#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 2.04 0.51 3.23 0.04 -1.26 -4.70 135.00 134.86 2jx8 s PRO 2 Ca 0.00 0.66 0.30 0.00 0.04 0.00 0.00 61.00 62.00 2jx8 s PRO 2 Cb 0.00 -1.91 1.41 0.00 0.04 0.00 0.00 34.50 34.04 2jx8 s PRO 2 CO 0.00 -1.66 1.85 0.93 0.04 0.00 0.00 177.00 178.17 2jx8 h GLU 3 N -1.12 0.09 -0.48 4.56 3.07 -2.04 -0.07 114.58 118.59 2jx8 h GLU 3 Ca -0.47 -0.01 0.03 0.00 -0.50 0.00 0.00 59.36 58.41 2jx8 h GLU 3 Cb 1.27 -0.02 -0.04 0.00 -0.84 0.00 0.00 28.75 29.12 2jx8 h GLU 3 CO 0.59 0.06 0.27 0.93 -1.40 0.00 0.00 179.01 179.46 2jx8 h GLU 4 N 0.09 0.52 0.02 2.33 3.07 -2.00 -0.63 114.58 117.97 2jx8 h GLU 4 Ca 0.48 -0.03 -0.08 0.00 -0.50 0.00 0.00 59.36 59.22 2jx8 h GLU 4 Cb 1.74 -0.12 0.01 0.00 -0.84 0.00 0.00 28.75 29.54 2jx8 h GLU 4 CO -0.06 0.34 -0.34 -0.07 -1.40 0.00 0.00 179.01 177.48 2jx8 h LEU 5 N 0.53 0.27 -2.00 1.33 3.38 -1.38 -3.20 115.31 114.24 2jx8 h LEU 5 Ca 0.20 -0.82 0.17 0.00 0.09 0.00 0.00 57.88 57.53 2jx8 h LEU 5 Cb 0.07 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 2jx8 h LEU 5 CO -0.12 1.06 0.46 0.58 0.09 0.00 0.00 178.44 180.51 2jx8 h VAL 6 N -0.48 0.62 -0.18 1.22 2.07 -1.23 -0.60 116.25 117.66 2jx8 h VAL 6 Ca -0.05 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.45 2jx8 h VAL 6 Cb 1.12 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 2jx8 h VAL 6 CO 0.07 0.00 0.03 0.45 0.02 0.00 0.00 177.57 178.14 2jx8 h HIS 7 N 0.00 0.31 0.00 1.57 3.86 -1.10 -3.34 115.15 116.45 2jx8 h HIS 7 Ca 0.28 -0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.45 2jx8 h HIS 7 Cb 1.20 -0.09 0.00 0.00 1.06 0.00 0.00 27.41 29.58 2jx8 h HIS 7 CO 0.00 0.45 0.00 0.00 0.86 0.00 0.00 177.93 179.24 2jx8 n ALA 8 N -2.29 -0.29 0.00 2.45 0.00 -0.27 -4.94 120.51 115.17 2jx8 n ALA 8 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2jx8 n ALA 8 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.63 2jx8 n ALA 8 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jx8 n GLY 9 N -0.14 0.00 3.89 0.00 0.00 -1.00 -4.76 105.19 103.18 2jx8 n GLY 9 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 0.00 3.46 -0.22 1.61 0.52 -1.19 -0.27 118.94 122.85 2jx8 s TRP 10 Ca 0.00 0.76 -0.11 0.00 0.02 0.00 0.00 56.10 56.76 2jx8 s TRP 10 Cb 0.00 -2.18 0.08 0.00 -1.15 0.00 0.00 33.47 30.21 2jx8 s TRP 10 CO 