#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b9k s ILE 2 N 0.00 2.03 0.30 0.00 -4.36 -1.26 -4.84 121.20 113.07 2b9k s ILE 2 Ca 0.00 0.01 0.09 0.00 -0.26 0.00 0.00 60.65 60.49 2b9k s ILE 2 Cb 0.00 -2.36 -0.04 0.00 1.25 0.00 0.00 42.46 41.31 2b9k s ILE 2 CO 0.00 -0.01 0.08 -0.54 0.24 0.00 0.00 174.94 174.71 2b9k s LYS 3 N -4.21 2.38 -0.05 0.37 1.02 0.72 -4.98 119.74 114.99 2b9k s LYS 3 Ca 0.72 -1.46 0.05 0.00 0.02 0.00 0.00 55.97 55.31 2b9k s LYS 3 Cb -0.28 -2.19 -0.01 0.00 -0.52 0.00 0.00 37.83 34.83 2b9k s LYS 3 CO 0.52 0.24 -0.21 -0.51 -0.92 0.00 0.00 175.35 174.47 2b9k s LEU 4 N -3.77 1.98 0.02 3.17 1.43 -1.26 -1.77 118.68 118.48 2b9k s LEU 4 Ca 0.35 -0.42 0.00 0.00 -1.03 0.00 0.00 54.13 53.03 2b9k s LEU 4 Cb -0.04 -1.14 -0.02 0.00 0.03 0.00 0.00 46.19 45.01 2b9k s LEU 4 CO 0.22 0.19 -0.03 -0.69 0.23 0.00 0.00 176.35 176.27 2b9k s VAL 5 N -0.04 0.14 -0.03 -1.59 1.01 -0.91 -4.98 120.40 114.00 2b9k s VAL 5 Ca -0.04 -0.82 -0.00 0.00 0.00 0.00 0.00 61.98 61.12 2b9k s VAL 5 Cb -0.13 -0.26 0.03 0.00 0.00 0.00 0.00 36.38 36.02 2b9k s VAL 5 CO 0.03 -0.43 0.03 -1.10 0.00 0.00 0.00 175.10 173.63 2b9k s GLN 6 N -1.30 0.03 -0.03 2.72 -0.21 -1.26 -1.44 119.66 118.17 2b9k s GLN 6 Ca -0.14 0.21 -0.30 0.00 0.02 0.00 0.00 55.36 55.16 2b9k s GLN 6 Cb -0.09 -0.37 0.08 0.00 1.00 0.00 0.00 33.01 33.63 2b9k s GLN 6 CO -0.01 -0.20 0.71 -1.12 -2.12 0.00 0.00 175.29 172.55 2b9k s SER 7 N 1.34 -0.61 0.38 5.90 0.01 -0.54 -4.93 113.70 115.24 2b9k s SER 7 Ca -0.06 0.57 0.17 0.00 1.31 0.00 0.00 55.95 57.94 2b9k s SER 7 Cb -0.13 0.52 0.75 0.00 0.21 0.00 0.00 66.02 67.37 2b9k s SER 7 CO -0.03 -0.63 1.79 1.55 0.41 0.00 0.00 173.24 176.33 2b9k h PRO 8 N 2.79 0.00 0.00 12.44 0.13 -1.88 -0.86 132.00 144.62 2b9k h PRO 8 Ca -0.27 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.76 2b9k h PRO 8 Cb 1.17 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 2b9k h PRO 8 CO 0.38 0.37 -0.46 -2.95 -0.23 0.00 0.00 178.00 175.11 2b9k h ASN 9 N 0.00 0.00 -4.34 1.44 7.08 -1.94 -3.39 115.58 114.44 2b9k h ASN 9 Ca -0.00 0.00 -0.31 0.00 -3.08 0.00 0.00 56.30 52.91 2b9k h ASN 9 Cb 0.77 0.00 -0.02 0.00 -2.08 0.00 0.00 38.32 36.99 2b9k h ASN 9 CO 0.05 0.46 -0.42 0.61 -2.08 0.00 0.00 177.43 176.05 2b9k n GLY 10 N 1.00 -0.50 3.60 9.14 0.00 -1.22 -4.82 105.19 112.40 2b9k n GLY 10 Ca 0.02 0.04 -0.48 0.00 0.00 0.00 0.00 46.02 45.59 2b9k n GLY 10 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2b9k