#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jx8 s PRO 2 N 0.00 1.41 0.47 3.23 0.04 -1.26 -4.70 135.00 134.19 2jx8 s PRO 2 Ca 0.00 0.57 0.25 0.00 0.04 0.00 0.00 61.00 61.86 2jx8 s PRO 2 Cb 0.00 -1.85 1.28 0.00 0.04 0.00 0.00 34.50 33.97 2jx8 s PRO 2 CO 0.00 -2.07 1.84 1.49 0.04 0.00 0.00 177.00 178.30 2jx8 h GLU 3 N -1.42 0.21 -0.69 4.56 4.22 -2.05 0.48 114.58 119.90 2jx8 h GLU 3 Ca -0.50 -0.01 0.05 0.00 0.08 0.00 0.00 59.36 58.98 2jx8 h GLU 3 Cb 1.30 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 30.45 2jx8 h GLU 3 CO 0.59 0.14 0.40 1.49 -2.18 0.00 0.00 179.01 179.45 2jx8 h GLU 4 N 0.22 0.73 -0.01 1.92 4.81 -2.01 -1.44 114.58 118.79 2jx8 h GLU 4 Ca 0.50 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.65 2jx8 h GLU 4 Cb 1.57 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.79 2jx8 h GLU 4 CO -0.13 0.48 -0.12 -0.07 -0.73 0.00 0.00 179.01 178.44 2jx8 h LEU 5 N 0.75 0.13 -1.44 1.64 3.38 -1.25 -3.18 115.31 115.33 2jx8 h LEU 5 Ca 0.30 -0.70 0.25 0.00 0.09 0.00 0.00 57.88 57.81 2jx8 h LEU 5 Cb 0.14 -0.04 -0.08 0.00 0.09 0.00 0.00 40.66 40.77 2jx8 h LEU 5 CO -0.16 0.82 0.66 0.58 0.09 0.00 0.00 178.44 180.42 2jx8 h VAL 6 N -0.54 0.57 -0.64 1.22 2.07 -1.21 0.26 116.25 117.99 2jx8 h VAL 6 Ca -0.01 -0.13 -0.08 0.00 0.82 0.00 0.00 66.70 67.30 2jx8 h VAL 6 Cb 0.82 0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 30.72 2jx8 h VAL 6 CO 0.02 0.07 0.08 0.45 0.02 0.00 0.00 177.57 178.22 2jx8 h HIS 7 N 0.38 1.13 0.00 1.57 3.86 -1.25 -2.31 115.15 118.52 2jx8 h HIS 7 Ca 0.55 -0.16 -0.03 0.00 -1.16 0.00 0.00 60.37 59.57 2jx8 h HIS 7 Cb 1.42 -0.31 -0.00 0.00 1.06 0.00 0.00 27.41 29.58 2jx8 h HIS 7 CO -0.00 0.96 -0.14 0.00 0.86 0.00 0.00 177.93 179.60 2jx8 h ALA 8 N 1.09 1.29 0.00 2.45 0.00 -0.48 -3.46 119.26 120.16 2jx8 h ALA 8 Ca 0.19 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2jx8 h ALA 8 Cb 0.45 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2jx8 h ALA 8 CO 0.02 0.18 0.00 0.41 0.00 0.00 0.00 179.25 179.86 2jx8 n GLY 9 N -0.63 1.99 3.93 0.00 0.00 -0.87 -4.52 105.19 105.09 2jx8 n GLY 9 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.75 2jx8 n GLY 9 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2jx8 s TRP 10 N -2.00 3.45 -0.11 1.61 0.52 -1.19 -0.24 118.94 120.99 2jx8 s TRP 10 Ca 0.00 0.51 -0.30 0.00 0.02 0.00 0.00 56.10 56.33 2jx8 s TRP 10 Cb 0.00 -2.17 0.09 0.00 -1.15 0.00 0.00 33.47 30.24 2jx8 s TRP 10 CO 