#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 0.43 -0.26 3.52 4.81 -1.98 -2.07 114.58 119.04 2k2y h GLU 2 Ca 0.00 -0.12 -0.00 0.00 -0.13 0.00 0.00 59.36 59.10 2k2y h GLU 2 Cb 0.00 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 2k2y h GLU 2 CO 0.00 0.57 0.15 0.00 -0.73 0.00 0.00 179.01 179.00 2k2y h VAL 4 N 0.35 1.44 0.00 0.00 2.07 -1.81 -3.03 116.25 115.26 2k2y h VAL 4 Ca 0.09 -1.73 -0.05 0.00 0.82 0.00 0.00 66.70 65.83 2k2y h VAL 4 Cb -0.01 2.37 -0.01 0.00 -1.52 0.00 0.00 31.29 32.13 2k2y h VAL 4 CO -0.02 0.49 -0.25 -1.28 0.02 0.00 0.00 177.57 176.54 2k2y h SER 5 N -0.20 0.00 0.35 0.57 0.87 -0.72 -1.17 113.55 113.24 2k2y h SER 5 Ca -0.02 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.54 2k2y h SER 5 Cb 0.96 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.92 2k2y h SER 5 CO 0.06 0.25 0.00 0.29 -0.53 0.00 0.00 176.83 176.90 2k2y n LYS 6 N -4.16 0.23 -0.93 2.24 4.76 -0.17 -4.91 118.16 115.22 2k2y n LYS 6 Ca -0.02 0.13 0.00 0.00 -2.87 0.00 0.00 58.31 55.55 2k2y n LYS 6 Cb 0.31 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.00 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 0.20 0.69 3.79 0.72 0.00 -0.44 -5.05 105.19 105.10 2k2y n GLY 7 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.68 2.64 -0.17 1.61 2.99 -1.15 -4.93 117.98 116.29 2k2y s PHE 8 Ca 0.00 0.99 -0.15 0.00 0.00 0.00 0.00 56.93 57.76 2k2y s PHE 8 Cb 0.00 -3.27 -0.04 0.00 0.00 0.00 0.00 43.02 39.71 2k2y s PHE 8 CO 0.00 -2.12 0.37 0.20 -0.00 0.00 0.00 175.22 173.67 2k2y s GLY 9 N -3.96 2.20 -1.35 4.36 0.00 -1.05 -4.66 107.32 102.86 2k2y s GLY 9 Ca 0.62 -0.43 -0.15 0.00 0.00 0.00 0.00 44.72 44.77 2k2y s GLY 9 CO 0.54 0.64 1.90 0.00 0.00 0.00 0.00 173.10 176.18 2k2y s LEU 11 N 2.58 2.39 0.85 0.00 2.01 -1.26 -5.02 118.68 120.24 2k2y s LEU 11 Ca 0.48 1.80 -0.12 0.00 0.01 0.00 0.00 54.13 56.30 2k2y s LEU 11 Cb 0.08 -4.18 0.10 0.00 0.01 0.00 0.00 46.19 42.20 2k2y s LEU 11 CO -0.00 -2.91 1.12 -2.16 1.01 0.00 0.00 176.35 173.41 2k2y s PRO 12 N -4.76 1.64 0.00 1.29 0.04 -1.26 -4.58 135.00 127.37 2k2y s PRO 12 Ca 0.65 0.41 0.10 0.00 0.04 0.00 0.00 61.00 62.19 2k2y s PRO 12 Cb -0.20 -1.89 0.57 0.00 0.04 0.00 0.00 34.50 33.02 2k2y s PRO 12 CO 0.58 -1.88 1.15 1.04 0.04 0.00 0.00 177.00 177.93 2k2y n GLN 13 N -3.57 0.72 -0.08 4.56 3.00 -1.26 -2.95 117.38 117.80 2k2y n GLN 13 Ca 0.07 0.00 0.01 0.00 -0.01 0.00 0.00 57.00 57.07 2k2y n GLN 13 Cb 0.58 -1.21 0.02 0.00 0.00 0.00 0.00 30.24 29.64 2k2y n GLN 13 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2k2y n SER 14 N -0.71 1.10 0.00 1.08 2.88 -1.26 -4.87 113.62 111.84 2k2y n SER 14 Ca 0.07 -1.82 0.00 0.00 -1.33 0.00 0.00 58.87 55.79 2k2y n SER 14 Cb 0.03 -0.09 0.00 0.00 -0.75 