#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6s n SER 2 N 0.00 2.74 -3.45 1.61 7.64 -1.26 -4.82 113.62 116.08 2k6s n SER 2 Ca 0.00 -3.46 -0.40 0.00 1.01 0.00 0.00 58.87 56.02 2k6s n SER 2 Cb 0.00 -0.56 -0.02 0.00 -1.01 0.00 0.00 64.21 62.63 2k6s n SER 2 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2k6s n LEU 3 N -1.01 8.19 0.00 -3.43 4.32 -1.26 -3.40 117.00 120.40 2k6s n LEU 3 Ca 0.25 -4.57 0.00 0.00 -0.02 0.00 0.00 56.01 51.67 2k6s n LEU 3 Cb 0.88 -1.49 0.00 0.00 -1.62 0.00 0.00 43.42 41.19 2k6s n LEU 3 CO 0.11 1.94 0.00 0.35 -1.22 0.00 0.00 177.39 178.57 2k6s n THR 4 N 2.98 0.00 -0.33 -5.08 -2.24 -1.26 -4.95 114.28 103.40 2k6s n THR 4 Ca 0.67 0.00 0.30 0.00 -2.27 0.00 0.00 64.05 62.76 2k6s n THR 4 Cb 0.26 0.00 0.56 0.00 -2.10 0.00 0.00 70.33 69.05 2k6s n THR 4 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 2k6s h TYR 5 N 0.00 0.85 0.00 4.78 3.20 -2.01 0.90 116.97 124.69 2k6s h TYR 5 Ca 0.00 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.91 2k6s h TYR 5 Cb 0.00 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.07 2k6s h TYR 5 CO 0.00 -0.40 0.00 0.93 -1.64 0.00 0.00 178.16 177.05 2k6s h GLU 6 N 0.08 0.00 0.03 1.82 5.08 -1.96 -1.73 114.58 117.91 2k6s h GLU 6 Ca 0.82 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 59.08 2k6s h GLU 6 Cb 2.12 0.00 0.01 0.00 0.50 0.00 0.00 28.75 31.38 2k6s h GLU 6 CO -0.73 0.00 -0.43 1.49 -1.00 0.00 0.00 179.01 178.35 2k6s h GLU 7 N 0.00 0.23 -0.07 2.33 4.22 0.82 -3.18 114.58 118.93 2k6s h GLU 7 Ca 0.00 -0.29 -0.17 0.00 0.08 0.00 0.00 59.36 58.98 2k6s h GLU 7 Cb 0.56 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.90 2k6s h GLU 7 CO 0.00 1.05 -0.69 -0.24 -2.18 0.00 0.00 179.01 176.95 2k6s h VAL 8 N -0.46 1.39 0.19 0.32 3.04 -1.50 -2.98 116.25 116.25 2k6s h VAL 8 Ca -0.06 -2.13 0.01 0.00 -1.01 0.00 0.00 66.70 63.51 2k6s h VAL 8 Cb 1.23 2.10 -0.04 0.00 -2.01 0.00 0.00 31.29 32.57 2k6s h VAL 8 CO 0.08 0.63 -0.43 -0.07 -1.01 0.00 0.00 177.57 176.77 2k6s h LEU 9 N 0.22 -1.25 -2.17 3.16 3.38 -1.41 -0.98 115.31 116.26 2k6s h LEU 9 Ca -0.02 0.13 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 2k6s h LEU 9 Cb 1.25 0.46 -0.00 0.00 0.09 0.00 0.00 40.66 42.45 2k6s h LEU 9 CO 0.11 -0.52 -0.02 1.56 0.09 0.00 0.00 178.44 179.67 2k6s h GLN 10 N -0.71 0.00 0.06 1.13 1.08 -1.62 -2.98 115.11 112.07 2k6s h GLN 10 Ca 0.00 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2k6s h GLN 10 Cb 0.71 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.14 2k6s h GLN 10 CO -0.21 0.02 -0.03 0.93 -0.95 0.00 0.00 178.83 178.59 2k6s h GLU 11 N 0.00 -0.08 -0.89 1.46 5.08 -1.03 -3.07 114.58 116.04 2k6s h GLU 11 Ca -0.00 0.01 0.10 0.00 -1.00 0.00 0.00 59.36 58.46 2k6s h GLU 11 Cb 0.27 