#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cf5 s LYS 2 N 0.00 1.51 -0.68 2.12 2.20 -0.29 -5.02 119.74 119.58 3cf5 s LYS 2 Ca 0.00 -2.08 -0.24 0.00 -0.36 0.00 0.00 55.97 53.29 3cf5 s LYS 2 Cb 0.00 -2.85 0.06 0.00 -1.51 0.00 0.00 37.83 33.52 3cf5 s LYS 2 CO 0.00 -1.07 1.06 0.08 -0.36 0.00 0.00 175.35 175.06 3cf5 s VAL 3 N 0.41 4.15 0.09 4.02 1.01 -1.24 -1.39 120.40 127.45 3cf5 s VAL 3 Ca 0.15 -0.11 0.10 0.00 0.00 0.00 0.00 61.98 62.12 3cf5 s VAL 3 Cb -0.23 -4.75 -0.03 0.00 0.00 0.00 0.00 36.38 31.37 3cf5 s VAL 3 CO -0.05 -1.56 -0.25 -0.13 0.00 0.00 0.00 175.10 173.11 3cf5 s ARG 4 N 4.56 1.43 0.25 2.72 0.52 -1.18 -4.95 118.95 122.29 3cf5 s ARG 4 Ca 0.26 -1.20 0.02 0.00 -0.52 0.00 0.00 55.73 54.29 3cf5 s ARG 4 Cb -0.14 -1.76 0.31 0.00 0.52 0.00 0.00 34.95 33.88 3cf5 s ARG 4 CO 0.12 0.43 1.63 1.03 0.02 0.00 0.00 175.30 178.53 3cf5 h SER 5 N 4.25 0.44 -3.87 0.23 0.87 -1.91 -3.32 113.55 110.25 3cf5 h SER 5 Ca -0.48 -0.20 -0.76 0.00 -1.23 0.00 0.00 61.79 59.12 3cf5 h SER 5 Cb 1.16 -0.12 -0.28 0.00 -0.44 0.00 0.00 62.40 62.72 3cf5 h SER 5 CO 0.41 0.81 -0.05 -0.55 -0.53 0.00 0.00 176.83 176.92 3cf5 s SER 6 N -6.87 6.31 -0.34 6.23 0.15 -1.26 -4.95 113.70 112.97 3cf5 s SER 6 Ca -0.06 -2.69 -0.18 0.00 0.70 0.00 0.00 55.95 53.73 3cf5 s SER 6 Cb 0.13 -2.11 -0.01 0.00 -1.71 0.00 0.00 66.02 62.32 3cf5 s SER 6 CO 0.80 -0.53 0.50 -0.69 1.20 0.00 0.00 173.24 174.52 3cf5 s VAL 7 N 0.18 5.03 0.04 4.45 1.01 -1.26 -5.04 120.40 124.82 3cf5 s VAL 7 Ca 0.17 0.35 -0.12 0.00 0.00 0.00 0.00 61.98 62.38 3cf5 s VAL 7 Cb -0.14 -3.94 0.01 0.00 0.00 0.00 0.00 36.38 32.31 3cf5 s VAL 7 CO -0.07 -0.18 0.25 -1.59 0.00 0.00 0.00 175.10 173.51 3cf5 s LYS 8 N 2.35 0.75 1.00 2.72 -2.85 -1.26 -5.08 119.74 117.37 3cf5 s LYS 8 Ca 0.18 -0.56 -0.18 0.00 -1.00 0.00 0.00 55.97 54.41 3cf5 s LYS 8 Cb -0.16 0.32 -0.11 0.00 -2.06 0.00 0.00 37.83 35.82 3cf5 s LYS 8 CO 0.13 -0.23 -0.67 1.63 0.10 0.00 0.00 175.35 176.31 3cf5 n LYS 9 N 0.64 -0.14 0.00 1.78 4.01 -1.26 -4.97 118.16 118.22 3cf5 n LYS 9 Ca -0.19 -0.03 0.00 0.00 -0.51 0.00 0.00 58.31 57.58 3cf5 n LYS 9 Cb 0.59 -1.20 0.00 0.00 -0.51 0.00 0.00 35.03 33.92 3cf5 n LYS 9 CO 0.00 0.00 0.00 -1.33 -1.11 0.00 0.00 177.40 