#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1icy h PRO 2 N 0.00 0.40 -6.49 2.98 0.13 -2.06 -3.46 132.00 123.50 1icy h PRO 2 Ca 0.00 -0.40 -0.55 0.00 -0.87 0.00 0.00 66.00 64.18 1icy h PRO 2 Cb 0.00 0.11 0.21 0.00 0.13 0.00 0.00 31.00 31.45 1icy h PRO 2 CO 0.00 1.07 -0.86 0.45 -0.23 0.00 0.00 178.00 178.42 1icy n SER 3 N -3.76 -2.83 0.00 1.44 2.88 -1.26 -4.81 113.62 105.29 1icy n SER 3 Ca -0.06 0.42 0.00 0.00 -1.33 0.00 0.00 58.87 57.90 1icy n SER 3 Cb 0.80 -1.07 0.00 0.00 -0.75 0.00 0.00 64.21 63.19 1icy n SER 3 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1icy n LYS 4 N -0.09 0.00 -1.17 -1.46 4.76 -1.26 -5.15 118.16 113.79 1icy n LYS 4 Ca 0.06 0.00 -0.31 0.00 -2.87 0.00 0.00 58.31 55.19 1icy n LYS 4 Cb 0.52 0.00 0.11 0.00 -1.84 0.00 0.00 35.03 33.83 1icy n LYS 4 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1icy s PRO 5 N 0.00 1.81 0.00 1.97 0.04 -1.26 -5.06 135.00 132.50 1icy s PRO 5 Ca 0.00 1.11 0.00 0.00 0.04 0.00 0.00 61.00 62.15 1icy s PRO 5 Cb 0.00 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.69 1icy s PRO 5 CO 0.00 -1.94 0.00 -3.47 0.04 0.00 0.00 177.00 171.63 1icy n ASP 6 N -3.72 0.00 -3.59 6.66 -0.08 -1.26 -5.19 116.55 109.38 1icy n ASP 6 Ca 0.09 0.00 -0.09 0.00 -1.51 0.00 0.00 54.79 53.27 1icy n ASP 6 Cb 0.53 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 43.95 1icy n ASP 6 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1icy s ASN 7 N 0.00 -0.33 -0.08 1.67 2.20 -1.26 -5.07 114.94 112.07 1icy s ASN 7 Ca 0.00 0.36 -0.14 0.00 -0.94 0.00 0.00 52.86 52.14 1icy s ASN 7 Cb 0.00 0.27 -0.11 0.00 -2.00 0.00 0.00 41.25 39.41 1icy s ASN 7 CO 0.00 -0.30 0.50 1.55 -2.94 0.00 0.00 177.10 175.91 1icy h PRO 8 N 2.49 -0.15 -3.17 3.55 0.13 -2.07 -3.48 132.00 129.30 1icy h PRO 8 Ca -0.17 0.01 -0.11 0.00 -0.87 0.00 0.00 66.00 64.86 1icy h PRO 8 Cb 1.17 0.03 -0.19 0.00 0.13 0.00 0.00 31.00 32.14 1icy h PRO 8 CO 0.30 0.18 -0.28 0.20 -0.23 0.00 0.00 178.00 178.17 1icy s GLY 9 N -3.48 -0.12 0.20 1.56 0.00 -1.26 -5.15 107.32 99.06 1icy s GLY 9 Ca -0.08 0.16 -0.02 0.00 0.00 0.00 0.00 44.72 44.78 1icy s GLY 9 CO 0.30 -0.04 0.29 1.18 0.00 0.00 0.00 173.10 174.82 1icy n GLU 10 N 1.01 0.41 -0.70 2.90 -0.58 -1.26 -5.04 120.64 117.39 1icy n GLU 10 Ca -0.20 -1.52 -0.01 0.00 -0.42 0.00 0.00 57.16 55.00 1icy n GLU 10 Cb 0.57 1.50 0.24 0.00 -0.57 0.00 0.00 31.44 33.18 1icy n GLU 10 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1icy n ASP 11 N -1.80 4.11 -2.69 1.62 -0.08 -1.26 -4.33 116.55 112.12 1icy n ASP 11 Ca -0.00 -2.79 -0.06 0.00 -1.51 0.00 0.00 54.79 50.43 1icy n ASP 11 Cb 0.32 -0.66 0.08 0.00 2.34 0.00 0.00 41.12 43.20 1icy n ASP 11 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1icy n ALA 12 N 0.12 -2.64 -1.80 -1.67 0.00 -1.26 -5.16 120.51 108.10 1icy n ALA 12 Ca 0.26 -0.73 -0.34 0.00 0.00 0.00 0.00 53.44 52.63 1icy n ALA 12 Cb 1.04 -2.50 -0.05 0.00 0.00 0.00 0.00 19.45 17.94 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 0.27 3.96 -0.36 0.00 0.04 -1.26 -4.99 135.00 132.66 1icy s PRO 13 Ca 0.26 1.31 0.04 0.00 0.04 0.00 0.00 61.00 62.65 1icy s PRO 13 Cb 0.24 -2.17 0.32 0.00 0.04 