#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 1.58 -4.14 1.61 7.64 -1.26 -4.65 113.62 114.40 2k6s n SER 2 Ca 0.00 0.26 -0.29 0.00 1.01 0.00 0.00 58.87 59.85 2k6s n SER 2 Cb 0.00 -0.47 -0.11 0.00 -1.01 0.00 0.00 64.21 62.62 2k6s n SER 2 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k6s n LEU 3 N -3.28 1.74 0.00 -3.43 -0.00 -1.26 -3.36 117.00 107.41 2k6s n LEU 3 Ca -0.27 -2.31 0.00 0.00 -0.00 0.00 0.00 56.01 53.43 2k6s n LEU 3 Cb 1.05 -1.28 0.00 0.00 -0.00 0.00 0.00 43.42 43.19 2k6s n LEU 3 CO 0.43 -2.56 0.00 0.35 -0.00 0.00 0.00 177.39 175.61 2k6s n THR 4 N 7.95 0.00 -0.34 1.47 -2.24 -1.26 -4.96 114.28 114.89 2k6s n THR 4 Ca 0.44 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 62.18 2k6s n THR 4 Cb 0.45 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.66 2k6s n THR 4 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k6s n TYR 5 N 0.00 -0.14 0.16 4.78 9.36 -1.26 0.11 117.16 130.17 2k6s n TYR 5 Ca 0.00 1.05 0.09 0.00 3.32 0.00 0.00 57.90 62.36 2k6s n TYR 5 Cb 0.00 -0.71 0.59 0.00 -0.63 0.00 0.00 39.34 38.59 2k6s n TYR 5 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 2k6s h GLU 6 N 0.00 0.13 0.00 2.98 5.08 -1.96 -1.42 114.58 119.39 2k6s h GLU 6 Ca 0.23 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.55 2k6s h GLU 6 Cb 0.44 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.66 2k6s h GLU 6 CO -0.82 0.09 -0.13 1.49 -1.00 0.00 0.00 179.01 178.63 2k6s h GLU 7 N 0.13 0.00 0.00 2.33 4.22 0.83 -3.22 114.58 118.87 2k6s h GLU 7 Ca 0.07 0.00 -0.20 0.00 0.08 0.00 0.00 59.36 59.32 2k6s h GLU 7 Cb 0.13 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 2k6s h GLU 7 CO -0.01 0.13 -1.48 1.55 -2.18 0.00 0.00 179.01 177.01 2k6s n VAL 8 N -3.16 1.28 0.45 0.32 3.14 -0.56 -3.94 118.33 115.87 2k6s n VAL 8 Ca 0.03 -0.71 -0.20 0.00 -2.96 0.00 0.00 64.34 60.49 2k6s n VAL 8 Cb 0.53 -0.80 -0.10 0.00 -1.06 0.00 0.00 33.84 32.41 2k6s n VAL 8 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 2k6s h LEU 9 N 0.00 -1.13 -1.44 6.55 3.38 -1.33 -2.67 115.31 118.68 2k6s h LEU 9 Ca -0.19 0.05 0.19 0.00 0.09 0.00 0.00 57.88 58.02 2k6s h LEU 9 Cb 1.68 0.31 -0.07 0.00 0.09 0.00 0.00 40.66 42.68 2k6s h LEU 9 CO 0.05 -0.74 0.59 1.56 0.09 0.00 0.00 178.44 179.99 2k6s h GLN 10 N -1.19 0.47 -0.16 1.13 1.08 -1.74 -0.21 115.11 114.48 2k6s h GLN 10 Ca -0.11 -0.03 0.05 0.00 -1.45 0.00 0.00 58.65 57.11 2k6s h GLN 10 Cb 0.94 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 28.26 2k6s h GLN 10 CO 0.15 0.31 0.15 0.93 -0.95 0.00 0.00 178.83 179.41 2k6s h GLU 11 N 0.48 0.00 0.00 1.46 5.08 -1.60 -2.94 114.58 117.07 2k6s h GLU 11 Ca 0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.83 2k6s h GLU 11 Cb 1.