#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tz4 s PRO 2 N 0.00 3.57 0.19 2.98 0.04 -1.26 -4.91 135.00 135.61 1tz4 s PRO 2 Ca 0.00 1.68 0.00 0.00 0.04 0.00 0.00 61.00 62.72 1tz4 s PRO 2 Cb 0.00 -2.21 0.00 0.00 0.04 0.00 0.00 34.50 32.33 1tz4 s PRO 2 CO 0.00 -0.69 0.00 0.43 0.04 0.00 0.00 177.00 176.78 1tz4 n SER 3 N -0.89 -0.71 -3.33 6.66 7.64 -1.26 -5.10 113.62 116.62 1tz4 n SER 3 Ca 0.09 0.35 -0.13 0.00 1.01 0.00 0.00 58.87 60.19 1tz4 n SER 3 Cb 0.50 0.82 0.00 0.00 -1.01 0.00 0.00 64.21 64.52 1tz4 n SER 3 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1tz4 n LYS 4 N -3.05 -1.58 -1.09 1.43 5.02 -1.26 -4.99 118.16 112.64 1tz4 n LYS 4 Ca 0.00 1.31 -0.30 0.00 -2.02 0.00 0.00 58.31 57.30 1tz4 n LYS 4 Cb 0.00 -4.20 0.14 0.00 -0.02 0.00 0.00 35.03 30.95 1tz4 n LYS 4 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1tz4 s PRO 5 N -3.58 1.24 0.34 1.97 0.04 -1.26 -5.08 135.00 128.66 1tz4 s PRO 5 Ca 0.07 1.00 0.10 0.00 0.04 0.00 0.00 61.00 62.20 1tz4 s PRO 5 Cb -0.01 -1.79 -0.06 0.00 0.04 0.00 0.00 34.50 32.68 1tz4 s PRO 5 CO 0.82 -2.30 -0.07 0.16 0.04 0.00 0.00 177.00 175.65 1tz4 s ASP 6 N -3.23 3.88 -0.30 6.66 1.47 -1.26 -5.15 116.67 118.74 1tz4 s ASP 6 Ca 0.64 -1.11 -0.20 0.00 1.18 0.00 0.00 52.55 53.06 1tz4 s ASP 6 Cb -0.19 -0.41 0.20 0.00 -0.34 0.00 0.00 42.92 42.17 1tz4 s ASP 6 CO 0.58 -0.19 1.29 0.54 0.68 0.00 0.00 175.17 178.07 1tz4 s ASN 7 N -3.64 -0.11 1.12 2.11 2.20 -1.26 -5.18 114.94 110.18 1tz4 s ASN 7 Ca 0.33 0.18 -0.12 0.00 -0.94 0.00 0.00 52.86 52.31 1tz4 s ASN 7 Cb 0.01 0.71 0.18 0.00 -2.00 0.00 0.00 41.25 40.15 1tz4 s ASN 7 CO 0.17 -0.03 0.70 -0.81 -2.94 0.00 0.00 177.10 174.19 1tz4 n PRO 8 N 2.57 -2.04 0.00 3.55 -0.04 -1.26 -5.08 135.00 132.71 1tz4 n PRO 8 Ca -0.15 -1.11 0.00 0.00 -0.04 0.00 0.00 63.50 62.20 1tz4 n PRO 8 Cb 0.57 -0.97 0.00 0.00 -0.04 0.00 0.00 33.50 33.05 1tz4 n PRO 8 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1tz4 n GLY 9 N -1.67 -0.99 0.00 0.55 0.00 -1.26 -5.06 105.19 96.76 1tz4 n GLY 9 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1tz4 n GLY 9 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1tz4 n GLU 10 N 0.00 0.00 0.06 1.61 -0.58 -1.26 -4.97 120.64 115.50 1tz4 n GLU 10 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1tz4 n GLU 10 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 