#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kby n GLU 2 N 0.00 0.00 0.00 -1.24 0.28 -1.26 -5.14 120.64 113.28 2kby n GLU 2 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2kby n GLU 2 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 2kby n GLU 2 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 2kby n ASP 3 N 0.00 0.00 -4.77 -1.84 5.75 -1.26 -4.99 116.55 109.45 2kby n ASP 3 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 54.79 54.39 2kby n ASP 3 Cb 0.32 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.38 2kby n ASP 3 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2kby s THR 4 N 0.42 3.24 0.28 2.12 2.01 -1.26 -5.04 115.64 117.42 2kby s THR 4 Ca 0.00 1.14 0.06 0.00 0.31 0.00 0.00 61.69 63.20 2kby s THR 4 Cb 0.00 -3.69 -0.06 0.00 0.01 0.00 0.00 72.50 68.77 2kby s THR 4 CO 0.00 0.19 -0.04 -0.31 -0.69 0.00 0.00 174.62 173.77 2kby s TYR 5 N -1.30 1.93 -0.15 4.92 2.02 -1.26 -5.14 117.35 118.37 2kby s TYR 5 Ca 0.51 -0.74 -0.01 0.00 -0.37 0.00 0.00 57.07 56.46 2kby s TYR 5 Cb -0.32 -1.13 -0.01 0.00 -0.40 0.00 0.00 41.96 40.10 2kby s TYR 5 CO 0.41 0.23 -0.12 0.71 -1.57 0.00 0.00 175.55 175.21 2kby s TYR 6 N -3.07 2.83 -0.32 2.71 2.02 -1.26 -5.09 117.35 115.18 2kby s TYR 6 Ca 0.30 -0.81 -0.03 0.00 -0.37 0.00 0.00 57.07 56.16 2kby s TYR 6 Cb 0.05 -1.90 0.05 0.00 -0.40 0.00 0.00 41.96 39.75 2kby s TYR 6 CO 0.12 -0.34 0.04 -1.17 -1.57 0.00 0.00 175.55 172.63 2kby s LEU 7 N 0.67 4.11 -0.44 -1.29 2.96 -1.26 -5.07 118.68 118.36 2kby s LEU 7 Ca -0.06 -1.28 -0.27 0.00 -0.22 0.00 0.00 54.13 52.30 2kby s LEU 7 Cb -0.15 -1.77 0.03 0.00 0.50 0.00 0.00 46.19 44.79 2kby s LEU 7 CO 0.02 -0.30 1.00 -1.58 -1.32 0.00 0.00 176.35 174.18 2kby s GLN 8 N 1.29 3.69 -0.16 1.98 0.74 -1.26 -5.00 119.66 120.94 2kby s GLN 8 Ca -0.03 0.43 -0.01 0.00 0.05 0.00 0.00 55.36 55.80 2kby s GLN 8 Cb -0.20 -3.88 -0.00 0.00 1.10 0.00 0.00 33.01 30.02 2kby s GLN 8 CO -0.00 -1.20 -0.13 0.08 -0.55 0.00 0.00 175.29 173.49 2kby s VAL 9 N 3.92 2.88 -0.07 1.34 1.01 -1.26 -5.10 120.40 123.13 2kby s VAL 9 Ca 0.41 -0.69 -0.11 0.00 0.00 0.00 0.00 61.98 61.59 2kby s VAL 9 Cb -0.10 -2.24 -0.05 0.00 0.00 0.00 0.00 36.38 34.00 2kby s VAL 9 CO 0.26 0.50 0.29 -0.60 0.00 0.00 0.00 175.10 175.55 2kby s ARG 10 N 0.88 3.76 0.00 2.72 3.00 -1.26 -4.72 118.95 123.33 2kby s ARG 10 Ca -0.03 0.16 0.00 0.00 -1.00 0.00 0.00 55.73 54.85 2kby s ARG 10 Cb -0.15 -3.23 0.00 0.00 0.00 0.00 0.00 34.95 31.57 2kby s ARG 10 CO -0.00 0.68 0.00 0.41 0.00 0.00 0.00 175.30 176.38 2kby n GLY 11 N 2.05 -0.94 0.18 8.12 0.00 -1.26 -4.57 105.19 108.78 