#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 1.02 0.55 3.23 0.04 -1.26 -4.69 135.00 133.90 2jx8 s PRO 2 Ca 0.00 0.41 0.32 0.00 0.04 0.00 0.00 61.00 61.77 2jx8 s PRO 2 Cb 0.00 -1.82 1.48 0.00 0.04 0.00 0.00 34.50 34.21 2jx8 s PRO 2 CO 0.00 -2.30 1.85 1.49 0.04 0.00 0.00 177.00 178.08 2jx8 h GLU 3 N -1.58 0.00 -0.64 4.56 4.22 -2.05 0.73 114.58 119.82 2jx8 h GLU 3 Ca -0.51 0.00 0.04 0.00 0.08 0.00 0.00 59.36 58.96 2jx8 h GLU 3 Cb 1.32 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.53 2jx8 h GLU 3 CO 0.60 0.00 0.39 0.93 -2.18 0.00 0.00 179.01 178.75 2jx8 h GLU 4 N 0.00 0.73 0.14 1.92 5.08 -2.01 -1.44 114.58 119.00 2jx8 h GLU 4 Ca 0.42 -0.04 -0.30 0.00 -1.00 0.00 0.00 59.36 58.44 2jx8 h GLU 4 Cb 1.78 -0.16 0.02 0.00 0.50 0.00 0.00 28.75 30.89 2jx8 h GLU 4 CO -0.00 0.48 -1.27 -0.07 -1.00 0.00 0.00 179.01 177.15 2jx8 h LEU 5 N 0.75 0.74 -1.44 1.33 3.38 -1.20 -3.25 115.31 115.62 2jx8 h LEU 5 Ca 0.27 -0.72 0.08 0.00 0.09 0.00 0.00 57.88 57.60 2jx8 h LEU 5 Cb 0.06 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.53 2jx8 h LEU 5 CO -0.12 1.54 0.47 0.58 0.09 0.00 0.00 178.44 180.99 2jx8 h VAL 6 N 0.20 0.97 -0.56 1.22 2.07 -1.10 -1.37 116.25 117.68 2jx8 h VAL 6 Ca -0.18 -0.23 -0.07 0.00 0.82 0.00 0.00 66.70 67.04 2jx8 h VAL 6 Cb 1.96 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.96 2jx8 h VAL 6 CO 0.23 0.12 0.09 0.45 0.02 0.00 0.00 177.57 178.48 2jx8 h HIS 7 N 0.66 1.00 0.57 1.57 3.86 -1.31 -3.27 115.15 118.22 2jx8 h HIS 7 Ca 0.32 -0.14 -0.03 0.00 -1.16 0.00 0.00 60.37 59.36 2jx8 h HIS 7 Cb 0.37 -0.27 0.01 0.00 1.06 0.00 0.00 27.41 28.58 2jx8 h HIS 7 CO -0.00 0.88 -0.27 0.00 0.86 0.00 0.00 177.93 179.39 2jx8 h ALA 8 N 1.00 -0.89 0.00 2.45 0.00 -1.34 -3.48 119.26 117.01 2jx8 h ALA 8 Ca 0.17 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2jx8 h ALA 8 Cb 0.42 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2jx8 h ALA 8 CO 0.01 -0.83 0.00 0.41 0.00 0.00 0.00 179.25 178.84 2jx8 n GLY 9 N -0.47 0.00 3.93 0.00 0.00 -0.77 -4.73 105.19 103.15 2jx8 n GLY 9 Ca -0.09 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.68 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 3.47 -0.28 1.61 0.52 -1.14 -0.73 118.94 122.39 2jx8 s TRP 10 Ca 0.00 0.47 -0.19 0.00 0.02 0.00 0.00 56.10 56.40 2jx8 s TRP 10 Cb 0.00 -2.10 0.10 0.00 -1.15 0.00 