#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 3.55 -0.05 -0.72 0.04 -1.26 -4.98 135.00 131.58 1icy s PRO 2 Ca 0.00 0.42 -0.09 0.00 0.04 0.00 0.00 61.00 61.37 1icy s PRO 2 Cb 0.00 -4.00 -0.05 0.00 0.04 0.00 0.00 34.50 30.49 1icy s PRO 2 CO 0.00 -1.62 0.26 -1.12 0.04 0.00 0.00 177.00 174.55 1icy s SER 3 N 3.10 6.55 -0.51 6.66 0.01 -1.26 -5.04 113.70 123.21 1icy s SER 3 Ca 0.47 0.65 0.07 0.00 1.31 0.00 0.00 55.95 58.45 1icy s SER 3 Cb -0.08 -2.13 0.26 0.00 0.21 0.00 0.00 66.02 64.28 1icy s SER 3 CO 0.28 0.34 0.65 2.29 0.41 0.00 0.00 173.24 177.21 1icy n LYS 4 N 1.68 1.66 -1.23 12.44 -0.00 -1.26 -5.12 118.16 126.34 1icy n LYS 4 Ca -0.16 -3.96 -0.30 0.00 -0.00 0.00 0.00 58.31 53.90 1icy n LYS 4 Cb 0.54 -1.75 0.13 0.00 -0.00 0.00 0.00 35.03 33.94 1icy n LYS 4 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 1icy s PRO 5 N -1.94 1.44 0.03 -1.58 0.04 -1.26 -5.07 135.00 126.65 1icy s PRO 5 Ca 0.38 0.86 0.07 0.00 0.04 0.00 0.00 61.00 62.36 1icy s PRO 5 Cb 0.18 -1.83 -0.02 0.00 0.04 0.00 0.00 34.50 32.87 1icy s PRO 5 CO -0.07 -2.13 -0.20 0.16 0.04 0.00 0.00 177.00 174.80 1icy s ASP 6 N -3.44 2.40 -0.33 6.66 -4.77 -1.26 -5.11 116.67 110.83 1icy s ASP 6 Ca 0.63 -0.48 -0.08 0.00 -3.30 0.00 0.00 52.55 49.32 1icy s ASP 6 Cb -0.18 -0.21 0.19 0.00 -1.09 0.00 0.00 42.92 41.63 1icy s ASP 6 CO 0.57 0.17 1.01 0.21 0.70 0.00 0.00 175.17 177.83 1icy s ASN 7 N -1.01 -0.45 0.65 2.11 3.84 -1.26 -5.17 114.94 113.64 1icy s ASN 7 Ca 0.07 -0.19 -0.15 0.00 0.21 0.00 0.00 52.86 52.80 1icy s ASN 7 Cb -0.08 0.66 -0.01 0.00 -0.55 0.00 0.00 41.25 41.27 1icy s ASN 7 CO 0.01 -0.05 1.10 -2.16 -2.79 0.00 0.00 177.10 173.21 1icy s PRO 8 N 2.08 2.91 -0.18 0.43 0.04 -1.26 -5.04 135.00 133.98 1icy s PRO 8 Ca 0.16 1.35 -0.09 0.00 0.04 0.00 0.00 61.00 62.46 1icy s PRO 8 Cb 0.02 -1.97 -0.05 0.00 0.04 0.00 0.00 34.50 32.54 1icy s PRO 8 CO -0.15 -1.16 0.13 0.20 0.04 0.00 0.00 177.00 176.06 1icy s GLY 9 N -2.63 2.07 -0.37 0.56 0.00 -1.26 -4.88 107.32 100.80 1icy s GLY 9 Ca 0.66 -0.68 0.07 0.00 0.00 0.00 0.00 44.72 44.78 1icy s GLY 9 CO 0.41 -0.01 0.61 1.85 0.00 0.00 0.00 173.10 175.96 1icy s GLU 10 N -0.03 0.73 -0.78 2.90 2.12 -1.26 -5.05 118.70 117.32 1icy s GLU 10 Ca 0.10 -0.01 -0.04 0.00 0.36 0.00 0.00 54.97 55.39 1icy s GLU 10 Cb -0.11 0.13 0.01 0.00 0.26 0.00 0.00 34.13 34.41 1icy s GLU 10 CO -0.00 -1.14 0.54 -3.47 -0.54 0.00 0.00 175.26 170.65 1icy n ASP 11 N 4.75 -4.20 0.00 -1.70 2.03 -1.26 -4.65 116.55 111.53 1icy n ASP 11 Ca 0.09 -0.92 0.00 0.00 0.52 0.00 0.00 54.79 54.48 1icy n ASP 11 Cb 0.56 -1.42 0.00 0.00 -0.72 0.00 0.00 41.12 39.54 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 -2.67 0.00 -1.95 -1.67 0.00 -1.26 -5.15 120.51 107.80 1icy n ALA 12 Ca -0.27 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 52.88 1icy n ALA 12 Cb 0.61 0.00 0.18 0.00 0.00 0.00 0.00 19.45 20.24 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 -2.00 0.69 -0.40 0.00 0.04 -1.26 -5.06 135.00 127.01 1icy s PRO 13 Ca 0.00 -0.64 0.05 0.00 0.04 0.00 0.00 61.00 60.45 1icy s PRO 13 Cb 0.00 -1.94 0.31 0.00 0.04 0.00 0.00 34.50 32.92 1icy s