#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 1.12 -0.35 1.20 4.81 -1.86 -1.51 114.58 118.00 2k2y h GLU 2 Ca 0.00 -0.07 -0.16 0.00 -0.13 0.00 0.00 59.36 59.00 2k2y h GLU 2 Cb 0.00 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.12 2k2y h GLU 2 CO 0.00 0.74 -0.40 0.00 -0.73 0.00 0.00 179.01 178.62 2k2y h VAL 4 N 0.70 1.30 -0.03 0.00 2.07 -1.71 -1.07 116.25 117.51 2k2y h VAL 4 Ca 0.05 -1.67 -0.06 0.00 0.82 0.00 0.00 66.70 65.84 2k2y h VAL 4 Cb 0.99 1.62 -0.01 0.00 -1.52 0.00 0.00 31.29 32.37 2k2y h VAL 4 CO 0.09 0.53 -0.26 -1.28 0.02 0.00 0.00 177.57 176.68 2k2y h SER 5 N 0.51 0.05 1.18 0.57 0.87 -1.21 -1.81 113.55 113.71 2k2y h SER 5 Ca 0.03 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 2k2y h SER 5 Cb 1.01 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.95 2k2y h SER 5 CO 0.09 0.32 -0.02 0.29 -0.53 0.00 0.00 176.83 176.98 2k2y n LYS 6 N -4.21 0.11 -0.30 2.24 4.76 -0.81 -4.96 118.16 114.99 2k2y n LYS 6 Ca -0.02 0.09 0.00 0.00 -2.87 0.00 0.00 58.31 55.51 2k2y n LYS 6 Cb 0.32 -1.63 0.00 0.00 -1.84 0.00 0.00 35.03 31.89 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 1.42 0.84 3.94 0.72 0.00 -0.68 -5.07 105.19 106.36 2k2y n GLY 7 Ca 0.06 -0.09 -0.24 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.00 3.05 0.48 1.61 2.99 -0.45 -4.22 117.98 119.44 2k2y s PHE 8 Ca 0.00 0.34 -0.03 0.00 0.00 0.00 0.00 56.93 57.24 2k2y s PHE 8 Cb 0.00 -2.79 0.10 0.00 0.00 0.00 0.00 43.02 40.33 2k2y s PHE 8 CO 0.00 -0.92 0.66 0.41 -0.00 0.00 0.00 175.22 175.38 2k2y n GLY 9 N -2.52 0.08 2.23 4.36 0.00 -0.78 -4.31 105.19 104.25 2k2y n GLY 9 Ca 0.06 -1.91 -0.22 0.00 0.00 0.00 0.00 46.02 43.95 2k2y n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k2y s LEU 11 N -1.84 3.21 0.87 0.00 1.02 -1.26 -4.98 118.68 115.69 2k2y s LEU 11 Ca 0.38 2.18 -0.11 0.00 0.02 0.00 0.00 54.13 56.60 2k2y s LEU 11 Cb 0.25 -4.57 0.11 0.00 0.02 0.00 0.00 46.19 42.00 2k2y s LEU 11 CO -0.09 -2.26 1.09 -2.16 0.02 0.00 0.00 176.35 172.95 2k2y s PRO 12 N -4.21 1.50 0.56 1.29 0.04 -1.26 -4.71 135.00 128.21 2k2y s PRO 12 Ca 0.70 0.84 0.32 0.00 0.04 0.00 0.00 61.00 62.90 2k2y s PRO 12 Cb -0.25 -1.83 1.64 0.00 0.04 0.00 0.00 34.50 34.10 2k2y s PRO 12 CO 0.48 -2.08 2.12 1.96 0.04 0.00 0.00 177.00 179.52 2k2y h GLN 13 N -1.43 0.00 -0.00 4.56 4.20 -1.94 -1.77 115.11 118.73 2k2y h GLN 13 Ca -0.48 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.23 2k2y h GLN 13 Cb 1.27 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.05 2k2y h GLN 13 CO 0.55 0.07 -0.05 0.43 -0.67 0.00 0.00 178.83 179.15 2k2y n SER 14 N -3.42 0.31 0.00 1.46 7.64 -1.26 -3.88 113.62 114.48 2k2y n SER 14 Ca -0.02 -0.60 0.00 0.00 1.01 0.00 0.00 58.87 59.26 