0.00 0.21 0.52 -1.83 0.02 0.00 0.00 176.95 175.87 2jx8 s GLU 11 N -3.23 0.50 0.15 4.98 4.04 -1.15 -4.61 118.70 119.39 2jx8 s GLU 11 Ca 0.46 1.02 -0.30 0.00 0.04 0.00 0.00 54.97 56.18 2jx8 s GLU 11 Cb -0.11 0.14 -0.07 0.00 0.02 0.00 0.00 34.13 34.11 2jx8 s GLU 11 CO 0.26 -0.17 1.20 0.21 -1.84 0.00 0.00 175.26 174.92 2jx8 s LYS 12 N 1.75 4.48 0.12 -4.83 2.20 -1.26 -2.54 119.74 119.66 2jx8 s LYS 12 Ca -0.08 1.84 -0.01 0.00 -0.36 0.00 0.00 55.97 57.36 2jx8 s LYS 12 Cb -0.08 -3.27 0.00 0.00 -1.51 0.00 0.00 37.83 32.97 2jx8 s LYS 12 CO -0.16 -0.13 0.17 0.00 -0.36 0.00 0.00 175.35 174.88 2jx8 s TRP 14 N -4.52 3.50 -0.11 0.00 -0.11 -1.26 -1.78 118.94 114.65 2jx8 s TRP 14 Ca 0.09 -2.61 -0.30 0.00 1.22 0.00 0.00 56.10 54.51 2jx8 s TRP 14 Cb -0.00 -2.41 -0.03 0.00 -1.50 0.00 0.00 33.47 29.53 2jx8 s TRP 14 CO 0.07 -0.91 1.32 0.45 -4.62 0.00 0.00 176.95 173.26 2jx8 s SER 15 N 1.04 6.92 0.27 5.86 0.15 0.91 -4.87 113.70 123.98 2jx8 s SER 15 Ca 0.00 1.84 0.05 0.00 0.70 0.00 0.00 55.95 58.54 2jx8 s SER 15 Cb -0.20 -2.54 0.38 0.00 -1.71 0.00 0.00 66.02 61.95 2jx8 s SER 15 CO -0.06 -0.74 1.65 0.03 1.20 0.00 0.00 173.24 175.32 2jx8 h ARG 16 N 8.18 0.26 -0.34 5.44 3.08 -1.97 0.60 114.38 129.64 2jx8 h ARG 16 Ca -0.31 -0.14 -0.03 0.00 0.07 0.00 0.00 59.98 59.57 2jx8 h ARG 16 Cb 1.13 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 31.18 2jx8 h ARG 16 CO 0.94 0.68 0.09 -0.09 -1.07 0.00 0.00 179.97 180.52 2jx8 h ARG 17 N 0.21 0.53 0.00 0.04 2.43 -1.94 -2.72 114.38 112.93 2jx8 h ARG 17 Ca 0.01 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.06 2jx8 h ARG 17 Cb 0.91 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.39 2jx8 h ARG 17 CO 0.07 0.58 -0.29 0.39 -1.51 0.00 0.00 179.97 179.21 2jx8 n GLU 18 N -4.64 0.08 -3.47 0.20 -0.58 -1.18 -4.94 120.64 106.10 2jx8 n GLU 18 Ca -0.02 0.04 -0.19 0.00 -0.42 0.00 0.00 57.16 56.58 2jx8 n GLU 18 Cb 0.18 -1.56 0.09 0.00 -0.57 0.00 0.00 31.44 29.58 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 -1.68 -3.04 -3.67 1.62 5.15 0.17 -4.97 115.26 108.85 2jx8 n ASN 19 Ca 0.06 -0.60 0.01 0.00 -0.60 0.00 0.00 54.58 53.45 2jx8 n ASN 19 Cb 0.36 -5.10 0.00 0.00 -0.53 0.00 0.00 39.78 34.52 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 -5.58 0.49 0.57 1.20 1.70 -1.00 -5.01 118.95 111.33 2jx8 s ARG 20 