0.00 -0.17 0.79 -1.83 0.02 0.00 0.00 176.95 175.76 2jx8 s GLU 11 N -4.56 0.89 -0.18 4.98 -1.05 -1.17 -4.67 118.70 112.94 2jx8 s GLU 11 Ca 0.45 0.28 -0.14 0.00 -0.15 0.00 0.00 54.97 55.41 2jx8 s GLU 11 Cb -0.10 0.42 -0.05 0.00 -0.44 0.00 0.00 34.13 33.96 2jx8 s GLU 11 CO 0.40 -0.26 0.30 0.21 0.95 0.00 0.00 175.26 176.86 2jx8 s LYS 12 N -1.02 4.23 0.07 -4.83 2.20 -1.26 -1.65 119.74 117.49 2jx8 s LYS 12 Ca -0.07 0.09 0.01 0.00 -0.36 0.00 0.00 55.97 55.63 2jx8 s LYS 12 Cb -0.01 -3.46 -0.00 0.00 -1.51 0.00 0.00 37.83 32.85 2jx8 s LYS 12 CO 0.06 0.17 0.08 0.00 -0.36 0.00 0.00 175.35 175.30 2jx8 s TRP 14 N -3.53 3.47 0.07 0.00 -0.11 -1.26 -1.55 118.94 116.02 2jx8 s TRP 14 Ca 0.07 -2.58 -0.31 0.00 1.22 0.00 0.00 56.10 54.51 2jx8 s TRP 14 Cb 0.00 -2.34 -0.06 0.00 -1.50 0.00 0.00 33.47 29.57 2jx8 s TRP 14 CO 0.05 -0.91 1.21 0.45 -4.62 0.00 0.00 176.95 173.14 2jx8 s SER 15 N 1.04 7.06 0.05 5.86 0.15 0.11 -4.86 113.70 123.10 2jx8 s SER 15 Ca -0.01 2.04 -0.16 0.00 0.70 0.00 0.00 55.95 58.52 2jx8 s SER 15 Cb -0.20 -2.58 -0.22 0.00 -1.71 0.00 0.00 66.02 61.31 2jx8 s SER 15 CO -0.06 -0.48 1.17 0.03 1.20 0.00 0.00 173.24 175.10 2jx8 h ARG 16 N 6.78 0.58 -0.86 5.44 3.08 -1.97 -0.38 114.38 127.06 2jx8 h ARG 16 Ca -0.42 -0.60 0.08 0.00 0.07 0.00 0.00 59.98 59.12 2jx8 h ARG 16 Cb 1.21 0.16 -0.07 0.00 0.08 0.00 0.00 29.97 31.36 2jx8 h ARG 16 CO 0.81 1.21 0.52 0.00 -1.07 0.00 0.00 179.97 181.44 2jx8 h ARG 17 N 0.19 0.88 0.00 0.04 3.08 -1.95 -1.32 114.38 115.29 2jx8 h ARG 17 Ca -0.09 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.90 2jx8 h ARG 17 Cb 1.47 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 31.33 2jx8 h ARG 17 CO 0.16 0.58 -0.60 0.39 -1.07 0.00 0.00 179.97 179.43 2jx8 n GLU 18 N -4.67 0.20 -3.45 0.04 -0.58 -1.23 -4.96 120.64 105.98 2jx8 n GLU 18 Ca 0.13 0.05 -0.18 0.00 -0.42 0.00 0.00 57.16 56.75 2jx8 n GLU 18 Cb 0.23 -1.62 0.09 0.00 -0.57 0.00 0.00 31.44 29.57 2jx8 n GLU 18 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 2jx8 n ASN 19 N -1.90 -2.39 -3.65 1.62 5.15 -0.19 -4.97 115.26 108.93 2jx8 n ASN 19 Ca 0.04 -0.62 0.01 0.00 -0.60 0.00 0.00 54.58 53.41 2jx8 n ASN 19 Cb 0.41 -5.09 0.00 0.00 -0.53 0.00 0.00 39.78 34.57 2jx8 n ASN 19 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2jx8 s ARG 20 N -5.46 0.63 0.57 1.20 1.04 -0.95 -5.01 118.95 110.96 2jx8 s ARG 20 Ca 0.05 -0.38 -0.06 0.00 -1.04 0.00 0.00 55.73 54.30 2jx8 s ARG 20 Cb -0.02 