#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2og0 s TYR 2 N 0.00 3.47 0.09 1.12 1.51 -1.26 -4.29 117.35 117.99 2og0 s TYR 2 Ca 0.00 0.71 0.03 0.00 -1.01 0.00 0.00 57.07 56.80 2og0 s TYR 2 Cb 0.00 -2.15 -0.04 0.00 -0.11 0.00 0.00 41.96 39.66 2og0 s TYR 2 CO 0.00 0.18 0.08 -0.51 -1.11 0.00 0.00 175.55 174.19 2og0 s LEU 3 N -3.40 3.78 0.71 -1.29 1.43 0.32 -4.85 118.68 115.37 2og0 s LEU 3 Ca 0.45 -0.04 -0.11 0.00 -1.03 0.00 0.00 54.13 53.40 2og0 s LEU 3 Cb -0.11 -2.45 0.02 0.00 0.03 0.00 0.00 46.19 43.68 2og0 s LEU 3 CO 0.28 0.16 1.07 0.42 0.23 0.00 0.00 176.35 178.51 2og0 s THR 4 N -1.43 3.74 0.20 5.49 -4.23 -1.26 0.46 115.64 118.60 2og0 s THR 4 Ca 0.29 0.60 -0.11 0.00 -1.18 0.00 0.00 61.69 61.29 2og0 s THR 4 Cb -0.12 -3.23 0.13 0.00 1.34 0.00 0.00 72.50 70.63 2og0 s THR 4 CO 0.22 -0.70 1.72 0.25 -0.54 0.00 0.00 174.62 175.57 2og0 h LEU 5 N -0.68 0.03 -0.76 4.79 6.46 -1.97 0.39 115.31 123.57 2og0 h LEU 5 Ca -0.44 0.10 -0.01 0.00 -0.12 0.00 0.00 57.88 57.40 2og0 h LEU 5 Cb 1.22 0.13 -0.04 0.00 -0.73 0.00 0.00 40.66 41.24 2og0 h LEU 5 CO 0.55 0.03 0.42 1.56 -0.62 0.00 0.00 178.44 180.38 2og0 h GLN 6 N 0.26 1.05 -0.33 1.25 4.20 -1.93 0.07 115.11 119.69 2og0 h GLN 6 Ca 0.28 -0.12 -0.07 0.00 0.06 0.00 0.00 58.65 58.80 2og0 h GLN 6 Cb 0.39 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 2og0 h GLN 6 CO -0.35 0.78 -0.07 0.93 -0.67 0.00 0.00 178.83 179.45 2og0 h GLU 7 N 1.04 0.63 0.06 1.46 5.08 -1.67 -1.53 114.58 119.66 2og0 h GLU 7 Ca 0.27 -0.23 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2og0 h GLU 7 Cb 0.03 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.24 2og0 h GLU 7 CO -0.04 0.79 -0.03 2.35 -1.00 0.00 0.00 179.01 181.08 2og0 h TRP 8 N 0.41 -0.08 -0.98 4.33 7.01 -0.19 -2.99 115.95 123.46 2og0 h TRP 8 Ca 0.08 -0.00 0.02 0.00 2.11 0.00 0.00 58.89 61.10 2og0 h TRP 8 Cb 0.56 0.03 -0.05 0.00 -2.10 0.00 0.00 29.16 27.59 2og0 h TRP 8 CO 0.05 -0.04 0.65 -0.97 -2.79 0.00 0.00 178.44 175.33 2og0 h ASN 9 N -0.09 1.11 0.36 2.65 -1.24 -0.87 -1.73 115.58 115.78 2og0 h ASN 9 Ca -0.01 -0.02 -0.03 0.00 0.71 0.00 0.00 56.30 56.95 2og0 h ASN 9 Cb 0.07 -0.27 -0.00 0.00 0.73 0.00 0.00 38.32 38.85 2og0 h ASN 9 CO 0.01 0.79 -0.12 0.00 -1.29 0.00 0.00 177.43 176.82 2og0 h