#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jot n ASP 2 N 0.00 2.51 -0.04 9.51 9.92 -1.26 -4.44 116.55 132.75 2jot n ASP 2 Ca 0.00 0.00 -0.19 0.00 -0.53 0.00 0.00 54.79 54.07 2jot n ASP 2 Cb 0.00 1.38 -0.13 0.00 -0.64 0.00 0.00 41.12 41.72 2jot n ASP 2 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 2jot h THR 3 N 0.00 1.35 0.00 -3.53 2.02 -1.95 -3.12 112.91 107.68 2jot h THR 3 Ca -0.04 -2.35 0.00 0.00 0.77 0.00 0.00 66.41 64.78 2jot h THR 3 Cb 0.68 2.91 0.00 0.00 -1.74 0.00 0.00 68.15 70.01 2jot h THR 3 CO 0.00 0.58 0.00 0.00 0.37 0.00 0.00 175.52 176.47 2jot n ARG 5 N -2.02 0.66 -2.98 0.00 1.85 -1.25 -4.44 116.66 108.48 2jot n ARG 5 Ca 0.01 0.17 -0.41 0.00 -1.00 0.00 0.00 57.85 56.62 2jot n ARG 5 Cb 0.13 -1.67 -0.05 0.00 -1.05 0.00 0.00 32.46 29.82 2jot n ARG 5 CO 0.00 0.00 0.00 -0.48 -0.01 0.00 0.00 177.63 177.14 2jot s LEU 6 N -5.91 4.15 0.77 2.89 0.05 -0.95 -5.06 118.68 114.62 2jot s LEU 6 Ca -0.09 1.01 -0.11 0.00 0.05 0.00 0.00 54.13 54.99 2jot s LEU 6 Cb 0.07 -3.08 0.05 0.00 -2.05 0.00 0.00 46.19 41.18 2jot s LEU 6 CO 0.82 -0.36 1.09 -2.16 -0.55 0.00 0.00 176.35 175.18 2jot s PRO 7 N 2.14 2.30 0.08 1.48 0.04 -1.26 -4.59 135.00 135.20 2jot s PRO 7 Ca 0.34 0.69 0.04 0.00 0.04 0.00 0.00 61.00 62.11 2jot s PRO 7 Cb -0.16 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 32.40 2jot s PRO 7 CO 0.11 -1.48 0.00 -1.12 0.04 0.00 0.00 177.00 174.55 2jot s SER 8 N -3.91 5.06 0.23 6.66 0.01 -1.26 -4.89 113.70 115.59 2jot s SER 8 Ca 0.60 -0.15 -0.12 0.00 1.31 0.00 0.00 55.95 57.59 2jot s SER 8 Cb -0.14 -1.23 -0.07 0.00 0.21 0.00 0.00 66.02 64.79 2jot s SER 8 CO 0.54 0.19 0.59 -1.81 0.41 0.00 0.00 173.24 173.15 2jot s ASP 9 N -2.24 6.70 0.01 2.44 1.11 0.32 -4.99 116.67 120.03 2jot s ASP 9 Ca 0.25 1.03 0.25 0.00 0.18 0.00 0.00 52.55 54.26 2jot s ASP 9 Cb -0.12 -2.27 0.49 0.00 1.07 0.00 0.00 42.92 42.09 2jot s ASP 9 CO 0.18 -0.06 1.40 0.54 1.18 0.00 0.00 175.17 178.42 2jot n ARG 10 N 0.05 0.03 -2.16 8.23 1.74 -1.26 -4.48 116.66 118.81 2jot n ARG 10 Ca -0.00 0.01 -0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2jot n ARG 10 Cb 0.52 -1.52 0.00 0.00 -1.02 0.00 0.00 32.46 30.45 2jot n ARG 10 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jot n GLY 11 N 1.49 0.00 0.08 -0.13 0.00 0.79 0.12 105.19 107.53 2jot n GLY 11 Ca 0.05 0.01 -0.03 0.00 0.00 0.00 0.00 46.02 46.06 2jot n GLY 11 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2jot h ARG 12 N 2.58 -0.10 0.00 1.61 3.08 -1.87 -2.39 114.38 117.29 