N -4.49 1.94 -0.30 3.26 -0.08 -1.26 -4.46 116.55 111.16 1iyt n ASP 7 Ca 0.13 0.35 0.04 0.00 -1.51 0.00 0.00 54.79 53.80 1iyt n ASP 7 Cb 0.39 -0.81 0.18 0.00 2.34 0.00 0.00 41.12 43.23 1iyt n ASP 7 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 1iyt h SER 8 N -1.00 0.68 -1.17 1.67 4.64 -1.80 0.73 113.55 117.30 1iyt h SER 8 Ca -0.46 0.06 0.35 0.00 -0.47 0.00 0.00 61.79 61.26 1iyt h SER 8 Cb 1.39 -0.07 -0.11 0.00 -0.31 0.00 0.00 62.40 63.29 1iyt h SER 8 CO -0.28 0.37 0.75 1.23 -0.87 0.00 0.00 176.83 178.03 1iyt h GLY 9 N 0.78 1.27 0.00 -0.77 0.00 -1.08 0.28 103.07 103.56 1iyt h GLY 9 Ca 0.42 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.59 1iyt h GLY 9 CO -0.27 -0.28 0.00 2.98 0.00 0.00 0.00 176.54 178.98 1iyt n TYR 10 N -4.67 0.00 -0.35 5.60 9.36 0.21 -4.10 117.16 123.21 1iyt n TYR 10 Ca 0.31 0.00 0.15 0.00 3.32 0.00 0.00 57.90 61.68 1iyt n TYR 10 Cb 1.15 -0.46 0.36 0.00 -0.63 0.00 0.00 39.34 39.75 1iyt n TYR 10 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 1iyt h GLU 11 N 0.00 0.65 -0.46 2.98 5.08 -0.88 -0.44 114.58 121.51 1iyt h GLU 11 Ca 0.00 -0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.36 1iyt h GLU 11 Cb 0.00 -0.15 -0.06 0.00 0.50 0.00 0.00 28.75 29.05 1iyt h GLU 11 CO 0.00 0.43 -0.27 0.28 -1.00 0.00 0.00 179.01 178.45 1iyt n VAL 12 N -4.82 -0.32 -0.05 3.13 0.31 0.91 -1.22 118.33 116.28 1iyt n VAL 12 Ca 0.25 1.64 -0.13 0.00 -0.01 0.00 0.00 64.34 66.09 1iyt n VAL 12 Cb 0.66 -2.08 -0.07 0.00 -0.91 0.00 0.00 33.84 31.44 1iyt n VAL 12 CO 0.00 0.00 0.00 0.45 -1.32 0.00 0.00 176.83 175.96 1iyt h HIS 13 N 0.00 0.46 -1.01 3.52 3.86 -1.23 0.42 115.15 121.17 1iyt h HIS 13 Ca 0.07 -0.14 0.38 0.00 -1.16 0.00 0.00 60.37 59.52 1iyt h HIS 13 Cb 0.19 -0.09 -0.17 0.00 1.06 0.00 0.00 27.41 28.40 1iyt h HIS 13 CO -0.80 0.78 0.56 0.45 0.86 0.00 0.00 177.93 179.78 1iyt h HIS 14 N 0.00 0.87 0.00 2.45 -0.00 -1.13 0.14 115.15 117.48 1iyt h HIS 14 Ca 0.02 0.04 -0.39 0.00 -0.00 0.00 0.00 60.37 60.04 1iyt h HIS 14 Cb 0.72 -0.21 -0.07 0.00 -0.00 0.00 0.00 27.41 27.85 1iyt h HIS 14 CO 0.09 -0.36 -2.41 0.00 -0.00 0.00 0.00 177.93 175.25 1iyt n GLN 15 N -5.17 0.59 -0.19 2.45 -0.00 -0.35 -4.37 117.38 110.33 1iyt n GLN 15 Ca 0.36 0.18 0.11 0.00 -0.00 0.00 0.00 57.00 57.64 1iyt n GLN 15 Cb 1.17 -1.46 0.42 0.00 -0.00 0.00 0.00 30.24 30.37 1iyt n GLN 15 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.06 176.84 1iyt h LYS 16 N -0.32 0.58 0.00 2.61 3.11 0.04 0.32 116.57 122.90 1iyt h LYS 16 Ca -0.58 -0.03 0.00 0.00 -2.81 0.00 0.00 60.65 57.22 1iyt h LYS 16 Cb 1.75 -0.13 0.00 0.00 -1.00 0.00 0.00 32.23 32.85 1iyt h LYS 16 CO -0.19 0.38 0.00 1.25 -2.81 0.00 0.00 179.45 178.08 1iyt h LEU 17 N 0.60 0.00 0.00 5.20 5.85 -0.91 -1.51 115.31 124.55 1iyt h LEU 17 Ca 0.36 0.00 -0.25 0.00 0.84 0.00 0.00 57.88 58.83 1iyt h LEU 17 Cb 0.60 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.59 1iyt h LEU 17 CO -0.13 0.00 -1.77 0.52 -0.34 0.00 0.00 178.44 176.72 1iyt n VAL 18 N -2.51 1.32 -0.12 1.05 0.31 -0.20 -4.37 118.33 113.81 1iyt n VAL 18 Ca 0.02 -0.14 -0.05 0.00 -0.01 0.00 0.00 64.34 64.17 