#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ne5 n ARG 2 N 0.00 -4.12 0.00 -1.24 3.00 -1.26 -5.03 116.66 108.01 1ne5 n ARG 2 Ca 0.00 3.10 0.00 0.00 -0.00 0.00 0.00 57.85 60.95 1ne5 n ARG 2 Cb 0.00 -3.97 0.00 0.00 0.00 0.00 0.00 32.46 28.49 1ne5 n ARG 2 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.63 177.23 1ne5 n ASP 3 N 1.46 0.00 -2.49 6.15 5.75 -1.26 -5.08 116.55 121.08 1ne5 n ASP 3 Ca -0.05 0.12 -0.04 0.00 -0.01 0.00 0.00 54.79 54.80 1ne5 n ASP 3 Cb 0.08 -0.19 -0.04 0.00 -1.03 0.00 0.00 41.12 39.95 1ne5 n ASP 3 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 1ne5 n SER 4 N -1.34 -2.70 0.17 -1.12 2.88 -1.26 -4.81 113.62 105.44 1ne5 n SER 4 Ca 0.00 1.44 0.13 0.00 -1.33 0.00 0.00 58.87 59.11 1ne5 n SER 4 Cb 0.00 -5.14 0.60 0.00 -0.75 0.00 0.00 64.21 58.92 1ne5 n SER 4 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ne5 h VAL 6 N 0.00 0.34 -0.33 0.00 2.07 -1.86 0.26 116.25 116.73 1ne5 h VAL 6 Ca 0.00 -0.01 -0.25 0.00 0.82 0.00 0.00 66.70 67.26 1ne5 h VAL 6 Cb 0.22 0.32 -0.26 0.00 -1.52 0.00 0.00 31.29 30.05 1ne5 h VAL 6 CO 0.00 0.00 -0.77 -0.67 0.02 0.00 0.00 177.57 176.15 1ne5 n ASP 7 N -4.17 2.75 0.09 0.57 -0.08 -1.15 -4.30 116.55 110.26 1ne5 n ASP 7 Ca 0.29 -3.34 0.00 0.00 -1.51 0.00 0.00 54.79 50.23 1ne5 n ASP 7 Cb 1.36 -0.42 0.00 0.00 2.34 0.00 0.00 41.12 44.40 1ne5 n ASP 7 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 1ne5 n LYS 8 N -0.68 0.00 -3.76 -0.67 3.00 0.86 -5.09 118.16 111.82 1ne5 n LYS 8 Ca 0.25 0.00 -0.30 0.00 -0.00 0.00 0.00 58.31 58.26 1ne5 n LYS 8 Cb 0.87 -0.28 -0.04 0.00 0.00 0.00 0.00 35.03 35.57 1ne5 n LYS 8 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1ne5 s SER 9 N -5.54 6.42 0.58 3.14 0.15 -0.95 -5.10 113.70 112.40 1ne5 s SER 9 Ca 0.00 0.44 -0.05 0.00 0.70 0.00 0.00 55.95 57.03 1ne5 s SER 9 Cb 0.00 -2.03 0.01 0.00 -1.71 0.00 0.00 66.02 62.29 1ne5 s SER 9 CO 0.00 0.06 0.88 -0.60 1.20 0.00 0.00 173.24 174.78 1ne5 s ARG 10 N -2.81 2.96 0.24 5.44 3.52 -1.26 -4.67 118.95 122.36 1ne5 s ARG 10 Ca 0.38 -0.03 -0.00 0.00 -0.13 0.00 0.00 55.73 55.95 1ne5 s ARG 10 Cb -0.12 -2.30 -0.03 0.00 -1.56 0.00 0.00 34.95 30.94 1ne5 s ARG 10 CO 0.27 -0.65 0.21 0.00 -0.81 0.00 0.00 175.30 174.32 1ne5 n ALA 12 N -0.37 -0.06 -0.33 0.00 0.00 -1.26 -4.54 120.51 113.95 1ne5 n ALA 12 Ca 0.03 -0.49 0.05 0.00 0.00 0.00 0.00 53.44 53.03 1ne5 n ALA 12 Cb 0.65 0.06 0.21 0.00 0.00 0.00 0.00 19.45 20.36 1ne5 n ALA 12 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1ne5 h LYS 13 N 0.00 0.85 0.00 0.00 3.64 -1.96 -0.58 116.57 118.52 1ne5 h LYS 13 Ca -0.09 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 1ne5 h LYS 13 Cb 0.32 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 1ne5 h LYS 13 CO 0.09 0.56 0.00 2.48 -2.27 0.00 0.00 179.45 180.31 1ne5 n TYR 14 N -4.70 0.00 0.00 1.91 0.18 -1.26 -1.08 117.16 112.22 1ne5 n TYR 14 Ca 0.16 