n ASN 11 N -2.03 3.01 -4.63 1.61 2.85 -1.26 -4.92 115.26 109.89 2b9k n ASN 11 Ca -0.11 0.68 -0.43 0.00 -0.11 0.00 0.00 54.58 54.61 2b9k n ASN 11 Cb 0.59 -1.36 -0.02 0.00 1.24 0.00 0.00 39.78 40.23 2b9k n ASN 11 CO 0.00 0.00 0.00 0.12 -2.11 0.00 0.00 177.26 175.27 2b9k s PHE 12 N 5.74 2.92 -0.86 1.20 5.36 -1.26 -4.92 117.98 126.17 2b9k s PHE 12 Ca 0.99 1.01 0.22 0.00 -0.96 0.00 0.00 56.93 58.20 2b9k s PHE 12 Cb -0.69 -3.85 -0.06 0.00 -0.34 0.00 0.00 43.02 38.08 2b9k s PHE 12 CO 0.49 -1.21 0.98 0.00 -1.46 0.00 0.00 175.22 174.01 2b9k n ALA 13 N 7.27 4.17 0.00 11.12 0.00 -1.26 -5.01 120.51 136.79 2b9k n ALA 13 Ca 0.13 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 53.05 2b9k n ALA 13 Cb 0.47 -0.86 0.00 0.00 0.00 0.00 0.00 19.45 19.06 2b9k n ALA 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2b9k n ALA 14 N -1.62 0.00 -3.57 0.00 0.00 -1.26 -4.70 120.51 109.37 2b9k n ALA 14 Ca 0.03 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.40 2b9k n ALA 14 Cb 0.37 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.80 2b9k n ALA 14 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2b9k s SER 15 N 0.00 -0.35 0.35 0.00 1.04 -1.26 -0.80 113.70 112.68 2b9k s SER 15 Ca 0.00 -0.13 -0.16 0.00 0.48 0.00 0.00 55.95 56.14 2b9k s SER 15 Cb 0.00 0.46 0.04 0.00 0.10 0.00 0.00 66.02 66.62 2b9k s SER 15 CO 0.00 -0.78 0.74 0.12 0.98 0.00 0.00 173.24 174.29 2b9k s PHE 16 N -3.31 0.13 -0.03 5.02 5.36 -0.19 -4.95 117.98 120.01 2b9k s PHE 16 Ca 0.06 -0.71 0.01 0.00 -0.96 0.00 0.00 56.93 55.33 2b9k s PHE 16 Cb -0.01 0.71 0.02 0.00 -0.34 0.00 0.00 43.02 43.40 2b9k s PHE 16 CO -0.06 -1.44 -0.02 0.08 -1.46 0.00 0.00 175.22 172.32 2b9k s VAL 17 N -2.83 0.33 -0.17 3.12 1.01 -1.26 -0.84 120.40 119.76 2b9k s VAL 17 Ca 0.16 -0.02 -0.14 0.00 0.00 0.00 0.00 61.98 61.98 2b9k s VAL 17 Cb -0.05 -0.39 0.05 0.00 0.00 0.00 0.00 36.38 35.99 2b9k s VAL 17 CO 0.11 0.17 0.44 -0.22 0.00 0.00 0.00 175.10 175.60 2b9k s LEU 18 N 0.90 0.23 -1.41 3.92 2.96 -0.42 -4.95 118.68 119.92 2b9k s LEU 18 Ca -0.10 0.89 -0.03 0.00 -0.22 0.00 0.00 54.13 54.67 2b9k s LEU 18 Cb -0.13 1.49 0.00 0.00 0.50 0.00 0.00 46.19 48.05 2b9k s LEU 18 CO -0.01 -0.16 0.35 -0.67 -1.32 0.00 0.00 176.35 174.54 2b9k n ASP 19 N 3.11 -0.52 -1.67 3.68 2.03 -1.26 -1.72 116.55 120.19 2b9k n ASP 19 Ca -0.15 -1.09 -0.19 0.00 0.52 0.00 0.00 54.79 53.88 2b9k n ASP 19 Cb 0.57 -2.64 -0.06 0.00 -0.72 0.00 0.00 41.12 38.27 2b9k n