#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 -1.60 -0.51 2.24 0.00 -1.26 -4.94 120.51 114.44 1iyt n ALA 2 Ca 0.00 -1.26 0.00 0.00 0.00 0.00 0.00 53.44 52.18 1iyt n ALA 2 Cb 0.00 -1.57 0.00 0.00 0.00 0.00 0.00 19.45 17.88 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 1.38 0.00 -0.18 0.00 4.71 -1.26 -4.82 120.64 120.48 1iyt n GLU 3 Ca 0.07 0.00 0.07 0.00 -0.01 0.00 0.00 57.16 57.29 1iyt n GLU 3 Cb 0.65 -3.73 0.36 0.00 -1.01 0.00 0.00 31.44 27.72 1iyt n GLU 3 CO 0.00 0.00 0.00 0.74 0.09 0.00 0.00 177.13 177.96 1iyt h PHE 4 N 0.00 0.75 0.32 -0.32 -1.00 -1.97 -1.80 116.94 112.91 1iyt h PHE 4 Ca 0.00 0.02 -0.02 0.00 2.81 0.00 0.00 57.97 60.78 1iyt h PHE 4 Cb 0.00 -0.25 0.00 0.00 3.61 0.00 0.00 35.95 39.32 1iyt h PHE 4 CO 0.00 0.39 -0.15 0.07 -1.61 0.00 0.00 178.31 177.01 1iyt h ARG 5 N 0.74 -0.41 -2.05 1.51 0.11 -1.94 0.25 114.38 112.58 1iyt h ARG 5 Ca 0.31 0.03 -0.05 0.00 0.10 0.00 0.00 59.98 60.36 1iyt h ARG 5 Cb 0.27 0.09 -0.02 0.00 1.11 0.00 0.00 29.97 31.42 1iyt h ARG 5 CO -0.10 -0.14 -0.08 0.72 0.10 0.00 0.00 179.97 180.47 1iyt n HIS 6 N -5.18 0.00 0.00 4.08 8.25 -0.70 -2.96 115.22 118.71 1iyt n HIS 6 Ca -0.10 -0.97 0.00 0.00 -0.26 0.00 0.00 57.72 56.39 1iyt n HIS 6 Cb 0.25 -0.77 0.00 0.00 1.12 0.00 0.00 29.99 30.59 1iyt n HIS 6 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1iyt n ASP 7 N 1.91 0.00 -0.19 0.41 -0.08 -1.08 -4.98 116.55 112.55 1iyt n ASP 7 Ca 0.12 0.00 -0.02 0.00 -1.51 0.00 0.00 54.79 53.38 1iyt n ASP 7 Cb 0.53 0.06 0.09 0.00 2.34 0.00 0.00 41.12 44.14 1iyt n ASP 7 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 1iyt h SER 8 N 0.00 0.30 0.08 1.67 0.02 -0.84 0.25 113.55 115.02 1iyt h SER 8 Ca 0.00 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1iyt h SER 8 Cb 0.00 0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.55 1iyt h SER 8 CO 0.00 0.19 0.00 1.23 -1.14 0.00 0.00 176.83 177.11 1iyt h GLY 9 N 0.46 0.00 0.00 -3.77 0.00 -0.55 0.44 103.07 99.65 1iyt h GLY 9 Ca 0.27 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.56 1iyt h GLY 9 CO -0.24 0.00 -0.57 -1.82 0.00 0.00 0.00 176.54 173.91 1iyt h TYR 10 N 0.00 0.00 0.00 5.60 3.20 -1.01 -3.40 116.97 121.35 1iyt h TYR 10 Ca 0.00 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 1iyt h TYR 10 Cb 0.04 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.31 1iyt h TYR 10 CO 0.00 0.30 -0.04 0.93 -1.64 0.00 0.00 178.16 177.71 1iyt h GLU 11 N -1.00 0.00 0.00 1.82 4.39 -0.26 -3.34 114.58 116.19 1iyt h GLU 11 Ca -0.06 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.64 1iyt h GLU 11 Cb 0.60 