2k2y n SER 14 Cb 0.22 -0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.31 2k2y n SER 14 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2k2y n ASP 15 N -0.98 0.57 -3.68 6.43 2.03 -0.73 -4.95 116.55 115.22 2k2y n ASP 15 Ca 0.17 -1.05 -0.28 0.00 0.52 0.00 0.00 54.79 54.15 2k2y n ASP 15 Cb 0.24 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.53 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 -0.72 0.02 0.00 0.00 0.04 -1.26 -4.83 135.00 128.26 2k2y s PRO 17 Ca 0.27 -0.05 0.11 0.00 0.04 0.00 0.00 61.00 61.38 2k2y s PRO 17 Cb -0.03 -1.74 0.54 0.00 0.04 0.00 0.00 34.50 33.31 2k2y s PRO 17 CO -0.17 -2.89 1.28 1.04 0.04 0.00 0.00 177.00 176.31 2k2y n GLN 18 N -4.18 0.11 0.08 4.56 6.02 -1.26 -2.09 117.38 120.63 2k2y n GLN 18 Ca 0.12 0.22 0.02 0.00 -0.01 0.00 0.00 57.00 57.34 2k2y n GLN 18 Cb 0.59 -1.50 -0.04 0.00 1.02 0.00 0.00 30.24 30.32 2k2y n GLN 18 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 2k2y h GLU 19 N 0.00 0.00 -0.00 -1.09 5.08 -2.02 -3.38 114.58 113.16 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 0.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.38 2k2y h GLU 19 CO 0.00 0.35 -0.34 0.00 -1.00 0.00 0.00 179.01 178.02 2k2y n ALA 20 N -2.31 3.05 -0.79 3.43 0.00 -0.97 -5.04 120.51 117.87 2k2y n ALA 20 Ca -0.04 -0.33 -0.29 0.00 0.00 0.00 0.00 53.44 52.77 2k2y n ALA 20 Cb 0.78 -0.34 0.19 0.00 0.00 0.00 0.00 19.45 20.08 2k2y n ALA 20 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2k2y s ARG 21 N -1.65 0.29 0.21 0.00 1.70 -0.89 -3.84 118.95 114.76 2k2y s ARG 21 Ca 0.05 1.04 0.02 0.00 -0.47 0.00 0.00 55.73 56.37 2k2y s ARG 21 Cb 0.07 -1.68 -0.05 0.00 -0.57 0.00 0.00 34.95 32.73 2k2y s ARG 21 CO 0.32 -2.97 0.03 -0.51 -1.08 0.00 0.00 175.30 171.09 2k2y s LEU 22 N -6.74 1.99 0.00 -1.89 1.43 -1.22 -4.94 118.68 107.31 2k2y s LEU 22 Ca 0.66 -1.24 0.28 0.00 -1.03 0.00 0.00 54.13 52.80 2k2y s LEU 22 Cb -0.22 -0.08 1.07 0.00 0.03 0.00 0.00 46.19 46.99 2k2y s LEU 22 CO 0.60 -0.60 1.80 -0.24 0.23 0.00 0.00 176.35 178.14 2k2y n SER 23 N -0.34 0.14 -0.58 2.29 2.88 -1.26 -3.98 113.62 112.77 2k2y n SER 23 Ca -0.04 0.25 0.06 0.00 -1.33 0.00 0.00 58.87 57.81 2k2y n SER 23 Cb 0.64 -0.29 0.09 0.00 -0.75 0.00 0.00 64.21 63.90 2k2y n SER 23 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 2k2y n TYR 24 N -1.47 0.15 -1.13 0.66 4.01 -1.26 -5.02 117.16 113.10 2k2y n TYR 24 Ca 0.07 -0.14 -0.13 0.00 -0.16 0.00 0.00 57.90 57.54 2k2y n TYR 24 Cb 0.33 -0.01 -0.14 0.00 -0.31 0.00 0.00 39.34 39.22 2k2y n TYR 24 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2k2y n GLY 25 N 0.71 -0.30 0.77 2.72 0.00 -1.26 -3.70 105.19 104.14 2k2y n GLY 25 Ca 0.09 -0.01 0.13 0.00 0.00 0.00 