0.00 33.47 30.32 2jx8 s TRP 10 CO 0.00 -0.09 0.79 -1.83 0.02 0.00 0.00 176.95 175.84 2jx8 s GLU 11 N -4.50 0.65 0.03 4.98 -1.05 -1.20 -4.71 118.70 112.90 2jx8 s GLU 11 Ca 0.44 0.99 -0.30 0.00 -0.15 0.00 0.00 54.97 55.95 2jx8 s GLU 11 Cb -0.10 0.20 -0.05 0.00 -0.44 0.00 0.00 34.13 33.74 2jx8 s GLU 11 CO 0.39 -0.11 1.14 0.21 0.95 0.00 0.00 175.26 177.84 2jx8 s LYS 12 N 1.15 4.46 0.32 -4.83 2.20 -1.26 -2.35 119.74 119.42 2jx8 s LYS 12 Ca -0.06 1.67 0.06 0.00 -0.36 0.00 0.00 55.97 57.27 2jx8 s LYS 12 Cb -0.05 -3.40 -0.02 0.00 -1.51 0.00 0.00 37.83 32.85 2jx8 s LYS 12 CO -0.13 -0.22 0.31 0.00 -0.36 0.00 0.00 175.35 174.94 2jx8 s TRP 14 N -3.24 3.42 -0.02 0.00 -0.11 -1.26 -1.61 118.94 116.13 2jx8 s TRP 14 Ca 0.36 -2.47 -0.30 0.00 1.22 0.00 0.00 56.10 54.91 2jx8 s TRP 14 Cb 0.01 -2.28 -0.04 0.00 -1.50 0.00 0.00 33.47 29.66 2jx8 s TRP 14 CO 0.26 -0.89 1.27 0.45 -4.62 0.00 0.00 176.95 173.41 2jx8 s SER 15 N 1.09 6.99 0.20 5.86 0.15 0.56 -4.88 113.70 123.67 2jx8 s SER 15 Ca -0.02 1.94 -0.01 0.00 0.70 0.00 0.00 55.95 58.56 2jx8 s SER 15 Cb -0.20 -2.56 0.14 0.00 -1.71 0.00 0.00 66.02 61.69 2jx8 s SER 15 CO -0.05 -0.61 1.51 0.03 1.20 0.00 0.00 173.24 175.31 2jx8 h ARG 16 N 7.48 0.45 -0.23 5.44 -0.00 -1.97 -0.63 114.38 124.92 2jx8 h ARG 16 Ca -0.36 -0.30 -0.04 0.00 -0.50 0.00 0.00 59.98 58.77 2jx8 h ARG 16 Cb 1.17 0.04 -0.01 0.00 0.00 0.00 0.00 29.97 31.18 2jx8 h ARG 16 CO 0.88 0.91 -0.01 0.00 0.00 0.00 0.00 179.97 181.75 2jx8 h ARG 17 N 0.34 0.42 0.00 0.04 3.08 -1.95 -2.85 114.38 113.47 2jx8 h ARG 17 Ca -0.00 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 59.90 2jx8 h ARG 17 Cb 1.13 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.15 2jx8 h ARG 17 CO 0.11 0.62 -0.05 0.39 -1.07 0.00 0.00 179.97 179.96 2jx8 n GLU 18 N -4.63 0.10 -3.51 0.04 -0.58 -1.22 -4.93 120.64 105.91 2jx8 n GLU 18 Ca -0.04 0.08 -0.20 0.00 -0.42 0.00 0.00 57.16 56.58 2jx8 n GLU 18 Cb 0.25 -1.61 0.08 0.00 -0.57 0.00 0.00 31.44 29.59 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 -1.79 -3.19 -3.65 1.62 5.15 -0.27 -4.96 115.26 108.17 2jx8 n ASN 19 Ca 0.06 -0.62 0.01 0.00 -0.60 0.00 0.00 54.58 53.43 2jx8 n ASN 19 Cb 0.37 -4.98 -0.00 0.00 -0.53 0.00 0.00 39.78 34.65 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 -5.70 0.48 0.62 1.20 1.04 -1.05 -5.01 118.95 110.53 2jx8 s ARG 