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.25 1iyt h GLU 11 CO -0.04 0.04 0.00 1.55 -1.16 0.00 0.00 179.01 179.40 1iyt n VAL 12 N -3.44 0.00 -0.26 3.13 3.14 0.15 -2.39 118.33 118.66 1iyt n VAL 12 Ca -0.02 0.72 0.05 0.00 -2.96 0.00 0.00 64.34 62.13 1iyt n VAL 12 Cb 0.15 -1.50 0.19 0.00 -1.06 0.00 0.00 33.84 31.62 1iyt n VAL 12 CO 0.00 0.00 0.00 0.45 -6.46 0.00 0.00 176.83 170.82 1iyt h HIS 13 N 0.00 0.55 -0.93 1.45 3.86 -1.84 0.52 115.15 118.75 1iyt h HIS 13 Ca 0.00 0.04 0.36 0.00 -1.16 0.00 0.00 60.37 59.61 1iyt h HIS 13 Cb 0.00 -0.13 -0.17 0.00 1.06 0.00 0.00 27.41 28.18 1iyt h HIS 13 CO 0.00 0.08 0.41 0.72 0.86 0.00 0.00 177.93 180.00 1iyt n HIS 14 N -4.98 0.99 -0.11 2.45 -0.00 -1.22 -0.29 115.22 112.06 1iyt n HIS 14 Ca 0.15 1.10 -0.20 0.00 -0.00 0.00 0.00 57.72 58.76 1iyt n HIS 14 Cb 0.42 -1.44 -0.09 0.00 -0.00 0.00 0.00 29.99 28.88 1iyt n HIS 14 CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 176.34 177.28 1iyt n GLN 15 N -5.15 0.49 -0.32 -0.41 0.00 0.19 -4.42 117.38 107.76 1iyt n GLN 15 Ca 0.33 0.17 0.29 0.00 -0.00 0.00 0.00 57.00 57.79 1iyt n GLN 15 Cb 1.10 -1.35 0.54 0.00 0.00 0.00 0.00 30.24 30.54 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 -0.48 0.03 -0.06 3.69 1.63 0.21 0.28 116.57 121.87 1iyt h LYS 16 Ca -0.53 -0.00 -0.16 0.00 -0.85 0.00 0.00 60.65 59.11 1iyt h LYS 16 Cb 1.59 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 33.20 1iyt h LYS 16 CO -0.24 0.02 -0.66 1.25 -3.45 0.00 0.00 179.45 176.37 1iyt h LEU 17 N 0.03 0.27 0.36 5.20 6.46 -0.87 0.85 115.31 127.62 1iyt h LEU 17 Ca 0.80 -0.17 -0.02 0.00 -0.12 0.00 0.00 57.88 58.38 1iyt h LEU 17 Cb 2.06 -0.08 0.00 0.00 -0.73 0.00 0.00 40.66 41.91 1iyt h LEU 17 CO -0.78 0.86 -0.17 0.58 -0.62 0.00 0.00 178.44 178.31 1iyt h VAL 18 N 0.17 0.21 -0.24 1.05 2.07 -0.87 -2.98 116.25 115.66 1iyt h VAL 18 Ca -0.01 -0.70 0.06 0.00 0.82 0.00 0.00 66.70 66.87 1iyt h VAL 18 Cb 1.19 0.35 -0.07 0.00 -1.52 0.00 0.00 31.29 31.24 1iyt h VAL 18 CO 0.10 0.05 -0.32 0.15 0.02 0.00 0.00 177.57 177.58 1iyt h PHE 19 N -1.07 -0.88 0.03 1.57 3.57 -0.53 0.62 116.94 120.25 1iyt h PHE 19 Ca -0.05 0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 1iyt h PHE 19 Cb 0.46 0.42 0.00 0.00 2.79 0.00 0.00 35.95 39.62 1iyt h PHE 19 CO 0.02 -0.39 -0.02 0.35 -2.23 0.00 0.00 178.31 176.05 1iyt h PHE 20 N -0.33 -0.04 -0.63 0.41 3.57 -0.97 0.24 116.94 119.18 1iyt h PHE 20 Ca 0.13 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.74 1iyt h PHE 20 Cb 0.54 0.01 -0.08 0.00 2.79 0.00 0.00 35.95 39.21 1iyt h PHE 20 CO -0.46 0.04 0.21 0.00 -2.23 0.00 0.00 178.31 175.87 1iyt h ALA 21 N 0.84 0.81 