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.30 2k6s h GLU 11 CO -0.19 0.00 0.00 -0.11 -1.00 0.00 0.00 179.01 177.71 2k6s n LEU 12 N -4.02 0.23 -0.33 1.33 -0.00 -0.09 -2.66 117.00 111.46 2k6s n LEU 12 Ca 0.01 0.71 0.27 0.00 -0.00 0.00 0.00 56.01 56.99 2k6s n LEU 12 Cb 0.27 -0.40 0.51 0.00 -0.00 0.00 0.00 43.42 43.80 2k6s n LEU 12 CO 0.30 -0.40 1.07 1.62 -0.00 0.00 0.00 177.39 179.97 2k6s h VAL 13 N 0.00 0.14 0.55 1.96 3.04 -1.68 0.12 116.25 120.39 2k6s h VAL 13 Ca 0.00 -0.05 -0.02 0.00 -1.01 0.00 0.00 66.70 65.62 2k6s h VAL 13 Cb 0.00 -0.02 -0.01 0.00 -2.01 0.00 0.00 31.29 29.25 2k6s h VAL 13 CO 0.00 0.03 -0.42 0.11 -1.01 0.00 0.00 177.57 176.28 2k6s h LYS 14 N 0.15 -0.91 -0.85 4.17 1.57 -1.59 0.57 116.57 119.67 2k6s h LYS 14 Ca 0.77 0.06 0.21 0.00 -1.87 0.00 0.00 60.65 59.82 2k6s h LYS 14 Cb 1.90 0.21 -0.12 0.00 0.08 0.00 0.00 32.23 34.29 2k6s h LYS 14 CO -0.70 -0.61 0.30 0.45 -0.57 0.00 0.00 179.45 178.32 2k6s h HIS 15 N -0.95 0.49 0.01 -1.35 3.86 -0.74 -1.28 115.15 115.18 2k6s h HIS 15 Ca -0.06 0.04 -0.18 0.00 -1.16 0.00 0.00 60.37 59.01 2k6s h HIS 15 Cb 0.80 -0.08 0.01 0.00 1.06 0.00 0.00 27.41 29.20 2k6s h HIS 15 CO -0.16 -0.09 -0.69 0.87 0.86 0.00 0.00 177.93 178.72 2k6s h LYS 16 N 0.33 0.45 -0.42 2.45 1.57 -1.26 -3.21 116.57 116.48 2k6s h LYS 16 Ca 0.52 -0.50 0.07 0.00 -1.87 0.00 0.00 60.65 58.87 2k6s h LYS 16 Cb 0.97 0.14 -0.02 0.00 0.08 0.00 0.00 32.23 33.40 2k6s h LYS 16 CO -0.55 1.15 0.28 1.05 -0.57 0.00 0.00 179.45 180.81 2k6s h GLU 17 N -0.04 0.27 0.00 3.15 4.11 -0.30 0.19 114.58 121.97 2k6s h GLU 17 Ca -0.09 -0.02 -0.08 0.00 0.07 0.00 0.00 59.36 59.25 2k6s h GLU 17 Cb 1.40 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.58 2k6s h GLU 17 CO 0.14 0.18 -0.38 -0.07 0.07 0.00 0.00 179.01 178.95 2k6s h LEU 18 N 0.28 0.00 0.07 3.06 3.38 -1.29 -0.71 115.31 120.10 2k6s h LEU 18 Ca 0.19 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.89 2k6s h LEU 18 Cb 0.38 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 2k6s h LEU 18 CO -0.04 0.38 -1.26 -0.07 0.09 0.00 0.00 178.44 177.54 2k6s h LEU 19 N 0.00 0.25 0.56 1.67 3.38 -0.72 -2.83 115.31 117.60 2k6s h LEU 19 Ca -0.00 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.65 2k6s h LEU 19 Cb 0.71 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 41.38 2k6s h LEU 19 CO 0.05 1.23 -0.27 0.03 0.09 0.00 0.00 178.44 179.57 2k6s h ARG 20 N 0.04 -0.72 -0.69 1.13 3.08 -0.73 -2.98 114.38 113.52 2k6s h ARG 20 Ca -0.13 0.05 0.14 0.00 0.07 0.00 0.00 59.98 60.11 2k6s h ARG 20 Cb 1.92 0.16 -0.10 0.00 0.08 0.00 0.00 29.97 32.04 2k6s h ARG 20 CO 0.16 -0.48 0.19 -0.09 -1.07 0.00 0.00 179.97 178.68 2k6s h ARG 21 N -1.18 0.30 -0.80 0.04 2.43 -1.29 0.55 114.38 114.43 2k6s h ARG 21 Ca -0.08 -0.02 0.17 0.00 -0.81 0.00 0.00 59.98 59.25 2k6s h ARG 21 Cb 0.57 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 30.00 2k6s h ARG 21 CO 0.13 0.20 0.54 -0.22 -1.51 0.00 0.00 179.97 179.10 2k6s h LYS 22 N 0.31 0.35 0.20 0.20 3.64 -1.54 0.21 116.57 119.94 2k6s h LYS 22 Ca 0.37 -0.02 -0.32 0.00 -1.27 0.00 0.00 60.65 59.42 2k6s h LYS 22 Cb 0.59 -0.08 0.04 0.00 -0.41 0.00 0.00 32.23 32.36 2k6s h LYS 22 CO -0.44 0.23 -1.36 0.22 -2.27 0.00 0.00 179.45 175.83 2k6s h ASP 23 N 0.36 0.85 0.45 4.20 1.82 -0.77 -3.07 116.42 120.26 2k6s h ASP 23 Ca 0.40 -0.88 -0.03 0.00 -0.39 0.00 0.00 57.03 56.13 2k6s h ASP 23 Cb 1.02 -0.27 -0.00 0.00 0.68 0.00 0.00 39.33 40.76 2k6s h ASP 23 CO -0.12 1.66 -0.14 0.74 -1.61 0.00 0.00 179.24 179.77 2k6s h THR 24 N 0.17 0.58 -0.04 2.25 2.02 -0.08 0.02 112.91 117.83 2k6s h THR 24 Ca -0.23 -0.64 -0.12 0.00 0.77 0.00 0.00 66.41 66.19 2k6s h THR 24 Cb 2.05 1.42 0.01 0.00 -1.74 0.00 0.00 68.15 69.89 2k6s h THR 24 CO 0.26 0.14 -0.44 -0.74 0.37 0.00 0.00 175.52 175.11 2k6s h HIS 25 N 0.00 0.52 0.00 3.16 -0.00 -0.66 0.10 115.15 118.28 2k6s h HIS 25 Ca -0.00 -0.26 -0.07 0.00 -0.00 0.00 0.00 60.37 60.05 2k6s h HIS 25 Cb 0.41 -0.07 -0.01 0.00 -0.00 0.00 0.00 27.41 27.74 2k6s h HIS 25 CO 0.00 1.04 -0.32 -0.84 -0.00 0.00 0.00 177.93 177.81 2k6s h ILE 26 N -0.14 0.81 -0.05 6.26 3.07 -1.40 0.19 117.51 126.26 2k6s h ILE 26 Ca -0.04 -1.31 -0.08 0.00 1.55 0.00 0.00 64.86 64.98 2k6s h ILE 26 Cb 1.13 1.81 0.00 0.00 -0.27 0.00 0.00 36.82 39.49 2k6s h ILE 26 CO 0.09 0.31 -0.29 -0.09 -1.05 0.00 0.00 178.15 177.11 2k6s h ARG 27 N 0.00 0.29 -0.37 0.16 1.12 -0.92 -2.34 114.38 112.31 2k6s h ARG 27 Ca -0.00 -0.24 -0.16 0.00 -1.11 0.00 0.00 59.98 58.46 2k6s h ARG 27 Cb 0.78 0.05 -0.00 0.00 -0.01 0.00 0.00 29.97 30.79 2k6s h ARG 27 CO 0.04 0.90 -0.41 1.05 -3.11 0.00 0.00 179.97 178.44 2k6s h GLU 28 N -0.25 0.93 0.00 0.20 -0.00 -0.66 -2.96 114.58 111.84 2k6s h GLU 28 Ca -0.02 -0.51 -0.04 0.00 -0.00 0.00 0.00 59.36 58.79 2k6s h GLU 28 Cb 0.96 0.03 -0.01 0.00 -0.00 0.00 0.00 28.75 29.73 2k6s h GLU 28 CO 0.06 1.16 -0.18 1.25 -0.00 0.00 0.00 179.01 181.30 2k6s h LEU 29 N 0.74 0.00 -1.40 3.06 5.85 -1.03 -2.16 115.31 120.36 2k6s h LEU 29 Ca 0.05 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.71 2k6s h LEU 29 Cb 1.01 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.03 2k6s h LEU 29 CO 0.10 0.18 -0.29 -0.33 -0.34 0.00 0.00 178.44 177.76 2k6s h GLU 30 N 0.00 0.00 -0.06 1.25 4.39 -1.24 -1.43 114.58 117.49 2k6s h GLU 30 Ca -0.00 0.00 -0.23 0.00 0.34 0.00 0.00 59.36 59.47 2k6s h GLU 30 Cb 0.41 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.07 2k6s h GLU 30 CO 0.02 0.29 -0.89 -0.44 -1.16 0.00 0.00 179.01 176.83 2k6s h ASP 