#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 1.31 0.55 3.23 0.04 -1.26 -4.71 135.00 134.16 2jx8 s PRO 2 Ca 0.00 0.58 0.32 0.00 0.04 0.00 0.00 61.00 61.94 2jx8 s PRO 2 Cb 0.00 -1.83 1.48 0.00 0.04 0.00 0.00 34.50 34.19 2jx8 s PRO 2 CO 0.00 -2.14 1.85 1.49 0.04 0.00 0.00 177.00 178.24 2jx8 h GLU 3 N -1.47 0.00 -0.41 4.56 4.81 -2.05 0.03 114.58 120.05 2jx8 h GLU 3 Ca -0.50 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 58.76 2jx8 h GLU 3 Cb 1.30 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.65 2jx8 h GLU 3 CO 0.58 0.00 0.21 0.93 -0.73 0.00 0.00 179.01 180.00 2jx8 h GLU 4 N 0.00 0.42 -0.03 1.92 5.08 -1.98 -0.88 114.58 119.11 2jx8 h GLU 4 Ca 0.42 -0.03 -0.24 0.00 -1.00 0.00 0.00 59.36 58.52 2jx8 h GLU 4 Cb 1.78 -0.09 0.02 0.00 0.50 0.00 0.00 28.75 30.95 2jx8 h GLU 4 CO -0.00 0.28 -0.92 -0.07 -1.00 0.00 0.00 179.01 177.30 2jx8 h LEU 5 N 0.43 0.85 -1.89 1.33 3.38 -1.34 -3.14 115.31 114.94 2jx8 h LEU 5 Ca 0.17 -0.72 0.08 0.00 0.09 0.00 0.00 57.88 57.50 2jx8 h LEU 5 Cb 0.07 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 2jx8 h LEU 5 CO -0.12 1.46 0.25 0.58 0.09 0.00 0.00 178.44 180.70 2jx8 h VAL 6 N 0.33 0.89 -0.43 1.22 2.07 -1.17 -1.12 116.25 118.04 2jx8 h VAL 6 Ca -0.11 -0.05 -0.05 0.00 0.82 0.00 0.00 66.70 67.32 2jx8 h VAL 6 Cb 1.57 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 32.07 2jx8 h VAL 6 CO 0.18 0.02 0.09 0.45 0.02 0.00 0.00 177.57 178.34 2jx8 h HIS 7 N 0.14 0.74 0.00 1.57 3.86 -1.12 -3.32 115.15 117.02 2jx8 h HIS 7 Ca 0.17 -0.09 0.00 0.00 -1.16 0.00 0.00 60.37 59.28 2jx8 h HIS 7 Cb 0.49 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 28.75 2jx8 h HIS 7 CO -0.00 0.70 0.00 0.00 0.86 0.00 0.00 177.93 179.49 2jx8 n ALA 8 N -2.37 -0.33 0.00 2.45 0.00 -0.47 -4.96 120.51 114.83 2jx8 n ALA 8 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2jx8 n ALA 8 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.67 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 -0.05 0.00 3.92 0.00 0.00 -0.93 -4.71 105.19 103.42 2jx8 n GLY 9 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 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 3.52 -0.29 1.61 0.52 -1.21 -0.71 118.94 122.38 2jx8 s TRP 10 Ca 0.00 0.57 -0.14 0.00 0.02 0.00 0.00 56.10 56.55 2jx8 s TRP 10 Cb 0.00 -2.08 0.12 0.00 -1.15 0.00 0.00 33.47 30.36 2jx8 s TRP 10 CO 0.00 -0.02 0.78 -1.83 0.02 0.00 0.00 176.95 175.90 2jx8 s GLU 11 N -4.34 0.54 0.07 4.98 -1.05 -1.17 -4.79 118.70 112.95 2jx8 s GLU 11 Ca 0.43 1.12 -0.30 0.00 -0.15 0.00 0.00 54.97 56.07 2jx8 s GLU 11 Cb -0.10 0.40 -0.06 0.00 -0.44 0.00 0.00 34.13 33.93 2jx8 s GLU 11 CO 0.38 -0.14 1.17 0.21 0.95 0.00 0.00 175.26 177.82 2jx8 s LYS 12 N 2.09 4.46 0.31 -4.83 2.20 -1.26 -1.81 119.74 120.90 2jx8 s LYS 12 Ca -0.07 1.73 -0.02 0.00 -0.36 0.00 0.00 55.97 57.25 2jx8 s LYS 12 Cb -0.07 -3.35 -0.01 0.00 -1.51 0.00 0.00 37.83 32.89 2jx8 s LYS 