ALA 10 N 1.40 1.30 -0.00 1.57 0.00 -1.28 -2.87 119.26 119.39 2og0 h ALA 10 Ca 0.37 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2og0 h ALA 10 Cb -0.11 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2og0 h ALA 10 CO -0.09 0.16 -0.34 0.54 0.00 0.00 0.00 179.25 179.52 2og0 n ARG 11 N -3.68 0.32 -2.00 0.00 1.74 -0.66 -4.88 116.66 107.50 2og0 n ARG 11 Ca -0.02 -0.17 -0.30 0.00 -0.77 0.00 0.00 57.85 56.59 2og0 n ARG 11 Cb 0.24 -1.50 0.02 0.00 -1.02 0.00 0.00 32.46 30.20 2og0 n ARG 11 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2og0 s GLN 12 N -2.80 3.42 0.49 5.56 -1.52 -1.08 -4.97 119.66 118.76 2og0 s GLN 12 Ca 0.17 0.59 0.25 0.00 -1.95 0.00 0.00 55.36 54.42 2og0 s GLN 12 Cb 0.18 -2.12 1.29 0.00 -0.22 0.00 0.00 33.01 32.15 2og0 s GLN 12 CO 0.61 -0.62 2.02 0.07 -0.25 0.00 0.00 175.29 177.11 2og0 h ARG 13 N -0.31 0.00 -2.64 2.91 0.11 -1.91 -3.32 114.38 109.22 2og0 h ARG 13 Ca -0.45 0.00 -0.59 0.00 0.10 0.00 0.00 59.98 59.05 2og0 h ARG 13 Cb 1.21 0.00 -0.39 0.00 1.11 0.00 0.00 29.97 31.90 2og0 h ARG 13 CO 0.62 0.16 -0.84 0.50 0.10 0.00 0.00 179.97 180.51 2og0 s ARG 14 N -4.15 0.70 0.31 0.08 6.06 -1.26 -5.13 118.95 115.56 2og0 s ARG 14 Ca -0.02 -1.49 -0.29 0.00 -2.50 0.00 0.00 55.73 51.42 2og0 s ARG 14 Cb 0.13 -1.49 -0.12 0.00 0.06 0.00 0.00 34.95 33.53 2og0 s ARG 14 CO 0.61 -1.21 1.47 -2.30 -2.50 0.00 0.00 175.30 171.37 2og0 n PRO 15 N 3.88 2.44 -3.82 5.12 -0.02 -1.25 -5.01 135.00 136.35 2og0 n PRO 15 Ca 0.13 0.86 -0.25 0.00 -2.02 0.00 0.00 63.50 62.22 2og0 n PRO 15 Cb 0.37 -2.57 -0.01 0.00 -0.02 0.00 0.00 33.50 31.28 2og0 n PRO 15 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2og0 s ARG 16 N -1.09 2.28 0.68 -0.52 1.81 -1.26 -5.08 118.95 115.76 2og0 s ARG 16 Ca 0.61 -1.95 -0.17 0.00 -1.72 0.00 0.00 55.73 52.50 2og0 s ARG 16 Cb -0.54 -2.15 0.00 0.00 -0.45 0.00 0.00 34.95 31.82 2og0 s ARG 16 CO 0.55 -0.58 1.23 -1.13 -0.68 0.00 0.00 175.30 174.69 2og0 n SER 17 N -1.76 1.69 -0.32 0.23 3.41 -1.26 -4.87 113.62 110.75 2og0 n SER 17 Ca -0.00 0.78 0.02 0.00 -0.26 0.00 0.00 58.87 59.41 2og0 n SER 17 Cb 0.64 -1.53 0.16 0.00 -0.26 0.00 0.00 64.21 63.23 2og0 n SER 17 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2og0 h LEU 18 N 0.24 0.83 -0.61 1.04 4.07 -1.99 -2.72 115.31 116.17 2og0 h LEU 18 Ca -0.50 0.03 0.12 0.00 0.08 0.00 0.00 57.88 57.61 2og0 h LEU 18 Cb 1.34 -0.14 -0.10 0.00 1.08 0.00 0.00 40.66 42.84 2og0 h LEU 18 CO 0.51 0.51 0.07 -0.08 -1.08 0.00 0.00 178.44 178.37 2og0 h GLU 19 N 0.95 0.18 -0.38 1.13 4.81 -1.99 -0.49 114.58 118.79 2og0 h GLU 19 Ca 0.40 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.53 2og0 h GLU 19 Cb 0.26 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.59 2og0 h GLU 19 CO -0.20 0.12 -0.12 1.15 -0.73 0.00 0.00 179.01 179.23 2og0 h THR 20 N 0.19 1.28 -0.47 0.32 2.02 -1.88 -1.85 112.91 112.52 2og0 h THR 20 Ca 0.32 -1.22 -0.04 0.00 0.77 0.00 0.00 66.41 66.24 2og0 h THR 20 Cb 0.51 1.27 -0.02 0.00 -1.74 0.00 0.00 68.15 68.16 2og0 h THR 20 CO -0.46 0.40 0.12 0.58 0.37 0.00 0.00 175.52 176.53 2og0 h VAL 21 N 0.56 1.23 -0.74 3.16 2.07 -1.16 -1.00 116.25 120.37 2og0 h VAL 21 Ca 0.09 -0.80 0.05 0.00 0.82 0.00 0.00 66.70 66.86 2og0 h VAL 21 Cb 0.65 0.86 -0.05 0.00 -1.52 0.00 0.00 31.29 31.23 2og0 h VAL 21 CO 0.04 0.29 0.45 0.03 0.02 0.00 0.00 177.57 178.40 2og0 h ARG 22 N 0.63 0.82 -0.33 1.57 3.08 -1.05 -1.57 114.38 117.53 2og0 h ARG 22 Ca 0.15 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.15 2og0 h ARG 22 Cb 0.31 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 2og0 h ARG 22 CO -0.00 0.54 0.22 -0.09 -1.07 0.00 0.00 179.97 179.57 2og0 h ARG 23 N 0.85 0.44 -0.79 0.04 2.43 -0.91 -0.75 114.38 115.69 2og0 h ARG 23 Ca 0.31 -0.03 0.12 0.00 -0.81 0.00 0.00 59.98 59.57 2og0 h ARG 23 Cb 0.11 -0.10 -0.08 0.00 -0.42 0.00 0.00 29.97 29.48 2og0 h ARG 23 CO -0.15 0.29 0.40 -1.49 -1.51 0.00 0.00 179.97 177.52 2og0 h TRP 24 N 0.45 0.72 -0.14 2.20 6.55 -0.73 0.10 115.95 125.10 2og0 h TRP 24 Ca 0.12 0.03 -0.01 0.00 0.95 0.00 0.00 58.89 59.99 2og0 h TRP 24 Cb -0.05 -0.20 -0.01 0.00 -0.86 0.00 0.00 29.16 28.04 2og0 h TRP 24 CO -0.05 0.22 0.06 0.28 -1.05 0.00 0.00 178.44 177.90 2og0 h VAL 25 N 0.63 1.14 -0.61 1.49 2.07 -0.93 -0.31 116.25 119.73 2og0 h VAL 25 Ca 0.41 -0.41 0.10 0.00 0.82 0.00 0.00 66.70 67.61 2og0 h VAL 25 Cb 0.49 1.15 -0.04 0.00 -1.52 0.00 0.00 31.29 31.38 2og0 h VAL 25 CO -0.31 0.13 0.41 0.03 0.02 0.00 0.00 177.57 177.85 2og0 h ARG 26 N 0.09 0.41 -0.57 1.57 3.08 -0.49 -1.97 114.38 116.50 