#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 -0.29 -0.63 3.52 4.81 -1.93 -2.66 114.58 117.39 2k2y h GLU 2 Ca 0.00 0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.20 2k2y h GLU 2 Cb 0.00 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.42 2k2y h GLU 2 CO 0.00 0.00 0.17 0.00 -0.73 0.00 0.00 179.01 178.46 2k2y h VAL 4 N 0.93 1.27 -0.46 0.00 2.07 -1.65 -0.35 116.25 118.06 2k2y h VAL 4 Ca 0.20 -1.25 -0.03 0.00 0.82 0.00 0.00 66.70 66.44 2k2y h VAL 4 Cb 0.30 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 2k2y h VAL 4 CO -0.00 0.44 0.15 -1.28 0.02 0.00 0.00 177.57 176.90 2k2y h SER 5 N 0.91 0.62 0.47 0.57 0.87 -1.18 -2.40 113.55 113.41 2k2y h SER 5 Ca 0.14 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.62 2k2y h SER 5 Cb 0.66 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.46 2k2y h SER 5 CO 0.05 0.59 -0.03 0.29 -0.53 0.00 0.00 176.83 177.20 2k2y n LYS 6 N -4.33 0.54 -0.40 2.24 4.76 -0.76 -4.94 118.16 115.28 2k2y n LYS 6 Ca 0.03 -0.05 0.00 0.00 -2.87 0.00 0.00 58.31 55.42 2k2y n LYS 6 Cb 0.18 -1.50 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 1.26 1.46 3.79 0.72 0.00 -0.74 -5.06 105.19 106.62 2k2y n GLY 7 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 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 -3.12 1.68 0.41 1.61 2.99 -0.22 -4.51 117.98 116.82 2k2y s PHE 8 Ca 0.00 0.57 0.04 0.00 0.00 0.00 0.00 56.93 57.54 2k2y s PHE 8 Cb 0.00 -3.66 -0.05 0.00 0.00 0.00 0.00 43.02 39.31 2k2y s PHE 8 CO 0.00 -2.84 0.04 0.20 -0.00 0.00 0.00 175.22 172.62 2k2y s GLY 9 N -4.31 2.53 -0.57 4.36 0.00 -1.15 -3.74 107.32 104.43 2k2y s GLY 9 Ca 0.69 -1.64 0.06 0.00 0.00 0.00 0.00 44.72 43.83 2k2y s GLY 9 CO 0.54 -2.01 0.63 0.00 0.00 0.00 0.00 173.10 172.26 2k2y s LEU 11 N -1.85 2.67 1.00 0.00 1.43 -1.26 -5.03 118.68 115.65 2k2y s LEU 11 Ca 0.36 1.75 -0.12 0.00 -1.03 0.00 0.00 54.13 55.08 2k2y s LEU 11 Cb 0.12 -4.28 0.19 0.00 0.03 0.00 0.00 46.19 42.25 2k2y s LEU 11 CO -0.07 -2.45 1.10 -2.16 0.23 0.00 0.00 176.35 173.00 2k2y s PRO 12 N -4.87 0.41 0.62 1.29 0.04 -1.26 -4.68 135.00 126.55 2k2y s PRO 12 Ca 0.63 0.48 0.39 0.00 0.04 0.00 0.00 61.00 62.53 2k2y s PRO 12 Cb -0.18 -1.74 2.01 0.00 0.04 0.00 0.00 34.50 34.63 2k2y s PRO 12 CO 0.57 -2.73 2.24 1.96 0.04 0.00 0.00 177.00 179.07 2k2y h GLN 13 N -1.89 0.00 0.34 4.56 4.20 -1.97 -1.64 115.11 118.70 2k2y h GLN 13 Ca -0.55 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.15 2k2y h GLN 13 Cb 1.33 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.12 2k2y h GLN 13 CO 0.58 0.02 -0.16 1.03 -0.67 0.00 0.00 178.83 179.63 2k2y h SER 14 N 0.00 -0.39 0.47 1.46 0.87 -2.03 -3.33 113.55 110.61 2k2y h SER 14 Ca -0.00 -0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.43 