#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bor s GLU 2 N 0.00 1.21 2.93 5.31 0.41 -1.26 -4.95 118.70 122.36 1bor s GLU 2 Ca 0.00 -1.28 0.00 0.00 -0.41 0.00 0.00 54.97 53.28 1bor s GLU 2 Cb 0.00 -1.42 0.00 0.00 -1.78 0.00 0.00 34.13 30.93 1bor s GLU 2 CO 0.00 0.31 0.00 0.39 -0.49 0.00 0.00 175.26 175.47 1bor n GLU 3 N 0.74 0.00 -1.54 1.61 4.71 -1.26 -4.72 120.64 120.19 1bor n GLU 3 Ca -0.17 0.00 -0.62 0.00 -0.01 0.00 0.00 57.16 56.37 1bor n GLU 3 Cb 0.55 0.00 -0.10 0.00 -1.01 0.00 0.00 31.44 30.88 1bor n GLU 3 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1bor n PHE 4 N 0.00 1.58 -1.94 -0.32 7.35 -1.19 -3.74 117.46 119.20 1bor n PHE 4 Ca 0.00 0.82 0.00 0.00 -0.76 0.00 0.00 57.45 57.51 1bor n PHE 4 Cb 0.00 -2.32 0.00 0.00 0.35 0.00 0.00 39.48 37.51 1bor n PHE 4 CO 0.00 0.00 0.00 0.94 -0.76 0.00 0.00 176.76 176.94 1bor n GLN 5 N 5.91 0.00 -4.01 -4.13 7.27 -1.26 -4.30 117.38 116.86 1bor n GLN 5 Ca 0.40 -0.11 -0.09 0.00 0.07 0.00 0.00 57.00 57.26 1bor n GLN 5 Cb 0.01 -0.07 -0.05 0.00 2.41 0.00 0.00 30.24 32.53 1bor n GLN 5 CO 0.00 0.00 0.00 0.12 0.07 0.00 0.00 177.06 177.25 1bor s PHE 6 N 0.00 0.43 0.00 3.69 5.36 -1.26 -5.05 117.98 121.15 1bor s PHE 6 Ca 0.00 -0.78 0.00 0.00 -0.96 0.00 0.00 56.93 55.19 1bor s PHE 6 Cb 0.00 0.15 0.00 0.00 -0.34 0.00 0.00 43.02 42.83 1bor s PHE 6 CO 0.00 -0.99 0.64 1.47 -1.46 0.00 0.00 175.22 174.88 1bor n LEU 7 N -0.38 -0.31 0.00 6.12 -0.00 -1.26 -4.69 117.00 116.47 1bor n LEU 7 Ca -0.01 -1.27 0.00 0.00 -0.00 0.00 0.00 56.01 54.72 1bor n LEU 7 Cb 0.62 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.04 1bor n LEU 7 CO 0.23 1.14 0.00 0.54 -0.00 0.00 0.00 177.39 179.30 1bor n ARG 8 N 0.00 0.00 -3.60 1.47 1.74 -1.20 -2.48 116.66 112.59 1bor n ARG 8 Ca -0.09 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.99 1bor n ARG 8 Cb 0.54 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.97 1bor n ARG 8 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1bor h GLN 10 N 2.00 -0.60 0.00 0.00 4.15 -1.89 -3.40 115.11 115.38 1bor h GLN 10 Ca -0.19 0.04 -0.09 0.00 0.77 0.00 0.00 58.65 59.18 1bor h GLN 10 Cb 1.17 0.14 -0.01 0.00 0.21 0.00 0.00 27.48 28.98 1bor h GLN 10 CO 0.25 -0.40 -1.03 1.04 -1.93 0.00 0.00 178.83 176.76 1bor n GLN 11 N -3.87 0.31 -2.23 1.69 1.13 -1.26 -4.76 117.38 108.39 1bor n GLN 11 Ca -0.08 0.13 -0.41 0.00 -1.94 0.00 0.00 57.00 54.70 1bor n GLN 11 Cb 0.24 -1.04 -0.01 0.00 0.11 0.00 0.00 30.24 29.55 1bor n GLN 11 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1bor s