#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1icy s PRO 2 N 0.00 3.63 -0.03 -0.72 0.04 -1.26 -4.97 135.00 131.70 1icy s PRO 2 Ca 0.00 0.88 0.03 0.00 0.04 0.00 0.00 61.00 61.95 1icy s PRO 2 Cb 0.00 -3.99 -0.00 0.00 0.04 0.00 0.00 34.50 30.55 1icy s PRO 2 CO 0.00 -1.49 -0.12 -1.12 0.04 0.00 0.00 177.00 174.30 1icy s SER 3 N 3.53 1.53 -0.67 6.66 0.01 -1.26 -5.10 113.70 118.40 1icy s SER 3 Ca 0.58 -0.24 0.00 0.00 1.31 0.00 0.00 55.95 57.60 1icy s SER 3 Cb -0.12 -0.34 0.17 0.00 0.21 0.00 0.00 66.02 65.93 1icy s SER 3 CO 0.32 0.11 0.48 -0.54 0.41 0.00 0.00 173.24 174.02 1icy s LYS 4 N 0.01 2.58 0.38 12.44 -0.14 -1.26 -5.10 119.74 128.65 1icy s LYS 4 Ca -0.01 -2.85 -0.06 0.00 -1.36 0.00 0.00 55.97 51.68 1icy s LYS 4 Cb -0.08 -3.64 0.09 0.00 -1.68 0.00 0.00 37.83 32.52 1icy s LYS 4 CO 0.01 -1.20 0.38 -0.35 -0.76 0.00 0.00 175.35 173.42 1icy n PRO 5 N 2.90 -1.42 -0.23 -1.68 -0.04 -1.26 -4.96 135.00 128.31 1icy n PRO 5 Ca 0.12 -0.60 0.00 0.00 -0.04 0.00 0.00 63.50 62.98 1icy n PRO 5 Cb 0.36 -0.52 0.00 0.00 -0.04 0.00 0.00 33.50 33.30 1icy n PRO 5 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1icy n ASP 6 N -3.54 -2.05 -4.05 3.54 8.00 -1.26 -4.91 116.55 112.28 1icy n ASP 6 Ca 0.05 0.19 -0.34 0.00 0.71 0.00 0.00 54.79 55.40 1icy n ASP 6 Cb 0.19 0.14 -0.10 0.00 -0.02 0.00 0.00 41.12 41.33 1icy n ASP 6 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1icy s ASN 7 N -2.31 5.26 0.06 -2.24 0.01 -1.26 -5.08 114.94 109.37 1icy s ASN 7 Ca 0.00 -3.24 0.00 0.00 -0.71 0.00 0.00 52.86 48.91 1icy s ASN 7 Cb 0.00 -1.81 0.00 0.00 0.41 0.00 0.00 41.25 39.85 1icy s ASN 7 CO 0.00 -0.26 0.00 -0.81 -1.51 0.00 0.00 177.10 174.52 1icy n PRO 8 N 2.92 0.91 0.00 -0.60 -0.04 -1.26 -5.07 135.00 131.87 1icy n PRO 8 Ca 0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 1icy n PRO 8 Cb 0.36 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.82 1icy n PRO 8 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1icy n GLY 9 N 3.61 -0.55 3.65 0.55 0.00 -1.26 -5.04 105.19 106.15 1icy n GLY 9 Ca 0.00 0.15 -0.03 0.00 0.00 0.00 0.00 46.02 46.13 1icy n GLY 9 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1icy s GLU 10 N 0.00 0.09 -0.36 1.61 2.12 -1.26 -5.02 118.70 115.88 1icy s GLU 10 Ca 0.00 0.11 -0.09 0.00 0.36 0.00 0.00 54.97 55.35 1icy s GLU 10 Cb 0.00 0.04 0.01 0.00 0.26 0.00 0.00 34.13 34.45 1icy s GLU 10 CO 0.00 -0.01 0.33 -3.47 -0.54 0.00 0.00 175.26 171.57 1icy n ASP 11 N 1.62 -7.73 -2.87 -1.70 2.03 -1.26 -4.51 116.55 102.14 1icy n ASP 11 Ca -0.10 0.89 -0.08 0.00 0.52 0.00 0.00 54.79 56.01 1icy n ASP 11 Cb 0.57 -5.18 0.01 0.00 -0.72 0.00 0.00 41.12 35.79 1icy n ASP 11 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1icy n ALA 12 N 0.11 -3.06 -2.16 -1.67 0.00 -1.26 -4.84 120.51 107.64 1icy n ALA 12 Ca 0.07 0.95 -0.43 0.00 0.00 0.00 0.00 53.44 54.03 1icy n ALA 12 Cb 0.25 -3.00 -0.02 0.00 0.00 0.00 0.00 19.45 16.67 1icy n ALA 12 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1icy s PRO 13 N -2.34 4.03 0.09 0.00 0.04 -1.26 -4.85 135.00 130.70 1icy s PRO 13 Ca 0.20 1.83 0.02 0.00 0.04 0.00 0.00 61.00 63.08 1icy s PRO 13 Cb -0.05 -3.95 -0.24 0.00 