174.96 3cf5 n MET 10 N 1.48 0.00 0.00 1.97 2.81 -1.26 -5.09 117.12 117.03 3cf5 n MET 10 Ca -0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 3cf5 n MET 10 Cb 0.59 -0.34 0.00 0.00 -0.71 0.00 0.00 33.22 32.76 3cf5 n MET 10 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3cf5 n ASP 12 N 0.00 3.62 0.00 0.00 9.92 -1.26 -2.29 116.55 126.54 3cf5 n ASP 12 Ca 0.00 -2.15 0.00 0.00 -0.53 0.00 0.00 54.79 52.11 3cf5 n ASP 12 Cb 0.00 -0.93 0.00 0.00 -0.64 0.00 0.00 41.12 39.55 3cf5 n ASP 12 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 3cf5 n ASN 13 N 2.91 0.00 -4.54 -2.24 3.02 -1.26 -5.04 115.26 108.11 3cf5 n ASN 13 Ca 0.30 0.00 -0.24 0.00 -0.03 0.00 0.00 54.58 54.62 3cf5 n ASN 13 Cb 0.51 0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.59 3cf5 n ASN 13 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3cf5 s LYS 15 N 8.46 3.31 -0.33 0.00 1.02 0.19 -4.85 119.74 127.54 3cf5 s LYS 15 Ca 1.05 -1.33 -0.28 0.00 0.02 0.00 0.00 55.97 55.42 3cf5 s LYS 15 Cb -0.36 -4.52 -0.03 0.00 -0.52 0.00 0.00 37.83 32.40 3cf5 s LYS 15 CO 0.25 -1.74 1.95 0.08 -0.92 0.00 0.00 175.35 174.97 3cf5 s VAL 16 N 3.18 3.31 0.28 3.17 1.01 -1.26 -2.86 120.40 127.23 3cf5 s VAL 16 Ca 0.24 0.31 0.08 0.00 0.00 0.00 0.00 61.98 62.61 3cf5 s VAL 16 Cb -0.13 -3.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 3cf5 s VAL 16 CO 0.01 -0.31 0.13 -0.69 0.00 0.00 0.00 175.10 174.24 3cf5 s VAL 17 N 7.71 3.74 -0.62 2.92 1.01 -1.10 -4.95 120.40 129.12 3cf5 s VAL 17 Ca 0.86 -1.63 0.04 0.00 0.00 0.00 0.00 61.98 61.25 3cf5 s VAL 17 Cb -0.24 -3.11 0.15 0.00 0.00 0.00 0.00 36.38 33.18 3cf5 s VAL 17 CO 0.33 -0.31 0.39 -0.13 0.00 0.00 0.00 175.10 175.38 3cf5 s ARG 18 N -3.80 2.21 0.00 2.72 1.81 -1.26 -1.07 118.95 119.56 3cf5 s ARG 18 Ca 0.34 -3.00 0.00 0.00 -1.72 0.00 0.00 55.73 51.35 3cf5 s ARG 18 Cb -0.06 -3.33 0.00 0.00 -0.45 0.00 0.00 34.95 31.11 3cf5 s ARG 18 CO 0.23 -1.21 0.00 0.54 -0.68 0.00 0.00 175.30 174.18 3cf5 n ARG 19 N 2.49 3.05 -1.52 3.54 1.74 -0.95 -4.77 116.66 120.23 3cf5 n ARG 19 Ca 0.13 0.00 -0.45 0.00 -0.77 0.00 0.00 57.85 56.76 3cf5 n ARG 19 Cb 0.34 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.73 3cf5 n ARG 19 CO 0.00 0.00 0.00 