#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbc s LYS 2 N 0.00 4.21 0.99 2.12 2.20 -1.26 -5.02 119.74 122.98 2qbc s LYS 2 Ca 0.00 1.29 -0.12 0.00 -0.36 0.00 0.00 55.97 56.78 2qbc s LYS 2 Cb 0.00 -3.66 0.19 0.00 -1.51 0.00 0.00 37.83 32.84 2qbc s LYS 2 CO 0.00 -0.70 1.08 1.03 -0.36 0.00 0.00 175.35 176.40 2qbc s ARG 3 N 3.31 0.46 -1.18 4.03 1.81 -1.26 -4.94 118.95 121.18 2qbc s ARG 3 Ca 0.44 0.84 -0.05 0.00 -1.72 0.00 0.00 55.73 55.24 2qbc s ARG 3 Cb -0.14 -1.71 0.23 0.00 -0.45 0.00 0.00 34.95 32.87 2qbc s ARG 3 CO 0.08 -2.80 1.86 -2.37 -0.68 0.00 0.00 175.30 171.40 2qbc n THR 4 N -4.27 5.20 -2.71 0.02 5.66 -1.26 -4.70 114.28 112.22 2qbc n THR 4 Ca 0.06 -5.16 -0.00 0.00 -3.05 0.00 0.00 64.05 55.90 2qbc n THR 4 Cb 0.55 -2.05 0.02 0.00 -1.55 0.00 0.00 70.33 67.30 2qbc n THR 4 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 175.07 172.14 2qbc s PHE 5 N -1.85 -0.25 -0.65 1.09 5.99 -1.26 -5.10 117.98 115.95 2qbc s PHE 5 Ca 0.40 -0.01 -0.14 0.00 0.00 0.00 0.00 56.93 57.18 2qbc s PHE 5 Cb 0.12 0.05 0.17 0.00 0.00 0.00 0.00 43.02 43.35 2qbc s PHE 5 CO -0.01 -0.18 0.58 -0.65 -0.00 0.00 0.00 175.22 174.96 2qbc s GLN 6 N 1.59 3.15 0.28 10.12 -1.52 -1.26 -5.05 119.66 126.97 2qbc s GLN 6 Ca 0.18 -2.06 -0.29 0.00 -1.95 0.00 0.00 55.36 51.24 2qbc s GLN 6 Cb 0.08 -4.28 -0.14 0.00 -0.22 0.00 0.00 33.01 28.45 2qbc s GLN 6 CO -0.14 -1.29 1.08 -0.35 -0.25 0.00 0.00 175.29 174.35 2qbc n PRO 7 N 4.61 1.47 -3.27 2.91 -0.04 -1.26 -5.01 135.00 134.41 2qbc n PRO 7 Ca -0.01 0.52 -0.06 0.00 -0.04 0.00 0.00 63.50 63.91 2qbc n PRO 7 Cb 0.43 -1.94 -0.05 0.00 -0.04 0.00 0.00 33.50 31.90 2qbc n PRO 7 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2qbc s SER 8 N -0.42 -0.13 0.47 3.54 0.15 -1.26 -5.03 113.70 111.03 2qbc s SER 8 Ca 0.60 -0.15 0.25 0.00 0.70 0.00 0.00 55.95 57.36 2qbc s SER 8 Cb -0.70 1.35 1.29 0.00 -1.71 0.00 0.00 66.02 66.25 2qbc s SER 8 CO 0.59 -0.33 1.83 1.62 1.20 0.00 0.00 173.24 178.15 2qbc h VAL 9 N 6.12 0.55 0.15 4.45 3.04 -1.99 -1.19 116.25 127.38 2qbc h VAL 9 Ca -0.09 -0.07 -0.01 0.00 -1.01 0.00 0.00 66.70 65.52 2qbc h VAL 9 Cb 1.14 0.32 0.00 0.00 -2.01 0.00 0.00 31.29 30.74 2qbc h VAL 9 CO 0.24 0.04 -0.07 0.25 -1.01 0.00 0.00 177.57 177.02 2qbc h LEU 10 N 0.21 -0.17 -0.59 3.16 6.46 -2.00 -2.94 115.31 119.44 2qbc h LEU 10 Ca 0.51 0.01 0.11 0.00 -0.12 0.00 0.00 57.88 58.38 2qbc h LEU 10 Cb 1.61 0.04 -0.11 0.00 -0.73 0.00 0.00 40.66 41.47 