#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 2.18 0.54 3.23 0.04 -1.26 -4.77 135.00 134.96 2jx8 s PRO 2 Ca 0.00 0.78 0.32 0.00 0.04 0.00 0.00 61.00 62.14 2jx8 s PRO 2 Cb 0.00 -1.92 1.49 0.00 0.04 0.00 0.00 34.50 34.11 2jx8 s PRO 2 CO 0.00 -1.59 1.87 1.49 0.04 0.00 0.00 177.00 178.81 2jx8 h GLU 3 N -1.07 0.00 -0.33 4.56 4.57 -2.05 -0.57 114.58 119.69 2jx8 h GLU 3 Ca -0.46 0.00 0.03 0.00 -1.18 0.00 0.00 59.36 57.75 2jx8 h GLU 3 Cb 1.25 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.81 2jx8 h GLU 3 CO 0.57 0.00 0.14 0.93 -1.18 0.00 0.00 179.01 179.47 2jx8 h GLU 4 N 0.00 0.28 -0.13 1.92 5.08 -2.01 -1.82 114.58 117.91 2jx8 h GLU 4 Ca 0.44 -0.02 -0.18 0.00 -1.00 0.00 0.00 59.36 58.60 2jx8 h GLU 4 Cb 1.78 -0.06 0.01 0.00 0.50 0.00 0.00 28.75 30.97 2jx8 h GLU 4 CO -0.00 0.19 -0.60 -0.07 -1.00 0.00 0.00 179.01 177.52 2jx8 h LEU 5 N 0.29 0.76 -0.86 1.33 3.38 -1.46 -3.13 115.31 115.62 2jx8 h LEU 5 Ca 0.14 -0.63 0.14 0.00 0.09 0.00 0.00 57.88 57.63 2jx8 h LEU 5 Cb 0.09 -0.22 -0.09 0.00 0.09 0.00 0.00 40.66 40.52 2jx8 h LEU 5 CO -0.13 1.27 0.45 0.58 0.09 0.00 0.00 178.44 180.70 2jx8 h VAL 6 N 0.31 0.75 -0.13 1.22 2.07 -1.23 0.18 116.25 119.42 2jx8 h VAL 6 Ca -0.04 -0.22 -0.06 0.00 0.82 0.00 0.00 66.70 67.20 2jx8 h VAL 6 Cb 1.24 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 2jx8 h VAL 6 CO 0.13 0.12 -0.19 -0.74 0.02 0.00 0.00 177.57 176.90 2jx8 h HIS 7 N 0.65 0.23 -0.28 1.57 2.76 -1.33 -2.52 115.15 116.22 2jx8 h HIS 7 Ca 0.46 -0.03 -0.09 0.00 -2.20 0.00 0.00 60.37 58.51 2jx8 h HIS 7 Cb 0.64 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 29.52 2jx8 h HIS 7 CO -0.08 0.40 -0.21 0.00 -1.30 0.00 0.00 177.93 176.74 2jx8 h ALA 8 N 1.61 1.11 0.00 5.26 0.00 -0.60 -3.46 119.26 123.18 2jx8 h ALA 8 Ca 0.04 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2jx8 h ALA 8 Cb 0.46 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2jx8 h ALA 8 CO 0.03 0.55 0.00 0.41 0.00 0.00 0.00 179.25 180.24 2jx8 n GLY 9 N -0.43 1.98 3.94 0.00 0.00 -0.90 -4.64 105.19 105.13 2jx8 n GLY 9 Ca -0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 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 3.12 -0.22 1.61 0.52 -1.17 -0.22 118.94 120.58 2jx8 s TRP 10 Ca 0.00 0.40 -0.27 0.00 0.02 0.00 0.00 56.10 56.25 2jx8 s TRP 10 Cb 0.00 -2.72 0.09 0.00 -1.15 0.00 