#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 0.71 -3.42 1.61 7.64 -1.26 -4.49 113.62 114.41 2k6s n SER 2 Ca 0.00 0.17 -0.36 0.00 1.01 0.00 0.00 58.87 59.69 2k6s n SER 2 Cb 0.00 0.60 -0.02 0.00 -1.01 0.00 0.00 64.21 63.77 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 -2.42 6.79 0.00 -3.43 -0.00 -1.26 -3.23 117.00 113.45 2k6s n LEU 3 Ca 0.01 -3.77 0.00 0.00 -0.00 0.00 0.00 56.01 52.25 2k6s n LEU 3 Cb 0.51 -1.41 0.00 0.00 -0.00 0.00 0.00 43.42 42.52 2k6s n LEU 3 CO 0.40 1.17 0.00 0.35 -0.00 0.00 0.00 177.39 179.31 2k6s n THR 4 N 4.42 0.00 -0.32 1.47 -2.24 -1.26 -4.95 114.28 111.39 2k6s n THR 4 Ca 0.60 0.00 0.30 0.00 -2.27 0.00 0.00 64.05 62.68 2k6s n THR 4 Cb 0.27 0.00 0.56 0.00 -2.10 0.00 0.00 70.33 69.06 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 -1.94 0.94 116.97 124.80 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 -0.41 0.00 1.49 -1.64 0.00 0.00 178.16 177.60 2k6s h GLU 6 N 0.08 0.00 0.01 1.82 4.81 -1.95 -1.94 114.58 117.40 2k6s h GLU 6 Ca 0.82 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 60.00 2k6s h GLU 6 Cb 2.11 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.49 2k6s h GLU 6 CO -0.73 0.00 -0.22 1.49 -0.73 0.00 0.00 179.01 178.82 2k6s h GLU 7 N 0.00 0.14 -0.12 1.92 4.22 0.95 -3.22 114.58 118.47 2k6s h GLU 7 Ca 0.00 -0.16 -0.14 0.00 0.08 0.00 0.00 59.36 59.14 2k6s h GLU 7 Cb 0.55 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 2k6s h GLU 7 CO 0.00 0.93 -0.53 -0.24 -2.18 0.00 0.00 179.01 177.00 2k6s h VAL 8 N -0.59 1.35 0.04 0.32 3.04 -1.49 -3.15 116.25 115.75 2k6s h VAL 8 Ca -0.03 -1.79 0.03 0.00 -1.01 0.00 0.00 66.70 63.90 2k6s h VAL 8 Cb 1.02 1.84 -0.05 0.00 -2.01 0.00 0.00 31.29 32.08 2k6s h VAL 8 CO 0.04 0.54 -0.37 -0.07 -1.01 0.00 0.00 177.57 176.71 2k6s h LEU 9 N 0.26 -1.10 -2.46 3.16 3.38 -1.44 -0.64 115.31 116.47 2k6s h LEU 9 Ca 0.01 0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2k6s h LEU 9 Cb 1.01 0.43 0.00 0.00 0.09 0.00 0.00 40.66 42.19 2k6s h LEU 9 CO 0.09 -0.43 0.00 1.56 0.09 0.00 0.00 178.44 179.75 2k6s h GLN 10 N -0.54 0.00 0.26 1.13 1.08 -1.59 -2.96 115.11 112.48 2k6s h GLN 10 Ca 0.05 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.23 2k6s h GLN 10 Cb 0.61 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.05 2k6s h GLN 10 CO -0.27 0.00 -0.12 0.93 -0.95 0.00 0.00 178.83 178.42 2k6s h GLU 11 N 0.00 -0.33 -0.85 1.46 5.08 -1.08 -1.93 114.58 116.93 2k6s h GLU 11 Ca 0.00 0.02 0.09 0.00 -1.00 0.00 0.00 59.36 58.47 2k6s h GLU 