Ca 0.13 -0.29 -0.07 0.00 -0.47 0.00 0.00 55.73 55.03 2jx8 s ARG 20 Cb -0.06 0.15 -0.01 0.00 -0.57 0.00 0.00 34.95 34.46 2jx8 s ARG 20 CO 0.73 -0.23 0.90 -1.25 -1.08 0.00 0.00 175.30 174.37 2jx8 s PRO 21 N -2.29 3.17 0.00 3.89 0.04 -1.26 -0.06 135.00 138.49 2jx8 s PRO 21 Ca 0.20 0.19 0.00 0.00 0.04 0.00 0.00 61.00 61.43 2jx8 s PRO 21 Cb 0.02 -2.25 0.00 0.00 0.04 0.00 0.00 34.50 32.31 2jx8 s PRO 21 CO -0.02 -0.58 0.00 2.48 0.04 0.00 0.00 177.00 178.92 2jx8 n TYR 22 N -2.55 0.00 -3.86 0.56 4.11 -0.74 -4.81 117.16 109.87 2jx8 n TYR 22 Ca 0.04 0.00 -0.17 0.00 -0.00 0.00 0.00 57.90 57.77 2jx8 n TYR 22 Cb 0.56 0.00 -0.16 0.00 -0.00 0.00 0.00 39.34 39.74 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 -0.53 0.21 -0.22 -3.48 2.02 -1.17 -3.38 117.35 110.80 2jx8 s TYR 23 Ca 0.00 0.05 0.01 0.00 -0.37 0.00 0.00 57.07 56.76 2jx8 s TYR 23 Cb 0.00 -0.36 0.05 0.00 -0.40 0.00 0.00 41.96 41.25 2jx8 s TYR 23 CO 0.00 -0.12 -0.06 0.12 -1.57 0.00 0.00 175.55 173.91 2jx8 s PHE 24 N 1.12 2.29 -0.71 2.71 5.36 -1.05 -0.46 117.98 127.23 2jx8 s PHE 24 Ca -0.09 -1.62 -0.27 0.00 -0.96 0.00 0.00 56.93 54.00 2jx8 s PHE 24 Cb -0.13 -1.55 0.02 0.00 -0.34 0.00 0.00 43.02 41.02 2jx8 s PHE 24 CO -0.02 -0.74 1.41 1.21 -1.46 0.00 0.00 175.22 175.61 2jx8 s ASN 25 N 1.43 5.97 0.20 6.13 3.04 -0.13 -2.92 114.94 128.67 2jx8 s ASN 25 Ca -0.04 -0.28 0.14 0.00 0.04 0.00 0.00 52.86 52.72 2jx8 s ASN 25 Cb -0.18 -2.55 0.76 0.00 -1.54 0.00 0.00 41.25 37.74 2jx8 s ASN 25 CO -0.07 -1.96 1.44 -2.11 -3.04 0.00 0.00 177.10 171.37 2jx8 n ARG 26 N 9.34 0.09 -0.08 0.43 1.85 0.63 0.11 116.66 129.02 2jx8 n ARG 26 Ca 0.07 0.56 -0.12 0.00 -1.00 0.00 0.00 57.85 57.36 2jx8 n ARG 26 Cb 0.50 -1.79 -0.07 0.00 -1.05 0.00 0.00 32.46 30.05 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 0.00 -0.63 2.89 3.57 -1.86 -3.37 116.94 117.54 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 0.04 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.78 2jx8 h PHE 27 CO 0.00 0.74 0.00 0.25 -2.23 0.00 0.00 178.31 177.07 2jx8 n THR 28 N -4.56 1.72 -1.23 4.41 -2.24 -1.09 -4.90 114.28 106.40 2jx8 n THR 28 Ca -0.17 -1.12 -0.11 0.00 -2.27 0.00 0.00 64.05 60.39 2jx8 n THR 28 Cb 0.43 0.11 -0.05 0.00 -2.10 0.00 0.00 70.33 68.72 2jx8 n THR 28 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2jx8 