2kby n GLY 11 Ca -0.16 -1.08 -0.04 0.00 0.00 0.00 0.00 46.02 44.75 2kby n GLY 11 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2kby h ARG 12 N 0.00 0.15 -0.52 1.61 9.65 -1.99 -1.26 114.38 122.02 2kby h ARG 12 Ca 0.00 -0.01 0.09 0.00 -1.10 0.00 0.00 59.98 58.96 2kby h ARG 12 Cb 0.00 -0.03 -0.07 0.00 -1.39 0.00 0.00 29.97 28.47 2kby h ARG 12 CO 0.00 0.10 0.12 1.49 2.80 0.00 0.00 179.97 184.48 2kby h GLU 13 N 0.16 0.25 -0.33 0.20 4.57 -2.00 0.33 114.58 117.75 2kby h GLU 13 Ca 0.22 -0.02 -0.05 0.00 -1.18 0.00 0.00 59.36 58.33 2kby h GLU 13 Cb 0.30 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.83 2kby h GLU 13 CO -0.33 0.17 0.01 -0.91 -1.18 0.00 0.00 179.01 176.77 2kby h ASN 14 N 0.26 0.57 -0.55 1.04 2.35 -1.71 -2.35 115.58 115.20 2kby h ASN 14 Ca 0.26 -0.30 0.04 0.00 -0.55 0.00 0.00 56.30 55.75 2kby h ASN 14 Cb 0.35 -0.15 -0.04 0.00 0.05 0.00 0.00 38.32 38.53 2kby h ASN 14 CO -0.33 0.73 0.31 0.15 -1.65 0.00 0.00 177.43 176.64 2kby h PHE 15 N 0.39 0.57 -0.32 1.19 3.57 -0.61 -0.92 116.94 120.82 2kby h PHE 15 Ca 0.10 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.60 2kby h PHE 15 Cb 0.43 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 2kby h PHE 15 CO 0.03 0.31 0.12 0.93 -2.23 0.00 0.00 178.31 177.47 2kby h GLU 16 N 0.60 0.48 -0.62 1.11 5.08 -0.88 0.66 114.58 121.02 2kby h GLU 16 Ca 0.23 -0.09 -0.03 0.00 -1.00 0.00 0.00 59.36 58.47 2kby h GLU 16 Cb 0.08 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 2kby h GLU 16 CO -0.13 0.49 0.27 0.82 -1.00 0.00 0.00 179.01 179.46 2kby h ILE 17 N 0.37 1.23 -0.03 3.13 2.04 -1.18 -0.24 117.51 122.83 2kby h ILE 17 Ca 0.11 -0.68 -0.20 0.00 1.00 0.00 0.00 64.86 65.08 2kby h ILE 17 Cb 0.19 0.52 -0.00 0.00 -0.74 0.00 0.00 36.82 36.79 2kby h ILE 17 CO -0.01 0.27 -0.84 -0.07 0.00 0.00 0.00 178.15 177.50 2kby h LEU 18 N 0.86 0.46 -0.06 1.44 3.38 -1.05 -2.34 115.31 118.00 2kby h LEU 18 Ca 0.21 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 2kby h LEU 18 Cb 0.17 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 2kby h LEU 18 CO -0.02 1.12 -0.00 -0.03 0.09 0.00 0.00 178.44 179.59 2kby h MET 19 N 0.23 0.11 -0.85 1.13 4.05 0.55 0.65 114.93 120.79 2kby h MET 19 Ca -0.05 -0.04 0.05 0.00 -0.28 0.00 0.00 59.70 59.38 2kby h MET 19 Cb 1.45 -0.01 -0.05 0.00 -0.80 0.00 0.00 31.60 32.19 2kby h MET 19 CO 0.14 0.40 0.56 -0.22 0.23 0.00 0.00 176.91 178.02 2kby h LYS 20 N -0.19 0.98 -0.33 0.39 3.11 -1.11 -1.56 116.57 117.86 2kby h LYS 20 Ca 0.02 -0.06 -0.10 0.00 -2.81 0.00 0.00 60.65 57.70 2kby h LYS 20 Cb 0.35 -0.22 -0.01 0.00 -1.00 0.00 0.00 32.23 31.35 