0.19 -0.01 0.00 -2.04 0.00 0.00 34.95 33.08 2jx8 s ARG 20 CO 0.73 -0.29 0.88 -1.25 -0.04 0.00 0.00 175.30 175.34 2jx8 s PRO 21 N -2.37 3.11 0.00 3.89 0.04 -1.26 0.03 135.00 138.45 2jx8 s PRO 21 Ca 0.19 0.10 0.00 0.00 0.04 0.00 0.00 61.00 61.33 2jx8 s PRO 21 Cb 0.01 -2.28 0.00 0.00 0.04 0.00 0.00 34.50 32.27 2jx8 s PRO 21 CO -0.01 -0.58 0.00 2.48 0.04 0.00 0.00 177.00 178.93 2jx8 n TYR 22 N -2.52 0.00 -4.41 0.56 4.11 -0.59 -4.80 117.16 109.50 2jx8 n TYR 22 Ca 0.04 0.00 -0.22 0.00 -0.00 0.00 0.00 57.90 57.72 2jx8 n TYR 22 Cb 0.57 0.00 -0.16 0.00 -0.00 0.00 0.00 39.34 39.75 2jx8 n TYR 22 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.86 177.57 2jx8 s TYR 23 N -1.59 1.07 -0.20 -3.48 1.51 -1.18 -2.91 117.35 110.57 2jx8 s TYR 23 Ca 0.00 -0.32 0.01 0.00 -1.01 0.00 0.00 57.07 55.75 2jx8 s TYR 23 Cb 0.00 -0.80 0.04 0.00 -0.11 0.00 0.00 41.96 41.10 2jx8 s TYR 23 CO 0.00 -0.17 -0.10 0.12 -1.11 0.00 0.00 175.55 174.30 2jx8 s PHE 24 N 0.47 2.34 -0.79 2.71 5.36 -0.66 -0.40 117.98 127.00 2jx8 s PHE 24 Ca -0.08 -1.54 -0.26 0.00 -0.96 0.00 0.00 56.93 54.09 2jx8 s PHE 24 Cb -0.12 -1.60 0.02 0.00 -0.34 0.00 0.00 43.02 40.98 2jx8 s PHE 24 CO 0.01 -0.73 1.44 1.21 -1.46 0.00 0.00 175.22 175.70 2jx8 s ASN 25 N 1.42 6.04 0.34 6.13 3.04 -0.14 -3.05 114.94 128.73 2jx8 s ASN 25 Ca -0.01 -0.56 0.20 0.00 0.04 0.00 0.00 52.86 52.52 2jx8 s ASN 25 Cb -0.16 -2.56 1.06 0.00 -1.54 0.00 0.00 41.25 38.05 2jx8 s ASN 25 CO -0.08 -1.90 1.56 0.08 -3.04 0.00 0.00 177.10 173.72 2jx8 h ARG 26 N 10.80 0.00 0.01 0.43 0.11 -0.91 0.68 114.38 125.51 2jx8 h ARG 26 Ca -0.15 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 59.93 2jx8 h ARG 26 Cb 1.06 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.14 2jx8 h ARG 26 CO 1.30 0.00 -0.00 0.35 0.10 0.00 0.00 179.97 181.71 2jx8 h PHE 27 N 0.00 -0.01 -0.50 4.08 3.04 -1.79 -3.37 116.94 118.38 2jx8 h PHE 27 Ca 0.00 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.95 2jx8 h PHE 27 Cb 0.24 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.75 2jx8 h PHE 27 CO 0.00 -0.01 0.00 -2.37 -2.02 0.00 0.00 178.31 173.91 2jx8 n THR 28 N -3.26 1.86 -1.68 4.41 5.66 -1.11 -4.89 114.28 115.27 2jx8 n THR 28 Ca -0.00 -1.05 -0.19 0.00 -3.05 0.00 0.00 64.05 59.76 2jx8 n THR 28 Cb 0.00 -0.13 -0.07 0.00 -1.55 0.00 0.00 70.33 68.59 2jx8 n THR 28 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 2jx8 n ASN 29 N 0.71 -5.05 -4.67 1.09 2.85 0.24 -4.93 115.26 