0.00 33.47 29.70 2jx8 s TRP 10 CO 0.00 -0.82 0.84 -1.83 0.02 0.00 0.00 176.95 175.16 2jx8 s GLU 11 N -4.89 0.75 -0.31 4.98 4.04 -1.19 -4.70 118.70 117.39 2jx8 s GLU 11 Ca 0.54 0.66 -0.12 0.00 0.04 0.00 0.00 54.97 56.09 2jx8 s GLU 11 Cb -0.10 0.36 -0.03 0.00 0.02 0.00 0.00 34.13 34.37 2jx8 s GLU 11 CO 0.42 -0.14 0.21 0.21 -1.84 0.00 0.00 175.26 174.13 2jx8 s LYS 12 N -0.11 3.74 0.00 -4.83 2.20 -1.26 -1.63 119.74 117.85 2jx8 s LYS 12 Ca -0.01 -0.47 0.00 0.00 -0.36 0.00 0.00 55.97 55.13 2jx8 s LYS 12 Cb -0.04 -3.73 0.00 0.00 -1.51 0.00 0.00 37.83 32.55 2jx8 s LYS 12 CO 0.01 -0.30 0.00 0.00 -0.36 0.00 0.00 175.35 174.69 2jx8 s TRP 14 N -1.16 3.43 -0.04 0.00 -0.11 -1.26 -2.07 118.94 117.73 2jx8 s TRP 14 Ca 0.00 -2.56 -0.30 0.00 1.22 0.00 0.00 56.10 54.46 2jx8 s TRP 14 Cb 0.00 -2.27 -0.04 0.00 -1.50 0.00 0.00 33.47 29.66 2jx8 s TRP 14 CO 0.00 -0.90 1.26 0.45 -4.62 0.00 0.00 176.95 173.14 2jx8 s SER 15 N 1.04 6.99 0.23 5.86 0.15 0.99 -4.87 113.70 124.08 2jx8 s SER 15 Ca -0.02 1.91 0.05 0.00 0.70 0.00 0.00 55.95 58.60 2jx8 s SER 15 Cb -0.20 -2.56 0.21 0.00 -1.71 0.00 0.00 66.02 61.76 2jx8 s SER 15 CO -0.06 -0.62 1.53 0.03 1.20 0.00 0.00 173.24 175.31 2jx8 h ARG 16 N 7.56 0.17 0.21 5.44 -0.00 -1.96 -0.88 114.38 124.90 2jx8 h ARG 16 Ca -0.35 -0.13 -0.01 0.00 -0.50 0.00 0.00 59.98 58.98 2jx8 h ARG 16 Cb 1.17 0.03 0.00 0.00 0.00 0.00 0.00 29.97 31.17 2jx8 h ARG 16 CO 0.89 0.78 -0.10 0.00 0.00 0.00 0.00 179.97 181.53 2jx8 h ARG 17 N 0.12 -0.27 0.00 0.04 3.08 -1.94 -2.69 114.38 112.72 2jx8 h ARG 17 Ca -0.01 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2jx8 h ARG 17 Cb 1.20 0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.31 2jx8 h ARG 17 CO 0.10 -0.08 -0.04 0.39 -1.07 0.00 0.00 179.97 179.27 2jx8 n GLU 18 N -5.15 0.02 -3.44 0.04 -0.58 -1.23 -4.93 120.64 105.36 2jx8 n GLU 18 Ca -0.09 0.01 -0.18 0.00 -0.42 0.00 0.00 57.16 56.49 2jx8 n GLU 18 Cb 0.18 -1.52 0.09 0.00 -0.57 0.00 0.00 31.44 29.62 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 -1.55 -2.47 -3.64 1.62 5.15 -0.38 -4.97 115.26 109.03 2jx8 n ASN 19 Ca 0.07 -0.61 0.00 0.00 -0.60 0.00 0.00 54.58 53.44 2jx8 n ASN 19 Cb 0.35 -5.11 0.00 0.00 -0.53 0.00 0.00 39.78 34.49 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 -5.45 0.71 0.58 1.20 1.04 -0.94 -5.01 118.95 111.08 2jx8 s ARG 20 Ca 0.06 -0.43 -0.06 0.00 -1.04 0.00 0.00 55.73 54.26 2jx8 s ARG 20 Cb -0.03 0.22 0.00 0.00 -2.04 0.00 0.00 34.95 33.10 2jx8 s ARG 20 CO 0.73 -0.33 0.90 -1.25 -0.04 0.00 0.00 175.30 175.31 2jx8 s PRO 21 N -2.42 3.03 0.00 3.89 0.04 -1.26 -0.01 135.00 138.28 2jx8 s PRO 21 Ca 0.19 0.09 0.00 0.00 0.04 0.00 0.00 61.00 61.32 2jx8 s PRO 21 Cb 0.01 -2.26 0.00 0.00 0.04 0.00 0.00 34.50 32.29 2jx8 s PRO 21 CO -0.00 -0.64 0.00 2.48 0.04 0.00 0.00 177.00 178.87 2jx8 n TYR 22 N -2.57 0.00 -3.85 0.56 4.11 -0.88 -4.80 117.16 109.72 2jx8 n TYR 22 Ca 0.04 0.00 -0.15 0.00 -0.00 0.00 0.00 57.90 57.79 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 -0.75 0.14 -0.23 -3.48 1.51 -1.17 -3.35 117.35 110.02 2jx8 s TYR 23 Ca 0.00 0.06 0.00 0.00 -1.01 0.00 0.00 57.07 56.12 2jx8 s TYR 23 Cb 0.00 -0.27 0.06 0.00 -0.11 0.00 0.00 41.96 41.65 2jx8 s TYR 23 CO 0.00 -0.09 -0.03 0.12 -1.11 0.00 0.00 175.55 174.44 2jx8 s PHE 24 N 0.87 2.18 -0.61 2.71 5.36 -0.65 -0.32 117.98 127.52 2jx8 s PHE 24 Ca -0.08 -1.63 -0.28 0.00 -0.96 0.00 0.00 56.93 53.98 2jx8 s PHE 24 Cb -0.11 -1.52 0.02 0.00 -0.34 0.00 0.00 43.02 41.07 2jx8 s PHE 24 CO -0.02 -0.75 1.36 1.21 -1.46 0.00 0.00 175.22 175.55 2jx8 s ASN 25 N 1.47 6.16 0.19 6.13 2.47 0.03 -3.16 114.94 128.22 2jx8 s ASN 25 Ca -0.04 0.09 0.14 0.00 0.42 0.00 0.00 52.86 53.46 2jx8 s ASN 25 Cb -0.19 -2.55 0.72 0.00 -1.45 0.00 0.00 41.25 37.79 2jx8 s ASN 25 CO -0.07 -1.72 1.43 -2.11 -3.72 0.00 0.00 177.10 170.90 2jx8 n ARG 26 N 8.80 0.09 -0.01 0.43 1.85 0.69 0.76 116.66 129.27 2jx8 n ARG 26 Ca 0.10 0.55 -0.00 0.00 -1.00 0.00 0.00 57.85 57.50 2jx8 n ARG 26 Cb 0.49 -1.77 -0.00 0.00 -1.05 0.00 0.00 32.46 30.13 2jx8 n ARG 26 CO 0.00 0.00 0.00 0.35 -0.01 0.00 0.00 177.63 177.97 2jx8 h PHE 27 N 0.00 -0.02 -0.52 2.89 3.04 -1.82 -3.37 116.94 117.14 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 0.04 0.01 0.00 0.00 2.56 0.00 0.00 35.95 38.56 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 -3.09 1.46 -1.51 4.41 5.66 -1.17 -4.89 114.28 115.15 2jx8 n THR 28 Ca -0.00 -0.94 -0.18 0.00 -3.05 0.00 0.00 64.05 59.88 2jx8 n THR 28 Cb 0.01 0.04 -0.08 0.00 -1.55 0.00 0.00 70.33 68.75 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 0.86 -5.15 -4.71 1.09 4.05 0.23 -4.93 115.26 106.70 2jx8 n ASN 29 Ca 0.21 0.44 -0.32 0.00 0.45 0.00 0.00 54.58 55.35 2jx8 n ASN 