#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qoz n ILE 4 N 0.00 0.00 -3.85 -0.61 -5.35 -1.26 -4.82 119.36 103.47 2qoz n ILE 4 Ca 0.00 0.00 -0.31 0.00 -0.27 0.00 0.00 62.75 62.17 2qoz n ILE 4 Cb 0.00 -0.41 -0.11 0.00 -1.74 0.00 0.00 39.64 37.37 2qoz n ILE 4 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 2qoz s ARG 5 N -1.78 2.46 0.60 6.28 1.81 -1.26 -4.38 118.95 122.68 2qoz s ARG 5 Ca 0.00 -2.99 -0.18 0.00 -1.72 0.00 0.00 55.73 50.83 2qoz s ARG 5 Cb 0.00 -3.53 -0.05 0.00 -0.45 0.00 0.00 34.95 30.92 2qoz s ARG 5 CO 0.00 -1.21 0.92 0.39 -0.68 0.00 0.00 175.30 174.72 2qoz n GLU 6 N 2.61 0.86 -2.37 3.54 4.71 -0.95 -4.55 120.64 124.50 2qoz n GLU 6 Ca 0.14 0.34 -0.43 0.00 -0.01 0.00 0.00 57.16 57.19 2qoz n GLU 6 Cb 0.35 -2.12 0.00 0.00 -1.01 0.00 0.00 31.44 28.66 2qoz n GLU 6 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2qoz n LYS 7 N -0.90 3.32 -1.19 3.49 5.02 -1.26 -1.96 118.16 124.68 2qoz n LYS 7 Ca 0.13 -3.35 -0.34 0.00 -2.02 0.00 0.00 58.31 52.74 2qoz n LYS 7 Cb 0.47 -3.12 0.12 0.00 -0.02 0.00 0.00 35.03 32.48 2qoz n LYS 7 CO 0.00 0.00 0.00 1.51 -0.52 0.00 0.00 177.40 178.39 2qoz n ILE 8 N 4.49 2.45 -4.48 -0.18 0.00 -0.31 -4.78 119.36 116.55 2qoz n ILE 8 Ca 0.43 -0.25 -0.26 0.00 0.00 0.00 0.00 62.75 62.67 2qoz n ILE 8 Cb 0.40 -1.24 -0.17 0.00 0.00 0.00 0.00 39.64 38.64 2qoz n ILE 8 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 176.55 174.96 2qoz s LYS 9 N -3.99 1.90 -0.39 9.51 0.00 -1.26 -1.41 119.74 124.09 2qoz s LYS 9 Ca 0.75 -0.46 -0.21 0.00 0.00 0.00 0.00 55.97 56.05 2qoz s LYS 9 Cb -0.30 -1.62 0.01 0.00 0.00 0.00 0.00 37.83 35.92 2qoz s LYS 9 CO 0.49 -0.03 0.68 -0.51 0.00 0.00 0.00 175.35 175.98 2qoz s LEU 10 N 0.89 4.30 0.34 2.77 1.02 -0.30 -4.31 118.68 123.40 2qoz s LEU 10 Ca -0.10 0.01 -0.18 0.00 0.02 0.00 0.00 54.13 53.88 2qoz s LEU 10 Cb -0.15 -2.83 -0.10 0.00 0.02 0.00 0.00 46.19 43.13 2qoz s LEU 10 CO 0.01 -0.71 0.82 -0.69 0.02 0.00 0.00 176.35 175.80 2qoz s VAL 11 N 2.88 4.54 0.02 -1.59 1.01 -0.37 -0.79 120.40 126.09 2qoz s VAL 11 Ca 0.26 1.23 -0.28 0.00 0.00 0.00 0.00 61.98 63.19 2qoz s VAL 11 Cb -0.14 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.53 2qoz s VAL 11 CO 0.17 -0.16 0.88 -0.55 0.00 0.00 0.00 175.10 175.45 2qoz s SER 12 N -2.12 7.29 0.00 3.32 0.15 -1.21 -1.45 113.70 119.68 2qoz s SER 12 Ca 0.55 1.55 0.00 0.00 0.70 0.00 0.00 55.95 58.75 2qoz s SER 12 Cb -0.11 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.68 2qoz s SER 12 CO 0.17 -0.14 0.54 -1.54 1.20 0.00 0.00 173.24 173.47 2qoz n SER 13 N 3.47 0.36 -4.94 5.45 3.41 0.09 -4.75 113.62 116.70 2qoz n SER 13 Ca 0.02 -1.44 -0.20 0.00 -0.26 