2kby h LYS 20 CO 0.00 0.65 -0.18 1.25 -2.81 0.00 0.00 179.45 178.36 2kby h LEU 21 N 1.01 0.72 -0.95 5.20 6.46 -1.11 -2.69 115.31 123.94 2kby h LEU 21 Ca 0.35 -0.42 0.19 0.00 -0.12 0.00 0.00 57.88 57.89 2kby h LEU 21 Cb 0.12 -0.20 -0.11 0.00 -0.73 0.00 0.00 40.66 39.75 2kby h LEU 21 CO -0.12 0.98 0.54 0.50 -0.62 0.00 0.00 178.44 179.73 2kby h LYS 22 N 0.47 0.65 -0.27 1.25 3.64 0.13 0.14 116.57 122.58 2kby h LYS 22 Ca 0.07 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.35 2kby h LYS 22 Cb 0.72 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.39 2kby h LYS 22 CO 0.05 0.43 -0.07 0.93 -2.27 0.00 0.00 179.45 178.52 2kby h GLU 23 N 0.67 0.52 -0.30 1.90 4.39 -1.27 -1.39 114.58 119.10 2kby h GLU 23 Ca 0.56 -0.20 -0.00 0.00 0.34 0.00 0.00 59.36 60.05 2kby h GLU 23 Cb 0.90 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.50 2kby h GLU 23 CO -0.41 0.74 0.18 0.66 -1.16 0.00 0.00 179.01 179.02 2kby h SER 24 N 0.27 0.35 -0.29 1.42 4.64 -0.51 0.39 113.55 119.82 2kby h SER 24 Ca 0.07 -0.05 -0.03 0.00 -0.47 0.00 0.00 61.79 61.31 2kby h SER 24 Cb 0.55 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.54 2kby h SER 24 CO 0.03 0.30 0.08 -0.07 -0.87 0.00 0.00 176.83 176.30 2kby h LEU 25 N 0.38 0.43 -0.42 5.97 3.38 -0.88 -0.38 115.31 123.79 2kby h LEU 25 Ca 0.11 -0.22 -0.10 0.00 0.09 0.00 0.00 57.88 57.76 2kby h LEU 25 Cb 0.01 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 2kby h LEU 25 CO -0.02 0.53 -0.14 -0.33 0.09 0.00 0.00 178.44 178.58 2kby h GLU 26 N 0.30 0.83 -0.16 1.13 5.08 -1.14 -3.05 114.58 117.57 2kby h GLU 26 Ca 0.09 -0.34 -0.08 0.00 -1.00 0.00 0.00 59.36 58.04 2kby h GLU 26 Cb 0.27 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 2kby h GLU 26 CO -0.00 0.97 -0.24 -0.07 -1.00 0.00 0.00 179.01 178.66 2kby h LEU 27 N 0.65 0.29 -1.07 1.33 3.38 -0.16 -2.68 115.31 117.05 2kby h LEU 27 Ca 0.10 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2kby h LEU 27 Cb 0.68 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2kby h LEU 27 CO 0.05 0.54 0.18 0.80 0.09 0.00 0.00 178.44 180.10 2kby n MET 28 N -4.16 0.11 0.08 1.13 1.56 -0.16 0.17 117.12 115.84 2kby n MET 28 Ca -0.01 0.59 0.06 0.00 -0.27 0.00 0.00 57.70 58.07 2kby n MET 28 Cb 0.37 -2.03 -0.03 0.00 2.15 0.00 0.00 33.22 33.67 2kby n MET 28 CO 0.00 0.00 0.00 1.05 -0.73 0.00 0.00 175.97 176.29 2kby h GLU 29 N 0.00 0.00 -0.09 2.12 4.11 -1.62 -3.31 114.58 115.78 2kby h GLU 29 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2kby h GLU 29 Cb 0.