20 Ca 0.18 -0.28 -0.06 0.00 -1.04 0.00 0.00 55.73 54.53 2jx8 s ARG 20 Cb -0.08 0.16 0.02 0.00 -2.04 0.00 0.00 34.95 33.01 2jx8 s ARG 20 CO 0.74 -0.22 0.93 -1.25 -0.04 0.00 0.00 175.30 175.46 2jx8 s PRO 21 N -2.42 2.70 0.00 3.89 0.04 -1.26 -0.32 135.00 137.63 2jx8 s PRO 21 Ca 0.16 -0.09 0.00 0.00 0.04 0.00 0.00 61.00 61.11 2jx8 s PRO 21 Cb 0.03 -2.24 0.00 0.00 0.04 0.00 0.00 34.50 32.33 2jx8 s PRO 21 CO -0.03 -0.86 0.00 2.48 0.04 0.00 0.00 177.00 178.63 2jx8 n TYR 22 N -2.68 0.00 -3.85 0.56 4.11 -0.63 -4.83 117.16 109.84 2jx8 n TYR 22 Ca 0.06 0.00 -0.16 0.00 -0.00 0.00 0.00 57.90 57.80 2jx8 n TYR 22 Cb 0.58 0.00 -0.16 0.00 -0.00 0.00 0.00 39.34 39.76 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 0.17 0.16 -0.22 -3.48 2.02 -1.16 -3.41 117.35 111.43 2jx8 s TYR 23 Ca 0.00 0.06 -0.00 0.00 -0.37 0.00 0.00 57.07 56.76 2jx8 s TYR 23 Cb 0.00 -0.31 0.06 0.00 -0.40 0.00 0.00 41.96 41.31 2jx8 s TYR 23 CO 0.00 -0.10 -0.02 0.12 -1.57 0.00 0.00 175.55 173.97 2jx8 s PHE 24 N 1.00 1.98 -0.44 2.71 5.36 -0.99 -0.20 117.98 127.40 2jx8 s PHE 24 Ca -0.09 -1.49 -0.29 0.00 -0.96 0.00 0.00 56.93 54.10 2jx8 s PHE 24 Cb -0.13 -1.42 0.02 0.00 -0.34 0.00 0.00 43.02 41.15 2jx8 s PHE 24 CO -0.02 -0.73 1.25 1.21 -1.46 0.00 0.00 175.22 175.47 2jx8 s ASN 25 N 1.54 6.52 0.00 6.13 2.47 -0.02 -3.26 114.94 128.32 2jx8 s ASN 25 Ca -0.04 0.64 0.12 0.00 0.42 0.00 0.00 52.86 54.00 2jx8 s ASN 25 Cb -0.18 -2.55 0.54 0.00 -1.45 0.00 0.00 41.25 37.61 2jx8 s ASN 25 CO -0.07 -1.31 1.34 -2.11 -3.72 0.00 0.00 177.10 171.23 2jx8 n ARG 26 N 7.90 0.07 -0.03 0.43 1.85 0.09 0.64 116.66 127.61 2jx8 n ARG 26 Ca 0.14 0.25 -0.21 0.00 -1.00 0.00 0.00 57.85 57.03 2jx8 n ARG 26 Cb 0.48 -1.50 -0.13 0.00 -1.05 0.00 0.00 32.46 30.26 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 0.26 -0.30 2.89 3.57 -1.85 -3.38 116.94 118.13 2jx8 h PHE 27 Ca 0.00 -0.19 0.00 0.00 3.53 0.00 0.00 57.97 61.31 2jx8 h PHE 27 Cb 0.17 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.90 2jx8 h PHE 27 CO 0.00 1.48 0.00 0.25 -2.23 0.00 0.00 178.31 177.81 2jx8 n THR 28 N -4.13 1.26 -1.19 4.41 -2.24 -1.12 -4.94 114.28 106.33 2jx8 n THR 28 Ca -0.25 -1.19 -0.09 0.00 -2.27 0.00 0.00 64.05 60.25 2jx8 n THR 28 Cb 0.79 0.34 -0.04 0.00 -2.10 0.00 0.00 70.33 69.33 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 0.22 -4.99 -4.75 3.42 5.15 0.21 -4.92 115.26 109.60 2jx8 n ASN 29 Ca 0.13 0.22 -0.32 0.00 -0.60 0.00 0.00 54.58 54.01 2jx8 n ASN 29 Cb 0.51 -3.69 0.08 0.00 -0.53 0.00 0.00 39.78 36.15 2jx8 n ASN 29 CO 0.00 0.00 0.00 -1.58 1.40 0.00 0.00 177.26 177.08 2jx8 s GLN 30 N -2.63 2.32 -0.35 1.20 0.74 -1.13 -4.76 119.66 115.06 2jx8 s GLN 30 Ca 0.00 1.35 0.01 0.00 0.05 0.00 0.00 55.36 56.77 2jx8 s GLN 30 Cb 0.00 -1.89 0.14 0.00 1.10 0.00 0.00 33.01 32.36 2jx8 s GLN 30 CO 0.00 -1.62 0.26 -1.54 -0.55 0.00 0.00 175.29 171.84 2jx8 s SER 31 N -2.87 2.40 0.31 6.67 1.04 -1.26 -0.84 113.70 119.15 2jx8 s SER 31 Ca 0.65 -1.84 0.00 0.00 0.48 0.00 0.00 55.95 55.24 2jx8 s SER 31 Cb -0.20 -0.05 0.00 0.00 0.10 0.00 0.00 66.02 65.87 2jx8 s SER 31 CO 0.50 -0.31 0.00 0.18 0.98 0.00 0.00 173.24 174.59 2jx8 n LEU 32 N 4.28 0.00 0.00 2.42 4.77 0.73 -4.90 117.00 124.30 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 0.40 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 2jx8 n LEU 32 CO 0.11 -0.27 0.16 0.79 -1.33 0.00 0.00 177.39 176.84 2jx8 n TRP 33 N -0.85 0.00 -3.74 -1.77 7.02 -1.26 -2.96 117.44 113.87 2jx8 n TRP 33 Ca 0.00 -0.03 -0.13 0.00 -1.02 0.00 0.00 57.50 56.31 2jx8 n TRP 33 Cb 0.00 -0.00 -0.10 0.00 -2.42 0.00 0.00 31.31 28.79 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 -0.07 0.52 -0.02 -0.99 -6.30 -1.26 -4.82 118.70 105.76 2jx8 s GLU 34 Ca 0.00 0.37 -0.39 0.00 -2.50 0.00 0.00 54.97 52.45 2jx8 s GLU 34 Cb 0.00 0.25 -0.19 0.00 0.00 0.00 0.00 34.13 34.18 2jx8 s GLU 34 CO 0.00 -0.09 1.06 -0.12 0.02 0.00 0.00 175.26 176.12 2jx8 n MET 35 N 2.45 0.00 -0.19 4.30 1.56 -1.26 -4.88 117.12 119.10 2jx8 n MET 35 Ca -0.15 0.00 -0.03 0.00 -0.27 0.00 0.00 57.70 57.25 2jx8 n MET 35 Cb 0.57 -1.45 0.02 0.00 2.15 0.00 0.00 33.22 34.51 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 1.55 -0.09 -4.38 2.12 -0.04 -1.26 -5.11 135.00 127.79 2jx8 n PRO 36 Ca 0.20 -0.18 -0.19 0.00 -0.04 0.00 0.00 63.50 63.28 2jx8 n PRO 36 Cb 0.07 -0.12 -0.10 0.00 -0.04 0.00 0.00 33.50 33.31 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 -1.21 0.73 0.00 0.52 1.01 -1.26 -5.06 120.40 115.14 2jx8 s VAL 37 Ca 0.07 -2.00 0.00 0.00 0.00 0.00 0.00 61.98 60.05 2jx8 s VAL 37 Cb -0.00 -2.65 0.00 0.00 0.00 0.00 0.00 36.38 33.73 2jx8 s VAL 37 CO 0.05 0.00 0.00 -0.11 0.00 0.00 0.00 175.10 175.04 2jx8 n LEU 38 