31 N 0.00 0.78 -0.50 1.42 5.19 -1.42 -2.38 116.42 119.50 2k6s h ASP 31 Ca -0.00 -0.57 -0.10 0.00 -0.62 0.00 0.00 57.03 55.73 2k6s h ASP 31 Cb 0.58 -0.23 -0.02 0.00 0.18 0.00 0.00 39.33 39.84 2k6s h ASP 31 CO 0.04 1.36 -0.08 1.88 -3.12 0.00 0.00 179.24 179.32 2k6s h TYR 32 N 0.39 1.08 0.00 4.55 -1.99 -1.38 -2.86 116.97 116.76 2k6s h TYR 32 Ca -0.08 -0.21 -0.07 0.00 2.00 0.00 0.00 58.73 60.37 2k6s h TYR 32 Cb 1.52 -0.27 -0.01 0.00 2.00 0.00 0.00 36.73 39.97 2k6s h TYR 32 CO 0.08 1.00 -0.36 0.82 -0.00 0.00 0.00 178.16 179.70 2k6s h ILE 33 N 0.88 0.83 -0.26 -2.88 2.04 -1.28 -3.16 117.51 113.68 2k6s h ILE 33 Ca 0.14 -1.48 0.00 0.00 1.00 0.00 0.00 64.86 64.52 2k6s h ILE 33 Cb 0.62 1.92 -0.01 0.00 -0.74 0.00 0.00 36.82 38.61 2k6s h ILE 33 CO 0.04 0.35 0.17 0.44 0.00 0.00 0.00 178.15 179.15 2k6s h ASP 34 N 0.00 0.30 -0.92 1.72 3.32 -1.18 -2.97 116.42 116.69 2k6s h ASP 34 Ca -0.00 -0.01 0.33 0.00 0.02 0.00 0.00 57.03 57.37 2k6s h ASP 34 Cb 0.89 -0.08 -0.17 0.00 0.22 0.00 0.00 39.33 40.20 2k6s h ASP 34 CO 0.05 0.22 0.30 0.59 -1.72 0.00 0.00 179.24 178.68 2k6s n ASN 35 N -4.50 0.15 -0.02 6.45 3.02 -1.19 1.00 115.26 120.17 2k6s n ASN 35 Ca 0.01 1.55 -0.12 0.00 -0.03 0.00 0.00 54.58 55.99 2k6s n ASN 35 Cb 0.07 -0.68 -0.07 0.00 -0.61 0.00 0.00 39.78 38.50 2k6s n ASN 35 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2k6s h LEU 36 N 0.00 0.13 -5.50 3.41 3.38 -1.78 -3.28 115.31 111.67 2k6s h LEU 36 Ca 0.69 -0.21 -0.64 0.00 0.09 0.00 0.00 57.88 57.81 2k6s h LEU 36 Cb 1.70 -0.03 -0.38 0.00 0.09 0.00 0.00 40.66 42.03 2k6s h LEU 36 CO -0.78 0.30 -0.24 0.00 0.09 0.00 0.00 178.44 177.82 2k6s n LEU 37 N -4.90 5.19 -3.56 1.67 -0.00 0.28 -5.00 117.00 110.68 2k6s n LEU 37 Ca -0.06 -5.61 -0.06 0.00 -0.00 0.00 0.00 56.01 50.28 2k6s n LEU 37 Cb 0.14 -0.70 -0.02 0.00 -0.00 0.00 0.00 43.42 42.83 2k6s n LEU 37 CO 0.34 2.28 0.87 0.54 -0.00 0.00 0.00 177.39 181.43 2k6s s VAL 38 N -4.46 0.00 0.04 1.47 0.11 0.17 -4.86 120.40 112.86 2k6s s VAL 38 Ca 0.47 0.00 -0.36 0.00 -2.93 0.00 0.00 61.98 59.16 2k6s s VAL 38 Cb 0.26 -1.00 -0.15 0.00 -1.53 0.00 0.00 36.38 33.96 2k6s s VAL 38 CO -0.14 0.00 1.57 -1.14 -3.33 0.00 0.00 175.10 172.06 2k6s n ARG 39 N -0.09 1.68 -4.06 1.54 0.63 -1.26 -4.66 116.66 110.44 2k6s n ARG 39 Ca -0.04 0.61 -0.31 0.00 -0.92 0.00 0.00 57.85 57.19 2k6s n ARG 39 Cb 0.60 -2.34 -0.07 0.00 0.45 0.00 0.00 32.46 31.10 2k6s n ARG 39 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 2k6s s VAL 40 N 1.63 4.63 0.00 5.15 -7.23 -1.26 -4.88 120.40 118.43 2k6s s VAL 40 Ca 0.86 -0.64 0.00 0.00 -1.81 0.00 0.00 61.98 60.39 2k6s s VAL 40 Cb -0.83 -3.20 0.00 0.00 0.56 0.00 0.00 36.38 32.92 2k6s s VAL 40 CO 0.47 0.19 0.23 1.15 -0.31 0.00 0.00 175.10 176.83