1tz4 n GLU 10 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1tz4 n ASP 11 N 0.00 -1.09 -2.71 1.62 -0.08 -1.26 -5.08 116.55 107.95 1tz4 n ASP 11 Ca 0.00 0.47 -0.04 0.00 -1.51 0.00 0.00 54.79 53.71 1tz4 n ASP 11 Cb 0.00 1.29 0.02 0.00 2.34 0.00 0.00 41.12 44.77 1tz4 n ASP 11 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1tz4 n ALA 12 N -2.89 -2.16 -2.33 -1.67 0.00 -1.26 -4.96 120.51 105.24 1tz4 n ALA 12 Ca 0.00 0.03 -0.39 0.00 0.00 0.00 0.00 53.44 53.08 1tz4 n ALA 12 Cb 0.00 -2.22 -0.03 0.00 0.00 0.00 0.00 19.45 17.20 1tz4 n ALA 12 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1tz4 s PRO 13 N -3.34 2.97 0.00 0.00 0.04 -1.26 -4.86 135.00 128.55 1tz4 s PRO 13 Ca 0.11 0.01 -0.00 0.00 0.04 0.00 0.00 61.00 61.16 1tz4 s PRO 13 Cb -0.01 -4.39 -0.02 0.00 0.04 0.00 0.00 34.50 30.12 1tz4 s PRO 13 CO 0.56 -2.44 1.38 0.00 0.04 0.00 0.00 177.00 176.54 1tz4 n ALA 14 N 10.85 3.21 -0.11 8.56 0.00 -1.26 -2.92 120.51 138.83 1tz4 n ALA 14 Ca 0.14 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1tz4 n ALA 14 Cb 0.50 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.50 1tz4 n ALA 14 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1tz4 n GLU 15 N 1.78 2.78 0.00 0.00 4.07 -1.26 -4.77 120.64 123.23 1tz4 n GLU 15 Ca 0.03 -0.15 0.00 0.00 -0.06 0.00 0.00 57.16 56.98 1tz4 n GLU 15 Cb 0.34 -0.57 0.00 0.00 -0.06 0.00 0.00 31.44 31.15 1tz4 n GLU 15 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 1tz4 n ASP 16 N -0.44 0.00 0.01 4.31 8.00 -1.21 -4.90 116.55 122.32 1tz4 n ASP 16 Ca 0.00 0.00 0.22 0.00 0.71 0.00 0.00 54.79 55.72 1tz4 n ASP 16 Cb 0.03 0.24 0.73 0.00 -0.02 0.00 0.00 41.12 42.10 1tz4 n ASP 16 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1tz4 h LEU 17 N 0.00 0.00 -1.08 0.64 6.46 -1.88 -1.27 115.31 118.19 1tz4 h LEU 17 Ca 0.00 0.00 0.20 0.00 -0.12 0.00 0.00 57.88 57.96 1tz4 h LEU 17 Cb 0.00 0.00 -0.10 0.00 -0.73 0.00 0.00 40.66 39.83 1tz4 h LEU 17 CO 0.00 0.00 0.61 0.00 -0.62 0.00 0.00 178.44 178.43 1tz4 h ALA 18 N 1.59 1.77 -0.05 1.25 0.00 -1.86 0.28 119.26 122.24 1tz4 h ALA 18 Ca 0.26 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 1tz4 h ALA 18 Cb 1.18 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 1tz4 h ALA 18 CO -0.00 -0.16 -0.01 0.37 0.00 0.00 0.00 179.25 179.45 1tz4 h GLN 19 N 0.69 0.09 0.10 0.00 -0.00 -1.62 -2.30 