1iyt n VAL 18 Cb 0.30 -1.95 0.02 0.00 -0.91 0.00 0.00 33.84 31.30 1iyt n VAL 18 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 1iyt h PHE 19 N -0.82 -0.12 -0.28 3.52 -1.00 -0.44 0.66 116.94 118.47 1iyt h PHE 19 Ca -0.38 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.43 1iyt h PHE 19 Cb 1.27 0.12 -0.01 0.00 3.61 0.00 0.00 35.95 40.93 1iyt h PHE 19 CO -0.17 -0.13 0.17 0.35 -1.61 0.00 0.00 178.31 176.92 1iyt h PHE 20 N 0.05 0.36 -0.50 -0.55 3.04 -1.49 0.19 116.94 118.03 1iyt h PHE 20 Ca 0.20 0.00 0.05 0.00 3.98 0.00 0.00 57.97 62.19 1iyt h PHE 20 Cb 0.29 -0.12 -0.04 0.00 2.56 0.00 0.00 35.95 38.64 1iyt h PHE 20 CO -0.32 0.25 0.25 0.00 -2.02 0.00 0.00 178.31 176.48 1iyt h ALA 21 N 1.07 0.64 -0.09 2.41 0.00 -1.53 0.50 119.26 122.27 1iyt h ALA 21 Ca 0.10 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1iyt h ALA 21 Cb -0.01 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1iyt h ALA 21 CO -0.02 -0.10 0.00 0.93 0.00 0.00 0.00 179.25 180.06 1iyt h GLU 22 N 0.49 0.03 0.00 0.00 4.39 -0.59 0.23 114.58 119.13 1iyt h GLU 22 Ca 0.22 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.92 1iyt h GLU 22 Cb 0.14 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.78 1iyt h GLU 22 CO -0.16 0.02 -0.02 -0.44 -1.16 0.00 0.00 179.01 177.25 1iyt h ASP 23 N 0.03 0.00 0.00 1.42 5.19 0.37 0.15 116.42 123.59 1iyt h ASP 23 Ca 0.04 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.44 1iyt h ASP 23 Cb 0.04 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.55 1iyt h ASP 23 CO -0.07 0.02 -0.14 0.58 -3.12 0.00 0.00 179.24 176.52 1iyt h VAL 24 N 0.00 0.55 -0.19 -1.35 2.07 -0.76 -3.32 116.25 113.26 1iyt h VAL 24 Ca -0.00 -1.45 0.03 0.00 0.82 0.00 0.00 66.70 66.11 1iyt h VAL 24 Cb 0.05 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 1iyt h VAL 24 CO 0.00 0.19 -0.03 1.23 0.02 0.00 0.00 177.57 178.98 1iyt h GLY 25 N -1.00 0.15 -3.86 2.17 0.00 -0.14 -2.33 103.07 98.05 1iyt h GLY 25 Ca -0.02 0.04 -0.59 0.00 0.00 0.00 0.00 47.33 46.76 1iyt h GLY 25 CO -0.01 -0.06 0.63 1.44 0.00 0.00 0.00 176.54 178.54 1iyt n SER 26 N -5.17 6.06 -2.31 0.19 7.64 0.50 -4.04 113.62 116.49 1iyt n SER 26 Ca -0.03 -3.74 -0.02 0.00 1.01 0.00 0.00 58.87 56.10 1iyt n SER 26 Cb 0.11 -0.87 0.07 0.00 -1.01 0.00 0.00 64.21 62.50 1iyt n SER 26 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1iyt n ASN 27 N -0.98 -0.44 -0.24 6.43 5.15 -0.89 -4.92 115.26 119.38 1iyt n ASN 27 Ca 0.59 -2.11 -0.01 0.00 -0.60 0.00 0.00 54.58 52.45 1iyt n ASN 27 Cb 1.00 0.25 0.11 0.00 -0.53 0.00 0.00 39.78 40.61 1iyt n ASN 27 CO 0.00 0.00 0.00 0.11 1.40 0.00 0.00 177.26 178.77 1iyt h LYS 28 N 1.21 0.67 -1.41 1.20 1.57 -1.68 0.16 116.57 118.29 1iyt h LYS 28 Ca -0.38 -0.04 0.41 0.00 -1.87 0.00 0.00 60.65 58.77 1iyt h LYS 28 Cb 1.37 -0.15 -0.06 0.00 0.08 0.00 0.00 32.23 33.47 1iyt h LYS 28 CO -0.09 0.44 1.04 0.78 -0.57 0.00 0.00 179.45 181.05 1iyt h GLY 29 N 0.69 0.00 0.12 3.86 0.00 -1.93 0.30 103.07 106.10 1iyt h GLY 29 Ca 0.31 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.33 1iyt h GLY 29 CO -0.19 0.00 -1.71 0.00 0.00 0.00 0.00 