#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1skh s VAL 2 N 0.00 0.77 -0.28 1.12 1.01 -1.26 -5.05 120.40 116.70 1skh s VAL 2 Ca 0.00 -2.00 0.13 0.00 0.00 0.00 0.00 61.98 60.10 1skh s VAL 2 Cb 0.00 -2.50 -0.17 0.00 0.00 0.00 0.00 36.38 33.71 1skh s VAL 2 CO 0.00 -0.16 0.40 1.17 0.00 0.00 0.00 175.10 176.51 1skh n LYS 3 N -0.44 1.55 0.00 2.72 4.81 -1.26 -4.93 118.16 120.60 1skh n LYS 3 Ca -0.03 -0.06 0.00 0.00 -0.87 0.00 0.00 58.31 57.35 1skh n LYS 3 Cb 0.65 -1.21 0.00 0.00 0.02 0.00 0.00 35.03 34.50 1skh n LYS 3 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 1skh n SER 4 N -1.64 0.00 -2.54 3.14 7.64 -1.26 -5.01 113.62 113.95 1skh n SER 4 Ca -0.00 0.00 -0.24 0.00 1.01 0.00 0.00 58.87 59.64 1skh n SER 4 Cb 0.27 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.37 1skh n SER 4 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1skh n LYS 5 N 0.00 2.73 0.00 1.43 5.02 -1.26 -4.69 118.16 121.39 1skh n LYS 5 Ca 0.00 -1.68 0.00 0.00 -2.02 0.00 0.00 58.31 54.61 1skh n LYS 5 Cb 0.00 -2.29 0.00 0.00 -0.02 0.00 0.00 35.03 32.72 1skh n LYS 5 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1skh n ILE 6 N 2.57 0.00 -0.30 -0.18 5.41 -1.26 -2.92 119.36 122.67 1skh n ILE 6 Ca 0.56 0.00 0.30 0.00 1.00 0.00 0.00 62.75 64.61 1skh n ILE 6 Cb 0.63 -0.31 0.67 0.00 -0.71 0.00 0.00 39.64 39.92 1skh n ILE 6 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 1skh h GLY 7 N 0.00 0.40 2.00 7.39 0.00 -1.99 1.44 103.07 112.31 1skh h GLY 7 Ca 0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 47.33 47.26 1skh h GLY 7 CO 0.00 -0.05 -0.03 1.76 0.00 0.00 0.00 176.54 178.23 1skh h SER 8 N 0.13 0.00 0.15 0.19 0.02 -1.85 0.15 113.55 112.33 1skh h SER 8 Ca 0.56 0.00 -0.34 0.00 -0.84 0.00 0.00 61.79 61.17 1skh h SER 8 Cb 1.95 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 64.49 1skh h SER 8 CO -0.10 0.03 -1.76 -0.25 -1.14 0.00 0.00 176.83 173.60 1skh h TRP 9 N 0.00 0.58 -0.11 3.45 2.91 0.21 -3.15 115.95 119.85 1skh h TRP 9 Ca -0.00 -0.43 -0.01 0.00 1.13 0.00 0.00 58.89 59.58 1skh h TRP 9 Cb 0.11 -0.02 -0.01 0.00 -0.51 0.00 0.00 29.16 28.73 1skh h TRP 9 CO 0.00 1.69 0.00 0.82 -1.03 0.00 0.00 178.44 179.92 1skh h ILE 10 N -0.00 1.07 0.10 2.65 1.08 -0.67 -1.07 117.51 120.67 1skh h ILE 10 Ca -0.36 -0.27 -0.00 0.00 -0.39 0.00 0.00 64.86 63.83 1skh h ILE 10 Cb 2.00 0.99 0.00 0.00 -3.07 0.00 0.00 36.82 36.74 1skh h ILE 10 CO 0.12 0.09 -0.05 -0.07 -0.69 0.00 0.00 178.15 177.55 