#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yl3 n LYS 2 N 0.00 0.00 0.00 2.12 5.02 -1.26 -4.87 118.16 119.17 1yl3 n LYS 2 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1yl3 n LYS 2 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1yl3 n LYS 2 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1yl3 n ARG 3 N 0.25 0.00 0.00 1.97 3.00 -1.26 -5.00 116.66 115.62 1yl3 n ARG 3 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.84 1yl3 n ARG 3 Cb 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 32.46 32.04 1yl3 n ARG 3 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 1yl3 n THR 4 N -0.03 0.00 0.32 0.55 -1.04 -1.26 -5.01 114.28 107.81 1yl3 n THR 4 Ca 0.00 0.00 0.15 0.00 -2.04 0.00 0.00 64.05 62.16 1yl3 n THR 4 Cb 0.00 0.00 0.60 0.00 -1.82 0.00 0.00 70.33 69.11 1yl3 n THR 4 CO 0.00 0.00 0.00 1.88 -0.64 0.00 0.00 175.07 176.31 1yl3 h TYR 5 N 0.00 0.00 0.00 -1.42 -1.99 -2.01 -3.46 116.97 108.09 1yl3 h TYR 5 Ca 0.00 0.00 -0.57 0.00 2.00 0.00 0.00 58.73 60.16 1yl3 h TYR 5 Cb 0.00 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 38.69 1yl3 h TYR 5 CO 0.00 0.00 1.13 1.04 -0.00 0.00 0.00 178.16 180.33 1yl3 n GLN 6 N -2.83 0.00 -2.71 4.88 3.00 -1.26 -4.80 117.38 113.66 1yl3 n GLN 6 Ca 0.01 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.58 1yl3 n GLN 6 Cb 0.30 -1.19 -0.03 0.00 0.00 0.00 0.00 30.24 29.32 1yl3 n GLN 6 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 1yl3 s PRO 7 N 5.29 4.13 -0.68 -1.09 0.04 -1.26 -5.00 135.00 136.43 1yl3 s PRO 7 Ca 0.98 1.11 -0.07 0.00 0.04 0.00 0.00 61.00 63.06 1yl3 s PRO 7 Cb -1.15 -3.69 0.18 0.00 0.04 0.00 0.00 34.50 29.87 1yl3 s PRO 7 CO 0.50 -0.74 0.53 -0.80 0.04 0.00 0.00 177.00 176.53 1yl3 s ASN 8 N 1.46 5.73 0.00 6.66 0.01 -1.26 -4.96 114.94 122.58 1yl3 s ASN 8 Ca 0.42 -2.75 0.00 0.00 -0.71 0.00 0.00 52.86 49.82 1yl3 s ASN 8 Cb -0.14 -1.97 0.00 0.00 0.41 0.00 0.00 41.25 39.55 1yl3 s ASN 8 CO 0.11 -0.45 0.21 0.59 -1.51 0.00 0.00 177.10 176.05 1yl3 n ASN 9 N 3.71 0.00 0.00 -1.22 3.02 -1.26 0.23 115.26 119.74 1yl3 n ASN 9 Ca 0.09 0.21 0.00 0.00 -0.03 0.00 0.00 54.58 54.84 1yl3 n ASN 9 Cb 0.41 -0.03 0.00 0.00 -0.61 0.00 0.00 39.78 39.55 1yl3 n ASN 9 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1yl3 n ARG 10 N -0.98 0.00 0.00 3.52 1.74 -1.26 -1.29 116.66 118.40 1yl3 n ARG 10 Ca 0.00 0.15 0.00 0.00 -0.77 0.00 0.00 57.85 57.23 1yl3 n ARG 10 Cb 0.00 -0.24 0.00 0.00 -1.02 0.00 0.00 32.46 31.20 1yl3 n ARG 10 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1yl3 n LYS 11 N -1.91 0.00 -0.27 5.56 4.81 0.63 -0.83 118.16 126.15 1yl3 n LYS 11 Ca 0.00 0.30 -0.03 0.00 -0.87 0.00 0.00 58.31 57.71 1yl3 n LYS 11 Cb 0.00 -1.22 -0.00 0.00 0.02 0.00 0.00 35.03 33.83 1yl3 n LYS 11 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 1yl3 n ARG 12 N -1.27 -0.20 0.07 1.64 0.63 0.30 0.21 116.66 118.03 1yl3 n ARG 12 Ca 0.00 1.04 -0.13 0.00 -0.92 0.00 0.00 57.85 57.84 1yl3 n ARG 12 Cb 0.00 -1.54 -0.08 0.00 0.45 0.00 0.00 32.46 31.29 1yl3 n ARG 12 