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.94 1ne5 n TYR 14 Cb 0.33 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.29 1ne5 n TYR 14 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1ne5 n GLY 15 N -0.42 0.26 3.36 -7.48 0.00 -0.93 -4.94 105.19 95.05 1ne5 n GLY 15 Ca 0.00 -1.62 -0.34 0.00 0.00 0.00 0.00 46.02 44.06 1ne5 n GLY 15 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1ne5 s TYR 16 N 0.00 2.91 -0.25 1.61 6.14 -1.26 -0.91 117.35 125.59 1ne5 s TYR 16 Ca 0.00 -0.75 0.02 0.00 0.64 0.00 0.00 57.07 56.98 1ne5 s TYR 16 Cb 0.00 -1.98 0.06 0.00 0.42 0.00 0.00 41.96 40.47 1ne5 s TYR 16 CO 0.00 -0.35 -0.07 -0.47 0.64 0.00 0.00 175.55 175.30 1ne5 s TYR 17 N 0.86 2.82 0.33 4.97 5.04 -1.26 -4.99 117.35 125.11 1ne5 s TYR 17 Ca -0.02 -2.05 0.11 0.00 -2.44 0.00 0.00 57.07 52.67 1ne5 s TYR 17 Cb -0.15 -1.77 1.00 0.00 0.35 0.00 0.00 41.96 41.38 1ne5 s TYR 17 CO 0.01 -0.83 1.65 0.37 -1.34 0.00 0.00 175.55 175.41 1ne5 h GLN 18 N 7.86 0.26 -0.85 4.97 5.75 -1.98 0.42 115.11 131.54 1ne5 h GLN 18 Ca -0.18 -0.02 0.03 0.00 -0.15 0.00 0.00 58.65 58.33 1ne5 h GLN 18 Cb 1.06 -0.06 -0.05 0.00 1.07 0.00 0.00 27.48 29.50 1ne5 h GLN 18 CO 0.44 0.17 0.55 1.49 -2.65 0.00 0.00 178.83 178.83 1ne5 h GLU 19 N 0.27 1.04 0.38 1.69 4.81 -1.94 -0.84 114.58 119.99 1ne5 h GLU 19 Ca 0.69 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.84 1ne5 h GLU 19 Cb 1.55 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 30.70 1ne5 h GLU 19 CO -0.64 0.69 -0.18 0.00 -0.73 0.00 0.00 179.01 178.15 1ne5 h GLN 21 N -0.78 0.00 -0.21 0.00 3.07 -1.27 -1.38 115.11 114.55 1ne5 h GLN 21 Ca -0.05 0.00 -0.10 0.00 0.09 0.00 0.00 58.65 58.59 1ne5 h GLN 21 Cb 0.52 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.08 1ne5 h GLN 21 CO 0.09 0.00 -0.27 0.22 0.09 0.00 0.00 178.83 178.96 1ne5 h ASP 22 N 0.00 0.59 0.74 0.06 1.82 -0.98 -2.33 116.42 116.32 1ne5 h ASP 22 Ca 0.13 -0.50 -0.04 0.00 -0.39 0.00 0.00 57.03 56.23 1ne5 h ASP 22 Cb 0.55 -0.17 0.01 0.00 0.68 0.00 0.00 39.33 40.40 1ne5 h ASP 22 CO -0.00 0.98 -0.35 0.00 -1.61 0.00 0.00 179.24 178.25 1ne5 h LYS 25 N -0.62 0.44 0.00 0.00 2.10 -1.45 0.55 116.57 117.60 1ne5 h LYS 25 Ca 0.04 -0.03 -0.06 0.00 -2.00 0.00 0.00 60.65 58.60 1ne5 h LYS 25 Cb 0.68 -0.10 -0.01 0.00 -0.90 0.00 0.00 32.23 31.90 1ne5 h LYS 25 CO -0.33 0.29 -0.30 -0.97 -2.00 0.00 0.00 179.45 176.15 1ne5 h ASN 26 N 0.46 0.00 0.68 7.07 -0.73 -0.16 -2.93 115.58 119.97 1ne5 h ASN 26 Ca 0.48 0.00 -0.21 0.00 1.87 0.00 0.00 56.30 58.44 1ne5 h ASN 26 Cb 1.13 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.70 1ne5 h ASN 26 CO -0.20 0.30 -0.95 0.00 -0.37 0.00 0.00 177.43 176.21 1ne5 h ALA 27 N 1.70 0.43 0.00 1.57 0.00 0.16 -3.47 119.26 119.66 1ne5 h ALA 27 Ca -0.00 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.12 1ne5 h ALA 27 Cb 0.80 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1ne5 h ALA 27 CO 0.04 0.99 