0.04 0.00 0.00 34.50 30.30 1icy s PRO 13 CO 0.77 -1.00 1.18 0.00 0.04 0.00 0.00 177.00 177.98 1icy h ALA 14 N 9.68 0.26 -0.44 8.56 0.00 -1.92 -3.12 119.26 132.28 1icy h ALA 14 Ca -0.34 -0.93 -0.10 0.00 0.00 0.00 0.00 54.91 53.54 1icy h ALA 14 Cb 1.15 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.83 1icy h ALA 14 CO 0.98 1.15 0.13 0.39 0.00 0.00 0.00 179.25 181.90 1icy n GLU 15 N -3.41 2.95 -0.33 0.00 1.02 -1.26 -4.32 120.64 115.29 1icy n GLU 15 Ca -0.05 -1.95 0.01 0.00 -0.02 0.00 0.00 57.16 55.15 1icy n GLU 15 Cb 0.98 -1.91 0.18 0.00 -0.02 0.00 0.00 31.44 30.67 1icy n GLU 15 CO 0.00 0.00 0.00 0.22 1.18 0.00 0.00 177.13 178.53 1icy h ASP 16 N 1.94 1.02 0.41 1.62 3.58 -1.93 0.13 116.42 123.19 1icy h ASP 16 Ca 0.12 -0.01 -0.02 0.00 0.42 0.00 0.00 57.03 57.54 1icy h ASP 16 Cb 1.66 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 42.47 1icy h ASP 16 CO 0.43 0.70 -0.08 -0.07 -2.88 0.00 0.00 179.24 177.34 1icy h LEU 17 N 1.18 0.00 -0.44 2.28 3.38 -1.85 -1.82 115.31 118.04 1icy h LEU 17 Ca 0.37 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.32 1icy h LEU 17 Cb -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1icy h LEU 17 CO -0.11 0.08 0.19 0.00 0.09 0.00 0.00 178.44 178.69 1icy h ALA 18 N 1.92 0.57 -0.11 1.53 0.00 -1.04 -1.15 119.26 120.97 1icy h ALA 18 Ca -0.00 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 1icy h ALA 18 Cb 0.31 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1icy h ALA 18 CO 0.01 0.17 -0.12 0.00 0.00 0.00 0.00 179.25 179.31 1icy h ARG 19 N 0.57 0.28 0.00 0.00 3.08 -1.25 -2.76 114.38 114.31 1icy h ARG 19 Ca 0.15 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1icy h ARG 19 Cb 0.18 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.23 1icy h ARG 19 CO -0.01 0.70 0.00 0.66 -1.07 0.00 0.00 179.97 180.25 1icy n TYR 20 N -4.61 0.68 -0.06 3.04 4.01 -0.88 -2.00 117.16 117.34 1icy n TYR 20 Ca -0.07 0.35 -0.11 0.00 -0.16 0.00 0.00 57.90 57.92 1icy n TYR 20 Cb 0.35 -1.06 -0.04 0.00 -0.31 0.00 0.00 39.34 38.27 1icy n TYR 20 CO 0.00 0.00 0.00 -0.92 -0.46 0.00 0.00 176.86 175.48 1icy h TYR 21 N 0.00 0.33 -0.06 -0.72 3.20 -0.90 -2.05 116.97 116.78 1icy h TYR 21 Ca 0.00 -0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.86 1icy h TYR 21 Cb 0.01 -0.10 -0.00 0.00 1.54 0.00 0.00 36.73 38.18 1icy h TYR 21 CO 0.00 0.39 0.11 0.77 -1.64 0.00 0.00 178.16 177.80 1icy h SER 22 N 0.18 0.00 0.43 -2.11 0.02 -1.52 -2.20 113.55 108.35 1icy h SER 22 Ca 0.07 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.00 1icy h SER 22 Cb 0.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.76 1icy h SER 22 CO -0.00 0.00 -0.21 0.00 -1.14 0.00 0.00 176.83 175.48 1icy h ALA 23 N 1.83 -0.58 -0.14 3.77 0.00 -1.49 -2.30 119.26 120.35 1icy h ALA 23 Ca 0.03 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.79 1icy h ALA 23 Cb 0.25 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1icy h ALA 23 CO -0.00 -0.68 0.13 -0.07 0.00 0.00 0.00 179.25 178.63 1icy h LEU 24 N -0.87 0.00 -0.82 0.00 3.38 -1.39 0.19 115.31 115.81 1icy h LEU 24 Ca -0.06 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1icy h LEU 24 Cb 0.56 