105.49 2jx8 n ASN 29 Ca 0.22 0.40 -0.31 0.00 -0.11 0.00 0.00 54.58 54.79 2jx8 n ASN 29 Cb 0.88 -4.46 0.16 0.00 1.24 0.00 0.00 39.78 37.60 2jx8 n ASN 29 CO 0.00 0.00 0.00 -1.58 -2.11 0.00 0.00 177.26 173.57 2jx8 s GLN 30 N -3.82 1.03 -0.43 1.20 0.74 -1.01 -4.71 119.66 112.67 2jx8 s GLN 30 Ca 0.00 1.37 0.05 0.00 0.05 0.00 0.00 55.36 56.82 2jx8 s GLN 30 Cb 0.00 -1.74 0.17 0.00 1.10 0.00 0.00 33.01 32.54 2jx8 s GLN 30 CO 0.00 -2.56 0.48 -1.54 -0.55 0.00 0.00 175.29 171.11 2jx8 s SER 31 N -2.82 0.36 0.08 6.67 1.04 -1.26 -0.97 113.70 116.80 2jx8 s SER 31 Ca 0.66 -2.01 0.00 0.00 0.48 0.00 0.00 55.95 55.08 2jx8 s SER 31 Cb -0.22 0.72 0.00 0.00 0.10 0.00 0.00 66.02 66.63 2jx8 s SER 31 CO 0.58 -0.17 0.00 0.18 0.98 0.00 0.00 173.24 174.81 2jx8 n LEU 32 N 3.50 0.00 0.00 2.42 4.77 0.46 -4.90 117.00 123.24 2jx8 n LEU 32 Ca 0.18 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 2jx8 n LEU 32 Cb 0.50 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 2jx8 n LEU 32 CO 0.05 -0.06 0.14 0.79 -1.33 0.00 0.00 177.39 176.98 2jx8 n TRP 33 N -0.20 0.00 -3.64 -1.77 7.02 -1.26 -3.12 117.44 114.46 2jx8 n TRP 33 Ca 0.00 -0.03 -0.16 0.00 -1.02 0.00 0.00 57.50 56.30 2jx8 n TRP 33 Cb 0.00 -0.00 -0.07 0.00 -2.42 0.00 0.00 31.31 28.81 2jx8 n TRP 33 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 2jx8 s GLU 34 N -0.05 0.85 -0.05 -0.99 2.02 -1.26 -4.74 118.70 114.48 2jx8 s GLU 34 Ca 0.00 0.07 -0.40 0.00 0.02 0.00 0.00 54.97 54.66 2jx8 s GLU 34 Cb 0.00 0.39 -0.19 0.00 0.10 0.00 0.00 34.13 34.43 2jx8 s GLU 34 CO 0.00 -0.25 1.20 -1.33 0.02 0.00 0.00 175.26 174.91 2jx8 n MET 35 N 1.19 0.25 -1.66 1.61 2.81 -1.26 -4.81 117.12 115.24 2jx8 n MET 35 Ca -0.20 0.09 -0.26 0.00 -1.81 0.00 0.00 57.70 55.52 2jx8 n MET 35 Cb 0.56 -1.62 0.18 0.00 -0.71 0.00 0.00 33.22 31.63 2jx8 n MET 35 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 2jx8 n PRO 36 N 2.09 -1.17 -4.43 0.03 -0.04 -1.26 -5.11 135.00 125.12 2jx8 n PRO 36 Ca 0.21 -1.81 -0.21 0.00 -0.04 0.00 0.00 63.50 61.65 2jx8 n PRO 36 Cb 0.09 -1.21 -0.11 0.00 -0.04 0.00 0.00 33.50 32.23 2jx8 n PRO 36 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2jx8 s VAL 37 N -3.55 1.14 0.14 0.52 1.01 -1.26 -5.04 120.40 113.36 2jx8 s VAL 37 Ca 0.66 -2.00 -0.21 0.00 0.00 0.00 0.00 61.98 60.43 2jx8 s VAL 37 Cb -0.02 -2.75 0.06 0.00 0.00 0.00 0.00 36.38 33.66 2jx8 s VAL 37 CO 0.47 -0.02 0.53 -0.22 0.00 0.00 0.00 175.10 175.85 2jx8 s LEU 38 