#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 0.14 -0.05 2.03 0.11 -1.26 -5.05 120.40 116.32 1skh s VAL 2 Ca 0.00 -1.19 -0.02 0.00 -2.93 0.00 0.00 61.98 57.84 1skh s VAL 2 Cb 0.00 -1.16 -0.27 0.00 -1.53 0.00 0.00 36.38 33.43 1skh s VAL 2 CO 0.00 -0.66 0.65 0.50 -3.33 0.00 0.00 175.10 172.26 1skh h LYS 3 N 3.20 0.22 -1.29 1.54 3.64 -2.07 -3.47 116.57 118.34 1skh h LYS 3 Ca -0.33 -0.38 0.14 0.00 -1.27 0.00 0.00 60.65 58.82 1skh h LYS 3 Cb 1.19 0.14 -0.26 0.00 -0.41 0.00 0.00 32.23 32.88 1skh h LYS 3 CO 0.54 1.05 0.35 -1.12 -2.27 0.00 0.00 179.45 178.00 1skh s SER 4 N -6.86 -0.50 0.25 4.20 0.01 -1.26 -5.01 113.70 104.54 1skh s SER 4 Ca -0.13 0.75 0.25 0.00 1.31 0.00 0.00 55.95 58.13 1skh s SER 4 Cb 0.07 1.35 0.69 0.00 0.21 0.00 0.00 66.02 68.34 1skh s SER 4 CO 0.82 -0.11 1.72 0.50 0.41 0.00 0.00 173.24 176.57 1skh h LYS 5 N 6.53 0.00 0.00 12.44 3.64 -1.99 -2.40 116.57 134.80 1skh h LYS 5 Ca -0.23 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.09 1skh h LYS 5 Cb 1.16 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.97 1skh h LYS 5 CO 0.16 0.00 -0.37 0.82 -2.27 0.00 0.00 179.45 177.78 1skh h ILE 6 N 0.00 0.40 0.03 2.00 2.04 -2.02 -3.27 117.51 116.70 1skh h ILE 6 Ca 0.00 -1.58 -0.25 0.00 1.00 0.00 0.00 64.86 64.03 1skh h ILE 6 Cb 0.79 2.15 -0.03 0.00 -0.74 0.00 0.00 36.82 38.99 1skh h ILE 6 CO 0.00 0.23 -1.35 1.23 0.00 0.00 0.00 178.15 178.25 1skh h GLY 7 N 3.77 0.08 0.76 5.37 0.00 -1.93 -3.34 103.07 107.77 1skh h GLY 7 Ca -0.01 -0.20 0.07 0.00 0.00 0.00 0.00 47.33 47.19 1skh h GLY 7 CO 0.03 0.18 0.55 0.23 0.00 0.00 0.00 176.54 177.53 1skh h SER 8 N -0.75 0.00 -0.71 0.19 0.87 -1.55 0.76 113.55 112.36 1skh h SER 8 Ca -0.34 0.00 0.17 0.00 -1.23 0.00 0.00 61.79 60.39 1skh h SER 8 Cb 1.46 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 63.38 1skh h SER 8 CO -0.13 0.00 0.49 -0.25 -0.53 0.00 0.00 176.83 176.41 1skh h TRP 9 N 0.00 0.26 -0.83 2.24 7.01 -1.68 0.74 115.95 123.68 1skh h TRP 9 Ca 0.12 0.01 0.20 0.00 2.11 0.00 0.00 58.89 61.33 1skh h TRP 9 Cb 1.22 -0.08 -0.14 0.00 -2.10 0.00 0.00 29.16 28.05 1skh h TRP 9 CO 0.00 0.09 0.06 0.97 -2.79 0.00 0.00 178.44 176.77 1skh h ILE 10 N 0.22 0.27 -0.31 2.65 6.09 0.32 0.66 117.51 127.40 1skh h ILE 10 Ca 0.35 -0.04 -0.01 0.00 -1.37 0.00 0.00 64.86 63.79 1skh h ILE 10 Cb 1.05 0.15 -0.01 0.00 0.47 0.00 0.00 36.82 38.48 1skh h ILE 10 CO -0.07 0.02 0.16 -0.07 -3.07 0.00 0.00 178.15 175.12 1skh h LEU 11 N 0.11 0.40 -2.39 