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 2kby h GLU 29 CO 0.00 0.15 0.00 1.47 0.07 0.00 0.00 179.01 180.70 2kby n LEU 30 N -2.80 1.58 -4.64 3.06 -0.00 0.13 -4.78 117.00 109.54 2kby n LEU 30 Ca -0.04 -0.60 -0.37 0.00 -0.00 0.00 0.00 56.01 54.99 2kby n LEU 30 Cb 0.69 -0.06 -0.09 0.00 -0.00 0.00 0.00 43.42 43.96 2kby n LEU 30 CO 0.41 0.30 -0.11 -0.69 -0.00 0.00 0.00 177.39 177.30 2kby s VAL 31 N -1.89 5.31 -0.12 1.47 1.01 -1.13 -5.03 120.40 120.03 2kby s VAL 31 Ca 0.35 0.29 -0.41 0.00 0.00 0.00 0.00 61.98 62.21 2kby s VAL 31 Cb 0.19 -3.56 -0.19 0.00 0.00 0.00 0.00 36.38 32.82 2kby s VAL 31 CO 0.30 0.29 1.26 -2.65 0.00 0.00 0.00 175.10 174.30 2kby n PRO 32 N 4.58 0.18 -0.21 2.72 -0.02 -1.26 -4.75 135.00 136.24 2kby n PRO 32 Ca -0.13 0.06 0.02 0.00 -2.02 0.00 0.00 63.50 61.43 2kby n PRO 32 Cb 0.52 -1.59 0.12 0.00 -0.02 0.00 0.00 33.50 32.53 2kby n PRO 32 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 2kby h GLN 33 N 3.83 0.28 -0.43 -0.52 5.75 -1.93 -0.85 115.11 121.24 2kby h GLN 33 Ca -0.49 -0.02 0.08 0.00 -0.15 0.00 0.00 58.65 58.08 2kby h GLN 33 Cb 1.40 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 29.86 2kby h GLN 33 CO 0.76 0.19 0.29 -1.35 -2.65 0.00 0.00 178.83 176.06 2kby h PRO 34 N 0.29 0.21 0.02 -2.39 0.11 -2.00 -0.30 132.00 127.94 2kby h PRO 34 Ca 0.33 -0.01 -0.21 0.00 0.11 0.00 0.00 66.00 66.22 2kby h PRO 34 Cb 0.50 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.55 2kby h PRO 34 CO -0.41 0.14 -0.94 1.25 -0.21 0.00 0.00 178.00 177.83 2kby h LEU 35 N 0.22 0.24 -0.31 2.35 5.85 -1.52 -2.84 115.31 119.31 2kby h LEU 35 Ca 0.20 -0.21 -0.18 0.00 0.84 0.00 0.00 57.88 58.52 2kby h LEU 35 Cb 0.49 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.45 2kby h LEU 35 CO -0.04 1.05 -0.51 0.58 -0.34 0.00 0.00 178.44 179.19 2kby h VAL 36 N 0.09 1.27 -0.68 1.05 2.07 -0.57 -2.70 116.25 116.79 2kby h VAL 36 Ca -0.05 -1.69 0.03 0.00 0.82 0.00 0.00 66.70 65.81 2kby h VAL 36 Cb 1.60 1.58 -0.04 0.00 -1.52 0.00 0.00 31.29 32.90 2kby h VAL 36 CO 0.14 0.55 0.42 0.44 0.02 0.00 0.00 177.57 179.14 2kby h ASP 37 N 0.68 0.68 -0.64 0.57 3.32 -1.10 -0.41 116.42 119.52 2kby h ASP 37 Ca 0.02 0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.10 2kby h ASP 37 Cb 1.11 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 40.48 2kby h ASP 37 CO 0.12 0.47 0.41 -1.28 -1.72 0.00 0.00 179.24 177.23 2kby h SER 38 N 0.82 0.68 -0.40 6.45 0.87 -1.40 -2.03 113.55 118.53 2kby h SER 38 Ca 0.27 -0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.82 2kby h SER 38 Cb 0.03 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 61.82 2kby h SER 38 CO -0.11 0.48 0.22 0.22 -0.53 0.00 0.00 