0.00 0.00 58.87 56.99 2qoz n SER 13 Cb 0.51 -0.18 -0.00 0.00 -0.26 0.00 0.00 64.21 64.27 2qoz n SER 13 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qoz s ALA 14 N -1.51 4.33 -1.90 7.33 0.00 -1.26 -4.95 121.76 123.81 2qoz s ALA 14 Ca 0.00 -1.80 0.00 0.00 0.00 0.00 0.00 51.96 50.16 2qoz s ALA 14 Cb 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 23.12 21.88 2qoz s ALA 14 CO 0.00 -0.35 0.82 0.41 0.00 0.00 0.00 175.76 176.64 2qoz n GLY 15 N -1.76 -0.66 3.89 0.00 0.00 -1.26 -4.80 105.19 100.60 2qoz n GLY 15 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.80 2qoz n GLY 15 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2qoz s THR 16 N -1.90 5.07 -2.02 2.61 -1.32 -1.26 -5.00 115.64 111.81 2qoz s THR 16 Ca 0.00 -0.71 0.09 0.00 -1.21 0.00 0.00 61.69 59.86 2qoz s THR 16 Cb 0.00 -3.56 0.25 0.00 -1.51 0.00 0.00 72.50 67.68 2qoz s THR 16 CO 0.00 -0.02 1.31 0.61 -2.21 0.00 0.00 174.62 174.31 2qoz n GLY 17 N -0.21 -0.70 3.65 6.08 0.00 -1.26 -4.71 105.19 108.04 2qoz n GLY 17 Ca -0.07 -0.12 -0.30 0.00 0.00 0.00 0.00 46.02 45.53 2qoz n GLY 17 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2qoz s HIS 18 N -1.93 1.79 0.03 1.61 5.65 -1.26 -4.94 115.29 116.24 2qoz s HIS 18 Ca 0.15 1.56 -0.27 0.00 0.25 0.00 0.00 55.06 56.75 2qoz s HIS 18 Cb 0.07 -3.22 0.09 0.00 -1.18 0.00 0.00 32.58 28.34 2qoz s HIS 18 CO 0.11 -2.84 1.23 -0.59 -0.65 0.00 0.00 174.74 172.00 2qoz s PHE 19 N -2.68 0.04 0.29 3.88 -0.71 -1.26 -3.29 117.98 114.25 2qoz s PHE 19 Ca 0.66 -0.22 0.04 0.00 -1.04 0.00 0.00 56.93 56.37 2qoz s PHE 19 Cb -0.22 0.59 -0.06 0.00 -1.21 0.00 0.00 43.02 42.13 2qoz s PHE 19 CO 0.59 -0.42 0.03 0.71 -1.34 0.00 0.00 175.22 174.79 2qoz s TYR 20 N -2.05 1.85 -0.04 3.49 2.02 0.03 -4.98 117.35 117.66 2qoz s TYR 20 Ca 0.28 -0.92 -0.01 0.00 -0.37 0.00 0.00 57.07 56.05 2qoz s TYR 20 Cb -0.01 -1.15 0.03 0.00 -0.40 0.00 0.00 41.96 40.43 2qoz s TYR 20 CO 0.01 0.02 0.05 -0.08 -1.57 0.00 0.00 175.55 173.98 2qoz s THR 21 N -3.30 -0.06 0.00 -0.71 -1.32 -1.26 -1.15 115.64 107.84 2qoz s THR 21 Ca 0.33 0.34 0.00 0.00 -1.21 0.00 0.00 61.69 61.16 2qoz s THR 21 Cb 0.07 -0.15 0.00 0.00 -1.51 0.00 0.00 72.50 70.91 2qoz s THR 21 CO 0.13 0.16 0.00 0.35 -2.21 0.00 0.00 174.62 173.05 2qoz n THR 22 N 4.93 0.00 -4.42 5.08 -2.24 -0.50 -5.01 114.28 112.12 2qoz n THR 22 Ca -0.11 0.00 -0.26 0.00 -2.27 0.00 0.00 64.05 61.41 2qoz n THR 22 Cb 0.50 0.00 -0.11 0.00 -2.10 0.00 0.00 70.33 68.62 2qoz n THR 22 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2qoz s THR 23 N -2.09 2.31 0.12 4.28 -4.23 -1.26 -1.16 115.64 113.62 2qoz s THR 23 Ca 0.00 -2.08 -0.10 0.00 -1.18 0.00 0.00 61.69 58.33 