176.54 174.63 1iyt n ALA 30 N -2.78 0.92 0.25 3.60 0.00 0.44 -4.35 120.51 118.59 1iyt n ALA 30 Ca 0.31 -0.66 0.10 0.00 0.00 0.00 0.00 53.44 53.19 1iyt n ALA 30 Cb 1.49 -0.43 0.65 0.00 0.00 0.00 0.00 19.45 21.16 1iyt n ALA 30 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1iyt h ILE 31 N -0.74 0.81 -2.92 0.00 5.03 -0.12 -3.45 117.51 116.12 1iyt h ILE 31 Ca -0.44 -0.52 -0.46 0.00 -0.12 0.00 0.00 64.86 63.31 1iyt h ILE 31 Cb 1.54 1.31 0.22 0.00 -3.03 0.00 0.00 36.82 36.86 1iyt h ILE 31 CO -0.19 0.13 -0.52 -0.38 -0.68 0.00 0.00 178.15 176.51 1iyt n ILE 32 N -3.96 0.00 0.00 -0.67 5.41 0.95 -3.01 119.36 118.08 1iyt n ILE 32 Ca -0.02 -0.33 0.00 0.00 1.00 0.00 0.00 62.75 63.40 1iyt n ILE 32 Cb 0.23 -0.79 0.00 0.00 -0.71 0.00 0.00 39.64 38.37 1iyt n ILE 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1iyt n GLY 33 N 1.46 2.31 0.27 7.39 0.00 -1.26 -4.24 105.19 111.11 1iyt n GLY 33 Ca 0.03 -0.07 0.11 0.00 0.00 0.00 0.00 46.02 46.09 1iyt n GLY 33 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1iyt h LEU 34 N 0.00 0.00 -0.92 0.99 3.38 -1.90 0.26 115.31 117.12 1iyt h LEU 34 Ca 0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 1iyt h LEU 34 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1iyt h LEU 34 CO 0.00 0.06 -0.28 -0.03 0.09 0.00 0.00 178.44 178.28 1iyt h MET 35 N 0.00 0.45 0.11 1.13 4.05 -1.71 0.32 114.93 119.28 1iyt h MET 35 Ca -0.00 -0.18 -0.31 0.00 -0.28 0.00 0.00 59.70 58.93 1iyt h MET 35 Cb 0.13 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 30.90 1iyt h MET 35 CO 0.01 0.70 -1.56 0.28 0.23 0.00 0.00 176.91 176.56 1iyt h VAL 36 N 0.40 1.11 0.01 -5.77 2.07 -1.14 -3.24 116.25 109.69 1iyt h VAL 36 Ca 0.05 -2.77 -0.03 0.00 0.82 0.00 0.00 66.70 64.77 1iyt h VAL 36 Cb 0.70 2.72 0.00 0.00 -1.52 0.00 0.00 31.29 33.20 1iyt h VAL 36 CO 0.05 0.80 -0.13 1.23 0.02 0.00 0.00 177.57 179.55 1iyt h GLY 37 N 1.78 0.07 2.00 2.17 0.00 -0.60 -3.34 103.07 105.15 1iyt h GLY 37 Ca -0.25 -0.15 -0.03 0.00 0.00 0.00 0.00 47.33 46.90 1iyt h GLY 37 CO 0.15 0.13 -0.14 -1.33 0.00 0.00 0.00 176.54 175.35 1iyt h GLY 38 N -0.80 0.00 1.56 4.60 0.00 -0.53 -0.84 103.07 107.06 1iyt h GLY 38 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.31 1iyt h GLY 38 CO 0.02 0.00 0.00 1.55 0.00 0.00 0.00 176.54 178.11 1iyt n VAL 39 N -4.00 0.01 0.08 4.60 3.14 -1.22 -3.37 118.33 117.57 1iyt n VAL 39 Ca -0.02 0.00 -0.12 0.00 -2.96 0.00 0.00 64.34 61.24 1iyt n VAL 39 Cb 0.23 -0.51 -0.06 0.00 -1.06 0.00 0.00 33.84 32.44 1iyt n VAL 39 CO 0.00 0.00 0.00 0.58 -6.46 0.00 0.00 176.83 170.95 1iyt h VAL 40 N 0.00 0.77 -4.17 1.55 2.07 -1.26 -3.42 116.25 111.78 1iyt h VAL 40 Ca 0.00 0.00 -0.51 0.00 0.82 0.00 0.00 66.70 67.01 1iyt h VAL 40 Cb 0.28 0.77 0.10 0.00 -1.52 0.00 0.00 31.29 30.92 1iyt h VAL 40 CO 0.00 0.00 0.39 -0.51 0.02 0.00 0.00 177.57 177.47 1iyt s ILE 41 N -6.16 3.09 0.00 4.57 2.07 -1.22 -5.17 121.20 118.39 1iyt s ILE 41 Ca -0.14 0.55 0.00 0.00 -1.41 0.00 0.00 60.65 59.65 1iyt s ILE 41 Cb 0.07 -3.10 0.00 0.00 0.13 0.00 0.00 42.46 39.57 1iyt s ILE 41 CO 0.66 -0.27 0.00 0.00 -1.91 0.00 0.00 174.94 173.42