GLN 13 N 4.26 3.29 0.10 0.00 -2.07 -1.26 -4.44 119.66 119.53 1bor s GLN 13 Ca 0.54 -0.26 0.00 0.00 -1.82 0.00 0.00 55.36 53.82 1bor s GLN 13 Cb 0.07 -4.12 0.00 0.00 -1.09 0.00 0.00 33.01 27.87 1bor s GLN 13 CO 0.05 -1.79 0.00 0.00 -1.32 0.00 0.00 175.29 172.23 1bor n ALA 14 N 8.28 3.00 -3.24 2.60 0.00 -1.26 -4.89 120.51 125.00 1bor n ALA 14 Ca 0.02 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.32 1bor n ALA 14 Cb 0.48 0.10 -0.06 0.00 0.00 0.00 0.00 19.45 19.97 1bor n ALA 14 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1bor s GLU 15 N -1.61 0.80 0.00 0.00 2.12 -1.26 -5.00 118.70 113.75 1bor s GLU 15 Ca 0.00 -1.09 0.00 0.00 0.36 0.00 0.00 54.97 54.24 1bor s GLU 15 Cb 0.00 -0.64 0.00 0.00 0.26 0.00 0.00 34.13 33.75 1bor s GLU 15 CO 0.00 -1.26 0.00 0.00 -0.54 0.00 0.00 175.26 173.46 1bor n ALA 16 N 3.73 -1.00 1.03 6.30 0.00 -1.03 -4.83 120.51 124.71 1bor n ALA 16 Ca 0.16 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.71 1bor n ALA 16 Cb 0.49 -0.03 0.04 0.00 0.00 0.00 0.00 19.45 19.94 1bor n ALA 16 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1bor n LYS 17 N 1.07 0.86 -3.94 0.00 4.81 -0.40 -4.67 118.16 115.89 1bor n LYS 17 Ca 0.00 -0.68 -0.34 0.00 -0.87 0.00 0.00 58.31 56.41 1bor n LYS 17 Cb 0.00 -1.49 -0.14 0.00 0.02 0.00 0.00 35.03 33.43 1bor n LYS 17 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1bor n PRO 19 N 4.60 0.87 -1.20 0.00 -0.04 -1.26 -4.07 135.00 133.91 1bor n PRO 19 Ca -0.14 -0.20 -0.37 0.00 -0.04 0.00 0.00 63.50 62.76 1bor n PRO 19 Cb 0.44 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.46 1bor n PRO 19 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1bor n LYS 20 N -0.89 0.17 -0.93 0.54 4.81 -1.18 -4.55 118.16 116.13 1bor n LYS 20 Ca 0.18 0.09 -0.34 0.00 -0.87 0.00 0.00 58.31 57.37 1bor n LYS 20 Cb 0.22 -1.55 0.04 0.00 0.02 0.00 0.00 35.03 33.76 1bor n LYS 20 CO 0.00 0.00 0.00 1.47 1.17 0.00 0.00 177.40 180.04 1bor n LEU 21 N 0.74 -5.54 -0.53 3.14 -0.00 -1.17 -4.42 117.00 109.23 1bor n LEU 21 Ca 0.08 0.16 0.05 0.00 -0.00 0.00 0.00 56.01 56.30 1bor n LEU 21 Cb 0.50 -0.70 0.11 0.00 -0.00 0.00 0.00 43.42 43.34 1bor n LEU 21 CO 0.51 -5.52 0.56 0.18 -0.00 0.00 0.00 177.39 173.13 1bor n LEU 22 N 3.26 2.58 0.09 1.47 4.77 -1.26 -3.59 117.00 124.32 1bor n LEU 22 Ca -0.02 -1.74 -0.05 0.00 -0.03 0.00 0.00 56.01 54.17 1bor n LEU 22 Cb 0.53 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 1bor n LEU 22 CO 0.49 0.62 0.29 1.55 -1.33 0.00 0.00 177.39 179.00 1bor h PRO 23 N 1.87 0.01 -2.32 