2qoz s THR 23 Cb 0.00 -2.12 0.00 0.00 1.34 0.00 0.00 72.50 71.72 2qoz s THR 23 CO 0.00 -0.18 0.26 -0.75 -0.54 0.00 0.00 174.62 173.41 2qoz s LYS 24 N -2.82 0.98 -0.90 3.99 2.20 -0.83 -4.83 119.74 117.53 2qoz s LYS 24 Ca 0.22 -0.97 -0.01 0.00 -0.36 0.00 0.00 55.97 54.85 2qoz s LYS 24 Cb -0.07 0.38 0.26 0.00 -1.51 0.00 0.00 37.83 36.89 2qoz s LYS 24 CO 0.10 -0.35 1.01 -1.71 -0.36 0.00 0.00 175.35 174.05 2qoz n ASN 25 N -0.14 4.85 -0.33 1.43 2.85 -1.26 -2.23 115.26 120.43 2qoz n ASN 25 Ca -0.13 -3.30 0.36 0.00 -0.11 0.00 0.00 54.58 51.40 2qoz n ASN 25 Cb 0.63 -1.04 0.75 0.00 1.24 0.00 0.00 39.78 41.36 2qoz n ASN 25 CO 0.00 0.00 0.00 0.50 -2.11 0.00 0.00 177.26 175.65 2qoz h LYS 26 N 5.38 0.00 -0.02 1.20 1.63 -1.76 1.01 116.57 124.00 2qoz h LYS 26 Ca 0.19 -0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.95 2qoz h LYS 26 Cb 0.71 -0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.34 2qoz h LYS 26 CO 1.01 0.00 -0.15 0.00 -3.45 0.00 0.00 179.45 176.86 2qoz h ARG 27 N 0.00 0.03 0.00 1.90 2.47 -1.90 -3.23 114.38 113.66 2qoz h ARG 27 Ca 0.57 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 59.29 2qoz h ARG 27 Cb 2.30 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 30.62 2qoz h ARG 27 CO -0.01 0.19 0.00 0.25 0.56 0.00 0.00 179.97 180.96 2qoz n THR 28 N -4.34 0.19 -3.04 2.04 -2.24 0.15 -4.90 114.28 102.14 2qoz n THR 28 Ca -0.02 -0.38 -0.18 0.00 -2.27 0.00 0.00 64.05 61.20 2qoz n THR 28 Cb 0.23 1.20 -0.03 0.00 -2.10 0.00 0.00 70.33 69.63 2qoz n THR 28 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2qoz n LYS 29 N -0.09 0.76 -0.14 -0.78 4.76 0.30 -5.00 118.16 117.97 2qoz n LYS 29 Ca 0.00 -2.73 -0.07 0.00 -2.87 0.00 0.00 58.31 52.64 2qoz n LYS 29 Cb 0.19 -1.32 0.02 0.00 -1.84 0.00 0.00 35.03 32.08 2qoz n LYS 29 CO 0.00 0.00 0.00 -1.35 -1.37 0.00 0.00 177.40 174.68 2qoz h PRO 30 N 3.90 0.48 -6.00 1.97 0.11 -1.78 -3.39 132.00 127.29 2qoz h PRO 30 Ca -0.00 -0.03 -0.78 0.00 0.11 0.00 0.00 66.00 65.30 2qoz h PRO 30 Cb 0.94 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 31.91 2qoz h PRO 30 CO 0.41 0.32 1.22 -0.85 -0.21 0.00 0.00 178.00 178.89 2qoz n GLU 31 N -4.86 0.08 -1.65 1.05 0.00 -1.26 -4.67 120.64 109.33 2qoz n GLU 31 Ca 0.02 0.02 -0.42 0.00 0.00 0.00 0.00 57.16 56.78 2qoz n GLU 31 Cb 0.07 -1.56 -0.03 0.00 0.00 0.00 0.00 31.44 29.92 2qoz n GLU 31 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 2qoz s LYS 32 N 5.50 3.03 0.67 3.44 1.02 -1.26 -4.75 119.74 127.38 2qoz s LYS 32 Ca 1.17 1.87 -0.17 0.00 0.02 0.00 0.00 55.97 58.85 2qoz s LYS 32 Cb -1.46 -4.38 -0.00 0.00 -0.52 0.00 0.00 37.83 31.47 2qoz s LYS 32 CO 0.68 -2.22 1.20 -0.11 -0.92 0.00 0.00 175.35 173.97 2qoz n LEU 33 N 12.04 5.25 -3.63 3.17 7.94 0.43 -4.69 117.00 137.51 2qoz n LEU 33 Ca 0.30 0.78 -0.12 0.00 -1.11 0.00 0.00 56.01 55.86 2qoz n LEU 33 Cb 0.46 -1.51 -0.07 0.00 0.53 0.00 0.00 43.42 42.83 2qoz n LEU 33 CO 0.67 -1.32 0.46 -1.83 -1.11 0.00 0.00 177.39 174.26 2qoz s GLU 34 N -3.35 0.77 0.00 1.96 -1.05 -1.26 -3.43 118.70 112.34 2qoz s GLU 34 Ca 0.80 0.97 0.00 0.00 -0.15 0.00 0.00 54.97 56.59 2qoz s GLU 34 Cb -0.37 0.35 0.00 0.00 -0.44 0.00 0.00 34.13 33.67 2qoz s GLU 34 CO 0.43 -0.10 0.00 1.47 0.95 0.00 0.00 175.26 178.01 2qoz n LEU 35 N 2.84 0.00 -1.76 1.83 -0.00 -1.08 -4.98 117.00 113.85 2qoz n LEU 35 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.86 2qoz n LEU 35 Cb 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.98 2qoz n LEU 35 CO 0.02 0.00 -0.33 1.17 -0.00 0.00 0.00 177.39 178.26 2qoz n LYS 36 N 0.00 -3.60 0.00 1.47 0.00 -1.26 -4.82 118.16 109.96 2qoz n LYS 36 Ca 0.00 2.75 0.00 0.00 0.00 0.00 0.00 58.31 61.06 2qoz n LYS 36 Cb 0.00 -3.15 0.00 0.00 0.00 0.00 0.00 35.03 31.88 2qoz n LYS 36 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2qoz n LYS 37 N 1.25 2.26 -4.70 1.64 5.02 -0.48 -4.83 118.16 118.31 2qoz n LYS 37 Ca 0.00 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.96 2qoz n LYS 37 Cb 0.00 0.00 -0.14 0.00 -0.02 0.00 0.00 35.03 34.87 2qoz n LYS 37 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2qoz s PHE 38 N 2.89 2.81 -0.63 2.13 5.36 -1.26 -2.01 117.98 127.26 2qoz s PHE 38 Ca 0.00 -0.72 -0.08 0.00 -0.96 0.00 0.00 56.93 55.17 2qoz s PHE 38 Cb 0.00 -1.86 0.16 0.00 -0.34 0.00 0.00 43.02 40.98 2qoz s PHE 38 CO 0.00 -0.27 0.49 0.34 -1.46 0.00 0.00 175.22 174.32 2qoz s ASP 39 N 0.48 5.78 0.28 6.13 -1.08 -1.24 -4.97 116.67 122.05 2qoz s ASP 39 Ca -0.09 -2.50 0.01 0.00 -0.52 0.00 0.00 52.55 49.45 2qoz s ASP 39 Cb -0.16 -2.00 0.67 0.00 -1.46 0.00 0.00 42.92 39.98 2qoz s ASP 39 CO 0.04 -0.53 1.65 -0.65 0.52 0.00 0.00 175.17 176.21 2qoz h PRO 40 N 7.69 0.21 -0.95 4.34 0.11 -1.95 1.35 132.00 142.80 2qoz h PRO 40 Ca -0.05 -0.01 0.18 0.00 0.11 0.00 0.00 66.00 66.23 2qoz h PRO 40 Cb 1.01 -0.05 -0.11 0.00 0.11 0.00 0.00 31.00 31.97 2qoz h PRO 40 CO 0.77 0.14 0.55 0.28 -0.21 0.00 0.00 178.00 179.53 2qoz h VAL 41 N 0.22 0.69 0.00 3.15 2.07 -1.99 -2.12 116.25 118.27 2qoz h VAL 41 Ca 0.53 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.81 2qoz h VAL 41 Cb 1.05 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.75 2qoz h VAL 41 CO -0.63 0.13 -1.66 0.52 0.02 0.00 0.00 177.57 175.94 2qoz n VAL 42 N -4.82 0.00 -3.44 2.57 0.31 -0.34 -5.02 118.33 107.59 2qoz n VAL 42 Ca 0.22 -0.36 -0.19 0.00 -0.01 