#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 0.31 -0.22 1.20 4.57 -1.98 -1.83 114.58 116.63 2k2y h GLU 2 Ca 0.00 -0.11 -0.12 0.00 -1.18 0.00 0.00 59.36 57.96 2k2y h GLU 2 Cb 0.00 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 28.56 2k2y h GLU 2 CO 0.00 0.55 -0.31 0.00 -1.18 0.00 0.00 179.01 178.06 2k2y h VAL 4 N 0.30 1.27 -0.10 0.00 2.07 -1.69 -1.90 116.25 116.19 2k2y h VAL 4 Ca 0.02 -1.30 -0.09 0.00 0.82 0.00 0.00 66.70 66.15 2k2y h VAL 4 Cb 0.89 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 2k2y h VAL 4 CO 0.07 0.46 -0.36 -1.28 0.02 0.00 0.00 177.57 176.48 2k2y h SER 5 N 0.91 0.21 0.76 0.57 0.87 -1.22 -1.53 113.55 114.12 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 0.71 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.61 2k2y h SER 5 CO 0.05 0.57 0.00 0.29 -0.53 0.00 0.00 176.83 177.21 2k2y n LYS 6 N -4.07 0.00 -0.21 2.24 4.76 -0.47 -4.93 118.16 115.49 2k2y n LYS 6 Ca -0.01 0.12 0.00 0.00 -2.87 0.00 0.00 58.31 55.54 2k2y n LYS 6 Cb 0.44 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.13 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 0.79 0.72 3.84 0.72 0.00 -0.58 -5.08 105.19 105.60 2k2y n GLY 7 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.50 2.67 0.35 1.61 0.40 -0.72 -4.97 117.98 114.81 2k2y s PHE 8 Ca 0.00 0.80 0.01 0.00 -0.60 0.00 0.00 56.93 57.13 2k2y s PHE 8 Cb 0.00 -3.45 -0.03 0.00 0.51 0.00 0.00 43.02 40.05 2k2y s PHE 8 CO 0.00 -2.13 0.55 0.20 0.70 0.00 0.00 175.22 174.53 2k2y s GLY 9 N -4.27 1.34 -0.56 4.36 0.00 -0.83 -4.04 107.32 103.31 2k2y s GLY 9 Ca 0.63 -0.92 0.06 0.00 0.00 0.00 0.00 44.72 44.49 2k2y s GLY 9 CO 0.51 -0.86 0.79 0.00 0.00 0.00 0.00 173.10 173.54 2k2y s LEU 11 N -2.65 2.35 0.98 0.00 1.43 -1.26 -4.99 118.68 114.54 2k2y s LEU 11 Ca 0.42 1.78 -0.13 0.00 -1.03 0.00 0.00 54.13 55.17 2k2y s LEU 11 Cb 0.21 -4.15 0.18 0.00 0.03 0.00 0.00 46.19 42.46 2k2y s LEU 11 CO -0.07 -2.93 1.12 -2.16 0.23 0.00 0.00 176.35 172.54 2k2y s PRO 12 N -4.76 0.59 0.55 1.29 0.04 -1.26 -4.55 135.00 126.89 2k2y s PRO 12 Ca 0.65 0.31 0.24 0.00 0.04 0.00 0.00 61.00 62.24 2k2y s PRO 12 Cb -0.20 -1.77 1.56 0.00 0.04 0.00 0.00 34.50 34.12 2k2y s PRO 12 CO 0.58 -2.58 2.19 1.96 0.04 0.00 0.00 177.00 179.19 2k2y h GLN 13 N -1.78 0.00 0.00 4.56 1.08 -1.96 -1.79 115.11 115.22 2k2y h GLN 13 Ca -0.52 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.68 2k2y h GLN 13 Cb 1.33 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.76 2k2y h GLN 13 CO 0.57 0.02 0.00 0.43 -0.95 0.00 0.00 178.83 178.91 2k2y n SER 14 N -4.08 0.09 0.00 1.46 7.64 -1.26 -3.67 113.62 113.80 2k2y n SER 14 Ca -0.03 0.52 0.00 0.00 1.01 0.00 0.00 58.87 60.37 2k2y