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1yl3 h ALA 13 N 0.76 -0.90 -2.47 5.13 0.00 -1.12 -1.12 119.26 119.55 1yl3 h ALA 13 Ca 0.20 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1yl3 h ALA 13 Cb 0.37 0.83 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1yl3 h ALA 13 CO -0.67 -1.01 0.00 1.63 0.00 0.00 0.00 179.25 179.20 1yl3 n LYS 14 N -4.88 0.00 -0.39 0.00 5.02 0.56 -2.34 118.16 116.13 1yl3 n LYS 14 Ca -0.07 0.45 0.31 0.00 -2.02 0.00 0.00 58.31 56.98 1yl3 n LYS 14 Cb 0.33 -1.09 0.58 0.00 -0.02 0.00 0.00 35.03 34.83 1yl3 n LYS 14 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 1yl3 h THR 15 N 0.00 0.23 -3.71 -0.18 1.35 -0.66 -3.39 112.91 106.56 1yl3 h THR 15 Ca 0.00 -0.07 0.00 0.00 -0.55 0.00 0.00 66.41 65.79 1yl3 h THR 15 Cb 0.00 0.02 0.00 0.00 -1.73 0.00 0.00 68.15 66.44 1yl3 h THR 15 CO 0.00 0.04 0.00 1.41 -0.25 0.00 0.00 175.52 176.72 1yl3 n HIS 16 N -4.81 -0.78 0.00 4.73 8.25 -0.43 -4.99 115.22 117.19 1yl3 n HIS 16 Ca 0.34 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.80 1yl3 n HIS 16 Cb 1.21 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.32 1yl3 n HIS 16 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1yl3 n GLY 17 N 5.00 3.84 0.00 -1.41 0.00 -1.24 -4.70 105.19 106.68 1yl3 n GLY 17 Ca 0.00 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 44.61 1yl3 n GLY 17 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1yl3 n PHE 18 N -0.40 0.00 0.00 1.61 0.99 -1.26 -0.25 117.46 118.15 1yl3 n PHE 18 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1yl3 n PHE 18 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.48 1yl3 n PHE 18 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 1yl3 n ARG 19 N -0.19 0.00 -0.11 -1.08 1.74 -1.26 0.13 116.66 115.89 1yl3 n ARG 19 Ca 0.00 0.20 -0.03 0.00 -0.77 0.00 0.00 57.85 57.25 1yl3 n ARG 19 Cb 0.00 -0.35 -0.03 0.00 -1.02 0.00 0.00 32.46 31.06 1yl3 n ARG 19 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1yl3 n ALA 20 N -1.26 -0.17 -0.27 7.54 0.00 0.66 0.12 120.51 127.12 1yl3 n ALA 20 Ca 0.00 0.23 0.06 0.00 0.00 0.00 0.00 53.44 53.73 1yl3 n ALA 20 Cb 0.00 0.10 0.18 0.00 0.00 0.00 0.00 19.45 19.73 1yl3 n ALA 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yl3 h ARG 21 N 0.00 0.10 0.21 0.00 3.08 0.35 0.65 114.38 118.77 1yl3 h ARG 21 Ca 0.04 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1yl3 h ARG 21 Cb 0.11 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 1yl3 h ARG 21 CO -0.26 0.07 -0.23 0.52 -1.07 0.00 0.00 179.97 179.00 1yl3 h MET 22 N 0.10 -0.46 -0.17 0.04 2.86 0.28 0.40 114.93 117.98 1yl3 h MET 22 Ca 0.44 0.03 0.04 0.00 -2.06 0.00 0.00 59.70 58.14 1yl3 h MET 22 Cb 0.78 0.10 -0.03 0.00 0.06 0.00 0.00 31.60 32.52 1yl3 h MET 22 CO -0.69 -0.31 -0.04 1.63 1.06 0.00 0.00 176.91 178.57 1yl3 n LYS 23 N -5.35 -0.02 -3.97 1.72 5.02 0.23 -4.10 118.16 111.69 1yl3 n LYS 23 Ca -0.08 0.27 -0.23 0.00 -2.02 0.00 0.00 58.31 56.25 1yl3 n LYS 23 Cb 0.26 -0.40 -0.06 0.00 -0.02 0.00 0.00 35.03 34.81 1yl3 n LYS 23 