#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 1.56 -1.16 1.39 -0.71 -1.26 -4.89 117.98 112.91 2kgh s PHE 2 Ca 0.00 0.62 -0.19 0.00 -1.04 0.00 0.00 56.93 56.32 2kgh s PHE 2 Cb 0.00 -4.04 0.08 0.00 -1.21 0.00 0.00 43.02 37.85 2kgh s PHE 2 CO 0.00 -3.33 1.55 -1.21 -1.34 0.00 0.00 175.22 170.88 2kgh s GLU 3 N 5.99 3.84 0.03 1.99 2.02 -1.26 -4.56 118.70 126.75 2kgh s GLU 3 Ca 0.87 -1.77 0.22 0.00 0.02 0.00 0.00 54.97 54.32 2kgh s GLU 3 Cb -0.26 -5.36 -0.23 0.00 0.10 0.00 0.00 34.13 28.38 2kgh s GLU 3 CO 0.34 -2.13 0.67 0.00 0.02 0.00 0.00 175.26 174.15 2kgh n VAL 5 N -2.28-11.28 -2.08 0.00 0.31 -1.26 -4.48 118.33 97.27 2kgh n VAL 5 Ca -0.02 2.47 -0.40 0.00 -0.01 0.00 0.00 64.34 66.37 2kgh n VAL 5 Cb 0.54 -5.74 -0.00 0.00 -0.91 0.00 0.00 33.84 27.73 2kgh n VAL 5 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 2kgh n PHE 6 N 1.45 2.65 1.47 3.52 7.35 -1.26 -4.15 117.46 128.49 2kgh n PHE 6 Ca -0.15 -2.81 0.14 0.00 -0.76 0.00 0.00 57.45 53.88 2kgh n PHE 6 Cb 0.23 -1.83 0.67 0.00 0.35 0.00 0.00 39.48 38.90 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 2.02 0.35 -1.28 -2.13 7.64 -1.26 -4.76 113.62 114.20 2kgh n SER 7 Ca 0.58 -0.55 -0.16 0.00 1.01 0.00 0.00 58.87 59.75 2kgh n SER 7 Cb 0.27 -0.11 -0.07 0.00 -1.01 0.00 0.00 64.21 63.29 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 -2.50 4.73 0.00 0.00 1.01 -1.26 -4.71 116.67 113.94 2kgh s ASP 9 Ca 0.00 2.36 0.25 0.00 0.71 0.00 0.00 52.55 55.87 2kgh s ASP 9 Cb 0.00 -2.59 1.23 0.00 1.01 0.00 0.00 42.92 42.57 2kgh s ASP 9 CO 0.00 -1.91 1.84 2.30 0.21 0.00 0.00 175.17 177.61 2kgh n ILE 10 N -2.16 0.21 -0.13 0.77 -5.35 -1.26 -1.08 119.36 110.35 2kgh n ILE 10 Ca 0.13 0.05 -0.25 0.00 -0.27 0.00 0.00 62.75 62.42 2kgh n ILE 10 Cb 0.50 -0.63 -0.11 0.00 -1.74 0.00 0.00 39.64 37.66 2kgh n ILE 10 CO 0.00 0.00 0.00 2.29 -1.76 0.00 0.00 176.55 177.08 2kgh n LYS 11 N -1.33 0.62 0.06 6.28 0.00 -1.26 -4.62 118.16 117.90 2kgh n LYS 11 Ca 0.11 0.21 -0.21 0.00 -0.00 0.00 0.00 58.31 58.42 2kgh n LYS 11 Cb 0.22 -1.51 -0.15 0.00 -0.00 0.00 0.00 35.03 33.60 2kgh n LYS 11 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.40 178.97 2kgh h LYS 12 N -0.56 0.34 0.00 -1.58 2.10 -1.90 -3.47 116.57 111.49 2kgh h LYS 12 Ca -0.65 -0.58 0.00 0.00 -2.00 0.00 0.00 60.65 57.42 2kgh h LYS 12 Cb 1.74 0.22 0.00 0.00 -0.90 0.00 0.00 32.23 33.29 2kgh h LYS 12 CO -0.28 1.24 0.00 0.39 -2.00 0.00 0.00 179.45 178.81 2kgh n GLU 13 N -3.53 1.78 0.00 0.07 -0.58 -0.24 -4.89 120.64 113.25 2kgh n GLU 13 Ca -0.24 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.50 2kgh n GLU 13 Cb 1.07 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.94 2kgh n GLU 13 