#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 0.85 -0.42 -3.83 4.57 -1.84 -2.42 114.58 111.49 2k2y h GLU 2 Ca 0.00 -0.21 -0.14 0.00 -1.18 0.00 0.00 59.36 57.84 2k2y h GLU 2 Cb 0.00 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 28.47 2k2y h GLU 2 CO 0.00 0.81 -0.28 0.00 -1.18 0.00 0.00 179.01 178.37 2k2y h VAL 4 N 0.77 1.27 -0.36 0.00 2.07 -1.74 -1.13 116.25 117.13 2k2y h VAL 4 Ca 0.09 -1.24 0.05 0.00 0.82 0.00 0.00 66.70 66.42 2k2y h VAL 4 Cb 0.84 0.95 -0.05 0.00 -1.52 0.00 0.00 31.29 31.52 2k2y h VAL 4 CO 0.07 0.44 0.09 -1.28 0.02 0.00 0.00 177.57 176.91 2k2y h SER 5 N 0.90 0.05 0.26 0.57 0.87 -1.39 -2.03 113.55 112.77 2k2y h SER 5 Ca 0.14 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.76 2k2y h SER 5 Cb 0.65 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.67 2k2y h SER 5 CO 0.04 0.06 0.00 0.29 -0.53 0.00 0.00 176.83 176.70 2k2y n LYS 6 N -5.07 0.42 -0.79 2.24 4.76 -1.01 -4.91 118.16 113.80 2k2y n LYS 6 Ca 0.01 0.06 0.00 0.00 -2.87 0.00 0.00 58.31 55.52 2k2y n LYS 6 Cb 0.15 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.84 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 0.42 0.88 3.75 0.72 0.00 -0.77 -5.05 105.19 105.16 2k2y n GLY 7 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 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 -3.52 2.51 0.00 1.61 0.08 -0.49 -4.97 117.98 113.20 2k2y s PHE 8 Ca 0.00 1.18 0.00 0.00 0.12 0.00 0.00 56.93 58.23 2k2y s PHE 8 Cb 0.00 -3.16 0.00 0.00 -0.57 0.00 0.00 43.02 39.29 2k2y s PHE 8 CO 0.00 -2.18 0.00 0.41 -0.10 0.00 0.00 175.22 173.35 2k2y n GLY 9 N -1.55 1.65 2.95 4.36 0.00 -1.25 -4.32 105.19 107.02 2k2y n GLY 9 Ca 0.07 -1.97 -0.14 0.00 0.00 0.00 0.00 46.02 43.98 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 2.42 3.40 0.91 0.00 1.02 -1.26 -4.97 118.68 120.20 2k2y s LEU 11 Ca 0.04 -0.49 -0.12 0.00 0.02 0.00 0.00 54.13 53.58 2k2y s LEU 11 Cb -0.13 -1.94 0.13 0.00 0.02 0.00 0.00 46.19 44.27 2k2y s LEU 11 CO -0.10 0.00 1.11 -2.16 0.02 0.00 0.00 176.35 175.22 2k2y s PRO 12 N -3.61 1.19 0.00 1.29 0.04 -1.26 -4.75 135.00 127.90 2k2y s PRO 12 Ca 0.31 0.47 0.12 0.00 0.04 0.00 0.00 61.00 61.94 2k2y s PRO 12 Cb -0.07 -1.83 0.55 0.00 0.04 0.00 0.00 34.50 33.19 2k2y s PRO 12 CO 0.21 -2.20 1.36 1.04 0.04 0.00 0.00 177.00 177.45 2k2y n GLN 13 N -3.80 0.05 -0.06 4.56 6.02 -1.26 -3.12 117.38 119.77 2k2y n GLN 13 Ca 0.06 0.25 -0.06 0.00 -0.01 0.00 0.00 57.00 57.25 2k2y n GLN 13 Cb 0.58 -1.50 -0.10 0.00 1.02 0.00 0.00 30.24 30.23 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 -1.43 1.81 0.02 1.08 3.41 -1.26 -4.70 113.62 112.54 2k2y n SER 14 Ca 0.04 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.64 