PRO 13 CO 0.00 -2.32 1.22 0.00 0.04 0.00 0.00 177.00 175.95 1icy n ALA 14 N -3.63 -1.94 0.09 8.56 0.00 -1.26 -4.96 120.51 117.36 1icy n ALA 14 Ca 0.16 -0.96 -0.05 0.00 0.00 0.00 0.00 53.44 52.59 1icy n ALA 14 Cb 0.60 -2.08 0.12 0.00 0.00 0.00 0.00 19.45 18.09 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 2.04 0.17 0.00 1.02 -1.26 -4.40 120.64 118.80 1icy n GLU 15 Ca 0.01 -1.34 -0.14 0.00 -0.02 0.00 0.00 57.16 55.67 1icy n GLU 15 Cb 0.72 -1.65 -0.08 0.00 -0.02 0.00 0.00 31.44 30.41 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 0.99 -0.32 0.06 1.62 1.82 -2.01 -1.55 116.42 117.02 1icy h ASP 16 Ca 0.16 -0.07 -0.00 0.00 -0.39 0.00 0.00 57.03 56.73 1icy h ASP 16 Cb 1.54 0.08 -0.00 0.00 0.68 0.00 0.00 39.33 41.64 1icy h ASP 16 CO 0.37 -0.13 -0.02 -0.07 -1.61 0.00 0.00 179.24 177.78 1icy h LEU 17 N -0.50 0.00 -0.59 2.28 3.38 -1.98 -1.62 115.31 116.27 1icy h LEU 17 Ca -0.04 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1icy h LEU 17 Cb 0.37 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 1icy h LEU 17 CO 0.06 0.02 0.25 0.00 0.09 0.00 0.00 178.44 178.87 1icy h ALA 18 N 1.98 0.76 -0.13 1.53 0.00 -1.57 0.95 119.26 122.78 1icy h ALA 18 Ca -0.00 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.69 1icy h ALA 18 Cb 0.05 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1icy h ALA 18 CO 0.00 0.36 -0.17 -0.09 0.00 0.00 0.00 179.25 179.35 1icy h ARG 19 N 0.81 0.35 0.00 0.00 2.43 -0.96 -2.73 114.38 114.28 1icy h ARG 19 Ca 0.20 -0.20 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1icy h ARG 19 Cb 0.17 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 1icy h ARG 19 CO -0.02 0.77 0.04 -0.92 -1.51 0.00 0.00 179.97 178.33 1icy h TYR 20 N -0.04 0.00 0.21 2.20 3.20 -1.27 -2.47 116.97 118.80 1icy h TYR 20 Ca 0.02 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 1icy h TYR 20 Cb 0.72 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.99 1icy h TYR 20 CO 0.09 0.00 -0.10 -0.92 -1.64 0.00 0.00 178.16 175.59 1icy h TYR 21 N 0.00 -0.27 -0.85 -3.82 3.20 -0.48 -1.77 116.97 112.98 1icy h TYR 21 Ca 0.00 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.86 1icy h TYR 21 Cb 0.09 0.09 -0.04 0.00 1.54 0.00 0.00 36.73 38.41 1icy h TYR 21 CO 0.00 -0.11 0.53 0.66 -1.64 0.00 0.00 178.16 177.61 1icy h SER 22 N -0.36 1.00 0.14 -2.11 4.64 -1.55 -2.38 113.55 112.94 1icy h SER 22 Ca -0.03 -0.05 -0.00 0.00 -0.47 0.00 0.00 61.79 61.24 1icy h SER 22 Cb 0.28 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 1icy h SER 22 CO 0.05 0.75 -0.10 0.00 -0.87 0.00 0.00 176.83 176.66 1icy h ALA 23 N 1.42 -0.22 -0.05 5.18 0.00 -1.46 0.18 119.26 124.31 1icy h ALA 23 Ca 0.31 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.19 1icy h ALA 23 Cb -0.08 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1icy h ALA 23 CO -0.06 -0.64 0.05 1.37 0.00 0.00 0.00 179.25 179.97 1icy h LEU 24 N -0.24 0.00 -1.49 0.00 8.10 -1.21 -0.82 115.31 119.65 1icy h LEU 24 Ca -0.01 0.00 -0.04 0.00 0.11 0.00 0.00 57.88 57.94 1icy h LEU 24 Cb 0.21 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.42 1icy h LEU 24 CO -0.00 