#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j28 s LYS 2 N 0.00 3.06 0.86 0.03 2.20 -1.26 -5.04 119.74 119.60 2j28 s LYS 2 Ca 0.00 -1.20 -0.12 0.00 -0.36 0.00 0.00 55.97 54.29 2j28 s LYS 2 Cb 0.00 -4.23 0.11 0.00 -1.51 0.00 0.00 37.83 32.20 2j28 s LYS 2 CO 0.00 -1.50 1.15 -2.13 -0.36 0.00 0.00 175.35 172.52 2j28 n ARG 3 N 6.39 -0.09 -2.75 4.03 3.00 -1.26 -4.89 116.66 121.10 2j28 n ARG 3 Ca -0.09 0.05 -0.42 0.00 -0.00 0.00 0.00 57.85 57.39 2j28 n ARG 3 Cb 0.43 -2.39 -0.03 0.00 0.00 0.00 0.00 32.46 30.47 2j28 n ARG 3 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 2j28 s THR 4 N -2.34 4.28 0.01 5.15 -4.23 -1.26 -4.37 115.64 112.88 2j28 s THR 4 Ca 0.70 -0.93 0.00 0.00 -1.18 0.00 0.00 61.69 60.28 2j28 s THR 4 Cb -0.27 -4.88 0.00 0.00 1.34 0.00 0.00 72.50 68.69 2j28 s THR 4 CO 0.54 -1.69 0.00 0.33 -0.54 0.00 0.00 174.62 173.26 2j28 n PHE 5 N 7.83 -0.77 -1.41 3.99 7.35 -1.26 -5.17 117.46 128.02 2j28 n PHE 5 Ca 0.22 0.04 0.18 0.00 -0.76 0.00 0.00 57.45 57.12 2j28 n PHE 5 Cb 0.49 0.23 -0.07 0.00 0.35 0.00 0.00 39.48 40.48 2j28 n PHE 5 CO 0.00 0.00 0.00 1.04 -0.76 0.00 0.00 176.76 177.04 2j28 n GLN 6 N -1.85 -2.99 0.00 -4.13 1.13 -1.26 -4.98 117.38 103.30 2j28 n GLN 6 Ca 0.00 2.24 0.00 0.00 -1.94 0.00 0.00 57.00 57.30 2j28 n GLN 6 Cb 0.00 -3.60 0.00 0.00 0.11 0.00 0.00 30.24 26.75 2j28 n GLN 6 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 2j28 n PRO 7 N -4.19 0.00 -1.66 -1.09 -0.04 -1.26 -5.09 135.00 121.66 2j28 n PRO 7 Ca -0.04 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.41 2j28 n PRO 7 Cb 0.68 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 34.13 2j28 n PRO 7 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2j28 n SER 8 N 0.00 -1.83 0.01 3.54 2.88 -1.26 -4.94 113.62 112.02 2j28 n SER 8 Ca 0.00 0.20 0.12 0.00 -1.33 0.00 0.00 58.87 57.85 2j28 n SER 8 Cb 0.00 -1.63 0.16 0.00 -0.75 0.00 0.00 64.21 61.99 2j28 n SER 8 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 2j28 n VAL 9 N 0.24 0.05 0.09 2.46 0.24 -1.26 -3.73 118.33 116.42 2j28 n VAL 9 Ca -0.06 -0.05 0.11 0.00 -2.04 0.00 0.00 64.34 62.31 2j28 n VAL 9 Cb 0.09 0.33 -0.02 0.00 -1.47 0.00 0.00 33.84 32.77 2j28 n VAL 9 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2j28 n LEU 10 N -1.60 0.76 0.07 1.34 -0.00 -1.26 -3.95 117.00 112.36 2j28 n LEU 10 Ca 0.05 0.29 0.12 0.00 -0.00 0.00 0.00 56.01 56.46 2j28 n LEU 10 Cb 0.35 -0.05 0.03 0.00 -0.00 0.00 0.00 43.42 43.75 2j28 n LEU 10 CO 0.37 -0.17 0.04 1.17 -0.00 0.00 0.00 177.39 178.80 2j28 n LYS 11 N -2.63 0.47 0.01 1.47 4.81 -1.25 -4.36 118.16 116.69 2j28 n LYS 11 Ca -0.00 0.07 -0.01 0.00 -0.87 0.00 0.00 58.31 57.49 2j28 n LYS 11 Cb 0.55 -1.73 -0.01 0.00 0.02 0.00 0.00 35.03 33.87 2j28 n LYS 11 CO 0.00 0.00 0.00 -0.09 1.17 0.00 0.00 177.40 178.48 2j28 h ARG 12 N 0.00 -0.07 -1.27 1.64 9.65 -1.68 -3.33 114.38 119.32 2j28 h ARG 12 Ca 0.00 0.00 0.37 0.00 -1.10 0.00 0.00 59.98 59.25 2j28 h ARG 12 Cb 0.89 0.02 -0.05 0.00 -1.39 0.00 0.00 29.97 29.43 2j28 h ARG 12 CO 0.00 -0.04 1.10 -0.97 2.80 