N -3.46 -0.21 -0.45 3.92 0.20 -1.26 -5.04 118.68 112.38 2jx8 s LEU 38 Ca 0.36 -0.09 0.07 0.00 0.69 0.00 0.00 54.13 55.15 2jx8 s LEU 38 Cb 0.08 2.31 0.22 0.00 -0.43 0.00 0.00 46.19 48.38 2jx8 s LEU 38 CO 0.15 -0.91 0.65 0.61 -0.29 0.00 0.00 176.35 176.55 2jx8 n GLY 39 N -0.27 1.26 0.00 7.98 0.00 -1.26 -5.11 105.19 107.78 2jx8 n GLY 39 Ca -0.17 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.22 2jx8 n GLY 39 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2jx8 n GLN 40 N 1.97 2.38 -3.16 1.61 6.02 -1.26 -4.83 117.38 120.11 2jx8 n GLN 40 Ca 0.18 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 57.10 2jx8 n GLN 40 Cb 0.56 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.82 2jx8 n GLN 40 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 2jx8 n HIS 41 N 0.00 -2.93 -0.72 1.08 8.25 -1.26 -5.00 115.22 114.65 2jx8 n HIS 41 Ca 0.00 1.14 0.00 0.00 -0.26 0.00 0.00 57.72 58.60 2jx8 n HIS 41 Cb 0.00 -3.79 0.00 0.00 1.12 0.00 0.00 29.99 27.32 2jx8 n HIS 41 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 2jx8 n ASP 42 N -1.54 -0.29 -4.04 0.41 8.00 -1.26 -4.39 116.55 113.44 2jx8 n ASP 42 Ca -0.03 -0.72 -0.39 0.00 0.71 0.00 0.00 54.79 54.36 2jx8 n ASP 42 Cb 0.53 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.63 2jx8 n ASP 42 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2jx8 n VAL 43 N -1.88 -3.05 -1.80 2.53 0.31 -1.26 -4.73 118.33 108.45 2jx8 n VAL 43 Ca 0.00 -0.65 -0.38 0.00 -0.01 0.00 0.00 64.34 63.30 2jx8 n VAL 43 Cb 0.00 -2.49 -0.03 0.00 -0.91 0.00 0.00 33.84 30.41 2jx8 n VAL 43 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2jx8 s ILE 44 N -3.72 3.19 -0.81 2.52 1.01 -1.26 -4.87 121.20 117.26 2jx8 s ILE 44 Ca 0.35 0.13 0.02 0.00 0.00 0.00 0.00 60.65 61.15 2jx8 s ILE 44 Cb -0.17 -3.45 0.28 0.00 0.01 0.00 0.00 42.46 39.13 2jx8 s ILE 44 CO 0.95 -0.41 1.07 -0.24 0.00 0.00 0.00 174.94 176.31 2jx8 n SER 45 N 13.79 4.93 -4.11 3.58 2.88 -1.26 -5.02 113.62 128.41 2jx8 n SER 45 Ca 0.28 -3.46 -0.16 0.00 -1.33 0.00 0.00 58.87 54.20 2jx8 n SER 45 Cb 0.52 -0.90 -0.12 0.00 -0.75 0.00 0.00 64.21 62.96 2jx8 n SER 45 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2jx8 s ASP 46 N -2.25 1.26 0.00 -3.46 1.01 -1.26 -5.30 116.67 106.67 2jx8 s ASP 46 Ca 0.37 -0.53 0.21 0.00 0.71 0.00 0.00 52.55 53.31 2jx8 s ASP 46 Cb 0.12 -0.02 1.27 0.00 1.01 0.00 0.00 42.92 45.29 2jx8 s ASP 46 CO 0.02 -0.11 1.65 -0.81 0.21 0.00 0.00 175.17 176.13