2qbc h LEU 10 CO -0.13 -0.03 -0.30 0.11 -0.62 0.00 0.00 178.44 177.48 2qbc h LYS 11 N -0.40 -0.13 -0.45 1.25 1.57 -1.91 -1.60 116.57 114.91 2qbc h LYS 11 Ca -0.02 0.01 0.07 0.00 -1.87 0.00 0.00 60.65 58.84 2qbc h LYS 11 Cb 0.16 0.03 -0.09 0.00 0.08 0.00 0.00 32.23 32.40 2qbc h LYS 11 CO 0.03 -0.09 -0.47 -0.09 -0.57 0.00 0.00 179.45 178.27 2qbc h ARG 12 N -0.14 -0.31 -0.46 3.15 2.43 -1.35 0.18 114.38 117.88 2qbc h ARG 12 Ca 0.24 0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.51 2qbc h ARG 12 Cb 0.54 0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 30.10 2qbc h ARG 12 CO -0.67 -0.21 0.12 -0.91 -1.51 0.00 0.00 179.97 176.79 2qbc h ASN 13 N -0.33 0.07 -0.02 -3.80 -0.26 -1.13 0.33 115.58 110.44 2qbc h ASN 13 Ca 0.13 0.07 0.00 0.00 -0.56 0.00 0.00 56.30 55.94 2qbc h ASN 13 Cb 0.58 0.08 0.00 0.00 -1.06 0.00 0.00 38.32 37.93 2qbc h ASN 13 CO -0.61 0.07 0.00 -2.11 -1.06 0.00 0.00 177.43 173.72 2qbc n ARG 14 N -5.07 1.14 -0.06 0.81 1.85 -0.76 -0.19 116.66 114.37 2qbc n ARG 14 Ca 0.04 -0.21 -0.08 0.00 -1.00 0.00 0.00 57.85 56.60 2qbc n ARG 14 Cb 0.20 -1.37 -0.07 0.00 -1.05 0.00 0.00 32.46 30.17 2qbc n ARG 14 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 2qbc n SER 15 N -0.64 2.83 -2.73 2.89 7.64 0.57 -4.75 113.62 119.43 2qbc n SER 15 Ca 0.17 -0.05 -0.03 0.00 1.01 0.00 0.00 58.87 59.97 2qbc n SER 15 Cb 0.13 0.02 0.05 0.00 -1.01 0.00 0.00 64.21 63.40 2qbc n SER 15 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2qbc n HIS 16 N -2.77 1.46 -2.98 1.43 8.25 0.10 -4.96 115.22 115.75 2qbc n HIS 16 Ca -0.22 -2.16 -0.21 0.00 -0.26 0.00 0.00 57.72 54.86 2qbc n HIS 16 Cb 0.77 -0.25 0.01 0.00 1.12 0.00 0.00 29.99 31.65 2qbc n HIS 16 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2qbc s GLY 17 N -3.77 1.66 0.07 -1.41 0.00 0.73 -4.26 107.32 100.34 2qbc s GLY 17 Ca 0.30 -1.24 -0.35 0.00 0.00 0.00 0.00 44.72 43.43 2qbc s GLY 17 CO -0.03 -1.05 1.59 -2.75 0.00 0.00 0.00 173.10 170.86 2qbc h PHE 18 N 0.42 -1.09 -0.41 1.90 3.04 -1.81 0.19 116.94 119.17 2qbc h PHE 18 Ca -0.45 -0.02 0.05 0.00 3.98 0.00 0.00 57.97 61.54 2qbc h PHE 18 Cb 1.27 0.38 -0.02 0.00 2.56 0.00 0.00 35.95 40.13 2qbc h PHE 18 CO 0.42 -0.65 0.28 0.00 -2.02 0.00 0.00 178.31 176.34 2qbc h ARG 19 N -1.09 0.33 -0.67 1.11 3.08 -1.91 0.78 114.38 116.01 2qbc h ARG 19 Ca -0.10 -0.02 -0.08 0.00 0.07 0.00 0.00 59.98 59.85 2qbc h ARG 19 Cb 0.86 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.81 