0.00 0.00 64.21 63.40 2k2y n SER 14 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2k2y n ASP 15 N -0.40 0.57 -4.50 -3.46 2.03 -1.15 -5.07 116.55 104.56 2k2y n ASP 15 Ca 0.02 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.90 2k2y n ASP 15 Cb 0.45 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.78 2k2y n ASP 15 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k2y s PRO 17 N 7.57 4.12 0.57 0.00 0.04 -1.26 -4.95 135.00 141.09 2k2y s PRO 17 Ca 1.11 1.61 0.25 0.00 0.04 0.00 0.00 61.00 64.01 2k2y s PRO 17 Cb -0.68 -2.58 1.64 0.00 0.04 0.00 0.00 34.50 32.92 2k2y s PRO 17 CO 0.40 -0.20 2.22 -0.56 0.04 0.00 0.00 177.00 178.90 2k2y h GLN 18 N 2.54 0.00 0.00 4.56 3.07 -1.97 -1.85 115.11 121.46 2k2y h GLN 18 Ca -0.48 0.00 -0.05 0.00 0.09 0.00 0.00 58.65 58.20 2k2y h GLN 18 Cb 1.22 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.77 2k2y h GLN 18 CO 0.62 0.00 -0.25 0.93 0.09 0.00 0.00 178.83 180.22 2k2y h GLU 19 N 0.00 0.00 -0.01 0.06 5.08 -2.02 -3.10 114.58 114.60 2k2y h GLU 19 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2k2y h GLU 19 Cb 0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 2k2y h GLU 19 CO -0.00 0.25 -0.76 0.00 -1.00 0.00 0.00 179.01 177.50 2k2y n ALA 20 N -2.49 4.20 -1.72 3.43 0.00 -0.71 -4.96 120.51 118.27 2k2y n ALA 20 Ca -0.02 -0.61 -0.42 0.00 0.00 0.00 0.00 53.44 52.38 2k2y n ALA 20 Cb 0.30 -0.77 -0.03 0.00 0.00 0.00 0.00 19.45 18.96 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 -2.74 4.15 0.99 0.00 0.52 -1.13 -1.21 118.95 119.53 2k2y s ARG 21 Ca 0.12 2.55 -0.14 0.00 -0.52 0.00 0.00 55.73 57.74 2k2y s ARG 21 Cb 0.17 -4.13 0.19 0.00 0.52 0.00 0.00 34.95 31.69 2k2y s ARG 21 CO 0.73 -0.94 1.16 -0.51 0.02 0.00 0.00 175.30 175.75 2k2y s LEU 22 N 4.37 1.79 0.03 2.53 1.43 -1.17 -4.95 118.68 122.70 2k2y s LEU 22 Ca 0.86 0.80 0.15 0.00 -1.03 0.00 0.00 54.13 54.92 2k2y s LEU 22 Cb -0.41 -2.94 0.65 0.00 0.03 0.00 0.00 46.19 43.52 2k2y s LEU 22 CO 0.40 -2.99 1.49 -0.24 0.23 0.00 0.00 176.35 175.23 2k2y n SER 23 N -4.03 0.07 -3.96 2.29 2.88 -1.26 -4.81 113.62 104.80 2k2y n SER 23 Ca 0.09 0.52 -0.15 0.00 -1.33 0.00 0.00 58.87 58.00 2k2y n SER 23 Cb 0.59 -0.53 -0.09 0.00 -0.75 0.00 0.00 64.21 63.42 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 -3.03 1.38 -0.49 0.66 -0.85 -1.26 -5.14 117.35 108.62 2k2y s TYR 24 Ca 0.07 -1.45 0.06 0.00 -0.52 0.00 0.00 57.07 55.23 2k2y s TYR 24 Cb 0.09 -0.65 0.21 0.00 0.38 0.00 0.00 41.96 42.00 2k2y s TYR 24 CO 0.27 -0.68 0.73 0.41 -1.52 0.00 0.00 175.55 174.76 2k2y n GLY 25 N -0.40 0.13 0.10 5.49 0.00 -1.26 -4.72 105.19 104.52 2k2y n GLY 25 Ca 0.03 0.04 0.10 0.00 0.00 0.00 0.00 46.02 46.20 2k2y n GLY 25 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k2y