n SER 14 Cb 0.11 -0.54 0.00 0.00 -1.01 0.00 0.00 64.21 62.77 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 -1.60 0.31 -3.81 6.43 2.03 -0.79 -4.93 116.55 114.19 2k2y n ASP 15 Ca 0.05 -0.64 -0.28 0.00 0.52 0.00 0.00 54.79 54.43 2k2y n ASP 15 Cb 0.25 0.34 -0.12 0.00 -0.72 0.00 0.00 41.12 40.87 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 -0.76 0.68 0.30 0.00 0.04 -1.26 -4.77 135.00 129.22 2k2y s PRO 17 Ca 0.23 0.02 0.22 0.00 0.04 0.00 0.00 61.00 61.52 2k2y s PRO 17 Cb -0.10 -1.81 1.11 0.00 0.04 0.00 0.00 34.50 33.73 2k2y s PRO 17 CO -0.11 -2.46 1.69 1.04 0.04 0.00 0.00 177.00 177.19 2k2y n GLN 18 N -3.90 0.16 0.09 4.56 3.00 -1.26 -2.38 117.38 117.66 2k2y n GLN 18 Ca 0.10 0.56 -0.04 0.00 -0.01 0.00 0.00 57.00 57.61 2k2y n GLN 18 Cb 0.60 -1.93 -0.01 0.00 0.00 0.00 0.00 30.24 28.89 2k2y n GLN 18 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.06 177.99 2k2y h GLU 19 N 0.00 0.00 -0.00 -1.09 4.39 -2.02 -3.37 114.58 112.49 2k2y h GLU 19 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2k2y h GLU 19 Cb 0.14 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 2k2y h GLU 19 CO 0.00 0.82 -0.45 0.00 -1.16 0.00 0.00 179.01 178.23 2k2y n ALA 20 N -2.35 3.30 -1.30 3.43 0.00 -1.00 -5.03 120.51 117.56 2k2y n ALA 20 Ca -0.00 -0.35 -0.31 0.00 0.00 0.00 0.00 53.44 52.78 2k2y n ALA 20 Cb 0.82 -0.40 0.08 0.00 0.00 0.00 0.00 19.45 19.95 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 -1.90 2.35 0.56 0.00 1.70 -1.10 -2.44 118.95 118.13 2k2y s ARG 21 Ca 0.05 1.17 0.08 0.00 -0.47 0.00 0.00 55.73 56.56 2k2y s ARG 21 Cb 0.09 -1.91 0.08 0.00 -0.57 0.00 0.00 34.95 32.63 2k2y s ARG 21 CO 0.41 -1.57 0.77 -0.51 -1.08 0.00 0.00 175.30 173.32 2k2y s LEU 22 N -5.81 3.19 0.00 -1.89 1.43 -1.07 -4.85 118.68 109.67 2k2y s LEU 22 Ca 0.61 -0.72 0.16 0.00 -1.03 0.00 0.00 54.13 53.16 2k2y s LEU 22 Cb -0.17 -1.86 0.83 0.00 0.03 0.00 0.00 46.19 45.03 2k2y s LEU 22 CO 0.55 -1.29 1.45 -0.24 0.23 0.00 0.00 176.35 177.05 2k2y n SER 23 N -2.24 0.00 -3.63 2.29 2.88 -1.26 -4.82 113.62 106.85 2k2y n SER 23 Ca 0.14 -0.02 -0.17 0.00 -1.33 0.00 0.00 58.87 57.49 2k2y n SER 23 Cb 0.61 -0.25 -0.09 0.00 -0.75 0.00 0.00 64.21 63.73 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 -2.50 1.57 -0.41 0.66 1.13 -1.26 -5.14 117.35 111.40 2k2y s TYR 24 Ca 0.16 -1.57 0.07 0.00 -1.41 0.00 0.00 57.07 54.32 2k2y s TYR 24 Cb 0.11 -0.67 0.23 0.00 -1.10 0.00 0.00 41.96 40.53 2k2y s TYR 24 CO 0.24 -0.80 0.53 0.41 -2.51 0.00 0.00 175.55 173.42 2k2y n GLY 25 N -0.51 2.17 0.23 5.49 0.00 -1.26 -4.67 105.19 106.64 2k2y n GLY 25 Ca 0.06 -1.20 0.15 0.00 0.00 0.00 0.00 46.02 45.03 2k2y n GLY 25 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2k2y