0.00 0.00 34.50 32.93 1icy s PRO 13 CO -0.14 -0.29 1.32 0.00 0.04 0.00 0.00 177.00 177.93 1icy n ALA 14 N -0.78 -2.62 0.48 8.56 0.00 -1.26 -4.99 120.51 119.90 1icy n ALA 14 Ca 0.08 -0.65 0.03 0.00 0.00 0.00 0.00 53.44 52.90 1icy n ALA 14 Cb 0.53 -2.66 0.14 0.00 0.00 0.00 0.00 19.45 17.46 1icy n ALA 14 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1icy n GLU 15 N 0.59 2.26 0.05 0.00 4.71 -1.26 -4.31 120.64 122.67 1icy n GLU 15 Ca -0.02 -1.10 -0.14 0.00 -0.01 0.00 0.00 57.16 55.90 1icy n GLU 15 Cb 0.74 -1.67 -0.07 0.00 -1.01 0.00 0.00 31.44 29.43 1icy n GLU 15 CO 0.00 0.00 0.00 0.38 0.09 0.00 0.00 177.13 177.60 1icy h ASP 16 N 1.45 -1.33 0.65 1.62 2.03 -2.00 -0.49 116.42 118.34 1icy h ASP 16 Ca 0.00 0.16 -0.03 0.00 -0.73 0.00 0.00 57.03 56.44 1icy h ASP 16 Cb 0.91 0.52 -0.00 0.00 -0.83 0.00 0.00 39.33 39.93 1icy h ASP 16 CO 0.14 -0.46 -0.12 -0.07 -1.03 0.00 0.00 179.24 177.70 1icy h LEU 17 N -0.57 0.00 -0.46 0.15 3.38 -1.98 -2.03 115.31 113.80 1icy h LEU 17 Ca 0.05 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 1icy h LEU 17 Cb 0.66 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 1icy h LEU 17 CO -0.34 0.12 0.11 0.00 0.09 0.00 0.00 178.44 178.43 1icy h ALA 18 N 1.88 0.61 -0.09 1.53 0.00 -1.43 -0.83 119.26 120.92 1icy h ALA 18 Ca -0.00 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 1icy h ALA 18 Cb 0.47 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1icy h ALA 18 CO 0.02 0.29 -0.06 -0.09 0.00 0.00 0.00 179.25 179.41 1icy h ARG 19 N 0.62 0.20 0.00 0.00 2.43 -0.44 -2.89 114.38 114.30 1icy h ARG 19 Ca 0.15 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1icy h ARG 19 Cb 0.32 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 1icy h ARG 19 CO 0.00 0.58 0.14 1.88 -1.51 0.00 0.00 179.97 181.06 1icy h TYR 20 N -0.18 0.00 -0.31 2.20 0.05 -1.39 -2.36 116.97 114.98 1icy h TYR 20 Ca 0.02 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.77 1icy h TYR 20 Cb 0.52 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.25 1icy h TYR 20 CO 0.07 0.00 0.06 -0.92 -1.05 0.00 0.00 178.16 176.32 1icy h TYR 21 N 0.00 0.53 -0.67 4.88 3.20 -0.92 -2.37 116.97 121.62 1icy h TYR 21 Ca 0.00 -0.07 0.13 0.00 3.14 0.00 0.00 58.73 61.93 1icy h TYR 21 Cb 0.29 -0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.37 1icy h TYR 21 CO 0.00 0.58 0.45 0.66 -1.64 0.00 0.00 178.16 178.21 1icy h SER 22 N 0.33 0.35 0.68 -2.11 4.64 -1.55 -1.55 113.55 114.34 1icy h SER 22 Ca 0.09 0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 61.40 1icy h SER 22 Cb 0.33 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 1icy h SER 22 CO 0.00 0.19 -0.38 0.00 -0.87 0.00 0.00 176.83 175.78 1icy h ALA 23 N 1.67 -1.00 -0.11 5.18 0.00 -1.58 0.48 119.26 123.92 1icy h ALA 23 Ca 0.32 -0.21 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1icy h ALA 23 Cb 0.73 0.44 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 1icy h ALA 23 CO -0.09 -1.07 0.11 -0.07 0.00 0.00 0.00 179.25 178.13 1icy h LEU 24 N -0.99 0.00 -0.33 0.00 3.38 -1.44 0.14 115.31 116.07 1icy h LEU 24 Ca -0.09 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 1icy h LEU 