11 Cb 0.18 0.08 -0.06 0.00 0.50 0.00 0.00 28.75 29.44 2k6s h GLU 11 CO 0.00 -0.02 0.55 1.25 -1.00 0.00 0.00 179.01 179.79 2k6s h LEU 12 N -0.67 0.77 -0.63 1.33 7.12 -1.33 0.98 115.31 122.88 2k6s h LEU 12 Ca -0.04 0.02 0.00 0.00 0.13 0.00 0.00 57.88 57.99 2k6s h LEU 12 Cb 0.47 -0.15 0.00 0.00 -0.53 0.00 0.00 40.66 40.45 2k6s h LEU 12 CO 0.06 0.47 0.00 1.62 -0.13 0.00 0.00 178.44 180.45 2k6s h VAL 13 N 0.86 0.00 0.00 1.05 3.04 -1.54 -2.13 116.25 117.53 2k6s h VAL 13 Ca 0.38 -0.62 -0.04 0.00 -1.01 0.00 0.00 66.70 65.41 2k6s h VAL 13 Cb 0.36 1.58 -0.01 0.00 -2.01 0.00 0.00 31.29 31.21 2k6s h VAL 13 CO -0.15 0.00 -0.23 0.50 -1.01 0.00 0.00 177.57 176.68 2k6s h LYS 14 N 0.00 0.00 0.44 4.17 3.64 -0.08 -3.22 116.57 121.52 2k6s h LYS 14 Ca 0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2k6s h LYS 14 Cb 0.68 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.49 2k6s h LYS 14 CO 0.00 0.84 -0.40 0.45 -2.27 0.00 0.00 179.45 178.07 2k6s h HIS 15 N -1.00 -1.10 -0.87 1.91 3.86 -0.96 -0.94 115.15 116.05 2k6s h HIS 15 Ca -0.06 0.01 0.21 0.00 -1.16 0.00 0.00 60.37 59.36 2k6s h HIS 15 Cb 0.91 0.42 -0.16 0.00 1.06 0.00 0.00 27.41 29.65 2k6s h HIS 15 CO 0.20 -0.54 -0.05 0.87 0.86 0.00 0.00 177.93 179.27 2k6s h LYS 16 N -0.82 0.05 -0.34 2.45 1.57 -1.57 0.29 116.57 118.19 2k6s h LYS 16 Ca -0.06 -0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.61 2k6s h LYS 16 Cb 0.71 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 2k6s h LYS 16 CO -0.03 0.03 -0.23 1.49 -0.57 0.00 0.00 179.45 180.14 2k6s h GLU 17 N 0.05 0.67 -0.91 3.15 4.81 -1.52 -2.15 114.58 118.68 2k6s h GLU 17 Ca 0.48 -0.26 -0.02 0.00 -0.13 0.00 0.00 59.36 59.43 2k6s h GLU 17 Cb 0.87 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 30.17 2k6s h GLU 17 CO -0.82 0.85 0.50 -0.07 -0.73 0.00 0.00 179.01 178.74 2k6s h LEU 18 N 0.59 1.14 -1.03 1.64 3.38 0.91 -1.72 115.31 120.21 2k6s h LEU 18 Ca 0.08 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 2k6s h LEU 18 Cb 0.71 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 2k6s h LEU 18 CO 0.05 0.91 -0.29 -0.07 0.09 0.00 0.00 178.44 179.13 2k6s h LEU 19 N 1.27 0.34 0.96 1.67 3.38 -0.76 -2.86 115.31 119.31 2k6s h LEU 19 Ca 0.32 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 58.13 2k6s h LEU 19 Cb 0.03 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 40.69 2k6s h LEU 19 CO -0.05 0.62 -0.48 0.03 0.09 0.00 0.00 178.44 178.65 2k6s h ARG 20 N 0.29 -1.26 -0.98 1.13 2.47 -0.67 -2.77 114.38 112.59 2k6s