#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 0.00 -0.41 3.52 4.81 -1.86 -3.32 114.58 117.32 2k2y h GLU 2 Ca 0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2k2y h GLU 2 Cb 0.00 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 2k2y h GLU 2 CO 0.00 0.00 0.23 0.00 -0.73 0.00 0.00 179.01 178.51 2k2y h VAL 4 N 0.53 1.29 -0.23 0.00 2.07 -1.81 -1.17 116.25 116.92 2k2y h VAL 4 Ca 0.14 -1.42 -0.10 0.00 0.82 0.00 0.00 66.70 66.15 2k2y h VAL 4 Cb 0.03 1.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 2k2y h VAL 4 CO -0.02 0.43 -0.26 -1.28 0.02 0.00 0.00 177.57 176.45 2k2y h SER 5 N 0.26 0.45 0.72 0.57 0.87 -1.64 -2.47 113.55 112.31 2k2y h SER 5 Ca 0.03 -0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.43 2k2y h SER 5 Cb 0.76 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.60 2k2y h SER 5 CO 0.06 0.71 0.00 0.29 -0.53 0.00 0.00 176.83 177.36 2k2y n LYS 6 N -4.12 0.04 -0.42 2.24 4.76 -0.91 -4.92 118.16 114.82 2k2y n LYS 6 Ca -0.01 0.11 0.00 0.00 -2.87 0.00 0.00 58.31 55.55 2k2y n LYS 6 Cb 0.41 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.10 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 0.76 0.99 3.65 0.72 0.00 -0.93 -5.07 105.19 105.32 2k2y n GLY 7 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.98 0.97 0.10 1.61 2.99 -0.49 -4.68 117.98 115.50 2k2y s PHE 8 Ca 0.00 0.57 0.01 0.00 0.00 0.00 0.00 56.93 57.51 2k2y s PHE 8 Cb 0.00 -3.49 -0.00 0.00 0.00 0.00 0.00 43.02 39.52 2k2y s PHE 8 CO 0.00 -3.52 0.12 0.41 -0.00 0.00 0.00 175.22 172.23 2k2y n GLY 9 N -1.35 3.28 2.96 4.36 0.00 -1.24 -3.80 105.19 109.40 2k2y n GLY 9 Ca 0.12 -1.60 -0.30 0.00 0.00 0.00 0.00 46.02 44.24 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 -1.22 3.48 0.94 0.00 1.02 -1.26 -4.97 118.68 116.67 2k2y s LEU 11 Ca 0.24 2.45 -0.12 0.00 0.02 0.00 0.00 54.13 56.72 2k2y s LEU 11 Cb -0.09 -4.60 0.15 0.00 0.02 0.00 0.00 46.19 41.68 2k2y s LEU 11 CO -0.13 -2.01 1.10 -2.16 0.02 0.00 0.00 176.35 173.16 2k2y s PRO 12 N -3.60 0.89 0.00 1.29 0.04 -1.26 -4.65 135.00 127.71 2k2y s PRO 12 Ca 0.78 0.60 0.11 0.00 0.04 0.00 0.00 61.00 62.52 2k2y s PRO 12 Cb -0.32 -1.78 0.46 0.00 0.04 0.00 0.00 34.50 32.89 2k2y s PRO 12 CO 0.40 -2.43 1.33 1.04 0.04 0.00 0.00 177.00 177.38 2k2y n GLN 13 N -3.98 0.01 0.01 4.56 6.02 -1.26 -1.43 117.38 121.31 2k2y n GLN 13 Ca 0.06 0.31 0.11 0.00 -0.01 0.00 0.00 57.00 57.47 2k2y n GLN 13 Cb 0.57 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 30.32 2k2y n GLN 13 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 2k2y n SER 14 N -1.48 0.64 -0.46 1.08 3.41 -1.26 -4.55 113.62 110.99 2k2y