12 CO -0.18 -0.21 0.39 0.00 -0.36 0.00 0.00 175.35 174.99 2jx8 s TRP 14 N -3.41 3.36 -0.24 0.00 -0.11 -1.26 -1.05 118.94 116.22 2jx8 s TRP 14 Ca 0.33 -1.62 -0.29 0.00 1.22 0.00 0.00 56.10 55.74 2jx8 s TRP 14 Cb 0.01 -2.96 -0.01 0.00 -1.50 0.00 0.00 33.47 29.01 2jx8 s TRP 14 CO 0.19 -0.86 1.41 0.45 -4.62 0.00 0.00 176.95 173.52 2jx8 s SER 15 N 2.08 6.63 0.50 5.86 0.15 0.91 -4.86 113.70 124.97 2jx8 s SER 15 Ca 0.03 1.46 0.25 0.00 0.70 0.00 0.00 55.95 58.39 2jx8 s SER 15 Cb -0.23 -2.54 1.35 0.00 -1.71 0.00 0.00 66.02 62.90 2jx8 s SER 15 CO 0.01 -1.08 2.04 0.03 1.20 0.00 0.00 173.24 175.45 2jx8 h ARG 16 N 9.57 0.00 0.30 5.44 2.47 -1.97 0.58 114.38 130.77 2jx8 h ARG 16 Ca -0.29 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.41 2jx8 h ARG 16 Cb 1.12 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.44 2jx8 h ARG 16 CO 1.01 0.14 -0.14 0.00 0.56 0.00 0.00 179.97 181.54 2jx8 h ARG 17 N 0.00 -0.39 -0.00 0.04 3.08 -1.94 -3.06 114.38 112.12 2jx8 h ARG 17 Ca -0.00 0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.08 2jx8 h ARG 17 Cb 0.36 0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.50 2jx8 h ARG 17 CO 0.02 -0.07 -0.03 0.39 -1.07 0.00 0.00 179.97 179.21 2jx8 n GLU 18 N -5.12 0.07 -3.36 0.04 -0.58 -1.16 -4.93 120.64 105.60 2jx8 n GLU 18 Ca -0.09 -0.00 -0.16 0.00 -0.42 0.00 0.00 57.16 56.48 2jx8 n GLU 18 Cb 0.26 -1.50 0.08 0.00 -0.57 0.00 0.00 31.44 29.72 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 -1.46 -3.01 -3.66 1.62 2.85 0.17 -4.98 115.26 106.79 2jx8 n ASN 19 Ca 0.08 -0.63 0.01 0.00 -0.11 0.00 0.00 54.58 53.94 2jx8 n ASN 19 Cb 0.32 -5.05 0.00 0.00 1.24 0.00 0.00 39.78 36.30 2jx8 n ASN 19 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2jx8 s ARG 20 N -5.12 0.54 0.63 1.20 1.70 -1.07 -5.01 118.95 111.82 2jx8 s ARG 20 Ca 0.10 -0.32 -0.05 0.00 -0.47 0.00 0.00 55.73 54.99 2jx8 s ARG 20 Cb -0.01 0.17 0.03 0.00 -0.57 0.00 0.00 34.95 34.57 2jx8 s ARG 20 CO 0.72 -0.25 0.92 -1.25 -1.08 0.00 0.00 175.30 174.36 2jx8 s PRO 21 N -2.37 2.57 0.00 3.89 0.04 -1.26 -0.06 135.00 137.81 2jx8 s PRO 21 Ca 0.18 -0.23 0.00 0.00 0.04 0.00 0.00 61.00 60.99 2jx8 s PRO 21 Cb 0.02 -2.27 0.00 0.00 0.04 0.00 0.00 34.50 32.30 2jx8 s PRO 21 CO -0.02 -0.91 0.00 2.48 0.04 0.00 0.00 177.00 178.59 2jx8 n TYR 22 N -2.67 0.00 -4.04 0.56 4.11 -0.22 -4.81 117.16 110.08 2jx8 n TYR 22 Ca 0.06 0.00 -0.20 0.00 -0.00 0.00 0.00 57.90 57.76 2jx8 n TYR 22 Cb 0.59 0.00 -0.17 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 -0.86 0.69 -0.24 -3.48 2.02 -1.18 -2.79 117.35 111.49 2jx8 s TYR 23 Ca 0.00 -0.18 0.03 0.00 -0.37 0.00 0.00 57.07 56.55 2jx8 s TYR 23 Cb 0.00 -0.67 0.05 0.00 -0.40 0.00 0.00 41.96 40.94 2jx8 s TYR 23 CO 0.00 -0.22 -0.13 0.12 -1.57 0.00 0.00 175.55 173.75 2jx8 s PHE 24 N 1.16 3.17 -0.65 2.71 5.36 -0.75 -0.69 117.98 128.29 2jx8 s PHE 24 Ca -0.07 -2.19 -0.28 0.00 -0.96 0.00 0.00 56.93 53.44 