1skh h LEU 11 N 0.15 -0.11 -2.77 1.44 -0.00 -0.84 -1.26 115.31 111.91 1skh h LEU 11 Ca 0.04 -0.34 0.00 0.00 -0.00 0.00 0.00 57.88 57.58 1skh h LEU 11 Cb 0.10 0.03 0.00 0.00 -0.00 0.00 0.00 40.66 40.79 1skh h LEU 11 CO 0.00 0.30 0.01 0.58 -0.00 0.00 0.00 178.44 179.33 1skh h VAL 12 N -0.55 0.00 0.06 1.22 2.07 -1.37 -1.37 116.25 116.31 1skh h VAL 12 Ca -0.01 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.50 1skh h VAL 12 Cb 0.45 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.14 1skh h VAL 12 CO 0.02 0.00 -0.03 -0.07 0.02 0.00 0.00 177.57 177.52 1skh h LEU 13 N 0.00 -0.06 -1.31 2.57 3.38 -0.76 0.07 115.31 119.20 1skh h LEU 13 Ca 0.00 -0.45 0.14 0.00 0.09 0.00 0.00 57.88 57.66 1skh h LEU 13 Cb 0.03 0.02 -0.07 0.00 0.09 0.00 0.00 40.66 40.72 1skh h LEU 13 CO 0.00 0.62 0.57 -0.26 0.09 0.00 0.00 178.44 179.46 1skh h PHE 14 N -0.96 0.79 0.00 1.13 0.04 -0.41 1.55 116.94 119.08 1skh h PHE 14 Ca -0.01 0.02 -0.10 0.00 2.80 0.00 0.00 57.97 60.69 1skh h PHE 14 Cb 0.51 -0.25 -0.01 0.00 2.20 0.00 0.00 35.95 38.40 1skh h PHE 14 CO 0.12 0.29 -0.59 -0.39 -0.60 0.00 0.00 178.31 177.15 1skh h VAL 15 N 0.67 0.71 0.11 -0.55 -1.51 -1.36 -2.69 116.25 111.62 1skh h VAL 15 Ca 0.44 -2.04 -0.26 0.00 -1.23 0.00 0.00 66.70 63.61 1skh h VAL 15 Cb 0.74 2.31 0.00 0.00 -2.13 0.00 0.00 31.29 32.20 1skh h VAL 15 CO -0.20 0.40 -1.20 0.00 -1.23 0.00 0.00 177.57 175.35 1skh h ALA 16 N 1.55 0.14 -0.10 5.19 0.00 0.17 -1.44 119.26 124.78 1skh h ALA 16 Ca -0.02 -0.88 -0.16 0.00 0.00 0.00 0.00 54.91 53.85 1skh h ALA 16 Cb 1.36 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 1skh h ALA 16 CO 0.05 1.00 -0.62 1.98 0.00 0.00 0.00 179.25 181.67 1skh h MET 17 N 0.07 0.34 0.00 0.00 -1.53 0.20 -2.79 114.93 111.22 1skh h MET 17 Ca -0.12 -0.24 -0.08 0.00 -3.44 0.00 0.00 59.70 55.82 1skh h MET 17 Cb 1.93 0.04 -0.01 0.00 -0.55 0.00 0.00 31.60 33.00 1skh h MET 17 CO 0.19 0.85 -0.48 2.35 0.14 0.00 0.00 176.91 179.96 1skh h TRP 18 N 0.25 0.00 0.00 1.39 7.01 -1.52 -2.33 115.95 120.75 1skh h TRP 18 Ca -0.01 0.00 -0.02 0.00 2.11 0.00 0.00 58.89 60.97 1skh h TRP 18 Cb 1.14 0.00 -0.00 0.00 -2.10 0.00 0.00 29.16 28.20 1skh h TRP 18 CO 0.03 0.38 -0.08 1.03 -2.79 0.00 0.00 178.44 177.00 1skh h SER 19 N 0.00 0.00 0.10 2.65 0.87 -0.98 -0.29 113.55 115.90 1skh h SER 19 Ca -0.02 0.00 -0.36 0.00 -1.23 0.00 0.00 61.79 60.18 1skh h SER 19 Cb 1.30 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 63.20 1skh h SER 19 CO 0.05 