3.23 0.13 -1.91 -3.34 132.00 129.67 1bor h PRO 23 Ca 0.00 -0.02 -0.66 0.00 -0.87 0.00 0.00 66.00 64.45 1bor h PRO 23 Cb 0.63 0.01 -0.38 0.00 0.13 0.00 0.00 31.00 31.39 1bor h PRO 23 CO 0.00 0.85 -0.14 0.00 -0.23 0.00 0.00 178.00 178.47 1bor n LEU 25 N 0.18 -0.12 -2.93 0.00 0.00 -1.25 -4.78 117.00 108.10 1bor n LEU 25 Ca 0.34 -0.47 -0.27 0.00 0.00 0.00 0.00 56.01 55.61 1bor n LEU 25 Cb 0.36 -0.57 -0.04 0.00 0.00 0.00 0.00 43.42 43.17 1bor n LEU 25 CO 0.43 0.27 0.13 1.41 0.00 0.00 0.00 177.39 179.63 1bor n HIS 26 N -2.40 3.85 -2.11 1.96 8.25 -1.24 -4.61 115.22 118.93 1bor n HIS 26 Ca -0.06 -3.95 -0.03 0.00 -0.26 0.00 0.00 57.72 53.42 1bor n HIS 26 Cb 0.22 -0.47 0.09 0.00 1.12 0.00 0.00 29.99 30.95 1bor n HIS 26 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1bor n THR 27 N -0.23 1.63 0.00 1.59 -1.04 -1.26 -3.35 114.28 111.62 1bor n THR 27 Ca 0.31 -2.91 0.00 0.00 -2.04 0.00 0.00 64.05 59.41 1bor n THR 27 Cb 0.42 0.07 0.00 0.00 -1.82 0.00 0.00 70.33 69.00 1bor n THR 27 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1bor n LEU 28 N -0.56 0.00 -3.30 -4.42 7.99 -1.26 -3.23 117.00 112.22 1bor n LEU 28 Ca 0.20 0.00 -0.08 0.00 -0.01 0.00 0.00 56.01 56.13 1bor n LEU 28 Cb 0.88 0.00 -0.06 0.00 -0.11 0.00 0.00 43.42 44.13 1bor n LEU 28 CO 0.09 0.00 -0.04 0.00 -1.51 0.00 0.00 177.39 175.92 1bor n SER 30 N 5.36 0.44 0.00 0.00 2.88 -1.19 -1.84 113.62 119.28 1bor n SER 30 Ca -0.01 -1.16 0.00 0.00 -1.33 0.00 0.00 58.87 56.38 1bor n SER 30 Cb 0.50 -1.21 0.00 0.00 -0.75 0.00 0.00 64.21 62.75 1bor n SER 30 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1bor n GLY 31 N 6.24 0.37 0.00 0.46 0.00 -1.26 -4.96 105.19 106.04 1bor n GLY 31 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.56 1bor n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bor s LEU 33 N -0.00 2.13 -0.39 0.00 1.98 -1.19 -4.74 118.68 116.45 1bor s LEU 33 Ca 0.00 -0.54 0.03 0.00 -2.89 0.00 0.00 54.13 50.74 1bor s LEU 33 Cb 0.00 -1.31 0.29 0.00 0.66 0.00 0.00 46.19 45.83 1bor s LEU 33 CO 0.00 0.29 1.18 -1.84 -1.89 0.00 0.00 176.35 174.08 1bor n GLU 34 N 2.06 0.49 -1.91 1.98 0.28 -1.26 -4.85 120.64 117.42 1bor n GLU 34 Ca -0.16 -1.22 -0.08 0.00 -0.16 0.00 0.00 57.16 55.54 1bor n GLU 34 Cb 0.52 -0.68 -0.02 0.00 1.43 0.00 0.00 31.44 32.69 1bor n GLU 34 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1bor n ALA 35 N 1.00 -0.53 0.10 -1.84 0.00 -1.26 -4.43 120.51 113.55 1bor n ALA 35 Ca 0.02 0.09 0.08 0.00 0.00 0.00 0.00 53.44 53.64 1bor n ALA 35 Cb 0.70 -1.05 -0.01 