29 Cb 0.74 -4.45 0.13 0.00 1.23 0.00 0.00 39.78 37.43 2jx8 n ASN 29 CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 177.26 172.63 2jx8 s GLN 30 N -3.50 1.65 -0.40 1.20 0.74 -1.04 -4.71 119.66 113.60 2jx8 s GLN 30 Ca 0.00 1.58 0.03 0.00 0.05 0.00 0.00 55.36 57.03 2jx8 s GLN 30 Cb 0.00 -1.80 0.16 0.00 1.10 0.00 0.00 33.01 32.48 2jx8 s GLN 30 CO 0.00 -2.17 0.38 -1.54 -0.55 0.00 0.00 175.29 171.42 2jx8 s SER 31 N -2.51 1.20 0.01 6.67 1.04 -1.26 -0.79 113.70 118.06 2jx8 s SER 31 Ca 0.69 -2.12 0.00 0.00 0.48 0.00 0.00 55.95 55.00 2jx8 s SER 31 Cb -0.25 0.29 0.00 0.00 0.10 0.00 0.00 66.02 66.17 2jx8 s SER 31 CO 0.52 -0.22 0.00 0.18 0.98 0.00 0.00 173.24 174.71 2jx8 n LEU 32 N 3.66 0.00 0.00 2.42 4.77 0.56 -4.90 117.00 123.50 2jx8 n LEU 32 Ca 0.17 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 2jx8 n LEU 32 Cb 0.46 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 2jx8 n LEU 32 CO 0.08 -0.01 0.12 0.79 -1.33 0.00 0.00 177.39 177.04 2jx8 n TRP 33 N -0.04 0.00 -3.62 -1.77 7.02 -1.26 -3.05 117.44 114.73 2jx8 n TRP 33 Ca 0.00 -0.02 -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 28.82 2jx8 n TRP 33 CO 0.00 0.00 0.00 -2.00 -2.02 0.00 0.00 177.69 173.67 2jx8 s GLU 34 N -0.04 0.91 -0.13 -0.99 2.12 -1.26 -4.67 118.70 114.63 2jx8 s GLU 34 Ca 0.00 0.07 -0.42 0.00 0.36 0.00 0.00 54.97 54.99 2jx8 s GLU 34 Cb 0.00 0.42 -0.20 0.00 0.26 0.00 0.00 34.13 34.61 2jx8 s GLU 34 CO 0.00 -0.27 1.25 -1.33 -0.54 0.00 0.00 175.26 174.36 2jx8 n MET 35 N 1.04 0.12 0.00 4.30 2.81 -1.26 -4.82 117.12 119.31 2jx8 n MET 35 Ca -0.20 0.04 0.00 0.00 -1.81 0.00 0.00 57.70 55.73 2jx8 n MET 35 Cb 0.57 -1.56 0.00 0.00 -0.71 0.00 0.00 33.22 31.52 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 2.34 0.49 -4.42 0.03 -0.04 -1.26 -5.12 135.00 127.02 2jx8 n PRO 36 Ca 0.23 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.47 2jx8 n PRO 36 Cb 0.05 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.43 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 -0.51 0.46 -0.04 0.52 1.01 -1.26 -5.09 120.40 115.49 2jx8 s VAL 37 Ca 0.00 -2.00 -0.12 0.00 0.00 0.00 0.00 61.98 59.86 2jx8 s VAL 37 Cb 0.00 -2.46 0.02 0.00 0.00 0.00 0.00 36.38 33.95 2jx8 s VAL 37 CO 0.00 0.00 0.27 -0.22 0.00 0.00 0.00 175.10 175.15 2jx8 s LEU 38 N -3.48 1.00 -0.01 3.92 0.20 -1.26 -5.02 118.68 114.02 