2jx8 s PHE 24 Cb -0.14 -1.93 0.02 0.00 -0.34 0.00 0.00 43.02 40.64 2jx8 s PHE 24 CO -0.01 -0.87 1.30 1.21 -1.46 0.00 0.00 175.22 175.40 2jx8 s ASN 25 N 1.14 6.20 0.06 6.13 3.04 -0.64 -3.03 114.94 127.84 2jx8 s ASN 25 Ca -0.06 -0.10 0.11 0.00 0.04 0.00 0.00 52.86 52.85 2jx8 s ASN 25 Cb -0.19 -2.55 0.50 0.00 -1.54 0.00 0.00 41.25 37.47 2jx8 s ASN 25 CO -0.07 -1.73 1.35 -2.11 -3.04 0.00 0.00 177.10 171.50 2jx8 n ARG 26 N 8.94 0.04 -0.08 0.43 1.85 0.11 0.98 116.66 128.93 2jx8 n ARG 26 Ca 0.07 0.39 -0.11 0.00 -1.00 0.00 0.00 57.85 57.21 2jx8 n ARG 26 Cb 0.49 -1.59 -0.07 0.00 -1.05 0.00 0.00 32.46 30.25 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 -0.69 2.89 3.04 -1.84 -3.37 116.94 116.96 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 0.15 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.66 2jx8 h PHE 27 CO 0.00 0.68 0.00 0.25 -2.02 0.00 0.00 178.31 177.22 2jx8 n THR 28 N -4.59 1.41 -1.27 4.41 -2.24 -1.14 -4.91 114.28 105.94 2jx8 n THR 28 Ca -0.14 -1.10 -0.12 0.00 -2.27 0.00 0.00 64.05 60.43 2jx8 n THR 28 Cb 0.38 0.32 -0.05 0.00 -2.10 0.00 0.00 70.33 68.88 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 1.39 -4.51 -4.66 3.42 5.15 0.28 -4.92 115.26 111.40 2jx8 n ASN 29 Ca 0.25 0.29 -0.30 0.00 -0.60 0.00 0.00 54.58 54.22 2jx8 n ASN 29 Cb 0.75 -3.64 0.16 0.00 -0.53 0.00 0.00 39.78 36.53 2jx8 n ASN 29 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2jx8 s GLN 30 N -2.85 0.81 -0.39 1.20 -1.52 -1.09 -4.76 119.66 111.06 2jx8 s GLN 30 Ca 0.00 0.99 0.03 0.00 -1.95 0.00 0.00 55.36 54.43 2jx8 s GLN 30 Cb 0.00 -1.74 0.16 0.00 -0.22 0.00 0.00 33.01 31.21 2jx8 s GLN 30 CO 0.00 -2.60 0.38 -1.54 -0.25 0.00 0.00 175.29 171.29 2jx8 s SER 31 N -3.08 1.16 0.22 5.90 1.04 -1.26 -1.63 113.70 116.05 2jx8 s SER 31 Ca 0.65 -1.93 0.00 0.00 0.48 0.00 0.00 55.95 55.15 2jx8 s SER 31 Cb -0.20 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.32 2jx8 s SER 31 CO 0.59 -0.23 0.00 0.18 0.98 0.00 0.00 173.24 174.76 2jx8 n LEU 32 N 3.85 0.00 0.00 2.42 4.77 0.13 -4.93 117.00 123.24 2jx8 n LEU 32 Ca 0.15 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 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 -0.22 0.15 0.79 -1.33 0.00 0.00 177.39 176.86 2jx8 n TRP 33 N -0.66 0.00 -3.69 -1.77 7.02 -1.26 -3.12 117.44 113.95 2jx8 n TRP 33 Ca 0.00 -0.03 -0.14 0.00 -1.02 0.00 0.00 57.50 56.31 2jx8 n TRP 33 Cb 0.00 -0.00 -0.08 0.00 -2.42 0.00 0.00 31.31 28.80 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 0.71 -0.05 -0.99 -6.30 -1.26 -4.76 118.70 105.99 2jx8 s GLU 34 Ca 0.00 0.17 -0.41 0.00 -2.50 0.00 0.00 54.97 52.24 2jx8 s GLU 34 Cb 0.00 0.33 -0.20 0.00 0.00 0.00 0.00 34.13 34.26 2jx8 s GLU 34 CO 0.00 -0.18 1.17 -1.33 0.02 0.00 0.00 175.26 174.94 2jx8 n MET 35 N 1.70 0.12 0.00 4.30 2.81 -1.26 -4.83 117.12 119.96 2jx8 n MET 35 Ca -0.18 0.04 0.00 0.00 -1.81 0.00 0.00 57.70 55.75 2jx8 n MET 35 Cb 