#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 1.55 0.56 3.23 0.04 -1.26 -4.70 135.00 134.43 2jx8 s PRO 2 Ca 0.00 0.69 0.31 0.00 0.04 0.00 0.00 61.00 62.04 2jx8 s PRO 2 Cb 0.00 -1.85 1.46 0.00 0.04 0.00 0.00 34.50 34.14 2jx8 s PRO 2 CO 0.00 -2.00 1.84 1.49 0.04 0.00 0.00 177.00 178.37 2jx8 h GLU 3 N -1.37 0.00 -0.00 4.56 4.57 -2.04 -0.84 114.58 119.45 2jx8 h GLU 3 Ca -0.49 0.00 0.01 0.00 -1.18 0.00 0.00 59.36 57.70 2jx8 h GLU 3 Cb 1.28 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.86 2jx8 h GLU 3 CO 0.57 0.00 -0.05 0.93 -1.18 0.00 0.00 179.01 179.28 2jx8 h GLU 4 N 0.00 -0.09 -0.10 1.92 5.08 -2.00 -1.07 114.58 118.33 2jx8 h GLU 4 Ca 0.36 0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 58.60 2jx8 h GLU 4 Cb 1.65 0.02 0.01 0.00 0.50 0.00 0.00 28.75 30.92 2jx8 h GLU 4 CO -0.00 -0.06 -0.42 -0.07 -1.00 0.00 0.00 179.01 177.46 2jx8 h LEU 5 N -0.09 0.54 -1.45 1.33 3.38 -1.51 -3.14 115.31 114.37 2jx8 h LEU 5 Ca 0.02 -0.63 0.18 0.00 0.09 0.00 0.00 57.88 57.53 2jx8 h LEU 5 Cb 0.12 -0.16 -0.07 0.00 0.09 0.00 0.00 40.66 40.64 2jx8 h LEU 5 CO -0.06 1.09 0.57 0.58 0.09 0.00 0.00 178.44 180.71 2jx8 h VAL 6 N 0.03 0.74 -0.49 1.22 2.07 -1.31 0.13 116.25 118.64 2jx8 h VAL 6 Ca -0.03 -0.17 -0.08 0.00 0.82 0.00 0.00 66.70 67.25 2jx8 h VAL 6 Cb 1.06 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 2jx8 h VAL 6 CO 0.09 0.09 -0.00 0.45 0.02 0.00 0.00 177.57 178.22 2jx8 h HIS 7 N 0.49 0.88 -0.07 1.57 3.86 -1.14 -2.42 115.15 118.31 2jx8 h HIS 7 Ca 0.45 -0.13 -0.06 0.00 -1.16 0.00 0.00 60.37 59.47 2jx8 h HIS 7 Cb 0.97 -0.24 -0.01 0.00 1.06 0.00 0.00 27.41 29.19 2jx8 h HIS 7 CO -0.00 0.81 -0.22 0.00 0.86 0.00 0.00 177.93 179.38 2jx8 h ALA 8 N 1.23 1.51 0.00 2.45 0.00 -0.75 -3.46 119.26 120.23 2jx8 h ALA 8 Ca 0.15 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2jx8 h ALA 8 Cb 0.46 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2jx8 h ALA 8 CO 0.02 0.36 0.00 0.41 0.00 0.00 0.00 179.25 180.04 2jx8 n GLY 9 N -0.78 1.99 3.82 0.00 0.00 -0.91 -4.52 105.19 104.79 2jx8 n GLY 9 Ca -0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 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 3.77 -0.06 1.61 0.52 -1.19 -0.46 118.94 121.12 2jx8 s TRP 10 Ca 0.00 1.12 -0.03 0.00 0.02 0.00 0.00 56.10 57.22 2jx8 s TRP 10 Cb 0.00 -2.38 0.04 0.00 -1.15 0.00 0.00 33.47 29.98 2jx8 s TRP 10 CO 0.00 0.62 0.12 -1.21 0.02 0.00 0.00 176.95 176.50 2jx8 s GLU 11 N -1.09 0.01 0.05 4.98 2.02 -0.89 -4.63 118.70 119.16 2jx8 s GLU 11 Ca 0.26 0.45 -0.30 0.00 0.02 0.00 0.00 54.97 55.39 2jx8 s GLU 11 Cb -0.18 -0.31 -0.05 0.00 0.10 0.00 0.00 34.13 33.69 2jx8 s GLU 11 CO 0.16 -0.27 1.18 0.21 0.02 0.00 0.00 175.26 176.56 2jx8 s LYS 12 N 1.93 4.44 0.28 1.61 2.20 -1.26 -1.56 119.74 127.37 2jx8 s LYS 12 Ca -0.00 1.74 -0.04 0.00 -0.36 0.00 0.00 55.97 57.31 2jx8 s LYS 12 Cb -0.12 -3.37 -0.01 0.00 -1.51 0.00 0.00 37.83 32.82 2jx8 