n SER 14 Ca 0.03 -0.39 0.01 0.00 -0.26 0.00 0.00 58.87 58.26 2k2y n SER 14 Cb 0.12 0.90 0.02 0.00 -0.26 0.00 0.00 64.21 64.99 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 -1.83 0.30 -3.62 4.04 8.00 -0.71 -4.92 116.55 117.81 2k2y n ASP 15 Ca 0.02 -2.14 -0.27 0.00 0.71 0.00 0.00 54.79 53.12 2k2y n ASP 15 Cb 0.41 -0.23 -0.10 0.00 -0.02 0.00 0.00 41.12 41.18 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 -1.15 1.17 0.21 0.00 0.04 -1.26 -4.84 135.00 129.18 2k2y s PRO 17 Ca 0.30 0.17 0.17 0.00 0.04 0.00 0.00 61.00 61.68 2k2y s PRO 17 Cb 0.03 -1.85 0.84 0.00 0.04 0.00 0.00 34.50 33.56 2k2y s PRO 17 CO -0.15 -2.15 1.53 1.04 0.04 0.00 0.00 177.00 177.31 2k2y n GLN 18 N -3.71 0.11 0.07 4.56 3.00 -1.26 -2.04 117.38 118.11 2k2y n GLN 18 Ca 0.08 0.51 -0.00 0.00 -0.01 0.00 0.00 57.00 57.58 2k2y n GLN 18 Cb 0.60 -1.80 -0.05 0.00 0.00 0.00 0.00 30.24 28.98 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 5.08 -2.03 -3.38 114.58 113.15 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 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2k2y h GLU 19 CO 0.00 0.41 -0.34 0.00 -1.00 0.00 0.00 179.01 178.08 2k2y n ALA 20 N -2.35 3.04 -0.87 3.43 0.00 -0.97 -5.04 120.51 117.75 2k2y n ALA 20 Ca -0.06 -0.31 -0.28 0.00 0.00 0.00 0.00 53.44 52.79 2k2y n ALA 20 Cb 0.82 -0.32 0.22 0.00 0.00 0.00 0.00 19.45 20.17 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 -0.35 0.27 0.00 1.70 -0.87 -2.49 118.95 115.57 2k2y s ARG 21 Ca 0.05 0.62 0.03 0.00 -0.47 0.00 0.00 55.73 55.96 2k2y s ARG 21 Cb 0.07 -1.64 -0.06 0.00 -0.57 0.00 0.00 34.95 32.76 2k2y s ARG 21 CO 0.32 -3.28 0.05 -0.51 -1.08 0.00 0.00 175.30 170.79 2k2y s LEU 22 N -6.86 2.03 0.50 -1.89 1.43 -1.05 -4.80 118.68 108.04 2k2y s LEU 22 Ca 0.67 -1.32 0.29 0.00 -1.03 0.00 0.00 54.13 52.74 2k2y s LEU 22 Cb -0.22 -0.23 0.97 0.00 0.03 0.00 0.00 46.19 46.74 2k2y s LEU 22 CO 0.61 -0.61 1.84 -1.28 0.23 0.00 0.00 176.35 177.14 2k2y h SER 23 N 2.32 0.00 -4.21 2.29 0.87 -1.99 -3.46 113.55 109.37 2k2y h SER 23 Ca -0.39 0.00 -0.47 0.00 -1.23 0.00 0.00 61.79 59.69 2k2y h SER 23 Cb 1.24 0.00 0.13 0.00 -0.44 0.00 0.00 62.40 63.32 2k2y h SER 23 CO 0.65 0.00 0.30 -0.31 -0.53 0.00 0.00 176.83 176.94 2k2y s TYR 24 N -3.49 2.59 -0.43 2.24 1.51 -1.26 -5.08 117.35 113.44 2k2y s TYR 24 Ca 0.03 1.04 0.06 0.00 -1.01 0.00 0.00 57.07 57.20 2k2y s TYR 24 Cb 0.07 -3.23 0.18 0.00 -0.11 0.00 0.00 41.96 38.87 2k2y s TYR 24 CO 0.59 -2.16 0.58 0.20 -1.11 0.00 0.00 175.55 173.65 2k2y s GLY 25 N -3.85 -0.84 0.00 0.71 0.00 -1.26 -4.74 107.32 97.34 2k2y s GLY 25 Ca 0.63 -0.35 0.23 0.00 0.00 0.00 0.00 44.72 45.22 