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.48 2k6s h GLU 11 CO 0.00 0.22 0.58 1.25 -1.00 0.00 0.00 179.01 180.06 2k6s h LEU 12 N -0.38 0.80 -0.41 1.33 7.12 -1.27 0.70 115.31 123.21 2k6s h LEU 12 Ca -0.01 0.02 0.00 0.00 0.13 0.00 0.00 57.88 58.02 2k6s h LEU 12 Cb 0.33 -0.14 0.00 0.00 -0.53 0.00 0.00 40.66 40.32 2k6s h LEU 12 CO 0.01 0.47 0.00 0.55 -0.13 0.00 0.00 178.44 179.35 2k6s n VAL 13 N -4.53 1.09 -0.02 1.05 3.14 -1.17 -2.38 118.33 115.51 2k6s n VAL 13 Ca 0.15 0.33 -0.21 0.00 -2.96 0.00 0.00 64.34 61.66 2k6s n VAL 13 Cb 0.31 -1.21 -0.13 0.00 -1.06 0.00 0.00 33.84 31.74 2k6s n VAL 13 CO 0.00 0.00 0.00 0.11 -6.46 0.00 0.00 176.83 170.48 2k6s h LYS 14 N 0.00 0.18 0.19 1.45 1.57 -0.79 -3.30 116.57 115.87 2k6s h LYS 14 Ca 0.00 -0.31 -0.01 0.00 -1.87 0.00 0.00 60.65 58.46 2k6s h LYS 14 Cb 0.23 0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.65 2k6s h LYS 14 CO 0.00 1.15 -0.09 0.45 -0.57 0.00 0.00 179.45 180.38 2k6s h HIS 15 N -0.47 -0.24 -0.98 -1.35 3.86 -1.25 -0.58 115.15 114.15 2k6s h HIS 15 Ca -0.29 -0.01 0.20 0.00 -1.16 0.00 0.00 60.37 59.11 2k6s h HIS 15 Cb 1.63 0.08 -0.19 0.00 1.06 0.00 0.00 27.41 30.00 2k6s h HIS 15 CO 0.13 -0.15 -0.21 0.87 0.86 0.00 0.00 177.93 179.43 2k6s h LYS 16 N -0.26 0.00 -0.26 2.45 1.57 -1.69 0.33 116.57 118.71 2k6s h LYS 16 Ca -0.03 -0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.62 2k6s h LYS 16 Cb 0.20 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 2k6s h LYS 16 CO 0.04 0.00 -0.40 1.49 -0.57 0.00 0.00 179.45 180.02 2k6s h GLU 17 N 0.00 0.61 -0.37 3.15 4.81 -1.64 -1.48 114.58 119.67 2k6s h GLU 17 Ca 0.49 -0.31 -0.04 0.00 -0.13 0.00 0.00 59.36 59.37 2k6s h GLU 17 Cb 0.78 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.15 2k6s h GLU 17 CO -1.00 0.90 0.07 -0.07 -0.73 0.00 0.00 179.01 178.18 2k6s h LEU 18 N 0.50 0.58 -0.95 1.64 3.38 0.12 -1.48 115.31 119.09 2k6s h LEU 18 Ca 0.04 -0.25 -0.09 0.00 0.09 0.00 0.00 57.88 57.67 2k6s h LEU 18 Cb 0.91 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 2k6s h LEU 18 CO 0.08 0.68 -0.19 0.25 0.09 0.00 0.00 178.44 179.35 2k6s h LEU 19 N 0.45 0.54 0.84 1.67 6.46 -0.71 -2.54 115.31 122.02 2k6s h LEU 19 Ca 0.11 -0.17 -0.04 0.00 -0.12 0.00 0.00 57.88 57.66 2k6s h LEU 19 Cb 0.35 -0.15 0.01 0.00 -0.73 0.00 0.00 40.66 40.14 2k6s h LEU 19 CO 0.01 0.74 -0.40 0.03 -0.62 0.00 0.00 178.44 178.20 2k6s h ARG 20 N 0.49 -1.08 -0.96 1.25 3.08 -1.00 -3.08 114.38 113.08 2k6s h ARG 20 Ca 0.08 0.07 0.21 0.00 0.07 0.00 0.00 59.98 60.41 2k6s h ARG 20 Cb 0.61 0.25 -0.11 0.00 0.08 0.00 0.00 29.97 30.79 2k6s h ARG 20 CO 0.04 -0.72 0.54 -0.09 -1.07 0.00 0.00 179.97 178.67 2k6s h ARG 21 N -1.27 0.60 -0.90 0.04 2.43 -1.28 -0.63 114.38 113.38 2k6s h ARG 21 Ca -0.12 -0.04 