0.00 0.41 0.00 0.00 0.00 179.25 180.69 1ne5 n GLY 28 N 1.05 0.21 0.00 0.00 0.00 -0.72 -5.11 105.19 100.62 1ne5 n GLY 28 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1ne5 n GLY 28 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ne5 n HIS 29 N 0.00 0.00 -0.08 1.61 8.25 -1.13 -5.00 115.22 118.87 1ne5 n HIS 29 Ca 0.00 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.32 1ne5 n HIS 29 Cb 0.00 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.06 1ne5 n HIS 29 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1ne5 n ASN 30 N 0.00 1.68 -0.04 0.41 4.13 -1.26 -4.29 115.26 115.88 1ne5 n ASN 30 Ca 0.00 0.28 0.00 0.00 1.68 0.00 0.00 54.58 56.54 1ne5 n ASN 30 Cb 0.00 -0.65 0.00 0.00 -1.54 0.00 0.00 39.78 37.59 1ne5 n ASN 30 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ne5 n GLY 31 N 1.78 2.23 3.57 7.41 0.00 -1.26 -4.11 105.19 114.81 1ne5 n GLY 31 Ca -0.24 -0.71 -0.11 0.00 0.00 0.00 0.00 46.02 44.95 1ne5 n GLY 31 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ne5 s GLY 32 N -0.38 0.86 0.42 -0.02 0.00 -1.26 -0.82 107.32 106.11 1ne5 s GLY 32 Ca 0.00 -1.10 0.06 0.00 0.00 0.00 0.00 44.72 43.68 1ne5 s GLY 32 CO 0.00 -0.73 0.01 -1.08 0.00 0.00 0.00 173.10 171.30 1ne5 s THR 33 N -3.50 1.77 -0.17 0.90 -1.32 -0.10 -4.39 115.64 108.83 1ne5 s THR 33 Ca 0.25 -2.00 -0.00 0.00 -1.21 0.00 0.00 61.69 58.73 1ne5 s THR 33 Cb -0.01 -2.82 0.00 0.00 -1.51 0.00 0.00 72.50 68.16 1ne5 s THR 33 CO 0.13 0.00 -0.15 0.00 -2.21 0.00 0.00 174.62 172.39 1ne5 s MET 35 N 1.06 1.46 -1.09 0.00 -1.94 -0.50 -2.18 119.30 116.11 1ne5 s MET 35 Ca -0.01 -2.17 -0.16 0.00 -1.71 0.00 0.00 55.69 51.64 1ne5 s MET 35 Cb -0.15 -2.56 -0.02 0.00 2.01 0.00 0.00 34.83 34.11 1ne5 s MET 35 CO -0.04 -1.15 0.82 0.34 -0.01 0.00 0.00 175.02 174.97 1ne5 n PHE 36 N 3.41 -2.08 -0.94 -0.03 7.35 -0.24 -1.48 117.46 123.46 1ne5 n PHE 36 Ca 0.08 0.58 0.00 0.00 -0.76 0.00 0.00 57.45 57.35 1ne5 n PHE 36 Cb 0.34 -3.61 0.00 0.00 0.35 0.00 0.00 39.48 36.56 1ne5 n PHE 36 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 1ne5 n PHE 37 N -3.84 0.00 -3.69 -5.13 3.72 -0.22 -4.99 117.46 103.31 1ne5 n PHE 37 Ca -0.09 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 56.95 1ne5 n PHE 37 Cb 0.60 -0.77 -0.09 0.00 -0.94 0.00 0.00 39.48 38.27 1ne5 n PHE 37 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1ne5 s LYS 38 N -0.71 4.06 -0.66 -1.08 -0.14 -0.55 -4.13 119.74 116.54 1ne5 s LYS 38 Ca 0.00 -0.28 -0.21 0.00 -1.36 0.00 0.00 55.97 54.13 1ne5 s LYS 38 Cb 0.00 -3.50 0.09 0.00 -1.68 0.00 0.00 37.83 32.73 1ne5 s LYS 38 CO 0.00 0.08 0.88 0.00 -0.76 0.00 0.00 175.35 175.55 1ne5 s LYS 40 N 3.40 2.46 0.13 0.00 2.47 -0.83 -3.18 119.74 124.19 1ne5 s LYS 40 Ca 0.19 -1.64 0.02 0.00 -1.56 0.00 0.00 55.97 52.98 1ne5 s LYS 40 Cb -0.18 -2.33 0.02 0.00 -1.46 0.00 0.00 37.83 33.87 1ne5 s LYS 40 CO 0.07 -0.32 0.18 0.00 0.16 0.00 0.00 175.35 175.44