2k2y h SER 14 Cb 0.16 0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.22 2k2y h SER 14 CO 0.00 -0.07 -0.29 0.47 -0.53 0.00 0.00 176.83 176.41 2k2y n ASP 15 N -5.18 0.55 -4.00 6.23 10.43 -0.99 -4.57 116.55 119.03 2k2y n ASP 15 Ca -0.10 -0.37 -0.32 0.00 2.57 0.00 0.00 54.79 56.57 2k2y n ASP 15 Cb 0.26 0.05 -0.10 0.00 1.84 0.00 0.00 41.12 43.17 2k2y n ASP 15 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2k2y s PRO 17 N -1.32 0.56 0.00 0.00 0.04 -1.26 -4.78 135.00 128.25 2k2y s PRO 17 Ca 0.25 0.10 0.10 0.00 0.04 0.00 0.00 61.00 61.50 2k2y s PRO 17 Cb -0.07 -1.79 0.50 0.00 0.04 0.00 0.00 34.50 33.18 2k2y s PRO 17 CO -0.14 -2.55 1.27 1.04 0.04 0.00 0.00 177.00 176.66 2k2y n GLN 18 N -3.98 0.09 -0.02 4.56 6.02 -1.26 -2.38 117.38 120.42 2k2y n GLN 18 Ca 0.09 0.24 -0.05 0.00 -0.01 0.00 0.00 57.00 57.27 2k2y n GLN 18 Cb 0.59 -1.50 -0.12 0.00 1.02 0.00 0.00 30.24 30.23 2k2y n GLN 18 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 2k2y n GLU 19 N -1.37 0.64 -0.00 -1.09 1.02 -1.26 -4.42 120.64 114.16 2k2y n GLU 19 Ca 0.04 0.20 0.09 0.00 -0.02 0.00 0.00 57.16 57.47 2k2y n GLU 19 Cb 0.10 -1.74 -0.11 0.00 -0.02 0.00 0.00 31.44 29.66 2k2y n GLU 19 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2k2y n ALA 20 N -2.52 4.29 -1.78 0.62 0.00 -1.05 -5.00 120.51 115.07 2k2y n ALA 20 Ca -0.17 -0.53 -0.41 0.00 0.00 0.00 0.00 53.44 52.33 2k2y n ALA 20 Cb 0.98 -0.69 -0.00 0.00 0.00 0.00 0.00 19.45 19.74 2k2y n ALA 20 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2k2y n ARG 21 N -1.53 2.71 -2.30 0.00 1.85 -1.00 -3.06 116.66 113.33 2k2y n ARG 21 Ca 0.03 0.95 -0.27 0.00 -1.00 0.00 0.00 57.85 57.56 2k2y n ARG 21 Cb 0.32 -2.70 0.04 0.00 -1.05 0.00 0.00 32.46 29.07 2k2y n ARG 21 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 2k2y s LEU 22 N -1.97 3.12 0.00 2.89 1.43 -1.12 -4.91 118.68 118.11 2k2y s LEU 22 Ca 0.54 0.72 0.24 0.00 -1.03 0.00 0.00 54.13 54.60 2k2y s LEU 22 Cb -0.47 -3.51 1.15 0.00 0.03 0.00 0.00 46.19 43.39 2k2y s LEU 22 CO 0.63 -1.19 1.80 -0.24 0.23 0.00 0.00 176.35 177.58 2k2y n SER 23 N -2.69 0.00 -3.86 2.29 2.88 -1.26 -4.85 113.62 106.12 2k2y n SER 23 Ca 0.05 0.18 -0.14 0.00 -1.33 0.00 0.00 58.87 57.64 2k2y n SER 23 Cb 0.58 -0.38 -0.08 0.00 -0.75 0.00 0.00 64.21 63.58 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 -2.76 1.21 0.00 0.66 -0.85 -1.26 -5.19 117.35 109.16 2k2y s TYR 24 Ca 0.18 -1.37 0.00 0.00 -0.52 0.00 0.00 57.07 55.37 2k2y s TYR 24 Cb 0.16 -0.46 0.00 0.00 0.38 0.00 0.00 41.96 42.04 2k2y s TYR 24 CO 0.41 -0.79 0.00 0.41 -1.52 0.00 0.00 175.55 174.05 2k2y n GLY 25 N -0.40 1.20 0.55 5.49 0.00 -1.26 -4.83 105.19 105.94 2k2y n GLY 25 Ca 0.03 