N -0.59 0.00 0.00 3.92 0.00 -1.26 -5.00 117.00 114.06 2jx8 n LEU 38 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.00 2jx8 n LEU 38 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 43.42 44.08 2jx8 n LEU 38 CO 0.39 0.00 0.00 0.61 0.00 0.00 0.00 177.39 178.39 2jx8 n GLY 39 N 0.00 1.95 3.71 -3.96 0.00 -1.26 -5.07 105.19 100.56 2jx8 n GLY 39 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.78 2.01 -0.26 1.61 6.02 -1.26 -4.96 117.38 119.76 2jx8 n GLN 40 Ca 0.00 0.71 -0.22 0.00 -0.01 0.00 0.00 57.00 57.48 2jx8 n GLN 40 Cb 0.00 -2.41 0.21 0.00 1.02 0.00 0.00 30.24 29.07 2jx8 n GLN 40 CO 0.00 0.00 0.00 -2.39 -1.01 0.00 0.00 177.06 173.66 2jx8 n HIS 41 N -0.11 -3.17 -1.99 1.08 1.44 -1.26 -5.05 115.22 106.17 2jx8 n HIS 41 Ca 0.06 -0.50 0.00 0.00 -2.01 0.00 0.00 57.72 55.27 2jx8 n HIS 41 Cb 0.39 -1.10 0.00 0.00 0.12 0.00 0.00 29.99 29.40 2jx8 n HIS 41 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 2jx8 n ASP 42 N -4.16 0.00 -4.86 4.39 9.92 -1.26 -5.16 116.55 115.43 2jx8 n ASP 42 Ca 0.10 0.00 -0.31 0.00 -0.53 0.00 0.00 54.79 54.05 2jx8 n ASP 42 Cb 0.44 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 40.89 2jx8 n ASP 42 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 2jx8 s VAL 43 N -2.70 4.64 0.52 2.53 -7.23 -1.26 -5.01 120.40 111.90 2jx8 s VAL 43 Ca 0.00 0.98 -0.23 0.00 -1.81 0.00 0.00 61.98 60.92 2jx8 s VAL 43 Cb 0.00 -3.75 -0.06 0.00 0.56 0.00 0.00 36.38 33.13 2jx8 s VAL 43 CO 0.00 -0.73 1.38 2.30 -0.31 0.00 0.00 175.10 177.74 2jx8 n ILE 44 N -1.74 3.53 -1.01 -0.62 -6.64 -1.26 -4.91 119.36 106.72 2jx8 n ILE 44 Ca 0.05 -0.50 0.09 0.00 -1.77 0.00 0.00 62.75 60.62 2jx8 n ILE 44 Cb 0.54 -1.72 0.25 0.00 -1.44 0.00 0.00 39.64 37.28 2jx8 n ILE 44 CO 0.00 0.00 0.00 -1.54 -1.77 0.00 0.00 176.55 173.24 2jx8 n SER 45 N -0.76 3.78 -2.89 7.28 3.41 -1.26 -5.00 113.62 118.18 2jx8 n SER 45 Ca 0.09 -3.03 -0.09 0.00 -0.26 0.00 0.00 58.87 55.58 2jx8 n SER 45 Cb 0.44 -0.54 0.01 0.00 -0.26 0.00 0.00 64.21 63.86 2jx8 n SER 45 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2jx8 n ASP 46 N -0.57 -7.85 0.00 4.04 -0.08 -1.26 -5.34 116.55 105.49 2jx8 n ASP 46 Ca 0.21 0.47 0.11 0.00 -1.51 0.00 0.00 54.79 54.07 2jx8 n ASP 46 Cb 0.88 -5.24 0.64 0.00 2.34 0.00 0.00 41.12 39.75 2jx8 n ASP 46 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51