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1yl3 s THR 24 N -5.19 2.62 0.00 -0.18 -1.32 -1.17 -5.00 115.64 105.40 1yl3 s THR 24 Ca -0.03 -1.60 0.00 0.00 -1.21 0.00 0.00 61.69 58.86 1yl3 s THR 24 Cb 0.05 -3.00 0.00 0.00 -1.51 0.00 0.00 72.50 68.04 1yl3 s THR 24 CO 0.13 -0.05 0.48 0.29 -2.21 0.00 0.00 174.62 173.26 1yl3 n LYS 25 N -1.30 0.00 -0.04 7.08 4.76 -1.26 -1.31 118.16 126.10 1yl3 n LYS 25 Ca -0.00 0.16 -0.01 0.00 -2.87 0.00 0.00 58.31 55.58 1yl3 n LYS 25 Cb 0.63 -0.98 -0.01 0.00 -1.84 0.00 0.00 35.03 32.83 1yl3 n LYS 25 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1yl3 n SER 26 N -0.64 -0.10 0.00 4.39 3.41 -1.26 -0.97 113.62 118.45 1yl3 n SER 26 Ca 0.00 0.74 0.00 0.00 -0.26 0.00 0.00 58.87 59.35 1yl3 n SER 26 Cb 0.00 -0.31 0.00 0.00 -0.26 0.00 0.00 64.21 63.64 1yl3 n SER 26 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1yl3 n GLY 27 N -1.02 -1.40 0.28 5.00 0.00 -1.21 0.29 105.19 107.13 1yl3 n GLY 27 Ca 0.00 0.30 -0.04 0.00 0.00 0.00 0.00 46.02 46.28 1yl3 n GLY 27 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yl3 n ARG 28 N -0.48 -0.23 0.00 1.61 1.74 0.14 -1.02 116.66 118.42 1yl3 n ARG 28 Ca 0.00 1.06 0.00 0.00 -0.77 0.00 0.00 57.85 58.14 1yl3 n ARG 28 Cb 0.00 -1.56 0.00 0.00 -1.02 0.00 0.00 32.46 29.88 1yl3 n ARG 28 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1yl3 n ASN 29 N -4.95 0.00 0.24 0.55 3.02 0.15 0.16 115.26 114.43 1yl3 n ASN 29 Ca 0.04 0.50 0.18 0.00 -0.03 0.00 0.00 54.58 55.27 1yl3 n ASN 29 Cb 0.23 -0.03 0.84 0.00 -0.61 0.00 0.00 39.78 40.21 1yl3 n ASN 29 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 1yl3 h ILE 30 N 0.00 0.20 0.41 2.41 1.08 -0.23 0.08 117.51 121.46 1yl3 h ILE 30 Ca 0.00 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.46 1yl3 h ILE 30 Cb 0.00 0.73 -0.02 0.00 -3.07 0.00 0.00 36.82 34.46 1yl3 h ILE 30 CO 0.00 0.00 -0.34 -0.07 -0.69 0.00 0.00 178.15 177.05 1yl3 h LEU 31 N 0.00 -0.91 -0.66 1.44 3.38 0.33 -0.09 115.31 118.80 1yl3 h LEU 31 Ca 0.07 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 1yl3 h LEU 31 Cb 0.68 0.30 -0.03 0.00 0.09 0.00 0.00 40.66 41.69 1yl3 h LEU 31 CO -0.00 -0.50 0.39 0.00 0.09 0.00 0.00 178.44 178.42 1yl3 h ALA 32 N -0.30 0.84 -0.81 1.53 0.00 0.67 -0.84 119.26 120.35 1yl3 h ALA 32 Ca -0.03 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1yl3 h ALA 32 Cb 0.66 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1yl3 h ALA 32 CO -0.02 0.33 0.00 0.54 0.00 0.00 0.00 179.25 180.09 1yl3 n ARG 33 N -4.56 0.00 0.06 0.00 1.74 -0.27 -0.58 116.66 113.05 1yl3 n ARG 33 Ca 0.05 0.57 -0.07 0.00 -0.77 0.00 0.00 57.85 57.63 1yl3 n ARG 33 Cb 0.07 -0.92 -0.04 0.00 -1.02 0.00 0.00 32.46 30.55 1yl3 n ARG 33 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 1yl3 h ARG 34 N 0.00 -0.33 0.00 5.56 2.43 -0.95 0.14 114.38 121.22 1yl3 h ARG 34 Ca 0.00 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1yl3 h ARG 34 Cb 0.00 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 1yl3 h ARG 34 CO 0.00 -0.22 0.00 0.54 -1.51 0.00 0.00 179.97 178.78 