0.00 0.00 179.97 182.85 2j28 h ASN 13 N -0.32 0.00 0.00 -3.80 -1.24 -1.70 0.35 115.58 108.87 2j28 h ASN 13 Ca -0.01 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 56.99 2j28 h ASN 13 Cb 0.05 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.10 2j28 h ASN 13 CO 0.01 0.00 -0.02 0.54 -1.29 0.00 0.00 177.43 176.68 2j28 n ARG 14 N -3.72 1.00 0.00 6.67 1.74 -1.25 -1.95 116.66 119.15 2j28 n ARG 14 Ca 0.28 -0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.32 2j28 n ARG 14 Cb 1.50 -1.07 0.00 0.00 -1.02 0.00 0.00 32.46 31.87 2j28 n ARG 14 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2j28 n SER 15 N 1.57 0.00 -3.66 0.55 3.41 0.12 -5.04 113.62 110.57 2j28 n SER 15 Ca 0.02 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.56 2j28 n SER 15 Cb 0.49 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.36 2j28 n SER 15 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 2j28 s HIS 16 N -0.52 -0.94 0.00 7.33 5.65 -0.82 -4.79 115.29 121.20 2j28 s HIS 16 Ca 0.00 1.78 0.00 0.00 0.25 0.00 0.00 55.06 57.09 2j28 s HIS 16 Cb 0.00 0.48 0.00 0.00 -1.18 0.00 0.00 32.58 31.88 2j28 s HIS 16 CO 0.00 -0.50 0.00 0.41 -0.65 0.00 0.00 174.74 174.00 2j28 n GLY 17 N 4.96 -0.67 3.27 1.59 0.00 -1.25 -3.64 105.19 109.45 2j28 n GLY 17 Ca -0.15 0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2j28 n GLY 17 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2j28 n PHE 18 N 0.00 0.00 0.03 1.61 1.16 -1.26 -3.50 117.46 115.50 2j28 n PHE 18 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 57.45 55.55 2j28 n PHE 18 Cb 0.00 -0.03 -0.09 0.00 -1.61 0.00 0.00 39.48 37.75 2j28 n PHE 18 CO 0.00 0.00 0.00 0.07 -1.87 0.00 0.00 176.76 174.96 2j28 h ARG 19 N 0.00 0.00 0.00 3.97 -0.00 -1.93 0.11 114.38 116.54 2j28 h ARG 19 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 59.98 59.79 2j28 h ARG 19 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 29.97 29.94 2j28 h ARG 19 CO 0.00 0.46 -1.11 0.00 -0.00 0.00 0.00 179.97 179.32 2j28 h ALA 20 N 1.26 0.59 0.00 0.08 0.00 -1.78 -3.20 119.26 116.21 2j28 h ALA 20 Ca -0.16 -0.89 0.00 0.00 0.00 0.00 0.00 54.91 53.86 2j28 h ALA 20 Cb 1.71 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.60 2j28 h ALA 20 CO 0.07 1.08 -0.02 0.00 0.00 0.00 0.00 179.25 180.38 2j28 h ARG 21 N 0.00 0.00 -0.50 0.00 2.47 -1.80 -3.35 114.38 111.19 2j28 h ARG 21 Ca -0.10 0.00 0.15 0.00 -1.26 0.00 0.00 59.98 58.77 2j28 h ARG 21 Cb 1.67 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.97 2j28 h ARG 21 CO 0.08 0.00 0.52 1.98 0.56 0.00 0.00 179.97 183.11 2j28 h MET 22 N -0.11 0.00 0.00 0.04 4.05 -0.96 0.14 114.93 118.09 2j28 h MET 22 Ca 0.00 0.00 -0.09 0.00 -0.28 0.00 0.00 59.70 59.33 2j28 h MET 22 Cb 0.02 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 30.80 2j28 h MET 22 CO 0.00 0.00 -0.45 0.00 0.23 0.00 0.00 176.91 176.69 2j28 h ALA 23 N 1.44 1.18 -2.71 0.39 0.00 -1.71 -3.43 119.26 114.42 2j28 h ALA 23 Ca 0.24 -0.41 -0.58 0.00 0.00 0.00 0.00 54.91 54.16 2j28 h ALA 23 Cb 1.28 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.96 