n ASN 29 N 1.10 -4.21 -4.70 3.42 2.85 0.29 -4.91 115.26 109.11 2jx8 n ASN 29 Ca 0.25 0.26 -0.31 0.00 -0.11 0.00 0.00 54.58 54.67 2jx8 n ASN 29 Cb 0.85 -3.42 0.14 0.00 1.24 0.00 0.00 39.78 38.59 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 -2.74 1.45 -0.42 1.20 0.74 -1.06 -4.72 119.66 114.11 2jx8 s GLN 30 Ca 0.00 1.49 0.05 0.00 0.05 0.00 0.00 55.36 56.95 2jx8 s GLN 30 Cb 0.00 -1.78 0.17 0.00 1.10 0.00 0.00 33.01 32.50 2jx8 s GLN 30 CO 0.00 -2.30 0.48 -1.54 -0.55 0.00 0.00 175.29 171.38 2jx8 s SER 31 N -2.76 0.33 0.12 6.67 1.04 -1.26 -0.95 113.70 116.89 2jx8 s SER 31 Ca 0.66 -1.92 0.00 0.00 0.48 0.00 0.00 55.95 55.17 2jx8 s SER 31 Cb -0.22 0.78 0.00 0.00 0.10 0.00 0.00 66.02 66.68 2jx8 s SER 31 CO 0.56 -0.18 0.00 0.18 0.98 0.00 0.00 173.24 174.78 2jx8 n LEU 32 N 3.59 0.00 0.00 2.42 4.77 0.39 -4.91 117.00 123.26 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 -0.12 0.14 0.79 -1.33 0.00 0.00 177.39 176.93 2jx8 n TRP 33 N -0.36 0.00 -3.68 -1.77 7.02 -1.26 -3.06 117.44 114.33 2jx8 n TRP 33 Ca 0.00 -0.03 -0.15 0.00 -1.02 0.00 0.00 57.50 56.30 2jx8 n TRP 33 Cb 0.00 -0.00 -0.08 0.00 -2.42 0.00 0.00 31.31 28.81 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 0.80 -0.10 -0.99 2.12 -1.26 -4.73 118.70 114.48 2jx8 s GLU 34 Ca 0.00 0.00 -0.41 0.00 0.36 0.00 0.00 54.97 54.93 2jx8 s GLU 34 Cb 0.00 0.36 -0.19 0.00 0.26 0.00 0.00 34.13 34.56 2jx8 s GLU 34 CO 0.00 -0.23 1.28 -0.12 -0.54 0.00 0.00 175.26 175.66 2jx8 n MET 35 N 1.23 0.34 -1.72 4.30 1.56 -1.26 -4.82 117.12 116.74 2jx8 n MET 35 Ca -0.20 0.12 -0.22 0.00 -0.27 0.00 0.00 57.70 57.13 2jx8 n MET 35 Cb 0.56 -1.67 0.14 0.00 2.15 0.00 0.00 33.22 34.41 2jx8 n MET 35 CO 0.00 0.00 0.00 -0.35 -0.73 0.00 0.00 175.97 174.89 2jx8 n PRO 36 N 2.52 -0.71 -4.44 2.12 -0.04 -1.26 -5.12 135.00 128.07 2jx8 n PRO 36 Ca 0.22 -1.80 -0.22 0.00 -0.04 0.00 0.00 63.50 61.66 2jx8 n PRO 36 Cb 0.08 -0.92 -0.09 0.00 -0.04 0.00 0.00 33.50 32.52 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 -3.05 0.71 0.00 0.52 1.01 -1.26 -5.06 120.40 113.28 2jx8 s VAL 37 Ca 0.58 -2.00 0.00 0.00 0.00 0.00 0.00 61.98 60.56 2jx8 s VAL 37 Cb -0.02 -2.55 0.00 0.00 0.00 0.00 0.00 36.38 33.81 2jx8 s VAL 37 CO 0.40 0.00 0.00 -0.11 0.00 0.00 0.00 175.10 175.39 2jx8 n LEU 38 N -0.73 0.00 0.00 3.92 7.94 -1.26 -4.96 117.00 121.91 2jx8 n LEU 38 Ca -0.03 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.87 2jx8 n LEU 38 Cb 0.66 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.61 2jx8 n LEU 38 CO 0.38 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.27 2jx8 n GLY 39 N 0.00 1.07 3.48 -3.96 0.00 -1.26 -5.03 105.19 99.48 2jx8 n GLY 39 Ca 0.00 -0.39 -0.37 0.00 0.00 0.00 0.00 46.02 45.25 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 -1.66 0.46 -2.95 1.61 1.13 -1.26 -4.97 117.38 109.73 2jx8 n GLN 40 Ca 0.00 0.19 -0.13 0.00 -1.94 0.00 0.00 57.00 55.12 2jx8 n GLN 40 Cb 0.10 -1.80 -0.01 0.00 0.11 0.00 0.00 30.24 28.64 2jx8 n GLN 40 CO 0.00 0.00 0.00 1.58 -1.44 0.00 0.00 177.06 177.20 2jx8 n HIS 41 N -1.99 -2.56 -3.49 1.08 -0.00 -1.26 -5.14 115.22 101.85 2jx8 n HIS 41 Ca 0.11 -2.22 0.00 0.00 0.46 0.00 0.00 57.72 56.07 2jx8 n HIS 41 Cb 0.49 0.97 0.00 0.00 -0.12 0.00 0.00 29.99 31.32 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 2.32 1.87 -2.36 0.26 9.92 -1.26 -5.06 116.55 122.23 2jx8 n ASP 42 Ca 0.18 -0.56 -0.26 0.00 -0.53 0.00 0.00 54.79 53.63 2jx8 n ASP 42 Cb 0.56 0.00 0.01 0.00 -0.64 0.00 0.00 41.12 41.04 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 -0.04 2.38 -0.27 2.53 0.31 -1.26 -5.07 118.33 116.91 2jx8 n VAL 43 Ca 0.00 -4.70 -0.28 0.00 -0.01 0.00 0.00 64.34 59.36 2jx8 n VAL 43 Cb 0.00 -1.18 0.27 0.00 -0.91 0.00 0.00 33.84 32.01 2jx8 n VAL 43 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 2jx8 n ILE 44 N -0.53 0.00 -3.36 2.52 -6.64 -1.26 -5.06 119.36 105.03 2jx8 n ILE 44 Ca 0.40 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 61.38 2jx8 n ILE 44 Cb 0.75 -0.89 0.00 0.00 -1.44 0.00 0.00 39.64 38.06 2jx8 n ILE 44 CO 0.00 0.00 0.00 -1.20 -1.77 0.00 0.00 176.55 173.58 2jx8 n SER 45 N -4.99 0.00 -3.86 7.28 7.64 -1.26 -5.17 113.62 113.26 2jx8 n SER 45 Ca 0.12 -0.78 -0.15 0.00 1.01 0.00 0.00 58.87 59.08 2jx8 n SER 45 Cb 0.54 0.00 -0.15 0.00 -1.01 0.00 0.00 64.21 63.59 2jx8 n SER 45 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2jx8 s ASP 46 N -0.46 0.27 0.00 6.43 -1.08 -1.26 -5.31 116.67 115.26 2jx8 s ASP 46 Ca 0.00 -0.03 0.20 0.00 -0.52 0.00 0.00 52.55 52.21 2jx8 s ASP 46 Cb 0.00 -0.09 1.21 0.00 -1.46 0.00 0.00 42.92 42.58 2jx8 s ASP 46 CO 0.00 -0.03 1.60 -0.81 0.52 0.00 0.00 175.17 176.45