h GLY 26 N 4.44 0.00 -0.91 -0.02 0.00 -1.94 -3.46 103.07 101.18 2k2y h GLY 26 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 47.33 47.01 2k2y h GLY 26 CO 0.40 0.00 0.13 0.00 0.00 0.00 0.00 176.54 177.07 2k2y n SER 28 N -4.85 0.38 0.05 0.00 7.64 -1.26 -4.67 113.62 110.90 2k2y n SER 28 Ca 0.15 -0.12 0.00 0.00 1.01 0.00 0.00 58.87 59.91 2k2y n SER 28 Cb 0.60 -0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.76 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 -1.35 0.00 -3.78 0.44 5.66 -1.26 -5.16 114.28 108.83 2k2y n THR 29 Ca 0.08 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.95 2k2y n THR 29 Cb 0.33 -0.29 -0.10 0.00 -1.55 0.00 0.00 70.33 68.72 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 -2.00 0.03 -0.23 1.08 -7.23 -1.26 -5.07 120.40 105.73 2k2y s VAL 30 Ca 0.00 -0.29 0.02 0.00 -1.81 0.00 0.00 61.98 59.90 2k2y s VAL 30 Cb 0.00 -0.49 0.05 0.00 0.56 0.00 0.00 36.38 36.50 2k2y s VAL 30 CO 0.00 -0.16 -0.10 0.00 -0.31 0.00 0.00 175.10 174.53 2k2y s ASP 33 N -0.97 6.87 -0.04 0.00 2.15 -1.02 -1.96 116.67 121.69 2k2y s ASP 33 Ca 0.10 1.03 0.06 0.00 0.43 0.00 0.00 52.55 54.18 2k2y s ASP 33 Cb -0.10 -2.29 0.10 0.00 -0.30 0.00 0.00 42.92 40.33 2k2y s ASP 33 CO 0.01 0.24 0.98 0.18 -0.17 0.00 0.00 175.17 176.42 2k2y n LEU 34 N 2.16 1.63 0.26 -1.34 4.77 -1.26 -4.85 117.00 118.37 2k2y n LEU 34 Ca -0.11 -1.99 0.17 0.00 -0.03 0.00 0.00 56.01 54.05 2k2y n LEU 34 Cb 0.52 -0.14 0.94 0.00 -2.33 0.00 0.00 43.42 42.40 2k2y n LEU 34 CO 0.40 0.48 1.03 -1.28 -1.33 0.00 0.00 177.39 176.68 2k2y h SER 35 N 0.00 0.00 0.34 -1.43 0.87 -1.95 -1.36 113.55 110.02 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 0.83 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.79 2k2y h SER 35 CO 0.00 0.00 -0.04 0.11 -0.53 0.00 0.00 176.83 176.37 2k2y h LYS 36 N 0.00 0.00 0.00 2.24 1.57 -1.98 -3.21 116.57 115.18 2k2y h LYS 36 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2k2y h LYS 36 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2k2y h LYS 36 CO 0.00 0.04 0.00 1.28 -0.57 0.00 0.00 179.45 180.20 2k2y n LEU 37 N -3.34 0.00 -3.74 2.94 4.77 -0.60 -4.86 117.00 112.17 2k2y n LEU 37 Ca -0.02 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.54 2k2y n LEU 37 Cb 0.18 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 2k2y n LEU 37 CO 0.26 -0.38 2.32 0.35 -1.33 0.00 0.00 177.39 178.61 2k2y n THR 38 N -2.16 4.18 -1.43 -5.08 -2.24 -0.69 -5.17 114.28 101.69 2k2y n THR 38 Ca 0.00 -3.86 0.00 0.00 -2.27 0.00 0.00 64.05 57.92 2k2y n THR 38 Cb 0.00 -2.42 0.00 0.00 -2.10 0.00 0.00 70.33 65.81 2k2y n THR 38 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11