2j28 h ALA 23 CO -0.00 0.56 -0.31 0.99 0.00 0.00 0.00 179.25 180.49 2j28 s THR 24 N -3.91 5.16 0.00 0.00 2.01 0.49 -5.03 115.64 114.37 2j28 s THR 24 Ca -0.02 0.09 0.00 0.00 0.31 0.00 0.00 61.69 62.07 2j28 s THR 24 Cb 0.13 -3.62 0.00 0.00 0.01 0.00 0.00 72.50 69.02 2j28 s THR 24 CO 0.73 0.08 0.64 0.29 -0.69 0.00 0.00 174.62 175.66 2j28 n LYS 25 N 0.22 0.00 0.22 4.92 4.01 -1.26 -2.22 118.16 124.05 2j28 n LYS 25 Ca -0.03 0.26 0.18 0.00 -0.51 0.00 0.00 58.31 58.20 2j28 n LYS 25 Cb 0.52 -1.14 0.86 0.00 -0.51 0.00 0.00 35.03 34.76 2j28 n LYS 25 CO 0.00 0.00 0.00 -2.95 -1.11 0.00 0.00 177.40 173.34 2j28 h ASN 26 N 0.00 0.00 -1.00 4.39 7.08 -1.97 -2.39 115.58 121.70 2j28 h ASN 26 Ca 0.00 0.00 0.13 0.00 -3.08 0.00 0.00 56.30 53.35 2j28 h ASN 26 Cb 0.00 0.00 -0.09 0.00 -2.08 0.00 0.00 38.32 36.15 2j28 h ASN 26 CO 0.00 0.00 0.63 1.23 -2.08 0.00 0.00 177.43 177.21 2j28 h GLY 27 N 0.00 1.63 2.00 9.14 0.00 -1.61 0.34 103.07 114.57 2j28 h GLY 27 Ca 0.08 -0.41 -0.04 0.00 0.00 0.00 0.00 47.33 46.96 2j28 h GLY 27 CO -0.00 0.13 -0.21 -0.09 0.00 0.00 0.00 176.54 176.36 2j28 h ARG 28 N 0.94 0.00 -0.40 4.80 1.12 -1.01 -2.53 114.38 117.30 2j28 h ARG 28 Ca 0.50 0.00 -0.14 0.00 -1.11 0.00 0.00 59.98 59.23 2j28 h ARG 28 Cb 0.56 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.51 2j28 h ARG 28 CO -0.27 0.21 -0.33 1.96 -3.11 0.00 0.00 179.97 178.43 2j28 h GLN 29 N 0.00 0.89 -1.03 0.20 4.20 -1.07 -3.09 115.11 115.22 2j28 h GLN 29 Ca -0.00 -0.43 0.26 0.00 0.06 0.00 0.00 58.65 58.54 2j28 h GLN 29 Cb 0.52 -0.00 -0.09 0.00 0.30 0.00 0.00 27.48 28.21 2j28 h GLN 29 CO 0.03 1.08 0.67 0.28 -0.67 0.00 0.00 178.83 180.22 2j28 h VAL 30 N 0.75 0.54 -0.01 -0.54 2.07 -1.15 0.91 116.25 118.82 2j28 h VAL 30 Ca 0.08 -0.13 -0.18 0.00 0.82 0.00 0.00 66.70 67.28 2j28 h VAL 30 Cb 0.90 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 2j28 h VAL 30 CO 0.08 0.07 -0.82 -0.07 0.02 0.00 0.00 177.57 176.85 2j28 h LEU 31 N 0.38 0.20 -0.28 2.57 4.07 -1.65 -3.07 115.31 117.54 2j28 h LEU 31 Ca 0.58 -0.16 -0.20 0.00 0.08 0.00 0.00 57.88 58.18 2j28 h LEU 31 Cb 1.50 -0.06 -0.00 0.00 1.08 0.00 0.00 40.66 43.17 2j28 h LEU 31 CO -0.26 0.93 -0.87 0.00 -1.08 0.00 0.00 178.44 177.16 2j28 h ALA 32 N 1.05 0.49 0.00 1.53 0.00 0.16 0.46 119.26 122.95 2j28 h ALA 32 Ca -0.03 -0.69 -0.00 0.00 0.00 0.00 0.00 54.91 54.19 2j28 h ALA 32 Cb 1.43 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.17 2j28 h ALA 32 CO 0.12 0.84 -0.00 0.00 0.00 0.00 0.00 179.25 180.21 2j28 h ARG 33 N 0.18 0.00 0.00 0.00 2.47 0.57 0.55 114.38 118.15 2j28 h ARG 33 Ca -0.05 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.67 2j28 h ARG 33 Cb 1.48 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.80 2j28 h ARG 33 CO 0.14 0.00 0.00 0.54 0.56 0.00 0.00 179.97 181.21 2j28 n ARG 34 N -4.38 0.00 0.09 0.04 1.74 -1.10 -2.85 116.66 110.20 2j28 n ARG 34 Ca -0.03 0.01 -0.12 0.00 -0.77 0.00 0.00 57.85 56.94 2j28 n ARG 34 Cb 0.09 -0.44 -0.07 0.00 -1.02 0.00 0.00 32.46 31.01 2j28 n ARG 34 