2k2y n SER 14 Cb 0.13 0.84 -0.10 0.00 -0.26 0.00 0.00 64.21 64.82 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 -2.47 0.77 -4.57 4.04 10.43 -1.18 -4.78 116.55 118.79 2k2y n ASP 15 Ca -0.21 0.34 -0.43 0.00 2.57 0.00 0.00 54.79 57.06 2k2y n ASP 15 Cb 0.91 0.28 -0.04 0.00 1.84 0.00 0.00 41.12 44.11 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 3.71 0.99 0.00 0.00 0.04 -1.26 -4.84 135.00 133.64 2k2y s PRO 17 Ca 0.37 0.63 0.14 0.00 0.04 0.00 0.00 61.00 62.18 2k2y s PRO 17 Cb -0.10 -1.79 0.64 0.00 0.04 0.00 0.00 34.50 33.29 2k2y s PRO 17 CO 0.25 -2.37 1.42 1.04 0.04 0.00 0.00 177.00 177.38 2k2y n GLN 18 N -3.95 0.09 -0.02 4.56 6.02 -1.26 -2.22 117.38 120.60 2k2y n GLN 18 Ca 0.06 0.22 -0.05 0.00 -0.01 0.00 0.00 57.00 57.21 2k2y n GLN 18 Cb 0.56 -1.50 -0.13 0.00 1.02 0.00 0.00 30.24 30.20 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 -1.41 0.64 0.01 -1.09 -0.58 -1.26 -4.44 120.64 112.51 2k2y n GLU 19 Ca 0.05 0.19 0.11 0.00 -0.42 0.00 0.00 57.16 57.09 2k2y n GLU 19 Cb 0.14 -1.73 -0.07 0.00 -0.57 0.00 0.00 31.44 29.20 2k2y n GLU 19 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2k2y n ALA 20 N -2.53 3.51 -1.78 0.62 0.00 -0.94 -4.95 120.51 114.43 2k2y n ALA 20 Ca -0.17 -0.48 -0.41 0.00 0.00 0.00 0.00 53.44 52.38 2k2y n ALA 20 Cb 0.99 -0.86 -0.00 0.00 0.00 0.00 0.00 19.45 19.57 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 -3.26 4.09 0.32 0.00 1.70 -0.94 -2.81 118.95 118.05 2k2y s ARG 21 Ca 0.01 2.60 -0.01 0.00 -0.47 0.00 0.00 55.73 57.86 2k2y s ARG 21 Cb 0.14 -2.97 -0.04 0.00 -0.57 0.00 0.00 34.95 31.52 2k2y s ARG 21 CO 0.85 -0.57 0.54 -0.51 -1.08 0.00 0.00 175.30 174.53 2k2y s LEU 22 N -1.91 4.04 0.00 -1.89 1.43 -0.95 -4.91 118.68 114.50 2k2y s LEU 22 Ca 0.54 0.50 0.03 0.00 -1.03 0.00 0.00 54.13 54.18 2k2y s LEU 22 Cb -0.47 -3.35 0.19 0.00 0.03 0.00 0.00 46.19 42.59 2k2y s LEU 22 CO 0.62 -0.25 1.12 -0.24 0.23 0.00 0.00 176.35 177.83 2k2y n SER 23 N -1.52 0.04 -4.75 2.29 2.88 -1.26 -4.81 113.62 106.50 2k2y n SER 23 Ca -0.04 -1.91 -0.24 0.00 -1.33 0.00 0.00 58.87 55.35 2k2y n SER 23 Cb 0.55 -0.01 -0.07 0.00 -0.75 0.00 0.00 64.21 63.94 2k2y n SER 23 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 2k2y s TYR 24 N -1.99 2.63 -0.40 0.66 2.02 -1.26 -5.06 117.35 113.95 2k2y s TYR 24 Ca 0.05 -0.54 0.05 0.00 -0.37 0.00 0.00 57.07 56.27 2k2y s TYR 24 Cb 0.02 -1.91 0.55 0.00 -0.40 0.00 0.00 41.96 40.23 2k2y s TYR 24 CO 0.04 0.19 1.68 0.41 -1.57 0.00 0.00 175.55 176.30 2k2y n GLY 25 N -1.25 5.01 0.00 0.71 0.00 -1.26 -4.68 105.19 103.73 2k2y n GLY 25 Ca -0.01 -1.43 0.13 0.00 0.00 0.00 0.00 46.02 44.71 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 -1.08 -0.83 0.80 -0.02 0.00 -1.26 -4.72 105.19 98.08 2k2y n GLY 26 Ca 0.48 -0.17 -0.07 0.00 0.00 0.00 0.00 46.02 46.26 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 -1.49 1.73 0.10 0.00 2.88 -1.26 -4.82 113.62 110.77 2k2y n SER 28 Ca -0.03 -1.37 0.00 0.00 -1.33 0.00 0.00 58.87 56.14 2k2y n SER 28 Cb 0.14 0.40 0.00 0.00 -0.75 0.00 0.00 64.21 64.00 2k2y n SER 28 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 2k2y n THR 29 N 0.04 0.00 -3.86 2.46 5.66 -1.26 -5.14 114.28 112.18 2k2y n THR 29 Ca 0.07 0.00 -0.11 0.00 -3.05 0.00 0.00 64.05 60.96 2k2y n THR 29 Cb 0.35 -0.39 -0.09 0.00 -1.55 0.00 0.00 70.33 68.64 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 0.10 0.04 1.08 -7.23 -1.26 -5.13 120.40 105.99 2k2y s VAL 30 Ca 0.00 -0.79 0.08 0.00 -1.81 0.00 0.00 61.98 59.46 2k2y s VAL 30 Cb 0.00 -0.68 -0.03 0.00 0.56 0.00 0.00 36.38 36.23 2k2y s VAL 30 CO 0.00 -0.44 -0.24 0.00 -0.31 0.00 0.00 175.10 174.11 2k2y s ASP 33 N -1.55 2.49 0.00 0.00 3.84 -1.12 -3.94 116.67 116.38 2k2y s ASP 33 Ca -0.08 0.61 0.00 0.00 -0.00 0.00 0.00 52.55 53.08 2k2y s ASP 33 Cb -0.10 -0.89 0.00 0.00 -1.38 0.00 0.00 42.92 40.55 2k2y s ASP 33 CO 0.01 -3.15 0.64 0.18 -0.00 0.00 0.00 175.17 172.84 2k2y n LEU 34 N -4.11 1.13 0.29 2.11 4.77 -1.26 -4.78 117.00 115.16 2k2y n LEU 34 Ca 0.12 -1.13 0.19 0.00 -0.03 0.00 0.00 56.01 55.15 2k2y n LEU 34 Cb 0.59 0.00 0.83 0.00 -2.33 0.00 0.00 43.42 42.51 2k2y n LEU 34 CO 0.49 0.28 1.04 -1.28 -1.33 0.00 0.00 177.39 176.60 2k2y h SER 35 N 0.00 0.00 0.50 -1.43 0.87 -1.96 -2.57 113.55 108.96 2k2y h SER 35 Ca 0.00 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.50 2k2y h SER 35 Cb 0.40 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.35 2k2y h SER 35 CO 0.00 0.00 -0.31 0.11 -0.53 0.00 0.00 176.83 176.10 2k2y h LYS 36 N 0.00 0.00 -0.25 2.24 1.57 -1.89 -1.86 116.57 116.38 2k2y h LYS 36 Ca 0.00 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.58 2k2y h LYS 36 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.68 2k2y h LYS 36 CO 0.00 0.31 -0.63 -0.07 -0.57 0.00 0.00 179.45 178.49 2k2y h LEU 37 N 0.00 0.98 -0.01 2.94 3.38 -1.86 -3.15 115.31 117.59 2k2y h LEU 37 Ca -0.00 -0.56 0.00 0.00 0.09 0.00 0.00 57.88 57.40 2k2y h LEU 37 Cb 0.64 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2k2y h LEU 37 CO 0.04 1.37 0.00 0.35 0.09 0.00 0.00 178.44 180.29 2k2y n THR 38 N -3.98 0.37 0.00 0.22 -2.24 -1.14 -5.22 114.28 102.28 2k2y n THR 38 Ca -0.05 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 2k2y n THR 38 Cb 0.67 -0.56 0.00 0.00 -2.10 0.00 0.00 70.33 68.34 2k2y n THR 38 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11