#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 0.19 -0.23 2.24 0.00 -1.26 -4.99 120.51 116.45 1iyt n ALA 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1iyt n ALA 2 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 -2.68 1.41 -0.28 0.00 1.02 -1.26 -4.79 120.64 114.06 1iyt n GLU 3 Ca 0.00 -0.06 0.09 0.00 -0.02 0.00 0.00 57.16 57.17 1iyt n GLU 3 Cb 0.00 -0.34 0.22 0.00 -0.02 0.00 0.00 31.44 31.30 1iyt n GLU 3 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 1iyt h PHE 4 N 0.00 0.15 0.00 -0.32 3.57 -2.02 0.72 116.94 119.05 1iyt h PHE 4 Ca 0.00 0.05 -0.07 0.00 3.53 0.00 0.00 57.97 61.48 1iyt h PHE 4 Cb 0.11 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.91 1iyt h PHE 4 CO 0.00 -0.22 -0.33 -0.09 -2.23 0.00 0.00 178.31 175.44 1iyt h ARG 5 N 0.16 0.00 0.00 1.11 2.43 -1.99 -3.43 114.38 112.66 1iyt h ARG 5 Ca 0.48 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.65 1iyt h ARG 5 Cb 0.90 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.45 1iyt h ARG 5 CO -0.65 0.33 0.00 1.58 -1.51 0.00 0.00 179.97 179.72 1iyt n HIS 6 N -3.80 0.00 -2.99 2.20 -0.00 0.25 -4.78 115.22 106.09 1iyt n HIS 6 Ca -0.01 0.00 -0.22 0.00 0.46 0.00 0.00 57.72 57.95 1iyt n HIS 6 Cb 0.41 0.00 0.02 0.00 -0.12 0.00 0.00 29.99 30.30 1iyt n HIS 6 CO 0.00 0.00 0.00 -3.47 0.46 0.00 0.00 176.34 173.33 1iyt n ASP 7 N 0.00 -5.49 0.23 0.26 2.03 -1.25 -4.90 116.55 107.42 1iyt n ASP 7 Ca 0.00 -0.25 -0.10 0.00 0.52 0.00 0.00 54.79 54.96 1iyt n ASP 7 Cb 0.00 -4.48 -0.05 0.00 -0.72 0.00 0.00 41.12 35.88 1iyt n ASP 7 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1iyt h SER 8 N -1.09 -0.53 -1.10 1.67 4.64 -1.93 -0.73 113.55 114.48 1iyt h SER 8 Ca -0.49 0.02 0.31 0.00 -0.47 0.00 0.00 61.79 61.16 1iyt h SER 8 Cb 1.34 0.14 -0.06 0.00 -0.31 0.00 0.00 62.40 63.51 1iyt h SER 8 CO 0.55 -0.17 0.77 1.23 -0.87 0.00 0.00 176.83 178.35 1iyt h GLY 9 N -1.05 0.28 0.22 -0.77 0.00 -2.00 0.18 103.07 99.93 1iyt h GLY 9 Ca -0.06 -0.05 -0.01 0.00 0.00 0.00 0.00 47.33 47.21 1iyt h GLY 9 CO 0.11 -0.03 -0.10 -1.82 0.00 0.00 0.00 176.54 174.69 1iyt h TYR 10 N 0.09 -0.27 -0.89 5.60 3.20 -1.93 -3.34 116.97 119.44 1iyt h TYR 10 Ca 0.55 -0.01 0.24 0.00 3.14 0.00 0.00 58.73 62.65 1iyt h TYR 10 Cb 1.99 0.09 -0.15 0.00 1.54 0.00 0.00 36.73 40.20 1iyt h TYR 10 CO -0.00 -0.17 0.21 0.93 -1.64 0.00 0.00 178.16 177.49 1iyt h GLU 11 N -0.60 0.17 -0.66 1.82 5.08 0.02 -0.94 114.58 119.48 1iyt h GLU 11 Ca -0.03 -0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.38 1iyt h GLU 11 Cb 0.22 -0.04 -0.08 0.00 0.50 0.00 0.00 28.75 29.35 1iyt h GLU 11 CO 0.05 0.11 -0.39 0.28 -1.00 