0.00 0.00 0.00 0.00 19.45 19.09 1bor n ALA 35 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1bor h SER 36 N 0.00 0.00 0.00 0.00 0.02 -1.91 -3.37 113.55 108.29 1bor h SER 36 Ca -0.18 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.74 1bor h SER 36 Cb 0.86 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.37 1bor h SER 36 CO 0.23 0.16 -0.05 0.61 -1.14 0.00 0.00 176.83 176.64 1bor n GLY 37 N 1.23 -0.38 0.00 -3.77 0.00 -1.26 -5.00 105.19 96.01 1bor n GLY 37 Ca -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1bor n GLY 37 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1bor n MET 38 N -0.24 1.86 0.00 1.61 0.00 -1.26 -5.04 117.12 114.05 1bor n MET 38 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.66 1bor n MET 38 Cb 0.52 -0.86 0.00 0.00 0.00 0.00 0.00 33.22 32.88 1bor n MET 38 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 175.97 177.01 1bor n GLN 39 N -1.81 0.00 -3.51 3.17 1.13 -1.26 -5.02 117.38 110.08 1bor n GLN 39 Ca 0.00 0.00 -0.13 0.00 -1.94 0.00 0.00 57.00 54.93 1bor n GLN 39 Cb 0.36 0.00 -0.04 0.00 0.11 0.00 0.00 30.24 30.67 1bor n GLN 39 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1bor s PRO 41 N -2.17 3.45 -0.85 0.00 0.04 -1.26 -4.47 135.00 129.73 1bor s PRO 41 Ca -0.03 -1.21 -0.11 0.00 0.04 0.00 0.00 61.00 59.69 1bor s PRO 41 Cb -0.01 -4.82 0.11 0.00 0.04 0.00 0.00 34.50 29.83 1bor s PRO 41 CO -0.01 -1.95 0.27 1.51 0.04 0.00 0.00 177.00 176.86 1bor n ILE 42 N 6.09 0.00 0.00 0.56 0.13 -1.26 -4.74 119.36 120.14 1bor n ILE 42 Ca 0.18 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.83 1bor n ILE 42 Cb 0.49 -0.23 0.00 0.00 -0.84 0.00 0.00 39.64 39.06 1bor n ILE 42 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1bor n GLN 44 N -1.25 -0.33 0.06 0.00 0.00 -1.26 -4.56 117.38 110.04 1bor n GLN 44 Ca 0.00 0.18 0.00 0.00 -0.00 0.00 0.00 57.00 57.18 1bor n GLN 44 Cb 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 30.24 29.80 1bor n GLN 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1bor n ALA 45 N -0.77 0.00 0.89 1.69 0.00 -1.26 -4.94 120.51 116.13 1bor n ALA 45 Ca -0.06 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.38 1bor n ALA 45 Cb 0.14 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.61 1bor n ALA 45 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1bor n PRO 46 N -2.66 1.12 -0.25 0.00 -0.04 -1.26 -4.42 135.00 127.49 1bor n PRO 46 Ca 0.00 -0.16 0.01 0.00 -0.04 0.00 0.00 63.50 63.31 1bor n PRO 46 Cb 0.00 -1.27 0.13 0.00 -0.04 0.00 0.00 33.50 32.32 1bor