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 45.02 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 -0.67 0.57 3.52 -0.02 0.00 -1.26 -4.91 105.19 102.42 2k2y n GLY 26 Ca 0.00 -0.04 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.85 0.00 0.00 0.00 0.87 -1.99 -3.44 113.55 106.15 2k2y h SER 28 Ca -0.43 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.13 2k2y h SER 28 Cb 1.30 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.26 2k2y h SER 28 CO 0.29 0.17 0.00 0.35 -0.53 0.00 0.00 176.83 177.12 2k2y n THR 29 N -2.96 0.21 -3.80 2.23 -2.24 -1.26 -5.16 114.28 101.30 2k2y n THR 29 Ca 0.01 0.07 -0.11 0.00 -2.27 0.00 0.00 64.05 61.74 2k2y n THR 29 Cb 0.62 -0.67 -0.08 0.00 -2.10 0.00 0.00 70.33 68.09 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 -1.97 0.09 -0.04 2.28 -7.23 -1.26 -5.13 120.40 107.15 2k2y s VAL 30 Ca 0.00 -0.75 0.02 0.00 -1.81 0.00 0.00 61.98 59.43 2k2y s VAL 30 Cb 0.00 -0.86 0.01 0.00 0.56 0.00 0.00 36.38 36.10 2k2y s VAL 30 CO 0.00 -0.42 -0.07 0.00 -0.31 0.00 0.00 175.10 174.31 2k2y s ASP 33 N -0.88 5.90 0.00 0.00 3.68 -1.17 -2.94 116.67 121.26 2k2y s ASP 33 Ca 0.02 0.34 0.08 0.00 2.13 0.00 0.00 52.55 55.12 2k2y s ASP 33 Cb -0.07 -2.54 0.07 0.00 -1.45 0.00 0.00 42.92 38.93 2k2y s ASP 33 CO 0.01 -1.88 0.78 0.00 0.13 0.00 0.00 175.17 174.21 2k2y n LEU 34 N 10.39 1.74 0.30 -1.34 -0.00 -1.26 -4.75 117.00 122.09 2k2y n LEU 34 Ca 0.15 -1.04 0.17 0.00 -0.00 0.00 0.00 56.01 55.28 2k2y n LEU 34 Cb 0.50 -0.01 0.96 0.00 -0.00 0.00 0.00 43.42 44.87 2k2y n LEU 34 CO 0.71 0.35 1.11 -1.28 -0.00 0.00 0.00 177.39 178.27 2k2y h SER 35 N 1.63 0.00 -0.15 1.45 0.87 -1.86 -0.97 113.55 114.51 2k2y h SER 35 Ca 0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 2k2y h SER 35 Cb 0.36 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.31 2k2y h SER 35 CO 0.00 0.03 0.07 0.11 -0.53 0.00 0.00 176.83 176.51 2k2y h LYS 36 N 0.00 0.22 0.05 2.24 1.57 -1.95 -3.31 116.57 115.39 2k2y h LYS 36 Ca -0.00 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2k2y h LYS 36 Cb 0.10 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.37 2k2y h LYS 36 CO 0.00 0.27 -0.02 -0.07 -0.57 0.00 0.00 179.45 179.06 2k2y h LEU 37 N 0.12 -0.06 -1.54 2.94 3.38 -1.85 -3.48 115.31 114.82 2k2y h LEU 37 Ca 0.05 -0.42 -0.61 0.00 0.09 0.00 0.00 57.88 56.99 2k2y h LEU 37 Cb 0.12 0.01 -0.28 0.00 0.09 0.00 0.00 40.66 40.60 2k2y h LEU 37 CO -0.01 0.63 -0.92 1.07 0.09 0.00 0.00 178.44 179.30 2k2y n THR 38 N -4.77 -0.69 1.09 0.22 5.66 -0.40 -5.18 114.28 110.21 2k2y n THR 38 Ca -0.05 -0.21 0.12 0.00 -3.05 0.00 0.00 64.05 60.86 2k2y n THR 38 Cb 0.23 -0.98 0.18 0.00 -1.55 0.00 0.00 70.33 68.21 2k2y n THR 38 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63