2jx8 s LEU 38 Ca 0.31 0.18 0.11 0.00 0.69 0.00 0.00 54.13 55.42 2jx8 s LEU 38 Cb 0.04 1.07 -0.17 0.00 -0.43 0.00 0.00 46.19 46.70 2jx8 s LEU 38 CO 0.17 -0.33 0.27 0.61 -0.29 0.00 0.00 176.35 176.78 2jx8 n GLY 39 N 1.80 -0.46 1.17 7.98 0.00 -1.26 -5.01 105.19 109.41 2jx8 n GLY 39 Ca -0.19 -0.27 -0.11 0.00 0.00 0.00 0.00 46.02 45.45 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 -1.82 -2.98 -3.84 1.61 6.02 -1.26 -4.16 117.38 110.94 2jx8 n GLN 40 Ca -0.02 -0.53 -0.35 0.00 -0.01 0.00 0.00 57.00 56.10 2jx8 n GLN 40 Cb 0.28 -0.69 0.02 0.00 1.02 0.00 0.00 30.24 30.87 2jx8 n GLN 40 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 177.06 177.63 2jx8 n HIS 41 N -4.02 -1.78 -3.50 1.08 -0.00 -1.26 -4.97 115.22 100.77 2jx8 n HIS 41 Ca 0.05 0.41 0.00 0.00 0.46 0.00 0.00 57.72 58.64 2jx8 n HIS 41 Cb 0.22 -3.04 0.00 0.00 -0.12 0.00 0.00 29.99 27.05 2jx8 n HIS 41 CO 0.00 0.00 0.00 -0.25 0.46 0.00 0.00 176.34 176.55 2jx8 n ASP 42 N -2.39 1.80 -4.13 0.26 9.92 -1.26 -5.06 116.55 115.70 2jx8 n ASP 42 Ca -0.15 -0.50 -0.42 0.00 -0.53 0.00 0.00 54.79 53.19 2jx8 n ASP 42 Cb 0.60 0.00 -0.01 0.00 -0.64 0.00 0.00 41.12 41.07 2jx8 n ASP 42 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 2jx8 n VAL 43 N 0.00 4.68 -1.60 2.53 0.31 -1.26 -5.03 118.33 117.96 2jx8 n VAL 43 Ca 0.00 -5.61 -0.52 0.00 -0.01 0.00 0.00 64.34 58.21 2jx8 n VAL 43 Cb 0.00 -2.32 -0.06 0.00 -0.91 0.00 0.00 33.84 30.55 2jx8 n VAL 43 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 2jx8 n ILE 44 N 1.94 0.02 0.00 2.52 5.41 -1.26 -4.93 119.36 123.05 2jx8 n ILE 44 Ca 0.25 -0.00 0.00 0.00 1.00 0.00 0.00 62.75 64.00 2jx8 n ILE 44 Cb 0.36 -0.89 0.00 0.00 -0.71 0.00 0.00 39.64 38.40 2jx8 n ILE 44 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 2jx8 n SER 45 N 2.72 0.00 -4.77 4.38 7.64 -1.26 -4.93 113.62 117.40 2jx8 n SER 45 Ca 0.19 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 59.68 2jx8 n SER 45 Cb 0.19 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.37 2jx8 n SER 45 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2jx8 s ASP 46 N -1.00 6.75 0.00 6.43 1.01 -1.26 -5.32 116.67 123.27 2jx8 s ASP 46 Ca 0.00 2.29 0.21 0.00 0.71 0.00 0.00 52.55 55.76 2jx8 s ASP 46 Cb 0.00 -2.61 1.24 0.00 1.01 0.00 0.00 42.92 42.56 2jx8 s ASP 46 CO 0.00 -0.51 1.63 -0.81 0.21 0.00 0.00 175.17 175.68