#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ckz s PRO 2 N 0.00 3.23 0.23 2.12 0.04 -1.26 -4.94 135.00 134.42 1ckz s PRO 2 Ca 0.00 0.60 -0.19 0.00 0.04 0.00 0.00 61.00 61.45 1ckz s PRO 2 Cb 0.00 -4.16 0.03 0.00 0.04 0.00 0.00 34.50 30.41 1ckz s PRO 2 CO 0.00 -2.01 0.61 0.20 0.04 0.00 0.00 177.00 175.84 1ckz s GLY 3 N 5.04 -0.10 -0.33 0.56 0.00 -1.26 -5.03 107.32 106.20 1ckz s GLY 3 Ca 0.58 -0.22 -0.01 0.00 0.00 0.00 0.00 44.72 45.07 1ckz s GLY 3 CO 0.26 -0.17 2.04 -0.37 0.00 0.00 0.00 173.10 174.85 1ckz n THR 4 N -0.40 2.82 -1.79 0.90 5.66 -1.26 -4.37 114.28 115.84 1ckz n THR 4 Ca -0.08 -1.73 -0.29 0.00 -3.05 0.00 0.00 64.05 58.91 1ckz n THR 4 Cb 0.61 -1.34 0.04 0.00 -1.55 0.00 0.00 70.33 68.10 1ckz n THR 4 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 175.07 171.64 1ckz n ILE 5 N 0.32 2.95 -2.68 1.09 5.41 -1.26 -4.62 119.36 120.57 1ckz n ILE 5 Ca 0.32 -3.80 -0.08 0.00 1.00 0.00 0.00 62.75 60.19 1ckz n ILE 5 Cb 0.58 -1.16 0.07 0.00 -0.71 0.00 0.00 39.64 38.42 1ckz n ILE 5 CO 0.00 0.00 0.00 2.29 0.00 0.00 0.00 176.55 178.84 1ckz n LYS 6 N -0.77 1.20 -3.60 0.38 2.85 -1.26 -4.99 118.16 111.97 1ckz n LYS 6 Ca 0.51 -2.67 -0.26 0.00 -1.05 0.00 0.00 58.31 54.84 1ckz n LYS 6 Cb 0.82 -0.76 0.03 0.00 -0.65 0.00 0.00 35.03 34.48 1ckz n LYS 6 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1ckz n GLU 7 N -0.34 -1.30 -2.23 -1.58 1.02 -1.26 -4.90 120.64 110.05 1ckz n GLU 7 Ca 0.04 0.65 -0.27 0.00 -0.02 0.00 0.00 57.16 57.55 1ckz n GLU 7 Cb 0.83 -4.16 0.01 0.00 -0.02 0.00 0.00 31.44 28.10 1ckz n GLU 7 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1ckz n ASN 8 N -2.57 5.15 -0.00 1.62 4.05 -1.26 -4.42 115.26 117.83 1ckz n ASN 8 Ca -0.11 -3.74 0.11 0.00 0.45 0.00 0.00 54.58 51.29 1ckz n ASN 8 Cb 0.59 -0.49 -0.15 0.00 1.23 0.00 0.00 39.78 40.96 1ckz n ASN 8 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 177.26 173.83 1ckz n ILE 9 N -0.58 0.05 -1.59 -1.44 -0.00 -1.26 -4.29 119.36 110.25 1ckz n ILE 9 Ca 0.43 -0.47 0.06 0.00 -0.00 0.00 0.00 62.75 62.77 1ckz n ILE 9 Cb 0.73 0.03 0.21 0.00 -0.00 0.00 0.00 39.64 40.61 1ckz n ILE 9 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1ckz n ILE 10 N -2.24 2.18 -0.78 1.39 0.13 -1.26 -4.92 119.36 113.86 1ckz n ILE 10 Ca -0.03 -3.20 0.00 0.00 -1.10 0.00 0.00 62.75 58.42 1ckz n ILE 10 Cb 0.55 -0.23 0.00 0.00 -0.84 0.00 0.00 39.64 39.12 1ckz n ILE 10 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1ckz n GLY 11 N -1.12 0.17 5.00 4.50 0.00 -1.26 -4.06 105.19 108.42 1ckz n GLY 11 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 1ckz n GLY 11 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ckz n VAL 12 N -2.09 0.00 -2.31 1.61 0.31 -1.26 -4.74 118.33 109.84 1ckz n VAL 12 Ca 0.00 0.00 -0.34 0.00 -0.01 0.00 0.00 64.34 63.99 1ckz n VAL 12 Cb 0.17 0.00 -0.04 0.00 -0.91 0.00 0.00 33.84 33.06 1ckz n VAL 12 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1ckz s SER 13 N 0.00 5.85 -0.34 4.52 0.15 -1.26 -4.65 113.70 117.98 1ckz s SER 13 Ca 0.00 -1.21 0.16 0.00 0.70 0.00 0.00 55.95 55.60 1ckz s SER 13 Cb 0.00 -2.57 0.44 0.00 -1.71 