#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k2y h GLU 2 N 0.00 0.42 -0.34 3.52 4.81 -1.93 -1.42 114.58 119.64 2k2y h GLU 2 Ca 0.00 -0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.25 2k2y h GLU 2 Cb 0.00 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.24 2k2y h GLU 2 CO 0.00 0.28 0.09 0.00 -0.73 0.00 0.00 179.01 178.65 2k2y h VAL 4 N 0.22 1.28 -0.14 0.00 2.07 -1.70 -2.27 116.25 115.70 2k2y h VAL 4 Ca 0.16 -1.72 -0.09 0.00 0.82 0.00 0.00 66.70 65.87 2k2y h VAL 4 Cb 0.17 1.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.54 2k2y h VAL 4 CO -0.19 0.56 -0.33 -1.28 0.02 0.00 0.00 177.57 176.35 2k2y h SER 5 N 0.65 0.28 0.67 0.57 0.87 -0.95 -1.53 113.55 114.12 2k2y h SER 5 Ca 0.02 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.48 2k2y h SER 5 Cb 1.12 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 63.01 2k2y h SER 5 CO 0.12 0.60 0.00 0.29 -0.53 0.00 0.00 176.83 177.31 2k2y n LYS 6 N -4.09 0.13 -0.18 2.24 4.76 -0.41 -4.91 118.16 115.69 2k2y n LYS 6 Ca -0.01 0.35 0.00 0.00 -2.87 0.00 0.00 58.31 55.78 2k2y n LYS 6 Cb 0.42 -1.74 0.00 0.00 -1.84 0.00 0.00 35.03 31.87 2k2y n LYS 6 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2k2y n GLY 7 N 0.05 0.60 3.88 0.72 0.00 -0.58 -5.09 105.19 104.78 2k2y n GLY 7 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 2k2y n GLY 7 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2k2y s PHE 8 N -2.34 2.59 0.73 1.61 0.08 -0.86 -4.90 117.98 114.88 2k2y s PHE 8 Ca 0.00 0.68 -0.02 0.00 0.12 0.00 0.00 56.93 57.71 2k2y s PHE 8 Cb 0.00 -3.60 0.12 0.00 -0.57 0.00 0.00 43.02 38.97 2k2y s PHE 8 CO 0.00 -2.07 1.01 0.20 -0.10 0.00 0.00 175.22 174.25 2k2y s GLY 9 N -4.54 1.76 -0.36 4.36 0.00 -1.11 -4.15 107.32 103.29 2k2y s GLY 9 Ca 0.65 -1.60 0.14 0.00 0.00 0.00 0.00 44.72 43.90 2k2y s GLY 9 CO 0.51 -1.05 0.83 0.00 0.00 0.00 0.00 173.10 173.39 2k2y n LEU 11 N 0.15 2.72 -4.65 0.00 4.77 -1.26 -5.01 117.00 113.72 2k2y n LEU 11 Ca 0.18 0.49 -0.29 0.00 -0.03 0.00 0.00 56.01 56.37 2k2y n LEU 11 Cb 0.72 -1.40 0.18 0.00 -2.33 0.00 0.00 43.42 40.59 2k2y n LEU 11 CO 0.22 -2.40 0.62 -2.16 -1.33 0.00 0.00 177.39 172.34 2k2y s PRO 12 N -3.97 0.41 0.61 3.23 0.04 -1.26 -4.71 135.00 129.35 2k2y s PRO 12 Ca 0.67 0.74 0.37 0.00 0.04 0.00 0.00 61.00 62.82 2k2y s PRO 12 Cb -0.27 -1.72 1.97 0.00 0.04 0.00 0.00 34.50 34.53 2k2y s PRO 12 CO 0.57 -2.80 2.24 1.96 0.04 0.00 0.00 177.00 179.01 2k2y h GLN 13 N -1.95 0.00 0.00 4.56 4.20 -1.95 -1.36 115.11 118.61 2k2y h GLN 13 Ca -0.54 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.17 2k2y h GLN 13 Cb 1.31 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.09 2k2y h GLN 13 CO 0.54 0.02 -0.28 -1.13 -0.67 0.00 0.00 178.83 177.32 2k2y n SER 14 N -3.36 0.50 -0.09 1.46 3.41 -1.26 -3.91 113.62 110.37 2k2y n