s LYS 12 CO -0.05 -0.25 0.37 0.00 -0.36 0.00 0.00 175.35 175.05 2jx8 s TRP 14 N -3.63 3.30 -0.07 0.00 -0.11 -1.26 -1.27 118.94 115.90 2jx8 s TRP 14 Ca 0.32 -1.35 -0.30 0.00 1.22 0.00 0.00 56.10 55.99 2jx8 s TRP 14 Cb 0.02 -2.67 -0.03 0.00 -1.50 0.00 0.00 33.47 29.28 2jx8 s TRP 14 CO 0.16 -0.77 1.29 0.45 -4.62 0.00 0.00 176.95 173.46 2jx8 s SER 15 N 1.81 6.95 0.34 5.86 0.15 0.66 -4.88 113.70 124.58 2jx8 s SER 15 Ca 0.02 1.88 0.17 0.00 0.70 0.00 0.00 55.95 58.71 2jx8 s SER 15 Cb -0.21 -2.55 0.52 0.00 -1.71 0.00 0.00 66.02 62.06 2jx8 s SER 15 CO 0.04 -0.68 1.66 -0.09 1.20 0.00 0.00 173.24 175.36 2jx8 h ARG 16 N 7.85 0.00 0.01 5.44 1.12 -1.97 -0.92 114.38 125.91 2jx8 h ARG 16 Ca -0.33 0.00 -0.00 0.00 -1.11 0.00 0.00 59.98 58.54 2jx8 h ARG 16 Cb 1.15 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.11 2jx8 h ARG 16 CO 0.91 0.45 -0.00 -0.09 -3.11 0.00 0.00 179.97 178.13 2jx8 h ARG 17 N 0.00 -0.01 0.00 0.20 2.43 -1.94 -3.08 114.38 111.97 2jx8 h ARG 17 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2jx8 h ARG 17 Cb 1.03 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.58 2jx8 h ARG 17 CO 0.06 0.47 -0.04 0.39 -1.51 0.00 0.00 179.97 179.34 2jx8 n GLU 18 N -4.87 0.02 -3.41 0.20 -0.58 -1.23 -4.93 120.64 105.85 2jx8 n GLU 18 Ca -0.08 0.02 -0.17 0.00 -0.42 0.00 0.00 57.16 56.50 2jx8 n GLU 18 Cb 0.25 -1.52 0.09 0.00 -0.57 0.00 0.00 31.44 29.68 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 -1.56 -2.21 -3.64 1.62 5.15 -0.38 -4.98 115.26 109.26 2jx8 n ASN 19 Ca 0.07 -0.62 0.01 0.00 -0.60 0.00 0.00 54.58 53.44 2jx8 n ASN 19 Cb 0.35 -5.08 -0.00 0.00 -0.53 0.00 0.00 39.78 34.51 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 -5.31 0.46 0.62 1.20 1.04 -1.00 -5.01 118.95 110.95 2jx8 s ARG 20 Ca 0.02 -0.26 -0.05 0.00 -1.04 0.00 0.00 55.73 54.39 2jx8 s ARG 20 Cb -0.00 0.15 0.03 0.00 -2.04 0.00 0.00 34.95 33.09 2jx8 s ARG 20 CO 0.72 -0.21 0.92 -1.25 -0.04 0.00 0.00 175.30 175.44 2jx8 s PRO 21 N -2.41 2.67 0.00 3.89 0.04 -1.26 -0.25 135.00 137.68 2jx8 s PRO 21 Ca 0.16 -0.15 0.00 0.00 0.04 0.00 0.00 61.00 61.05 2jx8 s PRO 21 Cb 0.04 -2.26 0.00 0.00 0.04 0.00 0.00 34.50 32.31 2jx8 s PRO 21 CO -0.03 -0.85 0.00 2.48 0.04 0.00 0.00 177.00 178.64 2jx8 n TYR 22 N -2.66 0.00 -4.50 0.56 4.11 -0.39 -4.82 117.16 109.46 2jx8 n TYR 22 Ca 0.06 0.00 -0.21 0.00 -0.00 0.00 0.00 57.90 57.74 2jx8 n TYR 22 Cb 0.59 0.00 -0.15 0.00 -0.00 0.00 0.00 39.34 39.77 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 -1.46 1.09 -0.19 -3.48 1.51 -1.17 -2.73 117.35 110.92 2jx8 s TYR 23 Ca 0.00 -0.26 -0.00 0.00 -1.01 0.00 0.00 57.07 55.80 2jx8 s TYR 23 Cb 0.00 -0.75 0.05 0.00 -0.11 0.00 0.00 41.96 41.15 2jx8 s TYR 23 CO 0.00 -0.08 -0.06 0.12 -1.11 0.00 0.00 175.55 174.42 2jx8 s PHE 24 N 0.02 1.98 -0.81 2.71 5.36 -0.60 -0.67 117.98 125.97 2jx8 s PHE 24 Ca -0.01 -1.33 -0.26 0.00 -0.96 0.00 0.00 56.93 54.37 2jx8 s PHE 24 Cb -0.08 -1.43 0.03 0.00 -0.34 0.00 0.00 43.02 41.20 2jx8 s PHE 24 CO 0.00 -0.68 1.42 1.21 -1.46 0.00 0.00 175.22 175.71 2jx8 s ASN 25 N 1.54 6.11 0.26 6.13 3.04 -0.25 -2.08 114.94 129.69 2jx8 s ASN 25 Ca -0.01 -0.65 0.17 0.00 0.04 0.00 0.00 52.86 52.41 2jx8 s ASN 25 Cb -0.16 -2.56 0.95 0.00 -1.54 0.00 0.00 41.25 37.94 2jx8 s ASN 25 CO -0.08 -1.85 1.53 -2.11 -3.04 0.00 0.00 177.10 171.56 2jx8 n ARG 26 N 9.20 0.11 -0.01 0.43 1.85 0.40 0.94 116.66 129.58 2jx8 n ARG 26 Ca 0.15 0.61 -0.01 0.00 -1.00 0.00 0.00 57.85 57.60 2jx8 n ARG 26 Cb 0.50 -1.88 -0.00 0.00 -1.05 0.00 0.00 32.46 30.02 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 -0.03 -0.55 2.89 3.57 -1.80 -3.36 116.94 117.66 2jx8 h PHE 27 Ca 0.00 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2jx8 h PHE 27 Cb 0.01 0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.76 2jx8 h PHE 27 CO 0.00 -0.02 0.00 -2.37 -2.23 0.00 0.00 178.31 173.69 2jx8 n THR 28 N -3.58 1.57 -1.50 4.41 5.66 -1.13 -4.89 114.28 114.81 2jx8 n THR 28 Ca -0.00 -0.99 -0.17 0.00 -3.05 0.00 0.00 64.05 59.83 2jx8 n THR 28 Cb 0.01 0.04 -0.07 0.00 -1.55 0.00 0.00 70.33 68.76 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 0.91 -5.12 -4.71 1.09 4.05 0.27 -4.93 115.26 106.80 2jx8 n ASN 29 Ca 0.22 0.43 -0.31 0.00 0.45 0.00 0.00 54.58 55.37 2jx8 n ASN 29 Cb 0.78 -4.40 0.14 0.00 1.23 0.00 0.00 39.78 37.53 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 -3.46 1.49 -0.35 1.20 0.74 -1.05 -4.74 119.66 113.49 2jx8 s GLN 30 Ca 0.00 1.37 0.01 0.00 0.05 0.00 0.00 55.36 56.79 2jx8 s GLN 30 Cb 0.00 -1.79 0.14 0.00 1.10 0.00 0.00 33.01 32.46 2jx8 s GLN 30 CO 0.00 -2.25 0.26 -1.54 -0.55 0.00 0.00 175.29 171.22 2jx8 s SER 31 N -2.98 2.36 0.14 6.67 1.04 -1.26 -1.09 113.70 118.57 2jx8 s SER 31 Ca 0.64 -1.83 0.00 0.00 0.48 0.00 0.00 55.95 55.25 2jx8 s SER 31 Cb -0.20 -0.03 0.00 0.00 0.10 0.00 0.00 66.02 65.89 2jx8 s SER 31 CO 0.57 -0.31 0.00 0.18 0.98 0.00 0.00 173.24 174.66 2jx8 n LEU 32 N 4.29 0.00 0.00 2.42 4.77 0.15 -4.94 117.00 123.69 2jx8 n LEU 32 Ca 0.09 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 2jx8 n LEU 32 Cb 0.41 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 2jx8 n LEU 32 CO 0.11 -0.21 0.14 0.79 -1.33 0.00 0.00 177.39 176.88 2jx8 n TRP 33 N -0.56 0.00 -3.59 -1.77 7.02 -1.26 -3.06 117.44 114.22 2jx8 n TRP 33 Ca 0.00 -0.03 -0.16 0.00 -1.02 0.00 0.00 57.50 56.29 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 -0.06 0.95 -0.09 -0.99 -6.30 -1.26 -4.74 118.70 106.22 2jx8 s GLU 34 Ca 0.00 0.06 -0.41 0.00 -2.50 0.00 0.00 54.97 52.12 2jx8 s GLU 34 Cb 0.00 0.44 -0.19 0.00 0.00 0.00 0.00 34.13 34.38 2jx8 s GLU 34 CO 0.00 -0.30 1.23 -1.33 0.02 0.00 0.00 175.26 174.89 2jx8 n MET 35 N 0.92 0.21 -0.05 4.30 2.81 -1.26 -4.82 117.12 119.23 2jx8 n MET 35 Ca -0.20 0.07 -0.00 0.00 -1.81 0.00 0.00 57.70 55.77 2jx8 n MET 35 Cb 0.57 -1.60 0.00 0.00 -0.71 0.00 0.00 