0.00 0.00 66.02 62.19 1ckz s SER 13 CO 0.00 -2.12 1.12 0.00 1.20 0.00 0.00 173.24 173.45 1ckz n TYR 14 N 11.38 -0.06 -1.99 3.44 9.36 -1.26 -4.92 117.16 133.11 1ckz n TYR 14 Ca 0.38 -2.39 -0.19 0.00 3.32 0.00 0.00 57.90 59.02 1ckz n TYR 14 Cb 0.49 0.32 0.05 0.00 -0.63 0.00 0.00 39.34 39.57 1ckz n TYR 14 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 1ckz n ASP 15 N -0.38 4.31 -2.78 2.98 -0.08 -1.26 -4.66 116.55 114.68 1ckz n ASP 15 Ca 0.04 -3.70 -0.01 0.00 -1.51 0.00 0.00 54.79 49.61 1ckz n ASP 15 Cb 0.83 -0.37 0.07 0.00 2.34 0.00 0.00 41.12 43.99 1ckz n ASP 15 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 1ckz n GLU 16 N -0.76 1.60 -4.08 -0.67 2.13 -1.26 -4.96 120.64 112.64 1ckz n GLU 16 Ca 0.39 -2.84 -0.33 0.00 0.66 0.00 0.00 57.16 55.04 1ckz n GLU 16 Cb 0.92 -1.01 -0.01 0.00 0.27 0.00 0.00 31.44 31.62 1ckz n GLU 16 CO 0.00 0.00 0.00 0.98 -0.41 0.00 0.00 177.13 177.70 1ckz n TYR 17 N -0.84 -1.93 -4.02 4.31 4.19 -1.26 0.51 117.16 118.11 1ckz n TYR 17 Ca 0.00 0.83 -0.43 0.00 3.31 0.00 0.00 57.90 61.61 1ckz n TYR 17 Cb 0.82 -3.41 0.02 0.00 0.49 0.00 0.00 39.34 37.26 1ckz n TYR 17 CO 0.00 0.00 0.00 -2.13 0.91 0.00 0.00 176.86 175.64 1ckz n ARG 18 N -4.49 -0.52 -1.59 2.98 0.63 -1.26 -2.83 116.66 109.59 1ckz n ARG 18 Ca 0.02 0.15 -0.01 0.00 -0.92 0.00 0.00 57.85 57.09 1ckz n ARG 18 Cb 0.53 -2.91 0.00 0.00 0.45 0.00 0.00 32.46 30.53 1ckz n ARG 18 CO 0.00 0.00 0.00 0.98 -2.51 0.00 0.00 177.63 176.10 1ckz n TYR 19 N -4.87 -0.14 -0.25 -0.14 9.36 -0.33 -4.86 117.16 115.94 1ckz n TYR 19 Ca -0.12 0.05 0.00 0.00 3.32 0.00 0.00 57.90 61.14 1ckz n TYR 19 Cb 0.58 -2.38 0.00 0.00 -0.63 0.00 0.00 39.34 36.91 1ckz n TYR 19 CO 0.00 0.00 0.00 -2.13 0.22 0.00 0.00 176.86 174.95 1ckz n ARG 20 N -1.47 0.50 -0.31 2.98 0.63 0.18 -3.37 116.66 115.80 1ckz n ARG 20 Ca -0.00 0.00 0.08 0.00 -0.92 0.00 0.00 57.85 57.00 1ckz n ARG 20 Cb 0.50 -1.25 0.18 0.00 0.45 0.00 0.00 32.46 32.35 1ckz n ARG 20 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 1ckz n SER 21 N 1.75 2.59 0.00 6.15 7.64 -1.26 -4.58 113.62 125.91 1ckz n SER 21 Ca 0.00 -3.28 0.00 0.00 1.01 0.00 0.00 58.87 56.60 1ckz n SER 21 Cb 0.25 -0.49 0.00 0.00 -1.01 0.00 0.00 64.21 62.96 1ckz n SER 21 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1ckz n VAL 22 N -1.16 0.00 -2.67 0.44 0.31 -1.22 -4.88 118.33 109.16 1ckz n VAL 22 Ca 0.19 0.00 -0.28 0.00 -0.01 0.00 0.00 64.34 64.24 1ckz n VAL 22 Cb 0.74 -0.15 -0.02 0.00 -0.91 0.00 0.00 33.84 33.51 1ckz n VAL 22 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1ckz n ILE 23 N -0.72 2.93 -1.54 2.52 -0.00 -1.26 -4.90 119.36 116.39 1ckz n ILE 23 Ca 0.00 -5.25 -0.33 0.00 -0.00 0.00 0.00 62.75 57.17 1ckz n ILE 23 Cb 0.08 -1.34 -0.05 0.00 -0.00 0.00 0.00 39.64 38.34 1ckz n ILE 23 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.55 177.72 1ckz n LYS 24 N -0.36 3.55 0.00 0.38 4.81 -1.26 -5.05 118.16 120.23 1ckz n LYS 24 Ca 0.36 -2.50 0.16 0.00 -0.87 0.00 0.00 58.31 55.46 1ckz n LYS 24 Cb 0.50 -2.50 0.93 0.00 0.02 0.00 0.00 35.03 33.98 1ckz n LYS 24 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57