0.07 2.41 0.00 -1.32 0.12 119.26 122.20 1iyt h ALA 21 Ca -0.00 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1iyt h ALA 21 Cb 0.11 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1iyt h ALA 21 CO 0.01 -0.23 -0.06 0.93 0.00 0.00 0.00 179.25 179.89 1iyt h GLU 22 N 0.37 -0.14 0.00 0.00 4.39 -0.39 0.25 114.58 119.05 1iyt h GLU 22 Ca 0.33 0.01 0.00 0.00 0.34 0.00 0.00 59.36 60.04 1iyt h GLU 22 Cb 0.46 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.14 1iyt h GLU 22 CO -0.36 -0.09 0.00 0.22 -1.16 0.00 0.00 179.01 177.62 1iyt h ASP 23 N -0.15 0.00 0.00 1.42 -0.00 0.74 0.16 116.42 118.60 1iyt h ASP 23 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 57.03 57.00 1iyt h ASP 23 Cb 0.14 0.00 -0.00 0.00 -0.00 0.00 0.00 39.33 39.46 1iyt h ASP 23 CO -0.01 0.00 -0.42 0.58 -0.00 0.00 0.00 179.24 179.38 1iyt h VAL 24 N 0.00 0.25 -0.12 2.25 2.07 -0.65 -3.37 116.25 116.67 1iyt h VAL 24 Ca 0.00 -1.25 0.03 0.00 0.82 0.00 0.00 66.70 66.30 1iyt h VAL 24 Cb 0.29 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 30.56 1iyt h VAL 24 CO 0.00 0.08 -0.09 1.23 0.02 0.00 0.00 177.57 178.81 1iyt h GLY 25 N -1.00 0.01 -3.13 2.17 0.00 -0.00 -0.24 103.07 100.88 1iyt h GLY 25 Ca -0.05 0.11 -0.28 0.00 0.00 0.00 0.00 47.33 47.12 1iyt h GLY 25 CO -0.03 -0.11 0.36 1.44 0.00 0.00 0.00 176.54 178.21 1iyt n SER 26 N -5.23 4.11 -1.39 0.19 7.64 0.52 -3.57 113.62 115.88 1iyt n SER 26 Ca -0.03 -2.88 -0.03 0.00 1.01 0.00 0.00 58.87 56.93 1iyt n SER 26 Cb 0.16 -0.76 -0.02 0.00 -1.01 0.00 0.00 64.21 62.58 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 -0.20 -0.36 -0.32 6.43 5.15 -0.14 -4.94 115.26 120.88 1iyt n ASN 27 Ca 0.31 -2.02 -0.04 0.00 -0.60 0.00 0.00 54.58 52.23 1iyt n ASN 27 Cb 0.98 0.13 0.08 0.00 -0.53 0.00 0.00 39.78 40.45 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 0.50 1.17 -1.40 1.20 1.57 -1.52 0.92 116.57 119.01 1iyt h LYS 28 Ca -0.44 -0.09 0.41 0.00 -1.87 0.00 0.00 60.65 58.65 1iyt h LYS 28 Cb 1.53 -0.25 -0.07 0.00 0.08 0.00 0.00 32.23 33.52 1iyt h LYS 28 CO -0.15 0.80 0.99 0.78 -0.57 0.00 0.00 179.45 181.31 1iyt h GLY 29 N 1.19 0.23 0.18 3.86 0.00 -1.91 0.31 103.07 106.93 1iyt h GLY 29 Ca 0.31 -0.03 -0.31 0.00 0.00 0.00 0.00 47.33 47.31 1iyt h GLY 29 CO -0.06 -0.05 -1.68 0.00 0.00 0.00 0.00 176.54 174.75 1iyt n ALA 30 N -2.76 0.89 0.28 3.60 0.00 0.22 -4.27 120.51 118.46 1iyt n ALA 30 Ca 0.32 -0.62 0.15 0.00 0.00 0.00 0.00 53.44 53.29 1iyt n ALA 30 Cb 1.44 -0.50 0.83 0.00 0.00 0.00 0.00 19.45 21.22 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 -0.64 0.42 -2.72 0.00 5.03 -0.27 -3.45 117.51 115.88 1iyt