SER 14 Ca -0.02 0.26 0.02 0.00 -0.26 0.00 0.00 58.87 58.86 2k2y n SER 14 Cb 0.14 -0.24 0.00 0.00 -0.26 0.00 0.00 64.21 63.85 2k2y n SER 14 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2k2y n ASP 15 N -1.86 0.83 -3.98 4.04 8.00 -0.64 -4.86 116.55 118.07 2k2y n ASP 15 Ca 0.05 -0.92 -0.31 0.00 0.71 0.00 0.00 54.79 54.33 2k2y n ASP 15 Cb 0.39 0.44 -0.10 0.00 -0.02 0.00 0.00 41.12 41.83 2k2y n ASP 15 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2k2y s PRO 17 N -1.36 0.53 0.54 0.00 0.04 -1.26 -4.83 135.00 128.66 2k2y s PRO 17 Ca 0.25 0.34 0.21 0.00 0.04 0.00 0.00 61.00 61.85 2k2y s PRO 17 Cb -0.06 -1.76 1.42 0.00 0.04 0.00 0.00 34.50 34.14 2k2y s PRO 17 CO -0.14 -2.62 2.13 1.96 0.04 0.00 0.00 177.00 178.36 2k2y h GLN 18 N -1.81 0.00 -0.16 4.56 7.50 -1.99 -2.51 115.11 120.70 2k2y h GLN 18 Ca -0.52 0.00 -0.21 0.00 0.50 0.00 0.00 58.65 58.41 2k2y h GLN 18 Cb 1.33 0.00 0.01 0.00 0.05 0.00 0.00 27.48 28.87 2k2y h GLN 18 CO 0.57 0.00 -0.72 0.93 -1.50 0.00 0.00 178.83 178.11 2k2y h GLU 19 N 0.00 0.78 -0.00 1.46 5.08 -2.02 -3.31 114.58 116.56 2k2y h GLU 19 Ca 0.06 -0.62 0.00 0.00 -1.00 0.00 0.00 59.36 57.80 2k2y h GLU 19 Cb 0.27 0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.64 2k2y h GLU 19 CO -0.00 1.23 -0.03 0.00 -1.00 0.00 0.00 179.01 179.21 2k2y n ALA 20 N -2.60 2.56 -1.78 3.43 0.00 -0.95 -4.90 120.51 116.28 2k2y n ALA 20 Ca -0.07 -0.17 -0.41 0.00 0.00 0.00 0.00 53.44 52.79 2k2y n ALA 20 Cb 0.72 -1.45 -0.01 0.00 0.00 0.00 0.00 19.45 18.71 2k2y n ALA 20 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2k2y s ARG 21 N -2.57 4.15 0.96 0.00 0.52 -1.20 -3.23 118.95 117.59 2k2y s ARG 21 Ca 0.28 2.49 -0.14 0.00 -0.52 0.00 0.00 55.73 57.83 2k2y s ARG 21 Cb 0.20 -2.98 0.17 0.00 0.52 0.00 0.00 34.95 32.86 2k2y s ARG 21 CO 0.47 -0.46 1.18 -0.51 0.02 0.00 0.00 175.30 176.00 2k2y s LEU 22 N -2.05 2.02 0.15 2.53 1.43 -1.16 -4.91 118.68 116.70 2k2y s LEU 22 Ca 0.52 0.73 0.17 0.00 -1.03 0.00 0.00 54.13 54.53 2k2y s LEU 22 Cb -0.45 -2.92 0.77 0.00 0.03 0.00 0.00 46.19 43.62 2k2y s LEU 22 CO 0.61 -2.77 1.53 -0.24 0.23 0.00 0.00 176.35 175.71 2k2y n SER 23 N -3.87 0.36 -4.13 2.29 2.88 -1.26 -4.79 113.62 105.10 2k2y n SER 23 Ca 0.10 0.61 -0.10 0.00 -1.33 0.00 0.00 58.87 58.15 2k2y n SER 23 Cb 0.60 -0.68 -0.10 0.00 -0.75 0.00 0.00 64.21 63.28 2k2y n SER 23 CO 0.00 0.00 0.00 -0.72 -1.23 0.00 0.00 175.04 173.09 2k2y s TYR 24 N -3.22 0.82 -0.52 0.66 -0.85 -1.26 -5.14 117.35 107.84 2k2y s TYR 24 Ca 0.03 -1.18 0.03 0.00 -0.52 0.00 0.00 57.07 55.44 2k2y s TYR 24 Cb 0.08 -0.43 0.14 0.00 0.38 0.00 0.00 41.96 42.13 2k2y s TYR 24 CO 0.27 -0.56 0.31 0.20 -1.52 0.00 0.00 175.55 174.25 2k2y s GLY 25 N -3.04 2.14 0.00 5.49 0.00 -1.26 -4.82 107.32 105.83 2k2y s GLY 25 Ca 0.24 -3.06 0.24 0.00 0.00 0.00 0.00 44.72 