n GLY 26 N 2.40 -1.16 3.49 -0.02 0.00 -1.26 -4.72 105.19 103.93 2k2y n GLY 26 Ca 0.16 0.06 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 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 -5.05 0.64 0.12 0.00 3.41 -1.26 -4.74 113.62 106.74 2k2y n SER 28 Ca 0.12 -0.30 0.00 0.00 -0.26 0.00 0.00 58.87 58.43 2k2y n SER 28 Cb 0.59 0.67 0.00 0.00 -0.26 0.00 0.00 64.21 65.21 2k2y n SER 28 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2k2y n THR 29 N -1.81 0.28 -3.80 6.66 -2.24 -1.26 -5.15 114.28 106.96 2k2y n THR 29 Ca 0.03 0.09 -0.11 0.00 -2.27 0.00 0.00 64.05 61.79 2k2y n THR 29 Cb 0.40 -0.75 -0.08 0.00 -2.10 0.00 0.00 70.33 67.80 2k2y n THR 29 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2k2y s VAL 30 N -2.00 0.09 -0.21 2.28 -7.23 -1.26 -5.09 120.40 106.98 2k2y s VAL 30 Ca 0.00 -0.73 -0.03 0.00 -1.81 0.00 0.00 61.98 59.42 2k2y s VAL 30 Cb 0.00 -0.83 0.06 0.00 0.56 0.00 0.00 36.38 36.17 2k2y s VAL 30 CO 0.00 -0.40 0.04 0.00 -0.31 0.00 0.00 175.10 174.43 2k2y s ASP 33 N -0.61 2.57 0.00 0.00 1.47 -0.35 -2.52 116.67 117.23 2k2y s ASP 33 Ca 0.12 1.52 0.00 0.00 1.18 0.00 0.00 52.55 55.36 2k2y s ASP 33 Cb -0.12 -2.19 0.00 0.00 -0.34 0.00 0.00 42.92 40.27 2k2y s ASP 33 CO 0.02 -3.21 0.83 0.18 0.68 0.00 0.00 175.17 173.67 2k2y n LEU 34 N -4.26 1.58 0.26 2.11 4.77 -1.26 -4.77 117.00 115.43 2k2y n LEU 34 Ca 0.06 -1.58 0.10 0.00 -0.03 0.00 0.00 56.01 54.56 2k2y n LEU 34 Cb 0.55 0.00 0.69 0.00 -2.33 0.00 0.00 43.42 42.33 2k2y n LEU 34 CO 0.56 0.39 1.05 -1.28 -1.33 0.00 0.00 177.39 176.78 2k2y h SER 35 N 0.00 0.00 0.52 -1.43 0.87 -1.98 -2.59 113.55 108.95 2k2y h SER 35 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2k2y h SER 35 Cb 0.44 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.40 2k2y h SER 35 CO 0.00 0.04 0.00 2.29 -0.53 0.00 0.00 176.83 178.63 2k2y n LYS 36 N -4.28 0.19 0.30 2.24 2.85 -1.26 -1.61 118.16 116.59 2k2y n LYS 36 Ca -0.03 0.50 -0.13 0.00 -1.05 0.00 0.00 58.31 57.60 2k2y n LYS 36 Cb 0.12 -1.92 -0.06 0.00 -0.65 0.00 0.00 35.03 32.53 2k2y n LYS 36 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 177.40 177.28 2k2y h LEU 37 N 0.00 -0.69 -0.04 -5.58 3.38 -1.87 -3.21 115.31 107.31 2k2y h LEU 37 Ca 0.00 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2k2y h LEU 37 Cb 0.26 0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.19 2k2y h LEU 37 CO 0.00 -0.32 0.00 0.35 0.09 0.00 0.00 178.44 178.56 2k2y n THR 38 N -5.15 0.53 0.31 0.22 -2.24 -1.20 -5.24 114.28 101.51 2k2y n THR 38 Ca -0.10 0.11 0.04 0.00 -2.27 0.00 0.00 64.05 61.83 2k2y n THR 38 Cb 0.32 -0.77 0.03 0.00 -2.10 0.00 0.00 70.33 67.81 2k2y n THR 38 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11