h ILE 31 Ca -0.42 -0.37 -0.46 0.00 -0.12 0.00 0.00 64.86 63.49 1iyt h ILE 31 Cb 1.58 1.26 0.23 0.00 -3.03 0.00 0.00 36.82 36.86 1iyt h ILE 31 CO -0.14 0.07 -0.69 -0.38 -0.68 0.00 0.00 178.15 176.33 1iyt n ILE 32 N -3.54 0.00 0.00 -0.67 5.41 0.10 -3.09 119.36 117.57 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 0.20 -0.73 0.00 0.00 -0.71 0.00 0.00 39.64 38.39 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 1.64 2.31 0.26 7.39 0.00 -1.26 -4.22 105.19 111.31 1iyt n GLY 33 Ca 0.02 -0.09 0.10 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.58 0.99 3.38 -1.91 0.28 115.31 117.48 1iyt h LEU 34 Ca 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1iyt h LEU 34 Cb 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1iyt h LEU 34 CO 0.00 0.08 0.24 -0.03 0.09 0.00 0.00 178.44 178.82 1iyt h MET 35 N 0.00 0.85 0.07 1.13 4.05 -1.71 0.32 114.93 119.64 1iyt h MET 35 Ca -0.00 -0.15 -0.24 0.00 -0.28 0.00 0.00 59.70 59.03 1iyt h MET 35 Cb 0.17 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 30.82 1iyt h MET 35 CO 0.01 0.73 -1.10 0.28 0.23 0.00 0.00 176.91 177.06 1iyt h VAL 36 N 0.79 1.54 0.16 -5.77 2.07 -1.19 -3.13 116.25 110.72 1iyt h VAL 36 Ca 0.19 -3.01 -0.30 0.00 0.82 0.00 0.00 66.70 64.40 1iyt h VAL 36 Cb 0.18 2.80 0.01 0.00 -1.52 0.00 0.00 31.29 32.76 1iyt h VAL 36 CO -0.02 0.88 -1.50 1.23 0.02 0.00 0.00 177.57 178.18 1iyt h GLY 37 N 1.90 0.38 0.98 2.17 0.00 -0.53 -3.37 103.07 104.60 1iyt h GLY 37 Ca -0.09 -0.98 -0.08 0.00 0.00 0.00 0.00 47.33 46.19 1iyt h GLY 37 CO 0.17 0.86 -0.04 -1.33 0.00 0.00 0.00 176.54 176.20 1iyt h GLY 38 N 0.27 0.84 2.00 4.60 0.00 -0.49 -3.09 103.07 107.20 1iyt h GLY 38 Ca -0.30 -0.65 0.00 0.00 0.00 0.00 0.00 47.33 46.38 1iyt h GLY 38 CO 0.13 0.59 0.00 -0.24 0.00 0.00 0.00 176.54 177.03 1iyt h VAL 39 N 0.60 0.00 -0.94 4.60 3.04 -1.70 -1.66 116.25 120.19 1iyt h VAL 39 Ca 0.11 -0.11 0.24 0.00 -1.01 0.00 0.00 66.70 65.94 1iyt h VAL 39 Cb 0.55 1.05 -0.13 0.00 -2.01 0.00 0.00 31.29 30.75 1iyt h VAL 39 CO 0.03 0.00 0.46 0.58 -1.01 0.00 0.00 177.57 177.63 1iyt h VAL 40 N 0.00 0.45 -2.06 1.51 2.07 -1.70 -3.40 116.25 113.11 1iyt h VAL 40 Ca 0.00 -0.14 -0.56 0.00 0.82 0.00 0.00 66.70 66.82 1iyt h VAL 40 Cb 0.11 -0.01 -0.09 0.00 -1.52 0.00 0.00 31.29 29.78 1iyt h VAL 40 CO 0.00 0.08 -0.61 -0.63 0.02 0.00 0.00 177.57 176.43 1iyt s ILE 41 N -5.82 3.21 0.00 4.57 1.09 -0.62 -5.18 121.20 118.44 1iyt s ILE 41 Ca -0.11 -1.85 0.00 0.00 -1.10 0.00 0.00 60.65 57.59 1iyt s ILE 41 Cb 0.27 -2.89 0.00 0.00 -1.06 0.00 0.00 42.46 38.78 1iyt s ILE 41 CO 0.78 -0.29 0.00 0.00 -0.10 0.00 0.00 174.94 175.33