2k2y s GLY 25 CO 0.54 3.36 1.57 0.61 0.00 0.00 0.00 173.10 179.19 2k2y n GLY 26 N 3.96 0.38 0.00 0.20 0.00 -1.26 -4.22 105.19 104.25 2k2y n GLY 26 Ca 0.14 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.45 -3.59 0.05 0.00 3.41 -1.26 -4.72 113.62 107.05 2k2y n SER 28 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2k2y n SER 28 Cb 0.00 -2.50 0.00 0.00 -0.26 0.00 0.00 64.21 61.45 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 -2.16 0.78 -3.70 6.66 -2.24 -1.26 -5.11 114.28 107.25 2k2y n THR 29 Ca 0.00 0.26 -0.12 0.00 -2.27 0.00 0.00 64.05 61.92 2k2y n THR 29 Cb 0.26 -1.43 -0.10 0.00 -2.10 0.00 0.00 70.33 66.96 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 -0.01 -0.11 2.28 -7.23 -1.26 -5.10 120.40 106.97 2k2y s VAL 30 Ca 0.00 0.03 -0.04 0.00 -1.81 0.00 0.00 61.98 60.16 2k2y s VAL 30 Cb 0.00 -0.67 0.05 0.00 0.56 0.00 0.00 36.38 36.33 2k2y s VAL 30 CO 0.00 0.01 0.22 0.00 -0.31 0.00 0.00 175.10 175.02 2k2y s ASP 33 N -1.57 6.07 -0.02 0.00 3.68 -1.04 -3.72 116.67 120.08 2k2y s ASP 33 Ca 0.01 0.74 0.20 0.00 2.13 0.00 0.00 52.55 55.63 2k2y s ASP 33 Cb -0.09 -2.54 -0.28 0.00 -1.45 0.00 0.00 42.92 38.56 2k2y s ASP 33 CO 0.02 -1.67 0.61 0.00 0.13 0.00 0.00 175.17 174.27 2k2y n LEU 34 N 9.76 0.37 0.29 -1.34 -0.00 -1.26 -4.56 117.00 120.26 2k2y n LEU 34 Ca 0.17 -0.20 0.19 0.00 -0.00 0.00 0.00 56.01 56.17 2k2y n LEU 34 Cb 0.48 0.00 0.85 0.00 -0.00 0.00 0.00 43.42 44.76 2k2y n LEU 34 CO 0.70 0.09 1.05 -1.28 -0.00 0.00 0.00 177.39 177.95 2k2y h SER 35 N 0.00 0.00 0.00 1.45 0.87 -1.88 -2.94 113.55 111.05 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 0.76 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.72 2k2y h SER 35 CO 0.00 0.00 0.16 0.07 -0.53 0.00 0.00 176.83 176.53 2k2y h LYS 36 N 0.00 0.00 -0.10 2.24 2.10 -1.93 -1.10 116.57 117.78 2k2y h LYS 36 Ca 0.00 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.57 2k2y h LYS 36 Cb 0.32 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.64 2k2y h LYS 36 CO 0.00 0.00 -0.28 -0.07 -2.00 0.00 0.00 179.45 177.10 2k2y h LEU 37 N 0.00 0.19 0.00 7.07 3.38 -1.88 -3.38 115.31 120.69 2k2y h LEU 37 Ca 0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2k2y h LEU 37 Cb 0.33 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2k2y h LEU 37 CO 0.00 0.47 -0.82 0.41 0.09 0.00 0.00 178.44 178.60 2k2y n THR 38 N -4.15 0.00 1.63 0.22 -1.04 -1.07 -5.25 114.28 104.62 2k2y n THR 38 Ca -0.01 0.00 0.15 0.00 -2.04 0.00 0.00 64.05 62.14 2k2y n THR 38 Cb 0.37 -0.72 0.64 0.00 -1.82 0.00 0.00 70.33 68.80 2k2y n THR 38 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04