115.11 112.06 1tz4 h GLN 19 Ca 0.58 -0.04 0.02 0.00 -0.00 0.00 0.00 58.65 59.21 1tz4 h GLN 19 Cb 1.01 -0.01 -0.03 0.00 0.00 0.00 0.00 27.48 28.46 1tz4 h GLN 19 CO -0.37 0.43 -0.19 -0.92 0.00 0.00 0.00 178.83 177.78 1tz4 h TYR 20 N -0.25 -0.51 -0.43 3.99 3.20 -1.15 0.16 116.97 121.98 1tz4 h TYR 20 Ca 0.01 0.01 0.08 0.00 3.14 0.00 0.00 58.73 61.97 1tz4 h TYR 20 Cb 0.39 0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.85 1tz4 h TYR 20 CO 0.05 -0.28 0.30 0.00 -1.64 0.00 0.00 178.16 176.59 1tz4 h ALA 21 N 0.46 2.09 -0.04 1.82 0.00 -0.62 -0.37 119.26 122.60 1tz4 h ALA 21 Ca 0.03 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1tz4 h ALA 21 Cb 0.39 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1tz4 h ALA 21 CO -0.11 -0.18 -0.13 0.00 0.00 0.00 0.00 179.25 178.83 1tz4 h ALA 22 N 1.78 0.07 -0.43 0.00 0.00 -0.68 -0.48 119.26 119.51 1tz4 h ALA 22 Ca 0.20 -0.36 0.07 0.00 0.00 0.00 0.00 54.91 54.82 1tz4 h ALA 22 Cb 0.46 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.19 1tz4 h ALA 22 CO -0.04 -0.03 0.10 0.22 0.00 0.00 0.00 179.25 179.50 1tz4 h ASP 23 N -0.39 0.03 -0.60 0.00 3.58 -0.11 0.37 116.42 119.31 1tz4 h ASP 23 Ca -0.00 0.07 -0.09 0.00 0.42 0.00 0.00 57.03 57.42 1tz4 h ASP 23 Cb 0.75 0.09 -0.02 0.00 1.72 0.00 0.00 39.33 41.86 1tz4 h ASP 23 CO 0.03 0.05 0.02 -0.07 -2.88 0.00 0.00 179.24 176.39 1tz4 h LEU 24 N 0.24 1.03 -0.60 2.28 3.38 -1.13 0.60 115.31 121.10 1tz4 h LEU 24 Ca 0.21 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1tz4 h LEU 24 Cb 0.25 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1tz4 h LEU 24 CO -0.26 1.07 0.38 0.03 0.09 0.00 0.00 178.44 179.75 1tz4 h ARG 25 N 0.97 0.80 0.07 1.13 2.47 -0.50 -0.33 114.38 118.98 1tz4 h ARG 25 Ca 0.18 -0.06 -0.00 0.00 -1.26 0.00 0.00 59.98 58.83 1tz4 h ARG 25 Cb 0.53 -0.18 0.00 0.00 -1.65 0.00 0.00 29.97 28.68 1tz4 h ARG 25 CO 0.03 0.55 -0.03 1.25 0.56 0.00 0.00 179.97 182.32 1tz4 h HIS 26 N 0.81 -0.08 -0.05 3.04 2.76 0.05 -1.00 115.15 120.68 1tz4 h HIS 26 Ca 0.22 -0.00 0.03 0.00 -2.20 0.00 0.00 60.37 58.42 1tz4 h HIS 26 Cb -0.07 0.03 -0.06 0.00 1.55 0.00 0.00 27.41 28.86 1tz4 h HIS 26 CO -0.03 0.20 -0.42 -0.92 -1.30 0.00 0.00 177.93 175.46 1tz4 h TYR 27 N -0.36 -1.20 -0.35 5.26 3.20 -0.85 0.92 116.97 123.59 1tz4 h TYR 27 Ca -0.01 0.04 0.07 0.00 3.14 0.00 0.00 58.73 61.97 1tz4 h TYR 27 