ASP 19 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2b9k n GLY 20 N -2.12 1.12 3.06 0.27 0.00 -1.26 -4.97 105.19 101.29 2b9k n GLY 20 Ca -0.29 -0.10 -0.18 0.00 0.00 0.00 0.00 46.02 45.45 2b9k n GLY 20 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2b9k s THR 21 N -2.78 0.77 0.24 2.61 2.01 -0.70 -5.15 115.64 112.64 2b9k s THR 21 Ca 0.00 -0.67 -0.09 0.00 0.31 0.00 0.00 61.69 61.24 2b9k s THR 21 Cb 0.00 -0.69 -0.07 0.00 0.01 0.00 0.00 72.50 71.75 2b9k s THR 21 CO 0.00 0.04 0.56 -0.75 -0.69 0.00 0.00 174.62 173.78 2b9k s LYS 22 N -0.71 3.79 -0.00 4.92 2.20 -1.26 -1.30 119.74 127.38 2b9k s LYS 22 Ca 0.00 0.26 0.01 0.00 -0.36 0.00 0.00 55.97 55.89 2b9k s LYS 22 Cb -0.06 -2.63 -0.00 0.00 -1.51 0.00 0.00 37.83 33.63 2b9k s LYS 22 CO 0.00 0.29 -0.04 -1.58 -0.36 0.00 0.00 175.35 173.66 2b9k s TRP 23 N -1.87 0.35 0.07 4.03 0.52 -0.02 -4.95 118.94 117.06 2b9k s TRP 23 Ca 0.47 -0.08 -0.19 0.00 0.02 0.00 0.00 56.10 56.33 2b9k s TRP 23 Cb -0.11 -0.22 0.04 0.00 -1.15 0.00 0.00 33.47 32.03 2b9k s TRP 23 CO 0.22 -0.01 0.44 -1.50 0.02 0.00 0.00 176.95 176.12 2b9k s ILE 24 N -0.12 0.05 0.77 2.03 2.07 0.68 -1.02 121.20 125.66 2b9k s ILE 24 Ca 0.01 -0.43 -0.15 0.00 -1.41 0.00 0.00 60.65 58.68 2b9k s ILE 24 Cb -0.02 -1.01 0.04 0.00 0.13 0.00 0.00 42.46 41.61 2b9k s ILE 24 CO -0.00 -0.24 1.05 0.33 -1.91 0.00 0.00 174.94 174.17 2b9k n PHE 25 N 0.29 0.84 0.11 3.50 7.35 0.02 -1.45 117.46 128.13 2b9k n PHE 25 Ca -0.18 0.39 0.00 0.00 -0.76 0.00 0.00 57.45 56.90 2b9k n PHE 25 Cb 0.61 -2.08 0.00 0.00 0.35 0.00 0.00 39.48 38.36 2b9k n PHE 25 CO 0.00 0.00 0.00 1.17 -0.76 0.00 0.00 176.76 177.17 2b9k n LYS 26 N -2.50 0.00 -3.48 -4.13 0.00 -1.24 -4.74 118.16 102.07 2b9k n LYS 26 Ca 0.13 0.00 -0.14 0.00 0.00 0.00 0.00 58.31 58.30 2b9k n LYS 26 Cb 0.50 -0.06 -0.04 0.00 0.00 0.00 0.00 35.03 35.43 2b9k n LYS 26 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2b9k s SER 27 N -4.98 -0.57 0.10 3.14 0.15 -0.29 -5.02 113.70 106.21 2b9k s SER 27 Ca 0.00 0.34 -0.08 0.00 0.70 0.00 0.00 55.95 56.91 2b9k s SER 27 Cb 0.00 0.53 -0.00 0.00 -1.71 0.00 0.00 66.02 64.84 2b9k s SER 27 CO 0.00 -0.73 0.19 -1.59 1.20 0.00 0.00 173.24 172.31 2b9k s LYS 28 N -2.37 0.87 0.09 5.44 -2.85 -1.26 -1.11 119.74 118.54 2b9k s LYS 28 Ca -0.04 -0.99 -0.14 0.00 -1.00 0.00 0.00 55.97 53.80 2b9k s LYS 28 Cb -0.01 0.34 0.02 0.00 -2.06 0.00 0.00 37.83 36.13 2b9k s LYS 28 CO -0.02 -0.28 0.33 1.52 0.10 0.00 0.00 