24 Cb 0.78 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 1icy h LEU 24 CO 0.12 0.00 0.08 -0.09 0.09 0.00 0.00 178.44 178.64 1icy h ARG 25 N 0.00 0.52 -0.79 1.13 2.43 -0.06 -1.59 114.38 116.03 1icy h ARG 25 Ca 0.05 -0.12 0.11 0.00 -0.81 0.00 0.00 59.98 59.21 1icy h ARG 25 Cb 0.26 -0.07 -0.08 0.00 -0.42 0.00 0.00 29.97 29.67 1icy h ARG 25 CO -0.00 0.58 0.41 1.25 -1.51 0.00 0.00 179.97 180.70 1icy h HIS 26 N 0.37 0.74 -0.20 2.20 2.76 0.13 0.88 115.15 122.02 1icy h HIS 26 Ca 0.10 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.29 1icy h HIS 26 Cb 0.29 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 29.03 1icy h HIS 26 CO 0.01 0.25 0.06 1.88 -1.30 0.00 0.00 177.93 178.83 1icy h TYR 27 N 0.66 0.33 0.00 5.26 -1.99 -1.38 -2.06 116.97 117.79 1icy h TYR 27 Ca 0.40 -0.03 0.00 0.00 2.00 0.00 0.00 58.73 61.09 1icy h TYR 27 Cb 0.46 -0.10 0.00 0.00 2.00 0.00 0.00 36.73 39.09 1icy h TYR 27 CO -0.09 0.41 0.00 -0.89 -0.00 0.00 0.00 178.16 177.59 1icy n ILE 28 N -4.79 0.38 1.20 -2.88 5.41 -0.61 -2.47 119.36 115.60 1icy n ILE 28 Ca -0.04 0.09 0.14 0.00 1.00 0.00 0.00 62.75 63.94 1icy n ILE 28 Cb 0.15 -0.70 0.60 0.00 -0.71 0.00 0.00 39.64 38.98 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 -1.43 0.19 0.00 4.38 4.13 0.30 -3.20 115.26 119.62 1icy n ASN 29 Ca 0.07 -0.03 0.10 0.00 1.68 0.00 0.00 54.58 56.40 1icy n ASN 29 Cb 0.24 -0.23 0.56 0.00 -1.54 0.00 0.00 39.78 38.81 1icy n ASN 29 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1icy n LEU 30 N -1.31 0.00 -3.50 3.41 4.32 -1.03 -4.78 117.00 114.11 1icy n LEU 30 Ca 0.10 0.13 -0.10 0.00 -0.02 0.00 0.00 56.01 56.13 1icy n LEU 30 Cb 0.30 -0.13 -0.03 0.00 -1.62 0.00 0.00 43.42 41.94 1icy n LEU 30 CO 0.26 -0.05 0.63 0.00 -1.22 0.00 0.00 177.39 177.02 1icy s ALA 31 N -2.27 -1.79 -0.10 -1.18 0.00 -1.19 -5.14 121.76 110.09 1icy s ALA 31 Ca 0.26 1.00 -0.30 0.00 0.00 0.00 0.00 51.96 52.92 1icy s ALA 31 Cb 0.14 0.36 -0.03 0.00 0.00 0.00 0.00 23.12 23.59 1icy s ALA 31 CO 0.27 -0.64 1.23 -1.25 0.00 0.00 0.00 175.76 175.37 1icy s PRO 32 N -2.91 4.30 -1.21 0.00 0.04 -1.26 -4.93 135.00 129.03 1icy s PRO 32 Ca 0.03 1.68 -0.21 0.00 0.04 0.00 0.00 61.00 62.54 1icy s PRO 32 Cb -0.01 -3.64 -0.02 0.00 0.04 0.00 0.00 34.50 30.87 1icy s PRO 32 CO -0.08 -0.56 1.84 0.50 0.04 0.00 0.00 177.00 178.75 1icy s ARG 33 N 2.74 3.12 -0.41 4.56 3.52 -1.26 -4.56 118.95 126.66 1icy s ARG 33 Ca 0.56 -1.44 -0.00 0.00 -0.13 0.00 0.00 55.73 54.72 1icy s ARG 33 Cb -0.24 -5.35 0.22 0.00 -1.56 0.00 0.00 34.95 28.02 1icy s ARG 33 CO 0.19 -3.21 0.99 0.94 -0.81 0.00 0.00 175.30 173.40 1icy n GLN 34 N 8.39 0.32 -2.71 5.12 -0.06 -1.26 -5.05 117.38 122.13 1icy n GLN 34 Ca 0.46 -1.26 -0.25 0.00 -2.00 0.00 0.00 57.00 53.95 1icy n GLN 34 Cb 0.47 -0.60 -0.01 0.00 -4.06 0.00 0.00 30.24 26.03 1icy n GLN 34 CO 0.00 0.00 0.00 2.89 -0.20 0.00 0.00 177.06 179.75 1icy n ARG 35 N 2.39 2.96 -0.45 3.69 1.85 -1.26 -5.28 116.66 120.55 1icy n ARG 35 Ca 0.11 -4.43 0.00 0.00 -1.00 0.00 0.00 57.85 52.54 1icy n ARG 35 Cb 0.63 -2.11 0.00 0.00 -1.05 0.00 0.00 32.46 29.93 1icy n ARG 35 CO 0.00 0.00 0.00 0.98 -0.01 0.00 0.00 177.63 178.60