Cb 0.32 0.53 -0.07 0.00 1.54 0.00 0.00 36.73 39.05 1tz4 h TYR 27 CO 0.02 -0.49 -0.10 0.97 -1.64 0.00 0.00 178.16 176.92 1tz4 h ILE 28 N -0.54 0.63 -0.79 1.81 2.10 -1.02 0.22 117.51 119.91 1tz4 h ILE 28 Ca 0.06 0.00 0.07 0.00 1.08 0.00 0.00 64.86 66.07 1tz4 h ILE 28 Cb 0.64 0.63 -0.05 0.00 -1.09 0.00 0.00 36.82 36.95 1tz4 h ILE 28 CO -0.35 0.00 0.52 0.78 -1.08 0.00 0.00 178.15 178.02 1tz4 h ASN 29 N -0.01 0.72 0.67 2.19 4.21 -0.72 0.36 115.58 122.99 1tz4 h ASN 29 Ca 0.17 0.01 -0.13 0.00 1.21 0.00 0.00 56.30 57.56 1tz4 h ASN 29 Cb 0.27 -0.14 -0.02 0.00 -1.12 0.00 0.00 38.32 37.31 1tz4 h ASN 29 CO -0.37 0.45 -0.60 -0.07 -1.29 0.00 0.00 177.43 175.55 1tz4 h LEU 30 N 0.81 0.00 0.18 1.61 3.38 0.64 -3.27 115.31 118.66 1tz4 h LEU 30 Ca 0.35 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 58.04 1tz4 h LEU 30 Cb 0.31 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.08 1tz4 h LEU 30 CO -0.13 0.60 -1.30 0.40 0.09 0.00 0.00 178.44 178.11 1tz4 h ILE 31 N 0.00 1.25 -0.46 1.22 1.08 0.68 -3.32 117.51 117.95 1tz4 h ILE 31 Ca -0.01 -2.55 0.09 0.00 -0.39 0.00 0.00 64.86 62.01 1tz4 h ILE 31 Cb 1.10 2.98 -0.10 0.00 -3.07 0.00 0.00 36.82 37.73 1tz4 h ILE 31 CO 0.08 0.77 -0.19 0.71 -0.69 0.00 0.00 178.15 178.82 1tz4 h THR 32 N -0.12 0.40 -0.20 -0.27 1.35 -0.42 0.23 112.91 113.88 1tz4 h THR 32 Ca -0.25 0.00 -0.08 0.00 -0.55 0.00 0.00 66.41 65.54 1tz4 h THR 32 Cb 1.90 0.40 -0.05 0.00 -1.73 0.00 0.00 68.15 68.68 1tz4 h THR 32 CO 0.18 0.00 0.10 -1.14 -0.25 0.00 0.00 175.52 174.40 1tz4 n ARG 33 N -5.39 1.57 -1.39 4.72 0.00 -1.23 -3.74 116.66 111.19 1tz4 n ARG 33 Ca 0.04 -0.75 -0.05 0.00 -0.00 0.00 0.00 57.85 57.09 1tz4 n ARG 33 Cb 0.30 -1.45 -0.02 0.00 0.00 0.00 0.00 32.46 31.28 1tz4 n ARG 33 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.63 178.57 1tz4 n GLN 34 N 0.12 0.29 -4.06 -0.14 7.27 0.69 -5.06 117.38 116.50 1tz4 n GLN 34 Ca 0.11 -1.17 -0.09 0.00 0.07 0.00 0.00 57.00 55.92 1tz4 n GLN 34 Cb 0.66 0.40 -0.09 0.00 2.41 0.00 0.00 30.24 33.63 1tz4 n GLN 34 CO 0.00 0.00 0.00 0.50 0.07 0.00 0.00 177.06 177.63 1tz4 s ARG 35 N -0.06 0.89 0.00 3.69 3.52 -0.45 -4.88 118.95 121.65 1tz4 s ARG 35 Ca 0.05 -1.27 0.00 0.00 -0.13 0.00 0.00 55.73 54.38 1tz4 s ARG 35 Cb 0.12 0.28 0.00 0.00 -1.56 0.00 0.00 34.95 33.79 1tz4 s ARG 35 CO -0.04 -0.26 0.00 2.48 -0.81 0.00 0.00 175.30 176.67