0.00 -0.12 -0.09 -4.11 0.00 0.00 178.44 174.12 1icy h ARG 25 N 0.00 0.18 -0.79 0.17 2.43 -0.44 -2.04 114.38 113.89 1icy h ARG 25 Ca 0.02 -0.04 0.16 0.00 -0.81 0.00 0.00 59.98 59.31 1icy h ARG 25 Cb 0.11 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.58 1icy h ARG 25 CO -0.00 0.31 0.52 1.25 -1.51 0.00 0.00 179.97 180.54 1icy h HIS 26 N 0.17 0.51 0.67 2.20 2.76 -0.63 0.31 115.15 121.15 1icy h HIS 26 Ca 0.04 0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.19 1icy h HIS 26 Cb 0.33 -0.16 0.01 0.00 1.55 0.00 0.00 27.41 29.13 1icy h HIS 26 CO 0.00 0.18 -0.32 1.88 -1.30 0.00 0.00 177.93 178.38 1icy h TYR 27 N 0.43 -0.83 0.00 5.26 -1.99 -1.51 -2.14 116.97 116.19 1icy h TYR 27 Ca 0.39 -0.02 -0.00 0.00 2.00 0.00 0.00 58.73 61.10 1icy h TYR 27 Cb 0.90 0.27 -0.00 0.00 2.00 0.00 0.00 36.73 39.90 1icy h TYR 27 CO -0.00 -0.52 -0.01 0.82 -0.00 0.00 0.00 178.16 178.45 1icy h ILE 28 N -1.12 0.35 0.00 -2.88 2.04 -1.50 0.13 117.51 114.54 1icy h ILE 28 Ca -0.09 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.72 1icy h ILE 28 Cb 0.69 1.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.80 1icy h ILE 28 CO 0.15 0.01 0.00 0.78 0.00 0.00 0.00 178.15 179.09 1icy h ASN 29 N 0.00 0.00 0.15 1.72 2.35 -0.10 -3.00 115.58 116.70 1icy h ASN 29 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1icy h ASN 29 Cb 0.03 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.40 1icy h ASN 29 CO 0.00 0.00 0.00 -0.11 -1.65 0.00 0.00 177.43 175.67 1icy n LEU 30 N -2.77 0.00 -2.95 1.61 7.94 0.47 -3.91 117.00 117.39 1icy n LEU 30 Ca 0.01 0.19 -0.01 0.00 -1.11 0.00 0.00 56.01 55.10 1icy n LEU 30 Cb 0.30 -0.19 0.00 0.00 0.53 0.00 0.00 43.42 44.06 1icy n LEU 30 CO 0.25 -0.12 0.18 0.00 -1.11 0.00 0.00 177.39 176.60 1icy s ALA 31 N -2.39 -2.74 -0.09 1.96 0.00 -1.13 -5.12 121.76 112.26 1icy s ALA 31 Ca 0.14 0.16 -0.29 0.00 0.00 0.00 0.00 51.96 51.97 1icy s ALA 31 Cb 0.08 -2.79 -0.06 0.00 0.00 0.00 0.00 23.12 20.35 1icy s ALA 31 CO 0.17 -2.29 1.91 -1.25 0.00 0.00 0.00 175.76 174.30 1icy s PRO 32 N 1.44 3.85 -0.56 0.00 0.04 -1.25 -4.90 135.00 133.62 1icy s PRO 32 Ca 0.21 2.23 -0.27 0.00 0.04 0.00 0.00 61.00 63.21 1icy s PRO 32 Cb -0.00 -4.16 -0.03 0.00 0.04 0.00 0.00 34.50 30.35 1icy s PRO 32 CO -0.08 -1.27 1.98 1.03 0.04 0.00 0.00 177.00 178.70 1icy s ARG 33 N 4.87 2.58 -0.38 4.56 3.00 -1.26 -4.76 118.95 127.55 1icy s ARG 33 Ca 0.85 0.87 -0.03 0.00 0.00 0.00 0.00 55.73 57.42 1icy s ARG 33 Cb -0.35 -4.41 0.21 0.00 0.00 0.00 0.00 34.95 30.39 1icy s ARG 33 CO 0.36 -2.77 1.03 0.94 0.00 0.00 0.00 175.30 174.86 1icy n GLN 34 N 9.08 0.21 -3.20 3.54 0.00 -1.26 -5.08 117.38 120.67 1icy n GLN 34 Ca 0.24 -1.07 -0.23 0.00 -0.00 0.00 0.00 57.00 55.95 1icy n GLN 34 Cb 0.52 -0.27 -0.06 0.00 0.00 0.00 0.00 30.24 30.43 1icy n GLN 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1icy n ARG 35 N 2.56 1.15 0.00 3.69 1.74 -1.26 -5.28 116.66 119.25 1icy n ARG 35 Ca 0.12 -3.53 0.00 0.00 -0.77 0.00 0.00 57.85 53.67 1icy n ARG 35 Cb 0.63 -1.53 0.00 0.00 -1.02 0.00 0.00 32.46 30.54 1icy n ARG 35 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09