#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kgh s PHE 2 N 0.00 3.51 -0.51 1.39 -0.12 -1.26 -4.99 117.98 116.00 2kgh s PHE 2 Ca 0.00 0.92 0.04 0.00 -0.05 0.00 0.00 56.93 57.83 2kgh s PHE 2 Cb 0.00 -2.58 0.16 0.00 -0.63 0.00 0.00 43.02 39.97 2kgh s PHE 2 CO 0.00 0.15 0.35 -2.00 -0.05 0.00 0.00 175.22 173.67 2kgh s GLU 3 N 0.67 1.52 0.00 1.99 2.12 -1.26 -5.02 118.70 118.72 2kgh s GLU 3 Ca 0.27 -2.45 0.00 0.00 0.36 0.00 0.00 54.97 53.15 2kgh s GLU 3 Cb -0.15 -2.37 0.00 0.00 0.26 0.00 0.00 34.13 31.87 2kgh s GLU 3 CO 0.11 -1.27 0.00 0.00 -0.54 0.00 0.00 175.26 173.56 2kgh n VAL 5 N 0.00 0.00 -3.64 0.00 0.24 -1.26 -5.05 118.33 108.61 2kgh n VAL 5 Ca 0.00 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 62.01 2kgh n VAL 5 Cb 0.00 -0.47 0.04 0.00 -1.47 0.00 0.00 33.84 31.94 2kgh n VAL 5 CO 0.00 0.00 0.00 0.33 -2.14 0.00 0.00 176.83 175.02 2kgh n PHE 6 N -1.61 -1.99 1.05 6.34 7.35 -1.26 -4.89 117.46 122.45 2kgh n PHE 6 Ca 0.00 0.52 0.11 0.00 -0.76 0.00 0.00 57.45 57.32 2kgh n PHE 6 Cb 0.30 -3.45 0.07 0.00 0.35 0.00 0.00 39.48 36.74 2kgh n PHE 6 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 2kgh n SER 7 N -2.63 1.27 -0.52 -2.13 7.64 -1.26 -4.96 113.62 111.03 2kgh n SER 7 Ca -0.10 -1.03 -0.05 0.00 1.01 0.00 0.00 58.87 58.70 2kgh n SER 7 Cb 0.59 0.55 -0.02 0.00 -1.01 0.00 0.00 64.21 64.32 2kgh n SER 7 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kgh s ASP 9 N -1.57 6.31 0.13 0.00 1.11 -1.26 -4.79 116.67 116.60 2kgh s ASP 9 Ca 0.00 2.04 0.22 0.00 0.18 0.00 0.00 52.55 54.99 2kgh s ASP 9 Cb 0.00 -2.57 0.87 0.00 1.07 0.00 0.00 42.92 42.29 2kgh s ASP 9 CO 0.00 -0.81 1.67 0.00 1.18 0.00 0.00 175.17 177.22 2kgh n ILE 10 N -0.77 0.73 0.01 0.77 3.06 -1.26 0.08 119.36 121.98 2kgh n ILE 10 Ca 0.08 0.12 0.08 0.00 -2.50 0.00 0.00 62.75 60.54 2kgh n ILE 10 Cb 0.51 -0.93 -0.12 0.00 0.54 0.00 0.00 39.64 39.64 2kgh n ILE 10 CO 0.00 0.00 0.00 1.17 -2.50 0.00 0.00 176.55 175.22 2kgh n LYS 11 N -1.90 0.65 -0.07 9.51 3.00 -1.26 -4.62 118.16 123.47 2kgh n LYS 11 Ca 0.04 -0.07 -0.14 0.00 -0.00 0.00 0.00 58.31 58.14 2kgh n LYS 11 Cb 0.26 -1.62 -0.05 0.00 0.00 0.00 0.00 35.03 33.62 2kgh n LYS 11 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2kgh n LYS 12 N -2.46 0.29 -2.90 1.64 5.02 -0.99 -5.01 118.16 113.74 2kgh n LYS 12 Ca -0.07 0.13 -0.20 0.00 -2.02 0.00 0.00 58.31 56.15 2kgh n LYS 12 Cb 0.65 -0.98 0.06 0.00 -0.02 0.00 0.00 35.03 34.73 2kgh n LYS 12 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2kgh s GLU 13 N -2.26 2.34 0.00 1.97 0.41 0.11 -4.78 118.70 116.49 2kgh s GLU 13 Ca -0.19 -1.35 0.00 0.00 -0.41 0.00 0.00 54.97 53.02 2kgh s GLU 13 Cb 0.07 -2.60 0.00 0.00 -1.78 0.00 0.00 34.13 29.82 2kgh s GLU 13 CO 0.24 -0.81 0.00 0.41 -0.49 0.00 0.00 175.26 