2og0 h ARG 26 Ca 0.05 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.07 2og0 h ARG 26 Cb 0.15 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.11 2og0 h ARG 26 CO -0.00 0.27 0.00 0.39 -1.07 0.00 0.00 179.97 179.56 2og0 n GLU 27 N -4.47 2.51 -3.81 0.04 1.02 0.29 -4.96 120.64 111.26 2og0 n GLU 27 Ca 0.10 -2.02 -0.27 0.00 -0.02 0.00 0.00 57.16 54.95 2og0 n GLU 27 Cb 0.38 -1.52 0.04 0.00 -0.02 0.00 0.00 31.44 30.31 2og0 n GLU 27 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2og0 n SER 28 N 1.00 -4.35 -0.06 1.62 7.64 -0.74 -4.89 113.62 113.84 2og0 n SER 28 Ca 0.19 -0.74 0.12 0.00 1.01 0.00 0.00 58.87 59.45 2og0 n SER 28 Cb 0.53 -4.14 0.28 0.00 -1.01 0.00 0.00 64.21 59.87 2og0 n SER 28 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2og0 n ARG 29 N -4.66 0.21 -4.35 1.43 1.74 -0.18 -4.89 116.66 105.95 2og0 n ARG 29 Ca -0.03 -0.12 -0.34 0.00 -0.77 0.00 0.00 57.85 56.59 2og0 n ARG 29 Cb 0.56 -1.50 -0.12 0.00 -1.02 0.00 0.00 32.46 30.38 2og0 n ARG 29 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2og0 s ILE 30 N -2.88 3.84 -0.05 0.55 -1.09 -1.26 -0.35 121.20 119.96 2og0 s ILE 30 Ca 0.14 -0.37 0.02 0.00 -2.23 0.00 0.00 60.65 58.21 2og0 s ILE 30 Cb 0.18 -2.69 0.02 0.00 -1.58 0.00 0.00 42.46 38.39 2og0 s ILE 30 CO 0.66 0.48 -0.09 -0.36 -1.23 0.00 0.00 174.94 174.40 2og0 s PHE 31 N 0.50 1.16 0.56 3.97 0.08 0.02 -2.40 117.98 121.87 2og0 s PHE 31 Ca -0.03 -0.39 -0.21 0.00 0.12 0.00 0.00 56.93 56.41 2og0 s PHE 31 Cb -0.14 -0.89 -0.04 0.00 -0.57 0.00 0.00 43.02 41.37 2og0 s PHE 31 CO 0.03 -0.23 1.33 -2.14 -0.10 0.00 0.00 175.22 174.11 2og0 s PRO 32 N 0.71 3.10 0.28 0.24 0.02 -1.26 -0.93 135.00 137.16 2og0 s PRO 32 Ca -0.13 2.17 -0.30 0.00 0.02 0.00 0.00 61.00 62.77 2og0 s PRO 32 Cb -0.15 -2.20 -0.11 0.00 0.02 0.00 0.00 34.50 32.06 2og0 s PRO 32 CO 0.02 -1.20 1.47 -1.25 -0.33 0.00 0.00 177.00 175.71 2og0 s PRO 33 N -2.97 4.22 0.51 5.54 0.04 -1.01 -4.73 135.00 136.60 2og0 s PRO 33 Ca 0.73 2.40 -0.22 0.00 0.04 0.00 0.00 61.00 63.95 2og0 s PRO 33 Cb -0.39 -3.07 -0.07 0.00 0.04 0.00 0.00 34.50 31.01 2og0 s PRO 33 CO 0.46 -0.47 1.16 -2.30 0.04 0.00 0.00 177.00 175.89 2og0 n PRO 34 N 1.91 1.47 -3.02 0.56 -0.02 -1.26 -4.92 135.00 129.71 2og0 n PRO 34 Ca 0.06 0.54 -0.40 