0.25 0.00 -0.81 0.00 0.00 59.98 59.27 2k6s h ARG 21 Cb 0.86 -0.14 -0.15 0.00 -0.42 0.00 0.00 29.97 30.12 2k6s h ARG 21 CO 0.19 0.40 0.18 -0.22 -1.51 0.00 0.00 179.97 179.01 2k6s h LYS 22 N 0.62 0.14 0.41 0.20 3.64 -1.36 0.49 116.57 120.72 2k6s h LYS 22 Ca 0.58 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.93 2k6s h LYS 22 Cb 1.00 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.79 2k6s h LYS 22 CO -0.44 0.09 -0.20 -0.44 -2.27 0.00 0.00 179.45 176.20 2k6s h ASP 23 N 0.14 -0.47 -1.08 4.20 5.19 -1.15 -2.81 116.42 120.44 2k6s h ASP 23 Ca 0.57 -0.07 0.34 0.00 -0.62 0.00 0.00 57.03 57.25 2k6s h ASP 23 Cb 1.16 0.12 -0.14 0.00 0.18 0.00 0.00 39.33 40.66 2k6s h ASP 23 CO -0.72 -0.03 0.65 0.74 -3.12 0.00 0.00 179.24 176.75 2k6s h THR 24 N -1.07 0.30 -0.02 0.35 2.02 -0.85 0.25 112.91 113.88 2k6s h THR 24 Ca -0.06 -0.10 -0.01 0.00 0.77 0.00 0.00 66.41 67.02 2k6s h THR 24 Cb 0.51 -0.01 -0.00 0.00 -1.74 0.00 0.00 68.15 66.90 2k6s h THR 24 CO 0.09 0.05 -0.01 -0.74 0.37 0.00 0.00 175.52 175.28 2k6s h HIS 25 N 0.28 0.05 0.00 3.16 6.17 -0.10 0.63 115.15 125.34 2k6s h HIS 25 Ca 0.73 -0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.80 2k6s h HIS 25 Cb 1.84 -0.01 0.00 0.00 2.52 0.00 0.00 27.41 31.76 2k6s h HIS 25 CO -0.01 0.47 0.00 -0.84 0.71 0.00 0.00 177.93 178.26 2k6s h ILE 26 N -0.39 0.00 0.14 6.26 3.07 -0.73 -1.88 117.51 123.97 2k6s h ILE 26 Ca 0.00 -0.27 -0.34 0.00 1.55 0.00 0.00 64.86 65.81 2k6s h ILE 26 Cb 0.46 1.06 -0.01 0.00 -0.27 0.00 0.00 36.82 38.06 2k6s h ILE 26 CO 0.00 0.00 -1.77 -0.09 -1.05 0.00 0.00 178.15 175.24 2k6s h ARG 27 N 0.00 0.29 -0.31 0.16 2.43 -0.39 -3.22 114.38 113.33 2k6s h ARG 27 Ca 0.00 -0.49 -0.11 0.00 -0.81 0.00 0.00 59.98 58.56 2k6s h ARG 27 Cb 0.34 0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.07 2k6s h ARG 27 CO 0.00 1.17 -0.24 1.05 -1.51 0.00 0.00 179.97 180.44 2k6s h GLU 28 N 0.08 0.72 0.00 0.20 4.11 -0.53 -2.66 114.58 116.49 2k6s h GLU 28 Ca -0.34 -0.35 0.00 0.00 0.07 0.00 0.00 59.36 58.74 2k6s h GLU 28 Cb 2.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.31 2k6s h GLU 28 CO 0.14 0.97 0.00 1.28 0.07 0.00 0.00 179.01 181.47 2k6s n LEU 29 N -4.28 0.57 0.14 3.06 4.32 -0.74 -1.91 117.00 118.17 2k6s n LEU 29 Ca -0.03 0.67 -0.00 0.00 -0.02 0.00 0.00 56.01 56.62 2k6s n LEU 29 Cb 0.45 -0.62 0.20 0.00 -1.62 0.00 0.00 43.42 41.83 2k6s n LEU 29 CO 0.44 -0.61 0.53 -0.33 -1.22 0.00 0.00 177.39 176.20 2k6s h GLU 30 N 0.00 0.00 0.00 3.23 4.39 -1.48 -1.63 114.58 119.09 2k6s h GLU 30 Ca 0.00 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.51 2k6s h GLU 30 Cb 0.27 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.89 2k6s h GLU 30 CO 0.00 0.58 -1.10 -0.44 -1.16 0.00 0.00 179.01 176.89 2k6s h ASP 31 N 