0.08 -2.25 -0.90 -0.53 0.00 0.00 176.83 173.29 1skh n ASP 20 N -3.33 1.01 0.27 6.23 5.68 -1.14 -4.09 116.55 121.18 1skh n ASP 20 Ca -0.01 0.06 0.15 0.00 -0.50 0.00 0.00 54.79 54.49 1skh n ASP 20 Cb 0.27 0.16 0.72 0.00 -1.14 0.00 0.00 41.12 41.13 1skh n ASP 20 CO 0.00 0.00 0.00 0.58 -1.33 0.00 0.00 177.20 176.45 1skh h VAL 21 N 0.01 0.30 0.00 2.12 2.07 -1.09 -3.32 116.25 116.34 1skh h VAL 21 Ca -0.50 -0.59 0.00 0.00 0.82 0.00 0.00 66.70 66.43 1skh h VAL 21 Cb 2.08 1.45 0.00 0.00 -1.52 0.00 0.00 31.29 33.30 1skh h VAL 21 CO 0.01 0.09 0.00 0.61 0.02 0.00 0.00 177.57 178.30 1skh n GLY 22 N -0.30 -2.47 0.61 2.17 0.00 -0.15 -0.14 105.19 104.90 1skh n GLY 22 Ca -0.01 0.48 0.44 0.00 0.00 0.00 0.00 46.02 46.92 1skh n GLY 22 CO 0.00 0.00 0.00 0.17 0.00 0.00 0.00 173.32 173.49 1skh h LEU 23 N 0.00 0.04 -6.81 0.99 8.10 -1.83 -2.43 115.31 113.38 1skh h LEU 23 Ca 0.00 0.02 -0.73 0.00 0.11 0.00 0.00 57.88 57.28 1skh h LEU 23 Cb 0.00 0.02 -0.12 0.00 -0.44 0.00 0.00 40.66 40.12 1skh h LEU 23 CO 0.00 -0.02 2.22 0.00 -4.11 0.00 0.00 178.44 176.53 1skh n LYS 25 N 5.54 0.00 0.00 0.00 3.00 -0.91 -4.80 118.16 120.98 1skh n LYS 25 Ca 0.44 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.75 1skh n LYS 25 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.43 1skh n LYS 25 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1skh n LYS 26 N 0.00 0.00 -1.08 1.64 5.02 -1.20 -4.87 118.16 117.67 1skh n LYS 26 Ca 0.00 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.93 1skh n LYS 26 Cb 0.00 0.00 0.03 0.00 -0.02 0.00 0.00 35.03 35.04 1skh n LYS 26 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1skh n ARG 27 N 0.00 0.00 -2.50 1.97 0.63 -1.26 -4.85 116.66 110.65 1skh n ARG 27 Ca 0.00 0.00 -0.40 0.00 -0.92 0.00 0.00 57.85 56.53 1skh n ARG 27 Cb 0.00 -0.97 -0.04 0.00 0.45 0.00 0.00 32.46 31.89 1skh n ARG 27 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 1skh s PRO 28 N -1.51 4.64 0.18 -0.14 0.04 -1.26 -5.00 135.00 131.95 1skh s PRO 28 Ca 0.46 1.76 0.04 0.00 0.04 0.00 0.00 61.00 63.31 1skh s PRO 28 Cb -0.32 -3.22 -0.04 0.00 0.04 0.00 0.00 34.50 30.97 1skh s PRO 28 CO 0.73 0.19 0.24 -1.59 0.04 0.00 0.00 177.00 176.62 1skh s LYS 29 N -1.12 3.22 0.00 4.56 -2.85 -1.26 -5.13 119.74 117.16 1skh s LYS 29 Ca 0.46 -0.75 0.24 0.00 -1.00 0.00 0.00 55.97 54.92 1skh s LYS 29 Cb -0.31 -2.81 1.44 0.00 -2.06 0.00 0.00 37.83 34.08 1skh s LYS 29 CO 0.39 0.49 1.80 -0.35 0.10 0.00 0.00 175.35 177.77