0.00 0.00 179.01 178.06 1iyt n VAL 12 N -5.26 -0.45 -0.05 3.13 0.31 0.52 -1.03 118.33 115.50 1iyt n VAL 12 Ca 0.22 1.89 -0.14 0.00 -0.01 0.00 0.00 64.34 66.30 1iyt n VAL 12 Cb 0.70 -2.37 -0.07 0.00 -0.91 0.00 0.00 33.84 31.19 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 0.52 -0.90 3.52 3.86 -1.30 0.51 115.15 121.35 1iyt h HIS 13 Ca 0.11 -0.18 0.25 0.00 -1.16 0.00 0.00 60.37 59.39 1iyt h HIS 13 Cb 0.27 -0.10 -0.14 0.00 1.06 0.00 0.00 27.41 28.50 1iyt h HIS 13 CO -0.87 0.86 0.30 0.45 0.86 0.00 0.00 177.93 179.53 1iyt h HIS 14 N 0.02 0.46 0.11 2.45 -0.00 -1.03 0.19 115.15 117.35 1iyt h HIS 14 Ca 0.01 0.05 -0.36 0.00 -0.00 0.00 0.00 60.37 60.07 1iyt h HIS 14 Cb 0.82 -0.06 -0.02 0.00 -0.00 0.00 0.00 27.41 28.14 1iyt h HIS 14 CO 0.10 -0.20 -2.01 0.00 -0.00 0.00 0.00 177.93 175.82 1iyt n GLN 15 N -5.19 0.74 0.25 2.45 10.64 -0.20 -4.25 117.38 121.82 1iyt n GLN 15 Ca 0.23 0.26 0.08 0.00 -1.83 0.00 0.00 57.00 55.73 1iyt n GLN 15 Cb 0.73 -1.70 0.60 0.00 -0.86 0.00 0.00 30.24 29.02 1iyt n GLN 15 CO 0.00 0.00 0.00 1.57 -1.83 0.00 0.00 177.06 176.80 1iyt h LYS 16 N 0.06 0.00 0.00 2.61 5.09 0.73 0.57 116.57 125.63 1iyt h LYS 16 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.31 1iyt h LYS 16 Cb 2.03 0.00 0.00 0.00 0.10 0.00 0.00 32.23 34.36 1iyt h LYS 16 CO 0.08 0.10 0.00 -0.11 -2.09 0.00 0.00 179.45 177.42 1iyt n LEU 17 N -4.31 0.07 -0.03 7.07 0.00 -0.01 -2.11 117.00 117.68 1iyt n LEU 17 Ca -0.03 0.51 -0.06 0.00 0.00 0.00 0.00 56.01 56.44 1iyt n LEU 17 Cb 0.17 -0.49 -0.02 0.00 0.00 0.00 0.00 43.42 43.08 1iyt n LEU 17 CO 0.34 -0.11 -0.41 0.52 0.00 0.00 0.00 177.39 177.73 1iyt n VAL 18 N -1.57 1.30 -0.39 1.96 0.31 0.19 -4.53 118.33 115.60 1iyt n VAL 18 Ca 0.06 0.22 -0.03 0.00 -0.01 0.00 0.00 64.34 64.58 1iyt n VAL 18 Cb 0.29 -1.94 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 0.33 -1.32 0.00 0.00 176.83 175.84 1iyt n PHE 19 N -3.94 -0.05 -0.08 3.52 7.35 0.17 -0.72 117.46 123.72 1iyt n PHE 19 Ca -0.09 1.22 -0.09 0.00 -0.76 0.00 0.00 57.45 57.73 1iyt n PHE 19 Cb 0.31 -0.82 -0.01 0.00 0.35 0.00 0.00 39.48 39.30 1iyt n PHE 19 CO 0.00 0.00 0.00 0.35 -0.76 0.00 0.00 176.76 176.35 1iyt h PHE 20 N 0.00 0.31 -0.55 -5.13 3.57 -1.62 0.33 116.94 113.85 1iyt h PHE 20 Ca 0.31 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.85 1iyt h PHE 20 Cb 0.56 -0.10 -0.04 0.00 2.79 0.00 0.00 35.95 39.17 1iyt h PHE 20 CO -0.89 0.18 0.34 0.00 -2.23 0.00 0.00 178.31 175.71 1iyt h ALA 21 N 1.13 0.71 -0.63 2.41 0.00 -1.51 0.52 119.26 121.88 1iyt h ALA 21 Ca 0.11 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1iyt h ALA 21 Cb -0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 1iyt h ALA 21 CO -0.05 0.06 0.33 0.93 0.00 0.00 0.00 179.25 180.52 1iyt h GLU 22 N 0.67 0.88 -0.34 0.00 4.39 -0.26 0.24 114.58 120.16 1iyt h GLU 22 Ca 0.22 -0.11 -0.03 0.00 0.34 0.00 0.00 59.36 59.78 1iyt h GLU 22 Cb 0.01 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.48 1iyt h GLU 22 CO -0.09 0.68 0.08 0.22 -1.16 0.00 0.00 179.01 178.73 1iyt h ASP 23 N 0.86 0.51 0.69 1.42 3.58 0.38 0.15 116.42 124.01 1iyt h ASP 23 Ca 0.22 -0.24 -0.03 0.00 0.42 0.00 0.00 57.03 57.40 1iyt h ASP 23 Cb 0.06 -0.14 0.01 0.00 1.72 0.00 0.00 39.33 40.98 1iyt h ASP 23 CO -0.03 0.62 -0.33 0.58 -2.88 0.00 0.00 179.24 177.19 1iyt h VAL 24 N 0.39 0.27 -0.47 2.25 2.07 -0.87 -3.19 116.25 116.70 1iyt h VAL 24 Ca 0.10 -0.14 0.07 0.00 0.82 0.00 0.00 66.70 67.56 1iyt h VAL 24 Cb 0.31 0.31 -0.06 0.00 -1.52 0.00 0.00 31.29 30.33 1iyt h VAL 24 CO 0.00 0.02 0.11 1.23 0.02 0.00 0.00 177.57 178.95 1iyt h GLY 25 N -1.03 0.59 -1.44 2.17 0.00 -0.27 -0.21 103.07 102.87 1iyt h GLY 25 Ca -0.09 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.19 1iyt h GLY 25 CO 0.15 -0.04 0.00 1.44 0.00 0.00 0.00 176.54 178.10 1iyt n SER 26 N -5.08 2.00 -2.69 0.19 7.64 0.51 -3.41 113.62 112.78 1iyt n SER 26 Ca 0.05 -2.19 -0.07 0.00 1.01 0.00 0.00 58.87 57.67 1iyt n SER 26 Cb 0.22 -0.42 0.05 0.00 -1.01 0.00 0.00 64.21 63.05 1iyt n SER 26 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1iyt n ASN 27 N 0.17 0.72 -0.24 6.43 3.02 -0.10 -4.91 115.26 120.35 1iyt n ASN 27 Ca 0.08 -2.56 0.03 0.00 -0.03 0.00 0.00 54.58 52.10 1iyt n ASN 27 Cb 0.42 -0.19 0.16 0.00 -0.61 0.00 0.00 39.78 39.56 1iyt n ASN 27 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 1iyt h LYS 28 N 2.69 0.41 -1.32 3.52 1.57 -1.55 0.19 116.57 122.08 1iyt h LYS 28 Ca -0.15 -0.02 0.38 0.00 -1.87 0.00 0.00 60.65 58.99 1iyt h LYS 28 Cb 1.22 -0.09 -0.07 0.00 0.08 0.00 0.00 32.23 33.37 1iyt h LYS 28 CO 0.33 0.27 0.93 0.78 -0.57 0.00 0.00 179.45 181.19 1iyt h GLY 29 N 0.42 0.34 0.00 3.86 0.00 -1.90 0.42 103.07 106.21 1iyt h GLY 29 Ca 0.38 -0.04 -0.24 0.00 0.00 0.00 0.00 47.33 47.42 1iyt h GLY 29 CO -0.38 -0.07 -1.43 0.00 0.00 0.00 0.00 176.54 174.66 1iyt n ALA 30 N -2.72 0.83 1.30 3.60 0.00 0.49 -4.38 120.51 119.63 1iyt n ALA 30 Ca 0.30 -0.63 0.11 0.00 0.00 0.00 0.00 53.44 53.23 1iyt n ALA 30 Cb 1.35 -0.31 0.64 0.00 0.00 0.00 0.00 19.45 21.14 1iyt n ALA 30 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1iyt n ILE 31 N -4.42 0.12 -0.83 0.00 -0.00 -0.11 -4.88 119.36 109.24 1iyt n ILE 31 Ca -0.33 0.03 -0.30 0.00 -0.00 0.00 0.00 62.75 62.15 1iyt n ILE 31 Cb 0.66 -0.66 0.03 0.00 -0.00 0.00 0.00 39.64 39.67 1iyt n ILE 31 CO 0.00 0.00 0.00 -0.38 -0.00 0.00 0.00 176.55 176.17 1iyt n ILE 32 N -1.12 0.00 0.00 1.39 5.41 0.14 -2.95 119.36 122.23 1iyt n ILE 32 Ca 0.15 -0.41 0.00 0.00 1.00 0.00 0.00 62.75 63.49 1iyt n ILE 32 Cb 0.12 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.05 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 2.84 2.34 0.28 7.39 0.00 -1.26 -4.38 105.19 112.41 1iyt n GLY 33 Ca -0.01 -0.12 0.04 0.00 0.00 0.00 0.00 46.02 45.93 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 0.30 -1.46 0.99 3.38 -1.97 0.21 115.31 116.76 1iyt h LEU 34 Ca 0.00 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 1iyt h LEU 34 Cb 0.00 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1iyt h LEU 34 CO 0.00 0.29 -0.25 -0.03 0.09 0.00 0.00 178.44 178.54 1iyt h MET 35 N 0.34 0.00 0.08 1.13 4.05 -1.73 0.25 114.93 119.05 1iyt h MET 35 Ca 0.09 0.00 -0.31 0.00 -0.28 0.00 0.00 59.70 59.19 1iyt h MET 35 Cb 0.08 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 30.86 1iyt h MET 35 CO -0.01 0.25 -1.69 0.28 0.23 0.00 0.00 176.91 175.98 1iyt h VAL 36 N 0.00 0.94 0.01 -5.77 2.07 -1.14 -3.32 116.25 109.04 1iyt h VAL 36 Ca -0.00 -2.67 -0.01 0.00 0.82 0.00 0.00 66.70 64.83 1iyt h VAL 36 Cb 0.56 2.59 0.00 0.00 -1.52 0.00 0.00 31.29 32.92 1iyt h VAL 36 CO 0.03 0.74 -0.05 1.23 0.02 0.00 0.00 177.57 179.54 1iyt h GLY 37 N 2.17 0.03 2.00 2.17 0.00 -0.45 -3.37 103.07 105.62 1iyt h GLY 37 Ca -0.29 -0.06 -0.11 0.00 0.00 0.00 0.00 47.33 46.86 1iyt h GLY 37 CO 0.12 0.06 -0.55 -1.33 0.00 0.00 0.00 176.54 174.84 1iyt h GLY 38 N -0.85 0.00 2.00 4.60 0.00 -0.71 -3.21 103.07 104.90 1iyt h GLY 38 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1iyt h GLY 38 CO 0.01 0.00 0.00 1.55 0.00 0.00 0.00 176.54 178.10 1iyt n VAL 39 N -3.38 1.23 -0.25 4.60 3.14 -1.25 -0.90 118.33 121.52 1iyt n VAL 39 Ca 0.01 0.43 0.19 0.00 -2.96 0.00 0.00 64.34 62.01 1iyt n VAL 39 Cb 0.69 -1.35 0.51 0.00 -1.06 0.00 0.00 33.84 32.62 1iyt n VAL 39 CO 0.00 0.00 0.00 1.62 -6.46 0.00 0.00 176.83 171.99 1iyt h VAL 40 N 0.00 0.66 -1.73 1.55 3.04 -1.77 -3.40 116.25 114.60 1iyt h VAL 40 Ca 0.00 -0.14 -0.46 0.00 -1.01 0.00 0.00 66.70 65.09 1iyt h VAL 40 Cb 0.15 0.22 -0.01 0.00 -2.01 0.00 0.00 31.29 29.64 1iyt h VAL 40 CO 0.00 0.08 -0.36 -0.63 -1.01 0.00 0.00 177.57 175.64 1iyt s ILE 41 N -5.44 3.62 0.00 3.17 -1.09 -0.08 -5.22 121.20 116.17 1iyt s ILE 41 Ca -0.08 -1.14 0.00 0.00 -2.23 0.00 0.00 60.65 57.20 1iyt s ILE 41 Cb 0.23 -3.24 0.00 0.00 -1.58 0.00 0.00 42.46 37.87 1iyt s ILE 41 CO 0.78 -0.12 0.00 0.00 -1.23 0.00 0.00 174.94 174.37