0.00 0.00 -0.24 1.42 3.32 -1.44 -2.57 116.42 116.91 2k6s h ASP 31 Ca -0.01 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.90 2k6s h ASP 31 Cb 1.04 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.59 2k6s h ASP 31 CO 0.08 0.76 -0.40 1.88 -1.72 0.00 0.00 179.24 179.84 2k6s h TYR 32 N 0.00 0.87 0.00 4.55 0.05 -1.38 -2.92 116.97 118.14 2k6s h TYR 32 Ca -0.10 -0.30 0.00 0.00 0.05 0.00 0.00 58.73 58.38 2k6s h TYR 32 Cb 1.67 -0.17 0.00 0.00 1.01 0.00 0.00 36.73 39.24 2k6s h TYR 32 CO 0.00 1.07 -0.02 -0.89 -1.05 0.00 0.00 178.16 177.27 2k6s n ILE 33 N -4.20 0.23 0.18 -2.88 5.41 -0.63 -3.29 119.36 114.18 2k6s n ILE 33 Ca -0.05 -0.11 0.04 0.00 1.00 0.00 0.00 62.75 63.63 2k6s n ILE 33 Cb 0.54 -0.51 0.35 0.00 -0.71 0.00 0.00 39.64 39.31 2k6s n ILE 33 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 2k6s h ASP 34 N 0.00 0.00 -1.11 4.38 1.82 -1.25 -3.03 116.42 117.23 2k6s h ASP 34 Ca 0.00 0.00 0.31 0.00 -0.39 0.00 0.00 57.03 56.95 2k6s h ASP 34 Cb 0.59 0.00 -0.10 0.00 0.68 0.00 0.00 39.33 40.50 2k6s h ASP 34 CO 0.00 0.40 0.71 0.78 -1.61 0.00 0.00 179.24 179.52 2k6s h ASN 35 N 0.00 0.40 -0.26 2.28 2.35 -1.59 0.68 115.58 119.44 2k6s h ASN 35 Ca -0.00 0.10 -0.07 0.00 -0.55 0.00 0.00 56.30 55.78 2k6s h ASN 35 Cb 0.78 0.05 -0.01 0.00 0.05 0.00 0.00 38.32 39.19 2k6s h ASN 35 CO 0.05 0.01 -0.11 -0.07 -1.65 0.00 0.00 177.43 175.66 2k6s h LEU 36 N 0.31 0.55 -5.26 1.61 3.38 -1.79 -3.32 115.31 110.80 2k6s h LEU 36 Ca 0.66 -0.40 -0.59 0.00 0.09 0.00 0.00 57.88 57.64 2k6s h LEU 36 Cb 1.78 -0.15 -0.42 0.00 0.09 0.00 0.00 40.66 41.96 2k6s h LEU 36 CO -0.34 0.82 -0.65 0.00 0.09 0.00 0.00 178.44 178.36 2k6s n LEU 37 N -4.48 4.49 -4.40 1.67 -0.00 0.14 -5.09 117.00 109.32 2k6s n LEU 37 Ca -0.04 -5.66 -0.36 0.00 -0.00 0.00 0.00 56.01 49.94 2k6s n LEU 37 Cb 0.34 -0.55 0.06 0.00 -0.00 0.00 0.00 43.42 43.27 2k6s n LEU 37 CO 0.40 2.35 -0.13 0.52 -0.00 0.00 0.00 177.39 180.54 2k6s n VAL 38 N -0.26 1.41 -1.40 1.47 0.31 0.19 -4.58 118.33 115.47 2k6s n VAL 38 Ca 0.31 -0.42 -0.12 0.00 -0.01 0.00 0.00 64.34 64.11 2k6s n VAL 38 Cb 0.40 -0.59 -0.10 0.00 -0.91 0.00 0.00 33.84 32.64 2k6s n VAL 38 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2k6s n ARG 39 N -0.23 0.16 -2.92 5.55 1.74 -1.26 -4.60 116.66 115.09 2k6s n ARG 39 Ca 0.09 -0.63 -0.13 0.00 -0.77 0.00 0.00 57.85 56.41 2k6s n ARG 39 Cb 0.50 -2.38 0.04 0.00 -1.02 0.00 0.00 32.46 29.60 2k6s n ARG 39 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2k6s n VAL 40 N 6.93 -0.09 0.82 1.55 0.31 -1.26 -5.27 118.33 121.32 2k6s n VAL 40 Ca 0.39 -2.72 0.10 0.00 -0.01 0.00 0.00 64.34 62.09 2k6s n VAL 40 Cb 0.38 0.72 0.08 0.00 -0.91 0.00 0.00 33.84 34.11 2k6s n VAL 40 CO 0.00 0.00 0.00 0.23 -1.32 0.00 0.00 176.83 175.74