174.60 2kgh n GLY 14 N -2.27 -1.08 0.00 -1.39 0.00 -1.24 -4.15 105.19 95.06 2kgh n GLY 14 Ca 0.13 0.27 0.00 0.00 0.00 0.00 0.00 46.02 46.41 2kgh n GLY 14 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2kgh n LYS 15 N 0.00 -0.13 -1.90 1.61 2.85 -0.95 -4.92 118.16 114.72 2kgh n LYS 15 Ca 0.00 0.00 -0.42 0.00 -1.05 0.00 0.00 58.31 56.84 2kgh n LYS 15 Cb 0.00 0.00 -0.03 0.00 -0.65 0.00 0.00 35.03 34.35 2kgh n LYS 15 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 177.40 175.21 2kgh s PRO 16 N -2.00 3.89 0.00 -1.58 0.02 -1.26 -0.51 135.00 133.56 2kgh s PRO 16 Ca 0.00 2.09 0.00 0.00 0.02 0.00 0.00 61.00 63.11 2kgh s PRO 16 Cb 0.00 -4.10 0.00 0.00 0.02 0.00 0.00 34.50 30.42 2kgh s PRO 16 CO 0.00 -1.21 0.00 0.00 -0.33 0.00 0.00 177.00 175.46 2kgh s LYS 18 N -1.17 3.29 0.00 0.00 0.00 -1.26 -2.63 119.74 117.98 2kgh s LYS 18 Ca 0.00 -1.86 -0.03 0.00 0.00 0.00 0.00 55.97 54.08 2kgh s LYS 18 Cb 0.00 -4.41 -0.15 0.00 0.00 0.00 0.00 37.83 33.26 2kgh s LYS 18 CO 0.00 -1.44 2.38 -2.30 0.00 0.00 0.00 175.35 173.99 2kgh n PRO 19 N 5.31 1.22 -2.01 1.78 -0.02 -1.26 -4.81 135.00 135.21 2kgh n PRO 19 Ca 0.02 -0.56 -0.36 0.00 -2.02 0.00 0.00 63.50 60.57 2kgh n PRO 19 Cb 0.44 -1.73 -0.03 0.00 -0.02 0.00 0.00 33.50 32.16 2kgh n PRO 19 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2kgh s LYS 20 N 1.52 2.57 0.00 -0.52 1.02 -1.26 -0.81 119.74 122.25 2kgh s LYS 20 Ca 0.38 0.52 0.00 0.00 0.02 0.00 0.00 55.97 56.88 2kgh s LYS 20 Cb 0.18 -4.51 0.00 0.00 -0.52 0.00 0.00 37.83 32.98 2kgh s LYS 20 CO 0.00 -2.89 0.00 0.41 -0.92 0.00 0.00 175.35 171.95 2kgh n GLY 21 N 5.91 1.24 3.90 -3.33 0.00 -1.26 -5.12 105.19 106.52 2kgh n GLY 21 Ca 0.25 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.99 2kgh n GLY 21 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2kgh s GLU 22 N 0.00 3.44 -0.23 1.61 0.41 0.01 -5.02 118.70 118.92 2kgh s GLU 22 Ca 0.00 0.30 -0.07 0.00 -0.41 0.00 0.00 54.97 54.79 2kgh s GLU 22 Cb 0.00 -2.29 -0.18 0.00 -1.78 0.00 0.00 34.13 29.88 2kgh s GLU 22 CO 0.00 -0.38 -0.08 1.63 -0.49 0.00 0.00 175.26 175.94 2kgh n LYS 23 N -2.44 0.65 -0.11 1.61 5.02 -1.26 -4.63 118.16 117.01 2kgh n LYS 23 Ca 0.02 0.25 -0.24 0.00 -2.02 0.00 0.00 58.31 56.32 2kgh n LYS 23 Cb 0.55 -1.58 -0.11 0.00 -0.02 0.00 0.00 35.03 33.87 2kgh n LYS 23 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2kgh n LYS 24 N -3.69 0.62 -1.67 1.97 4.81 -1.26 -4.92 118.16 114.02 2kgh n LYS 24 Ca -0.43 0.34 -0.42 0.00 -0.87 0.00 0.00 58.31 56.93 2kgh n LYS 24 Cb 0.94 -1.60 -0.03 0.00 0.02 0.00 0.00 35.03 34.36 2kgh n LYS 24 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2kgh n THR 26 N 5.54 0.00 -3.60 0.00 5.66 -1.26 -4.59 114.28 116.03 2kgh n THR 26 Ca 0.20 0.44 -0.09 0.00 -3.05 0.00 0.00 64.05 