2.19 -0.00 -1.04 -0.38 115.31 114.20 1skh h LEU 11 Ca 0.48 -0.10 0.02 0.00 -0.00 0.00 0.00 57.88 58.28 1skh h LEU 11 Cb 0.91 -0.10 -0.00 0.00 -0.00 0.00 0.00 40.66 41.46 1skh h LEU 11 CO -0.72 0.39 0.19 0.58 -0.00 0.00 0.00 178.44 178.88 1skh h VAL 12 N 0.37 0.16 0.01 1.22 2.07 0.23 0.06 116.25 120.36 1skh h VAL 12 Ca 0.11 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.61 1skh h VAL 12 Cb 0.09 0.83 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 1skh h VAL 12 CO -0.02 0.00 -0.07 0.25 0.02 0.00 0.00 177.57 177.75 1skh h LEU 13 N 0.00 0.05 -0.96 2.57 5.85 0.87 -1.86 115.31 121.84 1skh h LEU 13 Ca 0.03 -0.91 0.11 0.00 0.84 0.00 0.00 57.88 57.94 1skh h LEU 13 Cb 0.40 -0.02 -0.08 0.00 0.37 0.00 0.00 40.66 41.34 1skh h LEU 13 CO -0.00 0.96 0.59 -0.26 -0.34 0.00 0.00 178.44 179.39 1skh h PHE 14 N -0.85 1.07 0.00 1.25 -1.00 -0.21 1.47 116.94 118.67 1skh h PHE 14 Ca -0.01 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.80 1skh h PHE 14 Cb 0.97 -0.34 0.00 0.00 3.61 0.00 0.00 35.95 40.19 1skh h PHE 14 CO 0.24 0.45 0.00 -0.39 -1.61 0.00 0.00 178.31 177.00 1skh h VAL 15 N 0.97 0.00 0.09 -0.55 -1.51 -1.33 -1.81 116.25 112.11 1skh h VAL 15 Ca 0.46 -0.49 -0.33 0.00 -1.23 0.00 0.00 66.70 65.11 1skh h VAL 15 Cb 0.41 1.47 -0.02 0.00 -2.13 0.00 0.00 31.29 31.02 1skh h VAL 15 CO -0.25 0.00 -1.81 0.00 -1.23 0.00 0.00 177.57 174.28 1skh h ALA 16 N 2.48 0.48 -0.10 5.19 0.00 0.66 -3.22 119.26 124.76 1skh h ALA 16 Ca 0.00 -1.34 -0.20 0.00 0.00 0.00 0.00 54.91 53.37 1skh h ALA 16 Cb 0.73 0.55 0.01 0.00 0.00 0.00 0.00 17.79 19.08 1skh h ALA 16 CO 0.00 1.34 -0.70 1.98 0.00 0.00 0.00 179.25 181.87 1skh h MET 17 N 0.05 0.65 0.00 0.00 -1.53 0.18 0.61 114.93 114.90 1skh h MET 17 Ca -0.34 -0.57 -0.01 0.00 -3.44 0.00 0.00 59.70 55.34 1skh h MET 17 Cb 2.03 0.13 -0.00 0.00 -0.55 0.00 0.00 31.60 33.20 1skh h MET 17 CO 0.11 1.18 -0.07 2.35 0.14 0.00 0.00 176.91 180.62 1skh h TRP 18 N 0.32 0.00 0.00 1.39 7.01 -1.49 0.24 115.95 123.42 1skh h TRP 18 Ca -0.06 0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.94 1skh h TRP 18 Cb 1.34 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.40 1skh h TRP 18 CO 0.10 0.07 -1.15 0.45 -2.79 0.00 0.00 178.44 175.13 1skh n SER 19 N -3.53 0.59 -0.88 2.65 2.88 -1.10 -3.13 113.62 111.09 1skh n SER 19 Ca -0.02 -0.02 0.12 0.00 -1.33 0.00 0.00 58.87 57.62 1skh n SER 19 Cb 0.19 0.85 0.21 0.00 -0.75 0.00 0.00 64.21 64.72 1skh n SER 19 