h ARG 20 Ca 0.04 0.09 0.23 0.00 -1.26 0.00 0.00 59.98 59.08 2k6s h ARG 20 Cb 0.67 0.29 -0.12 0.00 -1.65 0.00 0.00 29.97 29.15 2k6s h ARG 20 CO 0.05 -0.84 0.57 -0.09 0.56 0.00 0.00 179.97 180.21 2k6s h ARG 21 N -1.31 0.58 -0.21 0.04 2.43 -1.45 0.41 114.38 114.87 2k6s h ARG 21 Ca -0.13 -0.03 0.06 0.00 -0.81 0.00 0.00 59.98 59.06 2k6s h ARG 21 Cb 1.01 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.42 2k6s h ARG 21 CO 0.21 0.38 0.40 0.87 -1.51 0.00 0.00 179.97 180.32 2k6s h LYS 22 N 0.60 0.00 0.00 0.20 1.57 -1.25 0.60 116.57 118.29 2k6s h LYS 22 Ca 0.61 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.39 2k6s h LYS 22 Cb 1.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.43 2k6s h LYS 22 CO -0.46 0.00 -0.53 -0.25 -0.57 0.00 0.00 179.45 177.64 2k6s n ASP 23 N -3.30 1.50 -0.32 0.86 9.92 0.14 -3.90 116.55 121.45 2k6s n ASP 23 Ca 0.03 0.48 0.17 0.00 -0.53 0.00 0.00 54.79 54.93 2k6s n ASP 23 Cb 0.51 -0.77 0.36 0.00 -0.64 0.00 0.00 41.12 40.58 2k6s n ASP 23 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 2k6s h THR 24 N -0.81 0.38 -0.33 -3.53 2.02 -0.89 0.30 112.91 110.03 2k6s h THR 24 Ca 0.00 -0.11 -0.05 0.00 0.77 0.00 0.00 66.41 67.02 2k6s h THR 24 Cb 0.53 0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 66.94 2k6s h THR 24 CO 0.00 0.06 0.03 -0.74 0.37 0.00 0.00 175.52 175.24 2k6s h HIS 25 N 0.33 0.61 -0.31 3.16 6.17 -0.02 0.37 115.15 125.47 2k6s h HIS 25 Ca 0.62 -0.10 -0.05 0.00 0.71 0.00 0.00 60.37 61.55 2k6s h HIS 25 Cb 1.27 -0.16 -0.01 0.00 2.52 0.00 0.00 27.41 31.03 2k6s h HIS 25 CO -0.13 0.66 -0.01 -0.84 0.71 0.00 0.00 177.93 178.32 2k6s h ILE 26 N 0.39 1.26 -0.69 6.26 3.07 -1.29 -1.23 117.51 125.28 2k6s h ILE 26 Ca 0.10 -0.97 0.02 0.00 1.55 0.00 0.00 64.86 65.56 2k6s h ILE 26 Cb 0.40 1.27 -0.04 0.00 -0.27 0.00 0.00 36.82 38.18 2k6s h ILE 26 CO 0.01 0.32 0.44 -0.09 -1.05 0.00 0.00 178.15 177.78 2k6s h ARG 27 N 0.35 0.85 -0.05 0.16 1.12 -0.94 -1.49 114.38 114.37 2k6s h ARG 27 Ca 0.09 -0.05 -0.01 0.00 -1.11 0.00 0.00 59.98 58.90 2k6s h ARG 27 Cb 0.46 -0.19 -0.00 0.00 -0.01 0.00 0.00 29.97 30.22 2k6s h ARG 27 CO 0.02 0.56 0.01 1.05 -3.11 0.00 0.00 179.97 178.49 2k6s h GLU 28 N 0.87 0.09 0.00 0.20 4.11 -0.80 -2.41 114.58 116.64 2k6s h GLU 28 Ca 0.27 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.68 2k6s h GLU 28 Cb -0.01 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.23 2k6s h GLU 28 CO -0.10 0.33 0.00 -0.11 0.07 0.00 0.00 179.01 179.21 2k6s n LEU 29 N -4.90 0.38 0.07 3.06 