176.83 177.11 2kby h TYR 39 N 0.81 0.55 -0.63 2.24 3.20 -1.06 -2.31 116.97 119.77 2kby h TYR 39 Ca 0.25 -0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.22 2kby h TYR 39 Cb -0.02 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 38.04 2kby h TYR 39 CO -0.04 0.41 0.42 0.00 -1.64 0.00 0.00 178.16 177.31 2kby h ARG 40 N 0.52 0.37 -0.11 1.82 3.08 -0.59 -0.12 114.38 119.36 2kby h ARG 40 Ca 0.14 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.14 2kby h ARG 40 Cb 0.05 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.01 2kby h ARG 40 CO -0.02 0.25 -0.06 1.96 -1.07 0.00 0.00 179.97 181.03 2kby h GLN 41 N 0.39 0.23 -0.07 0.04 4.20 -0.86 0.13 115.11 119.17 2kby h GLN 41 Ca 0.29 -0.10 -0.01 0.00 0.06 0.00 0.00 58.65 58.89 2kby h GLN 41 Cb 0.63 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.41 2kby h GLN 41 CO -0.08 0.59 0.00 0.37 -0.67 0.00 0.00 178.83 179.04 2kby h GLN 42 N -0.13 0.09 0.13 1.46 4.15 -0.73 -1.93 115.11 118.15 2kby h GLN 42 Ca 0.02 -0.01 -0.29 0.00 0.77 0.00 0.00 58.65 59.14 2kby h GLN 42 Cb 0.52 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.19 2kby h GLN 42 CO 0.02 0.10 -1.38 0.37 -1.93 0.00 0.00 178.83 176.01 2kby h GLN 43 N 0.09 0.27 0.00 1.69 5.75 -0.95 -3.24 115.11 118.73 2kby h GLN 43 Ca 0.02 -0.46 -0.01 0.00 -0.15 0.00 0.00 58.65 58.05 2kby h GLN 43 Cb 0.06 0.17 -0.00 0.00 1.07 0.00 0.00 27.48 28.78 2kby h GLN 43 CO 0.00 1.18 -0.05 0.37 -2.65 0.00 0.00 178.83 177.68 2kby h GLN 44 N 0.07 0.00 -0.60 1.69 5.75 -0.02 -1.17 115.11 120.84 2kby h GLN 44 Ca -0.19 0.00 0.07 0.00 -0.15 0.00 0.00 58.65 58.38 2kby h GLN 44 Cb 2.00 0.00 -0.06 0.00 1.07 0.00 0.00 27.48 30.49 2kby h GLN 44 CO 0.19 0.05 0.28 1.25 -2.65 0.00 0.00 178.83 177.95 2kby h LEU 45 N 0.00 0.37 0.00 -2.39 5.85 -1.40 -3.40 115.31 114.34 2kby h LEU 45 Ca -0.00 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.77 2kby h LEU 45 Cb 0.26 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.28 2kby h LEU 45 CO 0.01 0.23 0.00 0.18 -0.34 0.00 0.00 178.44 178.52 2kby n LEU 46 N -4.90 0.00 -3.68 2.25 4.77 -1.01 -5.01 117.00 109.41 2kby n LEU 46 Ca 0.07 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.79 2kby n LEU 46 Cb 0.21 -0.18 0.05 0.00 -2.33 0.00 0.00 43.42 41.17 2kby n LEU 46 CO 0.26 -0.47 0.17 1.67 -1.33 0.00 0.00 177.39 177.69 2kby n GLN 47 N -2.42 -6.72 0.00 3.23 0.00 -0.47 -5.13 117.38 105.87 2kby n GLN 47 Ca 0.00 0.74 0.00 0.00 -0.00 0.00 0.00 57.00 57.74 2kby n GLN 47 Cb 0.00 -5.71 0.00 0.00 0.00 0.00 0.00 30.24 24.53 2kby n GLN 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60