61.55 2kgh n THR 26 Cb 0.41 -1.43 -0.05 0.00 -1.55 0.00 0.00 70.33 67.71 2kgh n THR 26 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 2kgh s GLY 27 N -2.68 -0.16 -0.85 1.09 0.00 -1.26 -4.15 107.32 99.29 2kgh s GLY 27 Ca 0.00 2.33 -0.05 0.00 0.00 0.00 0.00 44.72 47.00 2kgh s GLY 27 CO 0.00 1.23 0.74 0.61 0.00 0.00 0.00 173.10 175.68 2kgh n GLY 28 N 1.00 0.00 3.18 0.20 0.00 -1.11 -4.93 105.19 103.54 2kgh n GLY 28 Ca -0.09 -0.09 -0.33 0.00 0.00 0.00 0.00 46.02 45.51 2kgh n GLY 28 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2kgh s TRP 29 N -3.20 2.67 -0.06 1.61 0.52 -1.08 -2.20 118.94 117.20 2kgh s TRP 29 Ca 0.35 -1.32 -0.30 0.00 0.02 0.00 0.00 56.10 54.85 2kgh s TRP 29 Cb -0.16 -1.82 -0.04 0.00 -1.15 0.00 0.00 33.47 30.31 2kgh s TRP 29 CO 0.46 -0.60 1.35 1.03 0.02 0.00 0.00 176.95 179.21 2kgh s ARG 30 N 0.80 4.27 -0.46 4.98 0.52 0.13 -0.19 118.95 129.01 2kgh s ARG 30 Ca -0.07 1.85 -0.28 0.00 -0.52 0.00 0.00 55.73 56.70 2kgh s ARG 30 Cb -0.16 -3.67 -0.00 0.00 0.52 0.00 0.00 34.95 31.65 2kgh s ARG 30 CO -0.02 -0.61 1.58 0.00 0.02 0.00 0.00 175.30 176.27 2kgh s LYS 32 N 5.56 1.23 0.00 0.00 2.47 0.17 -2.25 119.74 126.93 2kgh s LYS 32 Ca 0.65 -1.24 0.00 0.00 -1.56 0.00 0.00 55.97 53.82 2kgh s LYS 32 Cb -0.15 -2.53 0.00 0.00 -1.46 0.00 0.00 37.83 33.69 2kgh s LYS 32 CO 0.29 -0.83 0.00 -0.89 0.16 0.00 0.00 175.35 174.09 2kgh n ILE 33 N 4.63 0.00 0.00 5.43 2.08 -1.26 -1.76 119.36 128.48 2kgh n ILE 33 Ca -0.04 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.27 2kgh n ILE 33 Cb 0.43 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.32 2kgh n ILE 33 CO 0.00 0.00 0.00 0.29 0.56 0.00 0.00 176.55 177.40 2kgh n LYS 34 N 0.00 3.65 -4.15 0.38 4.01 -1.26 -4.42 118.16 116.37 2kgh n LYS 34 Ca 0.00 0.00 -0.22 0.00 -0.51 0.00 0.00 58.31 57.58 2kgh n LYS 34 Cb 0.00 -0.69 -0.06 0.00 -0.51 0.00 0.00 35.03 33.77 2kgh n LYS 34 CO 0.00 0.00 0.00 -0.48 -1.11 0.00 0.00 177.40 175.81 2kgh s LEU 35 N -1.17 3.44 -0.36 -0.35 2.34 -0.72 -5.06 118.68 116.80 2kgh s LEU 35 Ca 0.00 -0.53 -0.21 0.00 0.06 0.00 0.00 54.13 53.44 2kgh s LEU 35 Cb 0.00 -1.97 0.00 0.00 -0.56 0.00 0.00 46.19 43.67 2kgh s LEU 35 CO 0.00 -0.11 0.67 0.00 -1.06 0.00 0.00 176.35 175.85 2kgh s LEU 37 N 2.81 4.13 0.09 0.00 2.96 0.13 -4.82 118.68 123.97 2kgh s LEU 37 Ca 0.26 -1.28 -0.37 0.00 -0.22 0.00 0.00 54.13 52.53 2kgh s LEU 37 Cb -0.14 -1.77 -0.17 0.00 0.50 0.00 0.00 46.19 44.61 2kgh s LEU 37 CO 0.15 -0.30 1.32 2.29 -1.32 0.00 0.00 176.35 178.49 2kgh n LYS 38 N 4.68 1.10 0.00 1.98 2.85 -1.26 0.18 118.16 127.69 2kgh n LYS 38 Ca -0.12 0.40 0.15 0.00 -1.05 0.00 0.00 58.31 57.68 2kgh n LYS 38 Cb 0.44 -2.02 0.67 0.00 -0.65 0.00 0.00 35.03 33.46 2kgh n LYS 38 CO 0.00 0.00 0.00 1.51 -0.05 0.00 0.00 177.40 178.86