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2kgh n GLY 14 N 5.00 0.85 0.00 0.62 0.00 -1.23 -4.28 105.19 106.16 2kgh n GLY 14 Ca 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.23 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 0.00 -2.47 1.61 2.85 -0.49 -4.85 118.16 114.81 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 -0.02 0.00 -0.65 0.00 0.00 35.03 34.36 2kgh n LYS 15 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 2kgh s PRO 16 N -2.00 3.47 0.00 -1.58 0.04 -1.26 -1.03 135.00 132.64 2kgh s PRO 16 Ca 0.00 0.50 0.00 0.00 0.04 0.00 0.00 61.00 61.54 2kgh s PRO 16 Cb 0.00 -4.04 0.00 0.00 0.04 0.00 0.00 34.50 30.50 2kgh s PRO 16 CO 0.00 -1.72 0.00 0.00 0.04 0.00 0.00 177.00 175.32 2kgh s LYS 18 N 4.65 2.70 0.97 0.00 0.00 -1.26 -2.47 119.74 124.33 2kgh s LYS 18 Ca 0.00 -0.74 -0.16 0.00 0.00 0.00 0.00 55.97 55.07 2kgh s LYS 18 Cb 0.00 -2.18 0.22 0.00 0.00 0.00 0.00 37.83 35.87 2kgh s LYS 18 CO 0.00 0.01 1.32 -0.35 0.00 0.00 0.00 175.35 176.33 2kgh n PRO 19 N 4.00 -1.27 -0.11 1.78 -0.04 -1.26 -4.43 135.00 133.67 2kgh n PRO 19 Ca -0.20 -2.08 -0.19 0.00 -0.04 0.00 0.00 63.50 61.00 2kgh n PRO 19 Cb 0.52 -1.35 -0.07 0.00 -0.04 0.00 0.00 33.50 32.56 2kgh n PRO 19 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2kgh n LYS 20 N -3.79 0.55 -0.84 0.54 3.00 -1.26 -4.81 118.16 111.55 2kgh n LYS 20 Ca 0.17 0.32 -0.01 0.00 -0.00 0.00 0.00 58.31 58.78 2kgh n LYS 20 Cb 0.58 -1.53 -0.02 0.00 0.00 0.00 0.00 35.03 34.06 2kgh n LYS 20 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2kgh n GLY 21 N 1.39 0.75 3.52 3.14 0.00 -1.26 -5.03 105.19 107.70 2kgh n GLY 21 Ca -0.32 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.12 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 3.64 0.10 1.61 8.01 -1.26 -4.71 118.70 126.09 2kgh s GLU 22 Ca 0.06 -1.46 0.26 0.00 0.01 0.00 0.00 54.97 53.85 2kgh s GLU 22 Cb 0.07 -5.20 0.79 0.00 -4.31 0.00 0.00 34.13 25.48 2kgh s GLU 22 CO -0.03 -2.04 1.67 1.17 0.01 0.00 0.00 175.26 176.04 2kgh n LYS 23 N 7.91 0.15 0.24 1.61 4.81 -1.26 -3.37 118.16 128.25 2kgh n LYS 23 Ca 0.31 0.09 0.10 0.00 -0.87 0.00 0.00 58.31 57.94 2kgh n LYS 23 Cb 0.50 -1.65 0.61 0.00 0.02 0.00 0.00 35.03 34.51 2kgh n LYS 23 CO 0.00 0.00 0.00 1.57 1.17 0.00 0.00 177.40 180.14 2kgh h LYS 24 N 0.00 0.00 -5.93 1.64 2.10 -1.99 -3.43 116.57 108.96 2kgh h LYS 24 Ca 0.00 0.00 -0.66 0.00 -2.00 0.00 0.00 60.65 57.99 2kgh h LYS 24 Cb 0.64 0.00 -0.09 0.00 -0.90 0.00 0.00 32.23 31.87 2kgh h LYS 24 CO 0.00 0.18 -0.56 0.00 -2.00 0.00 0.00 179.45 177.08 2kgh s THR 26 N -1.16 0.68 0.00 0.00 -1.32 -1.26 -4.96 115.64 107.61 2kgh s THR 26 Ca 0.22 -0.88 0.00 0.00 -1.21 0.00 0.00 61.69 59.82 2kgh s THR 26 Cb -0.12 -0.67 0.00 0.00 -1.51 0.00 0.00 72.50 70.20 2kgh s THR 26 CO 0.12 -0.17 0.00 0.61 -2.21 0.00 0.00 174.62 172.97 2kgh n GLY 27 N 1.89 1.69 3.36 6.08 0.00 -1.26 -4.02 105.19 112.94 2kgh n GLY 27 Ca -0.19 -0.34 -0.36 0.00 0.00 0.00 0.00 46.02 45.13 2kgh n GLY 27 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2kgh s GLY 28 N 0.00 1.71 -0.76 -0.02 0.00 -1.26 -4.98 107.32 102.00 2kgh s GLY 28 Ca 0.00 -1.24 -0.18 0.00 0.00 0.00 0.00 44.72 43.30 2kgh s GLY 28 CO 0.00 0.53 0.87 -0.98 0.00 0.00 0.00 173.10 173.52 2kgh s TRP 29 N 1.53 3.21 -0.01 1.90 0.51 -1.03 -0.80 118.94 124.25 2kgh s TRP 29 Ca 0.05 -1.34 -0.28 0.00 -2.12 0.00 0.00 56.10 52.41 2kgh s TRP 29 Cb -0.15 -4.07 -0.03 0.00 -0.81 0.00 0.00 33.47 28.40 2kgh s TRP 29 CO 0.01 -1.30 0.91 1.03 -0.51 0.00 0.00 176.95 177.09 2kgh s ARG 30 N 2.13 4.54 -0.07 4.98 0.52 -0.63 -0.22 118.95 130.19 2kgh s ARG 30 Ca 0.20 1.29 -0.28 0.00 -0.52 0.00 0.00 55.73 56.42 2kgh s ARG 30 Cb -0.14 -3.45 -0.02 0.00 0.52 0.00 0.00 34.95 31.86 2kgh s ARG 30 CO -0.02 0.00 0.93 0.00 0.02 0.00 0.00 175.30 176.23 2kgh s LYS 32 N 1.53 1.39 0.00 0.00 2.20 0.74 -1.40 119.74 124.20 2kgh s LYS 32 Ca 0.47 -2.19 0.00 0.00 -0.36 0.00 0.00 55.97 53.88 2kgh s LYS 32 Cb -0.19 -2.35 0.00 0.00 -1.51 0.00 0.00 37.83 33.78 2kgh s LYS 32 CO 0.20 -1.21 0.00 0.44 -0.36 0.00 0.00 175.35 174.43 2kgh n ILE 33 N 3.25 0.00 -0.02 5.43 -5.35 -1.26 -2.49 119.36 118.91 2kgh n ILE 33 Ca 0.13 0.00 -0.04 0.00 -0.27 0.00 0.00 62.75 62.57 2kgh n ILE 33 Cb 0.36 0.00 -0.02 0.00 -1.74 0.00 0.00 39.64 38.24 2kgh n ILE 33 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96 2kgh n LYS 34 N 0.00 0.11 -2.63 6.28 4.81 -1.26 -4.91 118.16 120.57 2kgh n LYS 34 Ca 0.00 0.03 -0.06 0.00 -0.87 0.00 0.00 58.31 57.41 2kgh n LYS 34 Cb 0.00 -0.93 -0.02 0.00 0.02 0.00 0.00 35.03 34.09 2kgh n LYS 34 CO 0.00 0.00 0.00 1.47 1.17 0.00 0.00 177.40 180.04 2kgh n LEU 35 N -2.86 0.00 -4.75 3.14 -0.00 -1.04 -5.13 117.00 106.36 2kgh n LEU 35 Ca -0.09 -1.04 -0.37 0.00 -0.00 0.00 0.00 56.01 54.51 2kgh n LEU 35 Cb 0.58 0.68 -0.07 0.00 -0.00 0.00 0.00 43.42 44.62 2kgh n LEU 35 CO 0.03 -0.20 0.04 0.00 -0.00 0.00 0.00 177.39 177.27 2kgh s LEU 37 N 0.19 1.28 0.34 0.00 2.96 0.11 -4.91 118.68 118.65 2kgh s LEU 37 Ca 0.20 -0.57 -0.28 0.00 -0.22 0.00 0.00 54.13 53.26 2kgh s LEU 37 Cb -0.14 -0.73 -0.13 0.00 0.50 0.00 0.00 46.19 45.69 2kgh s LEU 37 CO 0.07 -0.21 1.20 2.29 -1.32 0.00 0.00 176.35 178.38 2kgh n LYS 38 N 4.98 1.89 0.00 1.98 2.85 -1.26 -1.61 118.16 126.98 2kgh n LYS 38 Ca -0.10 0.66 0.08 0.00 -1.05 0.00 0.00 58.31 57.90 2kgh n LYS 38 Cb 0.48 -2.20 0.06 0.00 -0.65 0.00 0.00 35.03 32.73 2kgh n LYS 38 CO 0.00 0.00 0.00 1.51 -0.05 0.00 0.00 177.40 178.86