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.28 1icy h LEU 24 CO 0.10 0.00 0.38 0.03 0.09 0.00 0.00 178.44 179.04 1icy h ARG 25 N 0.00 1.19 -0.84 1.13 2.47 -0.95 -2.12 114.38 115.25 1icy h ARG 25 Ca 0.07 -0.18 0.10 0.00 -1.26 0.00 0.00 59.98 58.70 1icy h ARG 25 Cb 0.32 -0.21 -0.07 0.00 -1.65 0.00 0.00 29.97 28.36 1icy h ARG 25 CO -0.00 0.92 0.49 1.25 0.56 0.00 0.00 179.97 183.19 1icy h HIS 26 N 1.17 0.89 -0.11 3.04 2.76 -0.42 0.35 115.15 122.83 1icy h HIS 26 Ca 0.28 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.47 1icy h HIS 26 Cb 0.13 -0.27 -0.00 0.00 1.55 0.00 0.00 27.41 28.82 1icy h HIS 26 CO 0.01 0.36 0.05 1.88 -1.30 0.00 0.00 177.93 178.94 1icy h TYR 27 N 0.82 0.17 0.00 5.26 0.05 -1.49 -2.22 116.97 119.55 1icy h TYR 27 Ca 0.41 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 59.18 1icy h TYR 27 Cb 0.37 -0.05 0.00 0.00 1.01 0.00 0.00 36.73 38.06 1icy h TYR 27 CO -0.05 0.25 0.00 -0.89 -1.05 0.00 0.00 178.16 176.42 1icy n ILE 28 N -4.92 0.96 -0.96 -2.88 -0.00 -0.68 -1.76 119.36 109.13 1icy n ILE 28 Ca -0.05 0.27 0.04 0.00 -0.00 0.00 0.00 62.75 63.01 1icy n ILE 28 Cb 0.11 -1.13 0.37 0.00 -0.00 0.00 0.00 39.64 38.99 1icy n ILE 28 CO 0.00 0.00 0.00 0.59 -0.00 0.00 0.00 176.55 177.14 1icy n ASN 29 N -1.89 5.34 -0.54 4.38 3.02 0.11 -4.13 115.26 121.55 1icy n ASN 29 Ca 0.02 -3.02 -0.00 0.00 -0.03 0.00 0.00 54.58 51.55 1icy n ASN 29 Cb 0.19 -0.69 -0.00 0.00 -0.61 0.00 0.00 39.78 38.67 1icy n ASN 29 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1icy n LEU 30 N 0.31 -0.02 -0.02 3.41 0.00 -0.72 -4.94 117.00 115.01 1icy n LEU 30 Ca 0.30 -1.06 -0.09 0.00 0.00 0.00 0.00 56.01 55.16 1icy n LEU 30 Cb 1.22 0.00 -0.03 0.00 0.00 0.00 0.00 43.42 44.61 1icy n LEU 30 CO 0.33 0.80 0.68 0.00 0.00 0.00 0.00 177.39 179.21 1icy h ALA 31 N 0.02 -0.22 -1.60 1.96 0.00 -1.66 -3.37 119.26 114.39 1icy h ALA 31 Ca -0.03 0.05 -0.55 0.00 0.00 0.00 0.00 54.91 54.38 1icy h ALA 31 Cb 1.15 0.52 -0.07 0.00 0.00 0.00 0.00 17.79 19.39 1icy h ALA 31 CO -0.01 -0.71 1.04 -1.25 0.00 0.00 0.00 179.25 178.32 1icy s PRO 32 N -6.06 3.43 -0.32 0.00 0.04 -1.26 -4.81 135.00 126.02 1icy s PRO 32 Ca -0.15 0.40 -0.10 0.00 0.04 0.00 0.00 61.00 61.19 1icy s PRO 32 Cb 0.11 -4.06 0.20 0.00 0.04 0.00 0.00 34.50 30.79 1icy s PRO 32 CO 0.67 -1.78 1.10 0.50 0.04 0.00 0.00 177.00 177.54 1icy s ARG 33 N 5.18 0.11 -0.66 4.56 3.00 -1.26 -5.02 118.95 124.87 1icy s ARG 33 Ca 0.49 -0.06 -0.01 0.00 -1.00 0.00 0.00 55.73 55.14 1icy s ARG 33 Cb -0.09 0.01 -0.02 0.00 0.00 0.00 0.00 34.95 34.85 1icy s ARG 33 CO 0.26 -0.15 0.60 0.94 0.00 0.00 0.00 175.30 176.95 1icy n GLN 34 N 3.35 -1.26 0.00 5.12 -0.06 -1.26 -4.95 117.38 118.32 1icy n GLN 34 Ca 0.06 1.11 0.11 0.00 -2.00 0.00 0.00 57.00 56.28 1icy n GLN 34 Cb 0.64 -4.89 0.11 0.00 -4.06 0.00 0.00 30.24 22.04 1icy n GLN 34 CO 0.00 0.00 0.00 -2.13 -0.20 0.00 0.00 177.06 174.73 1icy n ARG 35 N -1.99 0.30 0.00 3.69 0.63 -1.26 -5.23 116.66 112.80 1icy n ARG 35 Ca -0.02 -0.22 0.00 0.00 -0.92 0.00 0.00 57.85 56.70 1icy n ARG 35 Cb 0.53 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 31.94 1icy n ARG 35 CO 0.00 0.00 0.00 0.98 -2.51 0.00 0.00 177.63 176.10