2jot h ARG 12 Ca -0.00 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2jot h ARG 12 Cb 0.62 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.69 2jot h ARG 12 CO 0.00 -0.07 0.00 0.00 -1.07 0.00 0.00 179.97 178.83 2jot n LYS 14 N 0.00 1.51 -3.99 0.00 3.00 -1.26 -4.88 118.16 112.54 2jot n LYS 14 Ca 0.00 -0.77 -0.23 0.00 -0.00 0.00 0.00 58.31 57.31 2jot n LYS 14 Cb 0.00 -1.33 -0.06 0.00 0.00 0.00 0.00 35.03 33.65 2jot n LYS 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2jot s ALA 15 N -1.82 3.64 -0.47 3.14 0.00 -1.15 -5.10 121.76 120.00 2jot s ALA 15 Ca 0.28 -1.84 0.04 0.00 0.00 0.00 0.00 51.96 50.44 2jot s ALA 15 Cb 0.14 -0.80 0.21 0.00 0.00 0.00 0.00 23.12 22.68 2jot s ALA 15 CO 0.22 -0.03 0.87 0.43 0.00 0.00 0.00 175.76 177.25 2jot n SER 16 N -1.25 -2.86 -4.78 0.00 7.64 -1.26 -4.26 113.62 106.85 2jot n SER 16 Ca -0.02 -2.67 -0.24 0.00 1.01 0.00 0.00 58.87 56.95 2jot n SER 16 Cb 0.61 1.56 -0.06 0.00 -1.01 0.00 0.00 64.21 65.31 2jot n SER 16 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2jot s PHE 17 N 0.77 2.59 -0.13 1.43 0.08 -1.18 -4.90 117.98 116.65 2jot s PHE 17 Ca 0.29 -0.58 -0.05 0.00 0.12 0.00 0.00 56.93 56.71 2jot s PHE 17 Cb 0.10 -2.01 -0.04 0.00 -0.57 0.00 0.00 43.02 40.51 2jot s PHE 17 CO -0.12 0.09 0.07 -1.21 -0.10 0.00 0.00 175.22 173.95 2jot s GLU 18 N -3.97 3.45 0.14 0.44 8.01 -1.26 0.14 118.70 125.65 2jot s GLU 18 Ca 0.42 -0.28 -0.07 0.00 0.01 0.00 0.00 54.97 55.05 2jot s GLU 18 Cb 0.02 -3.07 -0.02 0.00 -4.31 0.00 0.00 34.13 26.75 2jot s GLU 18 CO 0.24 0.61 0.20 1.03 0.01 0.00 0.00 175.26 177.35 2jot s ARG 19 N -0.58 1.03 -0.02 1.61 0.52 -1.05 -4.87 118.95 115.60 2jot s ARG 19 Ca 0.11 -1.20 0.01 0.00 -0.52 0.00 0.00 55.73 54.13 2jot s ARG 19 Cb -0.12 0.33 -0.04 0.00 0.52 0.00 0.00 34.95 35.65 2jot s ARG 19 CO 0.02 -0.35 -0.00 -1.58 0.02 0.00 0.00 175.30 173.41 2jot s TRP 20 N -3.97 3.09 0.07 -0.53 0.52 0.25 -2.97 118.94 115.41 2jot s TRP 20 Ca 0.16 0.10 0.04 0.00 0.02 0.00 0.00 56.10 56.42 2jot s TRP 20 Cb 0.05 -1.69 -0.03 0.00 -1.15 0.00 0.00 33.47 30.64 2jot s TRP 20 CO -0.02 0.46 -0.11 1.52 0.02 0.00 0.00 176.95 178.82 2jot s TYR 21 N -1.04 1.01 0.48 -1.98 1.13 -0.89 0.12 117.35 116.17 2jot s TYR 21 Ca 0.18 -0.54 -0.22 0.00 -1.41 0.00 0.00 57.07 55.08 2jot s TYR 21 Cb -0.11 -0.57 -0.07 0.00 -1.10 0.00 0.00 41.96 40.11 2jot s TYR 21 CO 0.08 -0.00 1.16 -0.06 -2.51 0.00 0.00 175.55 174.22 2jot s PHE 22 N -1.70 2.84 -0.46 -3.49 0.08 -1.11 -0.62 117.98 113.51 2jot s PHE 22 Ca -0.02 1.54 0.07 0.00 0.12 0.00 0.00 56.93 58.64 2jot s PHE 22 Cb -0.08 -3.36 0.23 0.00 -0.57 0.00 0.00 43.02 39.25 2jot s PHE 22 CO 0.01 -1.51 0.73 -1.71 -0.10 0.00 0.00 175.22 172.64 2jot n ASN 23 N -0.64 -1.89 0.00 1.36 5.15 0.13 -4.78 115.26 114.59 2jot n ASN 23 Ca 0.08 -3.03 0.00 0.00 -0.60 0.00 0.00 54.58 51.03 2jot n ASN 23 Cb 0.49 0.95 0.00 0.00 -0.53 0.00 0.00 39.78 40.68 2jot n ASN 23 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2jot n GLY 24 N 1.76 2.34 0.01 8.20 0.00 -1.26 -3.17 105.19 113.07 2jot n GLY 24 Ca 0.15 -0.03 -0.01 0.00 0.00 0.00 0.00 46.02 46.12 2jot n GLY 24 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2jot n ARG 25 N 0.00 3.37 -4.37 1.61 0.00 -1.26 -4.96 116.66 111.05 2jot n ARG 25 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 57.85 57.57 2jot n ARG 25 Cb 0.00 -1.03 -0.06 0.00 -0.00 0.00 0.00 32.46 31.36 2jot n ARG 25 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.63 177.55 2jot s THR 26 N -2.03 1.69 0.27 8.89 -1.32 -1.19 -4.11 115.64 117.83 2jot s THR 26 Ca -0.01 -1.80 0.09 0.00 -1.21 0.00 0.00 61.69 58.76 2jot s THR 26 Cb 0.00 -2.49 -0.04 0.00 -1.51 0.00 0.00 72.50 68.47 2jot s THR 26 CO 0.05 0.00 0.08 0.00 -2.21 0.00 0.00 174.62 172.54 2jot s ALA 28 N -2.27 4.02 -0.01 0.00 0.00 0.20 -4.89 121.76 118.82 2jot s ALA 28 Ca 0.33 -0.69 0.02 0.00 0.00 0.00 0.00 51.96 51.62 2jot s ALA 28 Cb -0.07 -0.02 -0.00 0.00 0.00 0.00 0.00 23.12 23.03 2jot s ALA 28 CO 0.22 -0.06 -0.08 0.21 0.00 0.00 0.00 175.76 176.05 2jot s LYS 29 N -3.89 0.69 0.34 0.00 2.20 -1.26 -2.09 119.74 115.72 2jot s LYS 29 Ca 0.12 -0.26 -0.12 0.00 -0.36 0.00 0.00 55.97 55.34 2jot s LYS 29 Cb 0.02 -0.66 0.03 0.00 -1.51 0.00 0.00 37.83 35.71 2jot s LYS 29 CO 0.06 0.14 0.64 -0.59 -0.36 0.00 0.00 175.35 175.24 2jot s PHE 30 N -0.03 0.37 -0.80 4.03 -0.12 -1.16 -5.01 117.98 115.27 2jot s PHE 30 Ca 0.01 -0.85 -0.20 0.00 -0.05 0.00 0.00 56.93 55.84 2jot s PHE 30 Cb -0.05 0.47 0.11 0.00 -0.63 0.00 0.00 43.02 42.91 2jot s PHE 30 CO -0.00 -1.31 1.03 0.42 -0.05 0.00 0.00 175.22 175.30 2jot s ILE 31 N -3.01 4.59 -0.64 -4.49 -1.09 -1.26 -2.52 121.20 112.78 2jot s ILE 31 Ca 0.20 -1.08 -0.21 0.00 -2.23 0.00 0.00 60.65 57.34 2jot s ILE 31 Cb -0.03 -4.72 0.09 0.00 -1.58 0.00 0.00 42.46 36.22 2jot s ILE 31 CO 0.13 -1.46 0.85 -0.47 -1.23 0.00 0.00 174.94 172.76 2jot s TYR 32 N 3.19 2.85 0.24 3.97 5.04 0.37 -4.69 117.35 128.32 2jot s TYR 32 Ca 0.27 -0.79 0.34 0.00 -2.44 0.00 0.00 57.07 54.45 2jot s TYR 32 Cb -0.11 -4.16 1.81 