n PRO 46 CO 0.00 0.00 0.00 2.35 -0.04 0.00 0.00 175.50 177.81 1bor h TRP 47 N 0.12 0.71 0.00 0.54 2.91 -1.93 -2.03 115.95 116.27 1bor h TRP 47 Ca 0.02 0.03 -0.08 0.00 1.13 0.00 0.00 58.89 59.99 1bor h TRP 47 Cb 0.87 -0.21 -0.01 0.00 -0.51 0.00 0.00 29.16 29.30 1bor h TRP 47 CO 0.07 0.30 -0.37 -1.00 -1.03 0.00 0.00 178.44 176.41 1bor h PRO 48 N 0.69 0.00 -4.95 2.65 0.13 -1.95 -3.11 132.00 125.45 1bor h PRO 48 Ca 0.34 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.82 1bor h PRO 48 Cb 0.29 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 31.25 1bor h PRO 48 CO -0.23 0.37 -0.35 -1.17 -0.23 0.00 0.00 178.00 176.39 1bor s LEU 49 N -6.82 4.27 0.24 1.56 0.20 -0.76 -4.90 118.68 112.46 1bor s LEU 49 Ca 0.01 -0.09 0.09 0.00 0.69 0.00 0.00 54.13 54.83 1bor s LEU 49 Cb 0.10 -2.28 -0.05 0.00 -0.43 0.00 0.00 46.19 43.52 1bor s LEU 49 CO 0.69 -0.23 -0.16 -0.83 -0.29 0.00 0.00 176.35 175.53 1bor s GLY 50 N 1.72 1.61 0.00 7.98 0.00 -1.26 -3.02 107.32 114.34 1bor s GLY 50 Ca 0.11 -1.75 0.00 0.00 0.00 0.00 0.00 44.72 43.08 1bor s GLY 50 CO 0.11 -1.84 0.00 0.00 0.00 0.00 0.00 173.10 171.37 1bor n ALA 51 N -0.48 0.00 -3.47 3.20 0.00 -1.26 -4.69 120.51 113.81 1bor n ALA 51 Ca -0.07 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.95 1bor n ALA 51 Cb 0.60 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.01 1bor n ALA 51 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1bor s ASP 52 N -0.98 6.45 0.43 0.00 1.47 -1.26 -4.92 116.67 117.86 1bor s ASP 52 Ca 0.00 -3.18 0.04 0.00 1.18 0.00 0.00 52.55 50.59 1bor s ASP 52 Cb 0.00 -2.08 -0.01 0.00 -0.34 0.00 0.00 42.92 40.49 1bor s ASP 52 CO 0.00 -0.38 0.14 0.35 0.68 0.00 0.00 175.17 175.97 1bor n THR 53 N 3.20 0.00 -0.02 2.11 -2.24 -1.26 -4.44 114.28 111.63 1bor n THR 53 Ca 0.17 -2.47 -0.18 0.00 -2.27 0.00 0.00 64.05 59.30 1bor n THR 53 Cb 0.41 0.87 -0.14 0.00 -2.10 0.00 0.00 70.33 69.37 1bor n THR 53 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1bor h PRO 54 N 0.00 0.14 0.00 -0.78 0.13 -1.91 -3.50 132.00 126.07 1bor h PRO 54 Ca -0.34 -0.24 0.10 0.00 -0.87 0.00 0.00 66.00 64.66 1bor h PRO 54 Cb 1.27 0.09 -0.02 0.00 0.13 0.00 0.00 31.00 32.46 1bor h PRO 54 CO 0.53 1.11 -0.13 0.00 -0.23 0.00 0.00 178.00 179.29 1bor n ALA 55 N -2.76 -0.93 -1.36 -0.56 0.00 -1.26 -5.06 120.51 108.58 1bor n ALA 55 Ca -0.15 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1bor n ALA 55 Cb 0.68 -0.32 0.00 0.00 0.00 0.00 0.00 19.45 19.81 1bor n ALA 55 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97