0.00 -2.02 0.00 0.00 63.50 61.68 2og0 n PRO 34 Cb 0.39 -2.32 -0.05 0.00 -0.02 0.00 0.00 33.50 31.51 2og0 n PRO 34 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2og0 s VAL 35 N -1.33 4.98 -0.30 -1.45 1.01 -0.39 -4.84 120.40 118.09 2og0 s VAL 35 Ca 0.69 1.50 -0.27 0.00 0.00 0.00 0.00 61.98 63.90 2og0 s VAL 35 Cb -0.46 -4.06 0.01 0.00 0.00 0.00 0.00 36.38 31.86 2og0 s VAL 35 CO 0.52 0.27 0.97 -0.75 0.00 0.00 0.00 175.10 176.12 2og0 s LYS 36 N 0.61 4.07 -0.30 2.72 2.47 -1.26 -0.44 119.74 127.62 2og0 s LYS 36 Ca 0.38 0.97 0.02 0.00 -1.56 0.00 0.00 55.97 55.78 2og0 s LYS 36 Cb -0.18 -3.71 0.09 0.00 -1.46 0.00 0.00 37.83 32.56 2og0 s LYS 36 CO 0.20 -0.77 0.02 0.34 0.16 0.00 0.00 175.35 175.29 2og0 s ASP 37 N 1.55 4.35 1.87 1.43 2.15 -0.08 -4.99 116.67 122.95 2og0 s ASP 37 Ca 0.41 -1.71 0.00 0.00 0.43 0.00 0.00 52.55 51.67 2og0 s ASP 37 Cb -0.13 -1.35 0.00 0.00 -0.30 0.00 0.00 42.92 41.14 2og0 s ASP 37 CO 0.12 -0.33 0.00 0.61 -0.17 0.00 0.00 175.17 175.41 2og0 n GLY 38 N 4.50 3.51 0.32 2.66 0.00 -1.26 -2.34 105.19 112.59 2og0 n GLY 38 Ca -0.03 0.13 0.11 0.00 0.00 0.00 0.00 46.02 46.23 2og0 n GLY 38 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2og0 n ARG 39 N 10.68 0.81 -4.36 1.61 1.85 -1.26 -4.95 116.66 121.03 2og0 n ARG 39 Ca 0.00 -0.65 -0.30 0.00 -1.00 0.00 0.00 57.85 55.90 2og0 n ARG 39 Cb 0.00 -1.49 -0.11 0.00 -1.05 0.00 0.00 32.46 29.81 2og0 n ARG 39 CO 0.00 0.00 0.00 -1.83 -0.01 0.00 0.00 177.63 175.79 2og0 s GLU 40 N -2.64 1.94 0.18 2.89 -1.05 -0.99 -5.12 118.70 113.92 2og0 s GLU 40 Ca 0.16 -1.09 -0.30 0.00 -0.15 0.00 0.00 54.97 53.59 2og0 s GLU 40 Cb 0.18 -2.18 -0.08 0.00 -0.44 0.00 0.00 34.13 31.61 2og0 s GLU 40 CO 0.66 0.50 0.98 0.71 0.95 0.00 0.00 175.26 179.06 2og0 s TYR 41 N -1.11 3.83 -0.19 4.83 2.02 -1.26 -0.90 117.35 124.58 2og0 s TYR 41 Ca 0.18 1.81 -0.00 0.00 -0.37 0.00 0.00 57.07 58.69 2og0 s TYR 41 Cb -0.11 -3.08 0.01 0.00 -0.40 0.00 0.00 41.96 38.39 2og0 s TYR 41 CO 0.10 0.13 -0.16 -0.51 -1.57 0.00 0.00 175.55 173.53 2og0 s LEU 42 N -0.63 2.33 -0.16 -1.29 1.43 0.42 -3.48 118.68 117.30 2og0 s LEU 42 Ca 0.45 -0.57 -0.08 0.00 -1.03 0.00 0.00 54.13 52.89 2og0 s LEU 42 Cb -0.26 -1.55 -0.04 0.00 0.03 0.00 0.00 46.19 44.37 2og0 s LEU 42 CO 0.32 0.00 0.13 -0.36 0.23 0.00 0.00 176.35 176.68 2og0 s PHE 43 N 1.28 3.51 0.53 0.29 0.40 0.17 -1.26 117.98 122.91 2og0 s PHE 43 Ca 0.04 0.43 -0.22 0.00 -0.60 0.00 0.00 56.93 56.59 2og0 s PHE 43 Cb -0.14 -2.04 -0.05 0.00 0.51 0.00 0.00 43.02 41.30 2og0 s PHE 43 CO -0.09 0.53 1.29 -1.01 0.70 0.00 0.00 175.22 176.63 2og0 s HIS 44 N -0.38 2.45 0.26 0.36 3.76 -1.26 0.12 115.29 120.59 2og0 s HIS 44 Ca 0.12 1.44 -0.04 0.00 -0.15 0.00 0.00 55.06 56.43 2og0 s HIS 44 Cb -0.12 -3.64 0.37 0.00 1.11 0.00 0.00 32.58 30.30 2og0 s HIS 44 CO 0.01 -2.45 1.88 0.93 -0.85 0.00 0.00 174.74 174.26 2og0 h GLU 45 N 1.51 1.09 0.00 1.40 5.08 -1.95 -2.16 114.58 119.54 2og0 h GLU 45 Ca -0.50 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 57.79 2og0 h GLU 45 Cb 1.29 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 30.29 2og0 h GLU 45 CO 0.58 0.72 0.00 -1.13 -1.00 0.00 0.00 179.01 178.18 2og0 n SER 46 N -4.53 0.00 -4.67 1.42 3.41 -1.26 -4.90 113.62 103.08 2og0 n SER 46 Ca 0.14 0.15 -0.46 0.00 -0.26 0.00 0.00 58.87 58.44 2og0 n SER 46 Cb 0.17 -0.36 -0.04 0.00 -0.26 0.00 0.00 64.21 63.71 2og0 n SER 46 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2og0 n ALA 47 N -1.36 1.35 -2.38 7.33 0.00 -0.81 -4.77 120.51 119.86 2og0 n ALA 47 Ca 0.09 0.42 -0.20 0.00 0.00 0.00 0.00 53.44 53.75 2og0 n ALA 47 Cb 0.22 -2.38 -0.10 0.00 0.00 0.00 0.00 19.45 17.19 2og0 n ALA 47 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2og0 s VAL 48 N 1.38 1.89 -0.17 0.00 -7.23 -0.11 -4.94 120.40 111.23 2og0 s VAL 48 Ca 0.81 -2.22 -0.18 0.00 -1.81 0.00 0.00 61.98 58.58 2og0 s VAL 48 Cb -0.67 -2.07 -0.04 0.00 0.56 0.00 0.00 36.38 34.16 2og0 s VAL 48 CO 0.40 -0.52 0.50 -0.75 -0.31 0.00 0.00 175.10 174.41 2og0 s LYS 49 N -3.52 4.25 -0.00 4.82 2.20 -1.26 -0.80 119.74 125.44 2og0 s LYS 49 Ca 0.23 0.42 -0.19 0.00 -0.36 0.00 0.00 55.97 56.08 2og0 s LYS 49 Cb -0.02 -3.51 -0.06 0.00 -1.51 0.00 0.00 37.83 32.73 2og0 s LYS 49 CO 0.08 -0.02 0.53 0.14 -0.36 0.00 0.00 175.35 175.72 2og0 s VAL 50 N 1.21 4.94 -2.00 4.02 -7.23 0.52 -4.98 120.40 116.88 2og0 s VAL 50 Ca 0.25 1.10 0.27 0.00 -1.81 0.00 0.00 61.98 61.78 2og0 s VAL 50 Cb -0.15 -3.86 0.76 0.00 0.56 0.00 0.00 36.38 33.69 2og0 s VAL 50 CO 0.10 0.47 1.94 0.47 -0.31 0.00 0.00 175.10 177.77