0.00 0.35 0.00 0.00 41.96 39.85 2jot s TYR 32 CO -0.01 -1.47 2.04 0.78 -1.34 0.00 0.00 175.55 175.55 2jot h GLY 33 N 10.64 0.00 0.00 8.97 0.00 0.15 -3.13 103.07 119.71 2jot h GLY 33 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.06 2jot h GLY 33 CO 1.14 0.00 0.00 0.61 0.00 0.00 0.00 176.54 178.29 2jot n GLY 34 N -1.00 0.82 3.41 4.60 0.00 -1.24 -4.38 105.19 107.39 2jot n GLY 34 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 2jot n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jot n GLY 36 N 4.08 0.67 3.25 0.00 0.00 -1.26 -0.15 105.19 111.78 2jot n GLY 36 Ca -0.18 -0.60 -0.13 0.00 0.00 0.00 0.00 46.02 45.11 2jot n GLY 36 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jot s GLY 37 N -2.17 -0.19 0.00 -0.02 0.00 -1.26 0.12 107.32 103.79 2jot s GLY 37 Ca 0.00 0.53 0.00 0.00 0.00 0.00 0.00 44.72 45.25 2jot s GLY 37 CO 0.00 0.34 0.00 1.16 0.00 0.00 0.00 173.10 174.60 2jot n ASN 38 N 1.72 0.00 0.00 1.64 0.23 -1.26 -5.02 115.26 112.57 2jot n ASN 38 Ca -0.19 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.86 2jot n ASN 38 Cb 0.56 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.26 2jot n ASN 38 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2jot n GLY 39 N 1.60 -0.19 0.09 4.83 0.00 -1.26 -4.76 105.19 105.50 2jot n GLY 39 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 2jot n GLY 39 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2jot h ASN 40 N 0.00 0.00 -4.18 1.61 -0.73 -1.81 -3.47 115.58 107.00 2jot h ASN 40 Ca 0.00 0.00 -0.47 0.00 1.87 0.00 0.00 56.30 57.70 2jot h ASN 40 Cb 0.27 0.00 0.02 0.00 0.27 0.00 0.00 38.32 38.87 2jot h ASN 40 CO 0.00 0.84 0.37 -1.59 -0.37 0.00 0.00 177.43 176.69 2jot s LYS 41 N -2.72 3.92 -0.07 6.67 0.00 -1.26 -2.76 119.74 123.52 2jot s LYS 41 Ca -0.04 0.98 -0.20 0.00 0.00 0.00 0.00 55.97 56.71 2jot s LYS 41 Cb 0.08 -2.13 0.04 0.00 0.00 0.00 0.00 37.83 35.83 2jot s LYS 41 CO 0.82 -0.29 0.47 -0.06 0.00 0.00 0.00 175.35 176.29 2jot s PHE 42 N -2.58 -0.42 -0.02 1.78 0.40 0.32 -4.94 117.98 112.51 2jot s PHE 42 Ca 0.59 0.82 -0.21 0.00 -0.60 0.00 0.00 56.93 57.53 2jot s PHE 42 Cb -0.10 0.21 -0.26 0.00 0.51 0.00 0.00 43.02 43.38 2jot s PHE 42 CO 0.30 -0.42 1.01 -1.00 0.70 0.00 0.00 175.22 175.82 2jot h PRO 43 N 4.03 0.33 -6.46 0.24 0.13 -1.91 0.73 132.00 129.09 2jot h PRO 43 Ca -0.28 -0.43 -0.63 0.00 -0.87 0.00 0.00 66.00 63.79 2jot h PRO 43 Cb 1.17 0.14 -0.14 0.00 0.13 0.00 0.00 31.00 32.29 2jot h PRO 43 CO 0.34 1.13 -0.72 0.95 -0.23 0.00 0.00 178.00 