2qbc h ARG 19 CO 0.14 0.22 0.10 0.00 -1.07 0.00 0.00 179.97 179.36 2qbc h ALA 20 N 1.78 0.91 -0.06 0.04 0.00 -1.72 -2.92 119.26 117.29 2qbc h ALA 20 Ca 0.18 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 2qbc h ALA 20 Cb 0.27 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2qbc h ALA 20 CO -0.04 0.67 -0.20 0.00 0.00 0.00 0.00 179.25 179.68 2qbc h ARG 21 N 1.04 0.24 -2.14 0.00 -0.00 0.17 -3.18 114.38 110.51 2qbc h ARG 21 Ca 0.20 -0.18 -0.06 0.00 -0.50 0.00 0.00 59.98 59.45 2qbc h ARG 21 Cb 0.45 0.03 -0.02 0.00 0.00 0.00 0.00 29.97 30.44 2qbc h ARG 21 CO 0.01 0.81 -0.05 -1.33 0.00 0.00 0.00 179.97 179.42 2qbc n MET 22 N -4.55 0.98 0.00 0.04 2.81 0.25 -2.16 117.12 114.49 2qbc n MET 22 Ca -0.08 -0.30 0.00 0.00 -1.81 0.00 0.00 57.70 55.51 2qbc n MET 22 Cb 0.43 -1.46 0.00 0.00 -0.71 0.00 0.00 33.22 31.48 2qbc n MET 22 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2qbc n ALA 23 N 2.10 0.83 -2.21 3.04 0.00 -1.16 -4.89 120.51 118.22 2qbc n ALA 23 Ca 0.13 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.44 2qbc n ALA 23 Cb 0.46 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.81 2qbc n ALA 23 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2qbc s THR 24 N -0.73 0.88 0.03 0.00 -4.23 -1.11 -5.02 115.64 105.46 2qbc s THR 24 Ca 0.00 -1.99 -0.12 0.00 -1.18 0.00 0.00 61.69 58.40 2qbc s THR 24 Cb 0.00 -1.81 -0.05 0.00 1.34 0.00 0.00 72.50 71.97 2qbc s THR 24 CO 0.00 -0.77 1.19 0.50 -0.54 0.00 0.00 174.62 175.00 2qbc h LYS 25 N 2.85 -0.28 0.00 3.99 1.63 -1.99 -0.28 116.57 122.48 2qbc h LYS 25 Ca -0.36 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.46 2qbc h LYS 25 Cb 1.18 0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.87 2qbc h LYS 25 CO 0.64 -0.19 0.00 0.09 -3.45 0.00 0.00 179.45 176.54 2qbc n ASN 26 N -3.43 0.23 0.10 4.20 4.13 -1.26 -0.92 115.26 118.30 2qbc n ASN 26 Ca -0.03 0.58 -0.08 0.00 1.68 0.00 0.00 54.58 56.73 2qbc n ASN 26 Cb 0.15 -0.62 -0.05 0.00 -1.54 0.00 0.00 39.78 37.72 2qbc n ASN 26 CO 0.00 0.00 0.00 1.23 0.28 0.00 0.00 177.26 178.77 2qbc h GLY 27 N 1.02 -0.35 2.00 7.41 0.00 -1.30 -2.67 103.07 109.18 2qbc h GLY 27 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.46 2qbc h GLY 27 CO 0.00 -0.13 0.00 3.21 0.00 0.00 0.00 176.54 179.62 2qbc h ARG 28 N -1.02 0.00 0.00 4.80 3.08 -0.60 0.13 114.38 120.76 2qbc h ARG 28 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.02 2qbc h ARG 