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2j28 h ARG 35 N 0.00 -0.55 0.20 5.56 -0.00 -0.20 0.22 114.38 119.61 2j28 h ARG 35 Ca 0.00 0.04 -0.01 0.00 -0.50 0.00 0.00 59.98 59.51 2j28 h ARG 35 Cb 0.00 0.12 0.00 0.00 0.00 0.00 0.00 29.97 30.10 2j28 h ARG 35 CO 0.00 -0.37 -0.09 0.00 0.00 0.00 0.00 179.97 179.51 2j28 h ALA 36 N -0.82 -0.75 0.20 0.04 0.00 -1.53 -3.38 119.26 113.02 2j28 h ALA 36 Ca -0.01 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2j28 h ALA 36 Cb 0.57 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2j28 h ALA 36 CO -0.21 -0.73 -0.17 -0.22 0.00 0.00 0.00 179.25 177.93 2j28 h LYS 37 N -0.36 -0.34 0.00 0.00 3.11 -0.03 -3.44 116.57 115.51 2j28 h LYS 37 Ca -0.03 0.02 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 2j28 h LYS 37 Cb 0.20 0.08 0.00 0.00 -1.00 0.00 0.00 32.23 31.51 2j28 h LYS 37 CO 0.04 -0.23 0.00 0.41 -2.81 0.00 0.00 179.45 176.87 2j28 n GLY 38 N -1.19 0.56 0.62 5.01 0.00 0.75 -4.99 105.19 105.95 2j28 n GLY 38 Ca -0.04 -1.44 -0.00 0.00 0.00 0.00 0.00 46.02 44.54 2j28 n GLY 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j28 n ARG 39 N 0.00 0.00 -1.65 1.61 3.00 -1.02 -4.62 116.66 113.98 2j28 n ARG 39 Ca 0.00 -0.78 -0.59 0.00 -0.01 0.00 0.00 57.85 56.47 2j28 n ARG 39 Cb 0.00 -0.24 -0.08 0.00 0.00 0.00 0.00 32.46 32.14 2j28 n ARG 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2j28 n ALA 40 N 0.05 -1.44 -0.09 7.54 0.00 -1.26 -4.86 120.51 120.45 2j28 n ALA 40 Ca -0.01 0.49 -0.06 0.00 0.00 0.00 0.00 53.44 53.86 2j28 n ALA 40 Cb 0.68 -2.01 0.01 0.00 0.00 0.00 0.00 19.45 18.13 2j28 n ALA 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2j28 h ARG 41 N 5.10 0.07 -1.47 0.00 3.08 -1.99 -3.44 114.38 115.73 2j28 h ARG 41 Ca -0.47 -0.00 0.12 0.00 0.07 0.00 0.00 59.98 59.70 2j28 h ARG 41 Cb 1.36 -0.02 -0.23 0.00 0.08 0.00 0.00 29.97 31.16 2j28 h ARG 41 CO 0.86 0.05 0.15 -1.17 -1.07 0.00 0.00 179.97 178.78 2j28 s LEU 42 N -10.47 -0.74 -0.35 3.04 2.96 -1.26 -5.13 118.68 106.73 2j28 s LEU 42 Ca -0.13 1.07 0.02 0.00 -0.22 0.00 0.00 54.13 54.86 2j28 s LEU 42 Cb 0.13 1.91 0.15 0.00 0.50 0.00 0.00 46.19 48.88 2j28 s LEU 42 CO 0.70 -0.15 0.35 0.42 -1.32 0.00 0.00 176.35 176.35 2j28 s THR 43 N 2.23 -0.32 0.00 3.68 -4.23 -1.26 -5.05 115.64 110.68 2j28 s THR 43 Ca -0.06 -0.93 0.00 0.00 -1.18 0.00 0.00 61.69 59.53 2j28 s THR 43 Cb -0.07 -0.77 0.00 0.00 1.34 0.00 0.00 72.50 73.01 2j28 s THR 43 CO -0.18 -0.58 0.00 1.33 -0.54 0.00 0.00 174.62 174.65 2j28 n VAL 44 N 4.46 0.00 -2.00 2.29 0.24 -1.26 -5.02 118.33 117.04 2j28 n VAL 44 Ca 0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.38 2j28 n VAL 44 Cb 0.45 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.82 2j28 n VAL 44 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2j28 n SER 45 N 0.00 0.00 -0.03 -1.34 7.64 -1.26 -4.73 113.62 113.90 2j28 n SER 45 Ca 0.00 0.00 0.16 0.00 1.01 0.00 0.00 58.87 60.04 2j28 n SER 45 Cb 0.00 0.00 0.92 0.00 -1.01 0.00 0.00 64.21 64.12 2j28 n SER 45 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32