0.56 -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 1.94 0.87 -4.22 0.03 -0.04 -1.26 -5.11 135.00 127.21 2jx8 n PRO 36 Ca 0.21 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.55 2jx8 n PRO 36 Cb 0.07 0.00 -0.10 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 -0.12 0.46 0.09 0.52 1.01 -1.26 -5.08 120.40 116.02 2jx8 s VAL 37 Ca 0.00 -1.96 -0.20 0.00 0.00 0.00 0.00 61.98 59.82 2jx8 s VAL 37 Cb 0.00 -2.15 0.05 0.00 0.00 0.00 0.00 36.38 34.28 2jx8 s VAL 37 CO 0.00 -0.42 0.48 -0.22 0.00 0.00 0.00 175.10 174.94 2jx8 s LEU 38 N -3.14 0.08 0.00 3.92 1.98 -1.26 -4.95 118.68 115.30 2jx8 s LEU 38 Ca 0.26 -0.04 0.00 0.00 -2.89 0.00 0.00 54.13 51.46 2jx8 s LEU 38 Cb 0.07 2.04 0.00 0.00 0.66 0.00 0.00 46.19 48.96 2jx8 s LEU 38 CO 0.04 -0.79 0.00 0.61 -1.89 0.00 0.00 176.35 174.32 2jx8 n GLY 39 N 0.11 0.19 3.54 7.98 0.00 -1.26 -5.04 105.19 110.71 2jx8 n GLY 39 Ca -0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 2jx8 n GLY 39 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jx8 s GLN 40 N 0.00 3.58 -1.49 1.61 -0.21 -1.26 -4.31 119.66 117.58 2jx8 s GLN 40 Ca 0.00 -1.23 -0.17 0.00 0.02 0.00 0.00 55.36 53.98 2jx8 s GLN 40 Cb 0.00 -5.24 0.16 0.00 1.00 0.00 0.00 33.01 28.93 2jx8 s GLN 40 CO 0.00 -2.12 0.54 1.58 -2.12 0.00 0.00 175.29 173.17 2jx8 n HIS 41 N 8.42 -1.50 -1.63 0.91 -0.00 -1.26 -4.91 115.22 115.26 2jx8 n HIS 41 Ca 0.30 0.58 0.00 0.00 -0.00 0.00 0.00 57.72 58.61 2jx8 n HIS 41 Cb 0.51 -2.13 0.00 0.00 -0.00 0.00 0.00 29.99 28.37 2jx8 n HIS 41 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.34 176.09 2jx8 n ASP 42 N -2.34 0.00 -1.61 0.26 8.00 -1.26 -4.97 116.55 114.63 2jx8 n ASP 42 Ca 0.08 -0.73 0.00 0.00 0.71 0.00 0.00 54.79 54.85 2jx8 n ASP 42 Cb 0.48 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.58 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 -1.12 -3.86 -2.01 2.53 0.31 -1.26 -4.70 118.33 108.22 2jx8 n VAL 43 Ca 0.00 1.83 -0.42 0.00 -0.01 0.00 0.00 64.34 65.74 2jx8 n VAL 43 Cb 0.00 -2.73 -0.03 0.00 -0.91 0.00 0.00 33.84 30.17 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 -4.48 2.96 -0.47 2.52 1.01 -1.26 -4.92 121.20 116.57 2jx8 s ILE 44 Ca 0.00 0.62 0.05 0.00 0.00 0.00 0.00 60.65 61.32 2jx8 s ILE 44 Cb 0.00 -3.40 0.27 0.00 0.01 0.00 0.00 42.46 39.34 2jx8 s ILE 44 CO 0.00 0.03 0.99 -1.54 0.00 0.00 0.00 174.94 174.42 2jx8 n SER 45 N 4.43 -2.62 -4.63 3.58 3.41 -1.26 -5.12 113.62 111.41 2jx8 n SER 45 Ca 0.14 -3.28 -0.40 0.00 -0.26 0.00 0.00 58.87 55.07 2jx8 n SER 45 Cb 0.40 1.77 -0.07 0.00 -0.26 0.00 0.00 64.21 66.06 2jx8 n SER 45 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2jx8 s ASP 46 N -1.46 6.55 0.00 4.04 1.01 -1.26 -5.18 116.67 120.38 2jx8 s ASP 46 Ca 0.29 0.67 0.20 0.00 0.71 0.00 0.00 52.55 54.42 2jx8 s ASP 46 Cb 0.25 -2.32 1.18 0.00 1.01 0.00 0.00 42.92 43.04 2jx8 s ASP 46 CO -0.19 -0.31 1.57 -0.81 0.21 0.00 0.00 175.17 175.65