28 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.45 2qbc h ARG 28 CO 0.06 0.00 0.00 0.94 -1.07 0.00 0.00 179.97 179.90 2qbc n GLN 29 N -2.78 0.32 -0.08 0.04 7.27 -0.10 -2.41 117.38 119.64 2qbc n GLN 29 Ca 0.01 0.05 -0.10 0.00 0.07 0.00 0.00 57.00 57.02 2qbc n GLN 29 Cb 0.29 -1.50 -0.05 0.00 2.41 0.00 0.00 30.24 31.40 2qbc n GLN 29 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 2qbc n VAL 30 N -1.31 1.46 -0.20 1.69 0.31 0.02 -3.32 118.33 116.98 2qbc n VAL 30 Ca 0.11 0.12 0.19 0.00 -0.01 0.00 0.00 64.34 64.76 2qbc n VAL 30 Cb 0.22 -2.28 0.54 0.00 -0.91 0.00 0.00 33.84 31.41 2qbc n VAL 30 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2qbc h LEU 31 N -1.00 0.33 -0.30 7.52 3.38 -1.54 0.32 115.31 124.03 2qbc h LEU 31 Ca -0.12 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.83 2qbc h LEU 31 Cb 0.80 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 2qbc h LEU 31 CO -0.07 0.14 -0.01 0.00 0.09 0.00 0.00 178.44 178.59 2qbc h ALA 32 N 1.62 0.41 -0.53 1.53 0.00 -1.64 1.04 119.26 121.68 2qbc h ALA 32 Ca 0.43 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2qbc h ALA 32 Cb 1.14 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 2qbc h ALA 32 CO -0.13 0.17 0.34 0.00 0.00 0.00 0.00 179.25 179.62 2qbc h ARG 33 N 0.33 0.71 -0.21 0.00 3.08 -0.48 0.63 114.38 118.44 2qbc h ARG 33 Ca 0.08 -0.05 -0.08 0.00 0.07 0.00 0.00 59.98 60.01 2qbc h ARG 33 Cb 0.45 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.34 2qbc h ARG 33 CO 0.02 0.49 -0.17 0.00 -1.07 0.00 0.00 179.97 179.24 2qbc h ARG 34 N 0.72 0.49 -0.65 0.04 3.08 -0.69 -1.75 114.38 115.61 2qbc h ARG 34 Ca 0.19 -0.24 0.03 0.00 0.07 0.00 0.00 59.98 60.04 2qbc h ARG 34 Cb -0.05 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 29.96 2qbc h ARG 34 CO -0.04 0.81 0.39 0.00 -1.07 0.00 0.00 179.97 180.06 2qbc h ARG 35 N 0.18 0.74 0.44 0.04 3.08 0.15 0.11 114.38 119.11 2qbc h ARG 35 Ca 0.04 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 2qbc h ARG 35 Cb 0.69 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.55 2qbc h ARG 35 CO 0.04 0.49 -0.43 0.00 -1.07 0.00 0.00 179.97 179.01 2qbc h ALA 36 N 1.29 -0.95 0.00 0.04 0.00 0.37 0.33 119.26 120.33 2qbc h ALA 36 Ca 0.26 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2qbc h ALA 36 Cb 0.05 0.62 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2qbc h ALA 36 CO -0.12 -1.07 0.01 1.17 0.00 0.00 0.00 179.25 179.24 2qbc