179.47 2jot s THR 44 N -2.90 3.33 -0.02 1.56 -4.23 -1.26 -4.49 115.64 107.64 2jot s THR 44 Ca -0.14 -1.51 0.26 0.00 -1.18 0.00 0.00 61.69 59.13 2jot s THR 44 Cb 0.02 -2.63 0.30 0.00 1.34 0.00 0.00 72.50 71.53 2jot s THR 44 CO 0.81 -0.05 1.80 -0.61 -0.54 0.00 0.00 174.62 176.04 2jot h GLN 45 N 3.06 0.00 0.00 3.99 4.15 -1.96 -2.99 115.11 121.36 2jot h GLN 45 Ca -0.47 0.00 -0.07 0.00 0.77 0.00 0.00 58.65 58.88 2jot h GLN 45 Cb 1.19 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.87 2jot h GLN 45 CO 0.54 0.12 -0.33 1.05 -1.93 0.00 0.00 178.83 178.29 2jot h GLU 46 N 0.00 0.00 0.02 1.69 4.11 -1.99 -2.13 114.58 116.28 2jot h GLU 46 Ca -0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.43 2jot h GLU 46 Cb 0.77 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.02 2jot h GLU 46 CO 0.02 0.33 -0.01 0.00 0.07 0.00 0.00 179.01 179.41 2jot h ALA 47 N 1.67 -0.02 -0.56 1.06 0.00 -1.93 -2.24 119.26 117.24 2jot h ALA 47 Ca -0.00 -0.38 0.05 0.00 0.00 0.00 0.00 54.91 54.57 2jot h ALA 47 Cb 0.61 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 2jot h ALA 47 CO 0.04 -0.09 0.37 0.00 0.00 0.00 0.00 179.25 179.57 2jot h MET 49 N 0.59 0.09 -0.01 0.00 2.07 -1.46 -2.73 114.93 113.48 2jot h MET 49 Ca 0.23 -0.10 0.00 0.00 -2.07 0.00 0.00 59.70 57.76 2jot h MET 49 Cb 0.18 0.03 0.00 0.00 -1.87 0.00 0.00 31.60 29.94 2jot h MET 49 CO -0.06 0.91 -0.02 1.17 1.07 0.00 0.00 176.91 179.97 2jot n LYS 50 N -3.57 1.59 -0.10 1.72 4.81 -0.55 -0.25 118.16 121.80 2jot n LYS 50 Ca -0.02 -0.92 -0.20 0.00 -0.87 0.00 0.00 58.31 56.30 2jot n LYS 50 Cb 0.82 -1.48 -0.07 0.00 0.02 0.00 0.00 35.03 34.33 2jot n LYS 50 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 2jot n ARG 51 N 0.10 0.47 -0.01 1.64 3.00 0.43 -4.43 116.66 117.85 2jot n ARG 51 Ca 0.18 0.20 0.01 0.00 -0.00 0.00 0.00 57.85 58.25 2jot n ARG 51 Cb 0.35 -1.29 -0.04 0.00 0.00 0.00 0.00 32.46 31.48 2jot n ARG 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2jot n ALA 53 N -1.84 3.04 -0.04 0.00 0.00 -1.04 -4.39 120.51 116.24 2jot n ALA 53 Ca -0.03 -0.25 -0.08 0.00 0.00 0.00 0.00 53.44 53.08 2jot n ALA 53 Cb 0.30 -1.24 -0.03 0.00 0.00 0.00 0.00 19.45 18.48 2jot n ALA 53 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2jot n LYS 54 N -1.64 0.28 0.00 0.00 5.02 0.65 -4.91 118.16 117.55 2jot n LYS 54 Ca 0.06 0.11 0.02 0.00 -2.02 0.00 0.00 58.31 56.48 2jot n LYS 54 Cb 0.36 -0.97 0.11 0.00 -0.02 0.00 0.00 35.03 34.51 2jot n LYS 54 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88