33.22 31.48 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 2.27 0.02 -4.02 0.03 -0.04 -1.26 -5.12 135.00 126.89 2jx8 n PRO 36 Ca 0.22 -0.02 -0.21 0.00 -0.04 0.00 0.00 63.50 63.45 2jx8 n PRO 36 Cb 0.07 -0.01 -0.06 0.00 -0.04 0.00 0.00 33.50 33.46 2jx8 n PRO 36 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2jx8 n VAL 37 N -1.98 0.00 -3.53 0.52 0.31 -1.26 -5.07 118.33 107.32 2jx8 n VAL 37 Ca 0.00 -2.00 0.00 0.00 -0.01 0.00 0.00 64.34 62.33 2jx8 n VAL 37 Cb 0.00 0.71 0.00 0.00 -0.91 0.00 0.00 33.84 33.65 2jx8 n VAL 37 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 2jx8 n LEU 38 N 0.00 0.00 -2.92 7.52 0.00 -1.26 -4.98 117.00 115.36 2jx8 n LEU 38 Ca -0.05 0.00 -0.12 0.00 0.00 0.00 0.00 56.01 55.84 2jx8 n LEU 38 Cb 0.51 0.00 0.06 0.00 0.00 0.00 0.00 43.42 43.99 2jx8 n LEU 38 CO 0.27 0.00 0.04 0.61 0.00 0.00 0.00 177.39 178.31 2jx8 n GLY 39 N 0.00 -0.63 1.60 -3.96 0.00 -1.26 -4.88 105.19 96.06 2jx8 n GLY 39 Ca 0.00 0.32 -0.12 0.00 0.00 0.00 0.00 46.02 46.22 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 -3.05 1.67 0.00 1.61 6.02 -1.26 -4.47 117.38 117.90 2jx8 n GLN 40 Ca -0.10 -1.51 0.00 0.00 -0.01 0.00 0.00 57.00 55.38 2jx8 n GLN 40 Cb 0.61 -1.60 0.00 0.00 1.02 0.00 0.00 30.24 30.27 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 -0.31 0.00 -2.47 1.08 8.25 -1.26 -5.17 115.22 115.34 2jx8 n HIS 41 Ca 0.30 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.76 2jx8 n HIS 41 Cb 1.08 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.19 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 0.00 0.49 -4.14 0.41 8.00 -1.26 -4.70 116.55 115.35 2jx8 n ASP 42 Ca 0.00 -0.23 -0.30 0.00 0.71 0.00 0.00 54.79 54.97 2jx8 n ASP 42 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.06 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 -0.17 -1.89 -3.70 2.53 0.31 -1.26 -4.88 118.33 109.26 2jx8 n VAL 43 Ca 0.00 -0.35 -0.35 0.00 -0.01 0.00 0.00 64.34 63.64 2jx8 n VAL 43 Cb 0.00 -1.90 -0.08 0.00 -0.91 0.00 0.00 33.84 30.95 2jx8 n VAL 43 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 2jx8 s ILE 44 N -3.85 3.95 -0.48 2.52 -4.36 -1.26 -4.90 121.20 112.82 2jx8 s ILE 44 Ca 0.24 -3.76 0.06 0.00 -0.26 0.00 0.00 60.65 56.93 2jx8 s ILE 44 Cb -0.13 -3.49 0.23 0.00 1.25 0.00 0.00 42.46 40.31 2jx8 s ILE 44 CO 0.93 -1.03 0.78 -1.54 0.24 0.00 0.00 174.94 174.32 2jx8 n SER 45 N 2.50 -2.43 -2.66 4.36 3.41 -1.26 -5.05 113.62 112.49 2jx8 n SER 45 Ca 0.18 -3.09 -0.01 0.00 -0.26 0.00 0.00 58.87 55.69 2jx8 n SER 45 Cb 0.37 1.33 0.03 0.00 -0.26 0.00 0.00 64.21 65.67 2jx8 n SER 45 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2jx8 s ASP 46 N -1.04 -0.04 0.00 4.04 -1.08 -1.26 -5.33 116.67 111.97 2jx8 s ASP 46 Ca 0.32 -0.04 0.20 0.00 -0.52 0.00 0.00 52.55 52.51 2jx8 s ASP 46 Cb 0.17 0.05 1.20 0.00 -1.46 0.00 0.00 42.92 42.88 2jx8 s ASP 46 CO -0.19 -0.00 1.59 -0.81 0.52 0.00 0.00 175.17 176.28