n LYS 37 N -5.52 0.00 -3.26 0.00 4.81 -0.67 -4.84 118.16 108.69 2qbc n LYS 37 Ca -0.11 0.45 -0.14 0.00 -0.87 0.00 0.00 58.31 57.64 2qbc n LYS 37 Cb 0.42 -1.51 0.06 0.00 0.02 0.00 0.00 35.03 34.01 2qbc n LYS 37 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2qbc n GLY 38 N -1.45 -1.17 3.84 3.14 0.00 0.11 -4.99 105.19 104.68 2qbc n GLY 38 Ca 0.00 0.56 -0.32 0.00 0.00 0.00 0.00 46.02 46.26 2qbc n GLY 38 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2qbc s ARG 39 N -4.31 3.93 -0.04 1.61 6.06 -0.78 -5.01 118.95 120.41 2qbc s ARG 39 Ca 0.40 0.92 -0.13 0.00 -2.50 0.00 0.00 55.73 54.41 2qbc s ARG 39 Cb -0.06 -2.15 -0.07 0.00 0.06 0.00 0.00 34.95 32.72 2qbc s ARG 39 CO 0.75 -0.26 0.57 0.00 -2.50 0.00 0.00 175.30 173.86 2qbc h ALA 40 N 0.93 -0.50 -2.44 6.12 0.00 -1.94 -3.42 119.26 118.01 2qbc h ALA 40 Ca -0.47 -0.10 -0.68 0.00 0.00 0.00 0.00 54.91 53.65 2qbc h ALA 40 Cb 1.18 0.18 -0.18 0.00 0.00 0.00 0.00 17.79 18.98 2qbc h ALA 40 CO 0.62 -0.47 -0.23 1.03 0.00 0.00 0.00 179.25 180.20 2qbc s ARG 41 N -3.11 3.24 0.05 0.00 0.52 -1.26 -4.98 118.95 113.41 2qbc s ARG 41 Ca -0.07 -0.64 -0.33 0.00 -0.52 0.00 0.00 55.73 54.16 2qbc s ARG 41 Cb 0.01 -3.92 -0.18 0.00 0.52 0.00 0.00 34.95 31.38 2qbc s ARG 41 CO 0.21 -0.75 1.44 1.25 0.02 0.00 0.00 175.30 177.47 2qbc h LEU 42 N 8.96 -1.02 -6.07 2.53 7.12 -1.98 -3.45 115.31 121.41 2qbc h LEU 42 Ca -0.27 0.04 0.03 0.00 0.13 0.00 0.00 57.88 57.80 2qbc h LEU 42 Cb 1.12 0.26 -0.22 0.00 -0.53 0.00 0.00 40.66 41.29 2qbc h LEU 42 CO 0.76 -0.70 -0.34 0.42 -0.13 0.00 0.00 178.44 178.45 2qbc s THR 43 N -5.53 -0.94 -0.19 1.05 -4.23 -1.26 -4.97 115.64 99.57 2qbc s THR 43 Ca -0.18 -0.03 -0.12 0.00 -1.18 0.00 0.00 61.69 60.19 2qbc s THR 43 Cb 0.02 -0.98 0.02 0.00 1.34 0.00 0.00 72.50 72.90 2qbc s THR 43 CO 0.53 -0.03 0.24 0.52 -0.54 0.00 0.00 174.62 175.34 2qbc n VAL 44 N 5.42 -1.38 0.00 2.29 0.31 -1.26 -4.32 118.33 119.39 2qbc n VAL 44 Ca 0.01 0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.36 2qbc n VAL 44 Cb 0.52 -1.26 0.00 0.00 -0.91 0.00 0.00 33.84 32.19 2qbc n VAL 44 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2qbc n SER 45 N 0.34 0.00 0.00 4.52 3.41 -1.26 -4.78 113.62 115.86 2qbc n SER 45 Ca -0.05 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.87 2qbc n SER 45 Cb 0.26 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.21 2qbc n SER 45 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05