175.35 177.01 2b9k s TYR 29 N -3.87 -0.10 -0.25 1.78 1.13 -0.01 -4.98 117.35 111.04 2b9k s TYR 29 Ca 0.06 -0.17 -0.20 0.00 -1.41 0.00 0.00 57.07 55.36 2b9k s TYR 29 Cb 0.05 0.14 -0.02 0.00 -1.10 0.00 0.00 41.96 41.03 2b9k s TYR 29 CO -0.10 -0.60 0.59 -0.47 -2.51 0.00 0.00 175.55 172.46 2b9k s TYR 30 N -3.39 3.29 -1.26 -3.49 5.04 -1.26 -0.89 117.35 115.39 2b9k s TYR 30 Ca 0.01 0.77 -0.13 0.00 -2.44 0.00 0.00 57.07 55.27 2b9k s TYR 30 Cb 0.02 -2.79 0.15 0.00 0.35 0.00 0.00 41.96 39.68 2b9k s TYR 30 CO -0.09 -0.29 1.65 -3.47 -1.34 0.00 0.00 175.55 172.01 2b9k n ASP 31 N 5.59 5.06 -0.06 4.32 2.03 0.13 -4.85 116.55 128.77 2b9k n ASP 31 Ca -0.02 -3.00 0.25 0.00 0.52 0.00 0.00 54.79 52.54 2b9k n ASP 31 Cb 0.49 -1.58 0.72 0.00 -0.72 0.00 0.00 41.12 40.04 2b9k n ASP 31 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 2b9k h SER 32 N 6.73 0.00 0.42 1.67 0.02 -1.95 0.12 113.55 120.56 2b9k h SER 32 Ca 0.37 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.32 2b9k h SER 32 Cb 0.79 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.33 2b9k h SER 32 CO 1.42 0.00 0.00 0.28 -1.14 0.00 0.00 176.83 177.39 2b9k h SER 33 N 0.00 0.00 0.00 3.07 0.02 -1.95 -3.23 113.55 111.47 2b9k h SER 33 Ca 0.32 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 2b9k h SER 33 Cb 1.44 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.98 2b9k h SER 33 CO -0.00 0.00 -0.25 0.29 -1.14 0.00 0.00 176.83 175.73 2b9k n LYS 34 N -2.67 3.24 -1.74 3.45 4.76 -0.24 -5.07 118.16 119.88 2b9k n LYS 34 Ca -0.01 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.43 2b9k n LYS 34 Cb 0.15 -0.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.84 2b9k n LYS 34 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2b9k n GLY 35 N 0.82 0.96 3.32 0.72 0.00 0.26 -5.09 105.19 106.19 2b9k n GLY 35 Ca 0.00 -0.50 -0.09 0.00 0.00 0.00 0.00 46.02 45.43 2b9k n GLY 35 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2b9k s TYR 36 N -2.64 0.26 0.55 1.61 -0.85 -1.24 -4.84 117.35 110.20 2b9k s TYR 36 Ca 0.00 -0.63 -0.16 0.00 -0.52 0.00 0.00 57.07 55.76 2b9k s TYR 36 Cb 0.00 0.00 -0.06 0.00 0.38 0.00 0.00 41.96 42.28 2b9k s TYR 36 CO 0.00 -0.70 1.02 -1.58 -1.52 0.00 0.00 175.55 172.77 2b9k s TRP 37 N -3.92 3.25 0.03 -3.49 0.52 -0.33 -0.69 118.94 114.31 2b9k s TRP 37 Ca 0.13 1.49 0.01 0.00 0.02 0.00 0.00 56.10 57.74 2b9k s TRP 37 Cb 0.03 -2.89 -0.02 0.00 -1.15 0.00 0.00 33.47 29.44 2b9k s TRP 37 CO -0.04 -0.69 -0.05 0.08 0.02 0.00 0.00 176.95 176.27 2b9k s VAL 38 N -2.55 0.32 0.19 4.03 1.01 -0.07 -1.47 120.40 121.86 2b9k s VAL 38 Ca 0.61 -1.02 -0.24 0.00 0.00 0.00 0.00 61.98 61.33 2b9k s VAL 38 Cb -0.13 -0.47 0.05 0.00 0.00 0.00 0.00 36.38 35.84 2b9k s VAL 38 CO 0.34 -0.46 0.84 -0.83 0.00 0.00 0.00 175.10 174.98 2b9k s GLY 39 N -1.57 -0.23 -0.22 4.51 0.00 -0.52 -0.83 107.32 108.47 2b9k s GLY 39 Ca -0.12 0.06 -0.02 0.00 0.00 0.00 0.00 44.72 44.64 2b9k s GLY 39 CO -0.01 0.01 -0.08 -0.42 0.00 0.00 0.00 173.10 172.60 2b9k s ILE 40 N -3.54 2.96 -0.11 0.90 1.01 -0.27 -2.14 121.20 120.02 2b9k s ILE 40 Ca 0.10 -0.73 -0.07 0.00 0.00 0.00 0.00 60.65 59.95 2b9k s ILE 40 Cb -0.03 -2.37 0.04 0.00 0.01 0.00 0.00 42.46 40.10 2b9k s ILE 40 CO 0.02 0.38 0.27 -0.47 0.00 0.00 0.00 174.94 175.14 2b9k s TYR 41 N 1.40 -0.33 -0.47 3.97 6.14 -0.73 -1.14 117.35 126.19 2b9k s TYR 41 Ca 0.04 0.79 0.03 0.00 0.64 0.00 0.00 57.07 58.57 2b9k s TYR 41 Cb -0.15 0.09 0.51 0.00 0.42 0.00 0.00 41.96 42.83 2b9k s TYR 41 CO -0.06 -0.20 1.72 -1.91 0.64 0.00 0.00 175.55 175.75 2b9k n GLU 42 N 3.65 2.62 0.00 4.97 2.13 -0.53 -0.20 120.64 133.27 2b9k n GLU 42 Ca -0.19 -3.40 0.00 0.00 0.66 0.00 0.00 57.16 54.23 2b9k n GLU 42 Cb 0.56 -2.17 0.00 0.00 0.27 0.00 0.00 31.44 30.10 2b9k n GLU 42 CO 0.00 0.00 0.00 1.55 -0.41 0.00 0.00 177.13 178.27 2b9k n VAL 43 N -0.96 0.00 -1.96 6.31 3.14 -1.21 -0.23 118.33 123.42 2b9k n VAL 43 Ca 0.52 0.00 -0.38 0.00 -2.96 0.00 0.00 64.34 61.52 2b9k n VAL 43 Cb 1.00 -0.08 0.02 0.00 -1.06 0.00 0.00 33.84 33.72 2b9k n VAL 43 CO 0.00 0.00 0.00 0.86 -6.46 0.00 0.00 176.83 171.23 2b9k s TRP 44 N -1.66 2.51 -0.33 1.45 -0.00 -1.26 -4.97 118.94 114.68 2b9k s TRP 44 Ca 0.00 1.43 0.16 0.00 -0.00 0.00 0.00 56.10 57.69 2b9k s TRP 44 Cb 0.00 -3.65 0.45 0.00 -0.00 0.00 0.00 33.47 30.27 2b9k s TRP 44 CO 0.00 -2.38 1.10 -3.47 -0.00 0.00 0.00 176.95 172.20 2b9k n ASP 45 N -0.80 0.48 -3.62 5.86 2.03 -1.26 -4.84 116.55 114.41 2b9k n ASP 45 Ca 0.09 -2.54 -0.22 0.00 0.52 0.00 0.00 54.79 52.64 2b9k n ASP 45 Cb 0.46 -0.08 0.04 0.00 -0.72 0.00 0.00 41.12 40.82 2b9k n ASP 45 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 2b9k n ARG 46 N -0.33 -4.21 0.00 -0.67 0.00 -1.26 -5.16 116.66 105.02 2b9k n ARG 46 Ca 0.04 0.65 0.00 0.00 -0.00 0.00 0.00 57.85 58.54 2b9k n ARG 46 Cb 0.83 -5.17 0.00 0.00 0.00 0.00 0.00 32.46 28.12 2b9k n ARG 46 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80