1yl3 n ARG 35 N -3.72 0.00 0.21 0.20 1.74 0.25 0.99 116.66 116.34 1yl3 n ARG 35 Ca -0.04 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.91 1yl3 n ARG 35 Cb 0.18 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.55 1yl3 n ARG 35 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1yl3 h ALA 36 N 0.00 -0.57 -1.86 7.54 0.00 -1.22 -1.49 119.26 121.66 1yl3 h ALA 36 Ca 0.00 -0.19 0.55 0.00 0.00 0.00 0.00 54.91 55.27 1yl3 h ALA 36 Cb 0.00 0.22 -0.09 0.00 0.00 0.00 0.00 17.79 17.92 1yl3 h ALA 36 CO 0.00 -0.64 1.32 0.87 0.00 0.00 0.00 179.25 180.79 1yl3 h LYS 37 N -0.93 0.00 0.00 0.00 1.57 0.35 -3.33 116.57 114.24 1yl3 h LYS 37 Ca -0.06 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1yl3 h LYS 37 Cb 0.56 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.87 1yl3 h LYS 37 CO 0.10 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.39 1yl3 n GLY 38 N -1.85 1.00 2.61 3.86 0.00 0.21 -4.99 105.19 106.02 1yl3 n GLY 38 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.45 1yl3 n GLY 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yl3 n ARG 39 N 0.00 0.00 0.00 1.61 1.74 -0.56 -5.05 116.66 114.40 1yl3 n ARG 39 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1yl3 n ARG 39 Cb 0.21 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.65 1yl3 n ARG 39 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1yl3 n HIS 40 N 4.48 -0.95 0.00 -1.55 8.25 -1.26 -4.47 115.22 119.72 1yl3 n HIS 40 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1yl3 n HIS 40 Cb 0.00 0.13 0.00 0.00 1.12 0.00 0.00 29.99 31.24 1yl3 n HIS 40 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1yl3 n GLN 41 N -0.44 0.76 -3.57 -0.41 6.02 -1.26 -5.06 117.38 113.42 1yl3 n GLN 41 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 56.89 1yl3 n GLN 41 Cb 0.00 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.24 1yl3 n GLN 41 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1yl3 s LEU 42 N 0.00 -0.39 0.00 1.08 1.43 -1.26 -4.92 118.68 114.62 1yl3 s LEU 42 Ca 0.00 -0.21 0.00 0.00 -1.03 0.00 0.00 54.13 52.89 1yl3 s LEU 42 Cb 0.00 2.56 0.00 0.00 0.03 0.00 0.00 46.19 48.78 1yl3 s LEU 42 CO 0.00 -1.07 0.00 0.35 0.23 0.00 0.00 176.35 175.86 1yl3 n THR 43 N -0.39 0.00 -0.39 5.49 -2.24 -1.26 -0.61 114.28 114.88 1yl3 n THR 43 Ca -0.13 0.00 0.34 0.00 -2.27 0.00 0.00 64.05 61.99 1yl3 n THR 43 Cb 0.63 -0.10 0.57 0.00 -2.10 0.00 0.00 70.33 69.33 1yl3 n THR 43 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1yl3 n VAL 44 N 0.00 -0.22 -0.28 2.28 0.31 -1.26 0.61 118.33 119.77 1yl3 n VAL 44 Ca 0.00 1.54 0.08 0.00 -0.01 0.00 0.00 64.34 65.95 1yl3 n VAL 44 Cb 0.00 -2.53 0.20 0.00 -0.91 0.00 0.00 33.84 30.60 1yl3 n VAL 44 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 1yl3 h SER 45 N 0.00 -0.31 0.00 4.52 4.64 -1.28 -3.50 113.55 117.62 1yl3 h SER 45 Ca 0.74 0.21 0.00 0.00 -0.47 0.00 0.00 61.79 62.27 1yl3 h SER 45 Cb 2.37 0.35 0.00 0.00 -0.31 0.00 0.00 62.40 64.82 1yl3 h SER 45 CO -0.41 -0.20 0.00 -0.90 -0.87 0.00 0.00 176.83 174.45