0.00 0.00 64.34 64.00 2qoz n VAL 42 Cb 0.54 0.24 0.06 0.00 -0.91 0.00 0.00 33.84 33.78 2qoz n VAL 42 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2qoz n ARG 43 N -2.01 -3.56 -3.65 5.55 1.74 0.45 -5.02 116.66 110.16 2qoz n ARG 43 Ca -0.02 0.76 -0.04 0.00 -0.77 0.00 0.00 57.85 57.78 2qoz n ARG 43 Cb 0.44 -5.47 -0.06 0.00 -1.02 0.00 0.00 32.46 26.35 2qoz n ARG 43 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2qoz s GLN 44 N -5.13 0.59 -0.22 5.56 -1.52 -1.22 -5.00 119.66 112.72 2qoz s GLN 44 Ca 0.28 1.31 -0.28 0.00 -1.95 0.00 0.00 55.36 54.72 2qoz s GLN 44 Cb -0.05 0.55 -0.05 0.00 -0.22 0.00 0.00 33.01 33.24 2qoz s GLN 44 CO 0.77 -0.19 2.18 -1.01 -0.25 0.00 0.00 175.29 176.79 2qoz s HIS 45 N 2.40 1.22 0.36 0.91 3.76 -1.26 -3.67 115.29 119.01 2qoz s HIS 45 Ca -0.07 0.51 0.03 0.00 -0.15 0.00 0.00 55.06 55.39 2qoz s HIS 45 Cb -0.10 -3.95 -0.05 0.00 1.11 0.00 0.00 32.58 29.59 2qoz s HIS 45 CO -0.18 -4.04 0.09 0.54 -0.85 0.00 0.00 174.74 170.29 2qoz s VAL 46 N 8.07 0.93 0.48 -0.90 0.11 -0.85 -4.95 120.40 123.28 2qoz s VAL 46 Ca 0.98 -2.00 -0.22 0.00 -2.93 0.00 0.00 61.98 57.82 2qoz s VAL 46 Cb -0.32 -2.59 -0.07 0.00 -1.53 0.00 0.00 36.38 31.86 2qoz s VAL 46 CO 0.35 0.00 1.13 -0.63 -3.33 0.00 0.00 175.10 172.62 2qoz s ILE 47 N -3.27 3.25 -0.19 7.04 1.09 -1.26 -1.39 121.20 126.48 2qoz s ILE 47 Ca 0.30 0.87 -0.01 0.00 -1.10 0.00 0.00 60.65 60.72 2qoz s ILE 47 Cb 0.06 -3.41 0.05 0.00 -1.06 0.00 0.00 42.46 38.10 2qoz s ILE 47 CO 0.14 -0.08 -0.03 -0.31 -0.10 0.00 0.00 174.94 174.57 2qoz s TYR 48 N -1.67 1.67 0.00 3.97 2.02 -1.26 -0.73 117.35 121.35 2qoz s TYR 48 Ca 0.66 -1.16 0.00 0.00 -0.37 0.00 0.00 57.07 56.20 2qoz s TYR 48 Cb -0.25 -1.29 0.00 0.00 -0.40 0.00 0.00 41.96 40.02 2qoz s TYR 48 CO 0.30 -0.64 0.00 1.17 -1.57 0.00 0.00 175.55 174.81 2qoz n LYS 49 N 4.88 3.17 -2.67 -0.62 3.00 -0.53 -2.63 118.16 122.76 2qoz n LYS 49 Ca -0.11 0.00 -0.05 0.00 -0.00 0.00 0.00 58.31 58.15 2qoz n LYS 49 Cb 0.47 0.00 -0.04 0.00 0.00 0.00 0.00 35.03 35.46 2qoz n LYS 49 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 2qoz n GLU 50 N 0.00 -4.13 -2.67 1.64 4.07 -1.25 -1.24 120.64 117.06 2qoz n GLU 50 Ca 0.00 3.16 -0.05 0.00 -0.06 0.00 0.00 57.16 60.21 2qoz n GLU 50 Cb 0.00 -4.61 0.06 0.00 -0.06 0.00 0.00 31.44 26.84 2qoz n GLU 50 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2qoz n ALA 51 N 1.72 -3.46 0.00 4.31 0.00 -1.22 -3.54 120.51 118.32 2qoz n ALA 51 Ca -0.34 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 52.78 2qoz n ALA 51 Cb 0.54 -3.10 0.00 0.00 0.00 0.00 0.00 19.45 16.88 2qoz n ALA 51 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13