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1skh n ASP 20 N -2.20 2.73 -0.02 -3.46 8.00 0.19 -3.96 116.55 117.83 1skh n ASP 20 Ca 0.01 -1.89 0.02 0.00 0.71 0.00 0.00 54.79 53.63 1skh n ASP 20 Cb 0.49 -0.05 -0.08 0.00 -0.02 0.00 0.00 41.12 41.46 1skh n ASP 20 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1skh n VAL 21 N 1.10 0.22 -1.05 2.53 0.31 0.61 -4.50 118.33 117.55 1skh n VAL 21 Ca 0.16 -0.30 -0.24 0.00 -0.01 0.00 0.00 64.34 63.95 1skh n VAL 21 Cb 0.54 -0.07 0.06 0.00 -0.91 0.00 0.00 33.84 33.46 1skh n VAL 21 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1skh n GLY 22 N 2.05 4.78 1.96 2.92 0.00 -1.18 -4.13 105.19 111.59 1skh n GLY 22 Ca -0.07 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.40 1skh n GLY 22 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1skh n LEU 23 N -0.15 -0.13 -4.00 0.99 -0.00 -1.26 -4.75 117.00 107.70 1skh n LEU 23 Ca 0.43 0.47 -0.42 0.00 -0.00 0.00 0.00 56.01 56.48 1skh n LEU 23 Cb 0.62 0.38 0.00 0.00 -0.00 0.00 0.00 43.42 44.42 1skh n LEU 23 CO 0.54 -0.78 1.03 0.00 -0.00 0.00 0.00 177.39 178.18 1skh n LYS 25 N 1.43 0.00 -2.41 0.00 4.81 -1.26 -4.97 118.16 115.76 1skh n LYS 25 Ca 0.26 0.00 -0.41 0.00 -0.87 0.00 0.00 58.31 57.29 1skh n LYS 25 Cb 0.34 0.00 0.03 0.00 0.02 0.00 0.00 35.03 35.42 1skh n LYS 25 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 1skh n LYS 26 N 0.00 4.60 -4.16 1.64 4.81 -1.26 -4.97 118.16 118.81 1skh n LYS 26 Ca 0.00 -4.31 -0.30 0.00 -0.87 0.00 0.00 58.31 52.83 1skh n LYS 26 Cb 0.00 -2.41 -0.09 0.00 0.02 0.00 0.00 35.03 32.56 1skh n LYS 26 CO 0.00 0.00 0.00 -0.98 1.17 0.00 0.00 177.40 177.59 1skh s ARG 27 N -4.25 2.39 -0.64 1.64 1.70 -1.26 -4.80 118.95 113.73 1skh s ARG 27 Ca 0.43 -0.91 -0.27 0.00 -0.47 0.00 0.00 55.73 54.51 1skh s ARG 27 Cb 0.27 -2.45 0.01 0.00 -0.57 0.00 0.00 34.95 32.20 1skh s ARG 27 CO -0.22 0.53 1.54 -1.25 -1.08 0.00 0.00 175.30 174.82 1skh s PRO 28 N -2.29 3.00 -0.03 3.89 0.04 -1.26 -4.86 135.00 133.50 1skh s PRO 28 Ca 0.24 0.28 -0.23 0.00 0.04 0.00 0.00 61.00 61.33 1skh s PRO 28 Cb -0.11 -4.25 -0.17 0.00 0.04 0.00 0.00 34.50 30.01 1skh s PRO 28 CO 0.17 -2.32 1.03 -0.22 0.04 0.00 0.00 177.00 175.70 1skh h LYS 29 N 12.21 -0.23 0.00 4.56 3.64 -1.98 -3.55 116.57 131.23 1skh h LYS 29 Ca -0.27 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.12 1skh h LYS 29 Cb 1.10 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 1skh h LYS 29 CO 1.23 0.19 0.00 -0.35 -2.27 0.00 0.00 179.45 178.25