0.00 46.02 46.23 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 4.32 0.64 3.55 -0.02 0.00 -1.26 -4.93 105.19 107.48 2k2y n GLY 26 Ca 0.41 -0.59 -0.29 0.00 0.00 0.00 0.00 46.02 45.55 2k2y n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k2y h SER 28 N -2.52 0.00 0.00 0.00 0.02 -2.00 -3.42 113.55 105.62 2k2y h SER 28 Ca -0.52 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.30 2k2y h SER 28 Cb 1.33 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.87 2k2y h SER 28 CO 0.45 0.06 0.00 0.35 -1.14 0.00 0.00 176.83 176.56 2k2y n THR 29 N -2.31 0.42 -3.69 -2.27 -2.24 -1.26 -5.16 114.28 97.77 2k2y n THR 29 Ca 0.03 0.14 -0.13 0.00 -2.27 0.00 0.00 64.05 61.82 2k2y n THR 29 Cb 0.46 -0.85 -0.07 0.00 -2.10 0.00 0.00 70.33 67.77 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 -1.86 0.06 -0.02 2.28 -7.23 -1.26 -5.11 120.40 107.25 2k2y s VAL 30 Ca 0.00 -0.46 0.03 0.00 -1.81 0.00 0.00 61.98 59.74 2k2y s VAL 30 Cb 0.00 -0.86 -0.00 0.00 0.56 0.00 0.00 36.38 36.08 2k2y s VAL 30 CO 0.00 -0.25 -0.10 0.00 -0.31 0.00 0.00 175.10 174.44 2k2y s ASP 33 N -2.47 7.07 0.00 0.00 -1.08 -1.25 -1.87 116.67 117.07 2k2y s ASP 33 Ca 0.02 1.83 0.02 0.00 -0.52 0.00 0.00 52.55 53.90 2k2y s ASP 33 Cb 0.00 -2.56 0.06 0.00 -1.46 0.00 0.00 42.92 38.97 2k2y s ASP 33 CO -0.04 -0.55 1.01 0.18 0.52 0.00 0.00 175.17 176.28 2k2y n LEU 34 N 4.99 2.10 0.29 -1.34 4.77 -1.26 -4.65 117.00 121.89 2k2y n LEU 34 Ca 0.10 -1.89 0.19 0.00 -0.03 0.00 0.00 56.01 54.39 2k2y n LEU 34 Cb 0.46 -0.05 0.94 0.00 -2.33 0.00 0.00 43.42 42.45 2k2y n LEU 34 CO 0.55 0.52 1.07 -1.28 -1.33 0.00 0.00 177.39 176.92 2k2y h SER 35 N 0.47 0.00 0.39 -1.43 0.87 -1.92 -2.61 113.55 109.32 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 0.50 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.46 2k2y h SER 35 CO 0.00 0.00 0.00 2.29 -0.53 0.00 0.00 176.83 178.59 2k2y n LYS 36 N -2.96 0.17 -0.08 2.24 2.85 -1.26 -2.87 118.16 116.25 2k2y n LYS 36 Ca -0.01 0.53 -0.12 0.00 -1.05 0.00 0.00 58.31 57.65 2k2y n LYS 36 Cb 0.16 -1.91 -0.05 0.00 -0.65 0.00 0.00 35.03 32.58 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 0.51 -0.05 -5.58 3.38 -1.83 -3.00 115.31 108.74 2k2y h LEU 37 Ca 0.00 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.57 2k2y h LEU 37 Cb 0.19 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2k2y h LEU 37 CO 0.00 0.80 -0.08 0.35 0.09 0.00 0.00 178.44 179.60 2k2y n THR 38 N -4.51 0.00 0.00 0.22 -2.24 -1.16 -5.23 114.28 101.36 2k2y n THR 38 Ca -0.04 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 2k2y n THR 38 Cb 0.34 -0.33 0.00 0.00 -2.10 0.00 0.00 70.33 68.24 2k2y n THR 38 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11