42.14 2k2y s GLY 25 CO 0.02 1.34 1.39 0.61 0.00 0.00 0.00 173.10 176.46 2k2y n GLY 26 N 2.99 0.93 4.01 0.20 0.00 -1.26 -4.92 105.19 107.14 2k2y n GLY 26 Ca 0.12 -0.64 -0.20 0.00 0.00 0.00 0.00 46.02 45.30 2k2y n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k2y n SER 28 N -2.25 0.79 0.12 0.00 7.64 -1.26 -4.59 113.62 114.08 2k2y n SER 28 Ca 0.12 -0.74 0.00 0.00 1.01 0.00 0.00 58.87 59.26 2k2y n SER 28 Cb 0.60 0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.86 2k2y n SER 28 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 2k2y n THR 29 N -0.80 0.13 -3.72 0.44 5.66 -1.26 -5.15 114.28 109.59 2k2y n THR 29 Ca 0.13 0.04 -0.12 0.00 -3.05 0.00 0.00 64.05 61.05 2k2y n THR 29 Cb 0.32 -0.57 -0.11 0.00 -1.55 0.00 0.00 70.33 68.43 2k2y n THR 29 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 2k2y s VAL 30 N -1.87 -0.01 -0.21 1.08 -7.23 -1.26 -5.10 120.40 105.79 2k2y s VAL 30 Ca 0.00 0.04 0.02 0.00 -1.81 0.00 0.00 61.98 60.23 2k2y s VAL 30 Cb 0.00 -0.56 0.04 0.00 0.56 0.00 0.00 36.38 36.42 2k2y s VAL 30 CO 0.00 0.02 -0.15 0.00 -0.31 0.00 0.00 175.10 174.66 2k2y s ASP 33 N -1.40 4.99 0.00 0.00 -4.77 -1.20 -2.73 116.67 111.57 2k2y s ASP 33 Ca 0.06 1.18 0.00 0.00 -3.30 0.00 0.00 52.55 50.49 2k2y s ASP 33 Cb -0.09 -1.93 0.00 0.00 -1.09 0.00 0.00 42.92 39.81 2k2y s ASP 33 CO 0.02 -1.64 0.79 0.18 0.70 0.00 0.00 175.17 175.23 2k2y n LEU 34 N -3.20 1.57 0.00 2.11 4.77 -1.26 -4.72 117.00 116.26 2k2y n LEU 34 Ca 0.07 -1.57 0.08 0.00 -0.03 0.00 0.00 56.01 54.56 2k2y n LEU 34 Cb 0.57 0.00 0.35 0.00 -2.33 0.00 0.00 43.42 42.01 2k2y n LEU 34 CO 0.57 0.39 0.75 -0.24 -1.33 0.00 0.00 177.39 177.54 2k2y n SER 35 N -0.30 0.00 0.20 -1.43 2.88 -1.26 -2.04 113.62 111.67 2k2y n SER 35 Ca 0.00 0.48 0.05 0.00 -1.33 0.00 0.00 58.87 58.07 2k2y n SER 35 Cb 0.16 -0.49 0.40 0.00 -0.75 0.00 0.00 64.21 63.53 2k2y n SER 35 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2k2y h LYS 36 N 0.00 0.00 -0.31 -1.46 1.57 -1.92 -1.81 116.57 112.63 2k2y h LYS 36 Ca 0.00 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 2k2y h LYS 36 Cb 0.27 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 2k2y h LYS 36 CO 0.00 0.34 0.03 -0.07 -0.57 0.00 0.00 179.45 179.18 2k2y h LEU 37 N 0.00 0.52 -0.07 2.94 3.38 -1.80 -2.70 115.31 117.58 2k2y h LEU 37 Ca -0.00 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.68 2k2y h LEU 37 Cb 0.72 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.33 2k2y h LEU 37 CO 0.04 0.67 0.00 0.35 0.09 0.00 0.00 178.44 179.60 2k2y n THR 38 N -4.59 0.44 -0.46 0.22 -2.24 -1.21 -5.22 114.28 101.23 2k2y n THR 38 Ca -0.02 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 2k2y n THR 38 Cb 0.24 -0.65 0.00 0.00 -2.10 0.00 0.00 70.33 67.82 2k2y n THR 38 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11