1.58 -1.52 0.00 0.00 177.63 177.69 3cf5 n HIS 20 N 0.00 1.68 -1.90 -1.55 -0.00 -1.26 -3.19 115.22 109.00 3cf5 n HIS 20 Ca 0.00 0.10 -0.04 0.00 0.46 0.00 0.00 57.72 58.24 3cf5 n HIS 20 Cb 0.00 -2.62 -0.01 0.00 -0.12 0.00 0.00 29.99 27.24 3cf5 n HIS 20 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 3cf5 n GLY 21 N 6.17 -0.27 3.01 1.57 0.00 -1.26 -4.84 105.19 109.56 3cf5 n GLY 21 Ca 0.37 0.01 -0.13 0.00 0.00 0.00 0.00 46.02 46.27 3cf5 n GLY 21 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3cf5 s ARG 22 N -3.11 0.43 -0.20 1.61 6.06 -1.19 -5.12 118.95 117.42 3cf5 s ARG 22 Ca 0.08 -0.54 -0.14 0.00 -2.50 0.00 0.00 55.73 52.64 3cf5 s ARG 22 Cb -0.05 -0.24 -0.04 0.00 0.06 0.00 0.00 34.95 34.68 3cf5 s ARG 22 CO 0.10 0.05 0.30 0.08 -2.50 0.00 0.00 175.30 173.33 3cf5 s VAL 23 N -0.98 5.27 0.40 7.11 1.01 -1.26 -2.25 120.40 129.70 3cf5 s VAL 23 Ca -0.07 0.51 0.03 0.00 0.00 0.00 0.00 61.98 62.45 3cf5 s VAL 23 Cb -0.07 -3.64 -0.01 0.00 0.00 0.00 0.00 36.38 32.66 3cf5 s VAL 23 CO 0.00 0.31 0.12 0.18 0.00 0.00 0.00 175.10 175.71 3cf5 n LEU 24 N 4.18 0.00 -3.40 3.92 4.32 -0.23 -2.86 117.00 122.93 3cf5 n LEU 24 Ca -0.11 -2.95 -0.19 0.00 -0.02 0.00 0.00 56.01 52.74 3cf5 n LEU 24 Cb 0.52 0.88 -0.09 0.00 -1.62 0.00 0.00 43.42 43.10 3cf5 n LEU 24 CO 0.38 -0.45 -0.20 -0.69 -1.22 0.00 0.00 177.39 175.22 3cf5 s VAL 25 N -2.95 -0.28 -0.36 4.08 1.01 -0.96 -2.71 120.40 118.23 3cf5 s VAL 25 Ca 0.17 -0.88 -0.18 0.00 0.00 0.00 0.00 61.98 61.08 3cf5 s VAL 25 Cb 0.01 -0.87 0.00 0.00 0.00 0.00 0.00 36.38 35.52 3cf5 s VAL 25 CO 0.12 -0.60 0.53 0.27 0.00 0.00 0.00 175.10 175.42 3cf5 s ILE 26 N 1.77 4.99 -0.02 2.22 -4.36 -1.14 -2.13 121.20 122.54 3cf5 s ILE 26 Ca 0.14 0.31 0.06 0.00 -0.26 0.00 0.00 60.65 60.90 3cf5 s ILE 26 Cb -0.16 -4.00 -0.01 0.00 1.25 0.00 0.00 42.46 39.54 3cf5 s ILE 26 CO -0.16 -0.26 -0.19 0.00 0.24 0.00 0.00 174.94 174.56 3cf5 h SER 28 N 5.79 0.24 -3.37 0.00 4.64 -1.97 -3.29 113.55 115.60 3cf5 h SER 28 Ca -0.37 0.26 -0.56 0.00 -0.47 0.00 0.00 61.79 60.66 3cf5 h SER 28 Cb 1.15 0.29 -0.05 0.00 -0.31 0.00 0.00 62.40 63.48 3cf5 h SER 28 CO 0.48 -0.43 0.09 0.21 -0.87 0.00 0.00 176.83 176.31 3cf5 s ASN 29 N -4.57 7.04 0.05 4.97 3.84 -1.26 -4.99 114.94 120.02 3cf5 s ASN 29 Ca -0.09 1.25 -0.16 0.00 0.21 0.00 0.00 52.86 54.07 3cf5 s ASN 29 Cb 0.34 -2.42 -0.26 0.00 -0.55 0.00 0.00 41.25 38.35 3cf5 s ASN 29 CO 0.78 -0.05 1.12 -0.37 -2.79 0.00 0.00 177.10 175.79 3cf5 h VAL 30 N 4.51 1.31 0.00 -5.21 -1.51 -1.99 -3.03 116.25 110.33 3cf5 h VAL 30 Ca -0.42 -2.33 0.00 0.00 -1.23 0.00 0.00 66.70 62.72 3cf5 h VAL 30 Cb 1.20 2.59 0.00 0.00 -2.13 0.00 0.00 31.29 32.95 3cf5 h VAL 30 CO 0.73 0.71 0.30 0.11 -1.23 0.00 0.00 177.57 178.19 3cf5 h LYS 31 N 0.24 0.00 0.00 5.19 6.56 -1.94 3.70 116.57 130.32 3cf5 h LYS 31 Ca -0.15 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.44 3cf5 h LYS 31 Cb 1.74 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.40 3cf5 h LYS 31 CO 0.21 0.00 -0.20 0.45 -2.06 0.00 0.00 179.45 177.85 3cf5 h HIS 32 N 0.00 0.00 -1.24 -1.35 3.86 -1.86 -3.45 115.15 111.11 3cf5 h HIS 32 Ca 0.00 0.00 -0.60 0.00 -1.16 0.00 0.00 60.37 58.61 3cf5 h HIS 32 Cb 0.60 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.06 3cf5 h HIS 32 CO 0.00 0.00 1.51 1.63 0.86 0.00 0.00 177.93 181.93 3cf5 n LYS 33 N -2.57 1.13 -3.90 2.45 5.02 1.23 -4.74 118.16 116.77 3cf5 n LYS 33 Ca 0.04 0.25 -0.25 0.00 -2.02 0.00 0.00 58.31 56.33 3cf5 n LYS 33 Cb 0.48 -2.70 -0.02 0.00 -0.02 0.00 0.00 35.03 32.77 3cf5 n LYS 33 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 3cf5 s GLN 34 N 6.90 2.30 0.00 1.97 -0.21 -0.91 -1.14 119.66 128.57 3cf5 s GLN 34 Ca 1.08 -1.92 0.00 0.00 0.02 0.00 0.00 55.36 54.54 3cf5 s GLN 34 Cb -0.67 -2.11 0.00 0.00 1.00 0.00 0.00 33.01 31.23 3cf5 s GLN 34 CO 0.42 -0.45 0.00 -2.13 -2.12 0.00 0.00 175.29 171.01 3cf5 n ARG 35 N -1.62 0.00 -0.22 2.91 0.63 -0.49 -2.26 116.66 115.60 3cf5 n ARG 35 Ca -0.01 0.00 0.12 0.00 -0.92 0.00 0.00 57.85 57.04 3cf5 n ARG 35 Cb 0.64 0.00 0.41 0.00 0.45 0.00 0.00 32.46 33.96 3cf5 n ARG 35 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 3cf5 h GLN 36 N 0.00 0.60 0.00 -0.14 4.20 -1.62 -3.13 115.11 115.03 3cf5 h GLN 36 Ca 0.00 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.67 3cf5 h GLN 36 Cb 0.00 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.64 3cf5 h GLN 36 CO 0.00 0.40 0.00 0.41 -0.67 0.00 0.00 178.83 178.97