7.94 -0.47 -2.20 117.00 120.88 2k6s n LEU 29 Ca -0.07 0.67 -0.09 0.00 -1.11 0.00 0.00 56.01 55.40 2k6s n LEU 29 Cb 0.16 -0.70 -0.06 0.00 0.53 0.00 0.00 43.42 43.35 2k6s n LEU 29 CO 0.34 -0.76 0.32 -0.33 -1.11 0.00 0.00 177.39 175.85 2k6s h GLU 30 N 0.00 -0.26 -0.71 1.96 4.39 -0.75 -2.86 114.58 116.36 2k6s h GLU 30 Ca 0.00 0.02 0.18 0.00 0.34 0.00 0.00 59.36 59.90 2k6s h GLU 30 Cb 0.04 0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 28.71 2k6s h GLU 30 CO 0.00 0.10 0.49 -0.44 -1.16 0.00 0.00 179.01 178.00 2k6s h ASP 31 N -0.94 0.16 -0.29 1.42 3.32 -1.42 0.12 116.42 118.79 2k6s h ASP 31 Ca -0.03 0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.00 2k6s h ASP 31 Cb 0.48 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.99 2k6s h ASP 31 CO 0.04 0.08 0.05 1.88 -1.72 0.00 0.00 179.24 179.57 2k6s h TYR 32 N 0.16 0.52 0.00 4.55 0.05 -1.53 -2.43 116.97 118.30 2k6s h TYR 32 Ca 0.34 -0.07 0.00 0.00 0.05 0.00 0.00 58.73 59.05 2k6s h TYR 32 Cb 1.12 -0.14 0.00 0.00 1.01 0.00 0.00 36.73 38.72 2k6s h TYR 32 CO -0.00 0.58 0.00 -0.89 -1.05 0.00 0.00 178.16 176.80 2k6s n ILE 33 N -4.64 0.53 -0.01 -2.88 5.41 -0.15 -3.20 119.36 114.43 2k6s n ILE 33 Ca -0.02 0.05 -0.03 0.00 1.00 0.00 0.00 62.75 63.75 2k6s n ILE 33 Cb 0.21 -0.76 0.21 0.00 -0.71 0.00 0.00 39.64 38.59 2k6s n ILE 33 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 2k6s h ASP 34 N 0.00 0.53 -1.03 4.38 3.32 -0.54 -3.01 116.42 120.08 2k6s h ASP 34 Ca 0.00 -0.16 0.35 0.00 0.02 0.00 0.00 57.03 57.25 2k6s h ASP 34 Cb 0.45 -0.14 -0.15 0.00 0.22 0.00 0.00 39.33 39.71 2k6s h ASP 34 CO 0.00 0.72 0.59 0.78 -1.72 0.00 0.00 179.24 179.61 2k6s h ASN 35 N 0.49 0.45 -0.27 6.45 2.35 -1.59 0.77 115.58 124.23 2k6s h ASN 35 Ca 0.08 0.20 -0.04 0.00 -0.55 0.00 0.00 56.30 55.99 2k6s h ASN 35 Cb 0.58 0.17 -0.01 0.00 0.05 0.00 0.00 38.32 39.11 2k6s h ASN 35 CO 0.04 -0.21 -0.00 -0.07 -1.65 0.00 0.00 177.43 175.54 2k6s h LEU 36 N 0.23 0.47 -5.21 1.61 3.38 -1.78 -3.31 115.31 110.70 2k6s h LEU 36 Ca 0.77 -0.31 -0.59 0.00 0.09 0.00 0.00 57.88 57.84 2k6s h LEU 36 Cb 1.89 -0.13 -0.42 0.00 0.09 0.00 0.00 40.66 42.09 2k6s h LEU 36 CO -0.63 0.66 -0.65 0.00 0.09 0.00 0.00 178.44 177.92 2k6s n LEU 37 N -4.60 4.51 0.00 1.67 -0.00 0.19 -5.03 117.00 113.73 2k6s n LEU 37 Ca -0.03 -5.64 -0.07 0.00 -0.00 0.00 0.00 56.01 50.28 2k6s n LEU 37 Cb 0.25 -0.54 0.02 0.00 -0.00 0.00 0.00 43.42 43.15 2k6s n LEU 37 CO 0.38 2.35 0.47 0.55 -0.00 0.00 0.00 177.39 181.14 2k6s n VAL 38 N -0.27 0.00 -2.37 1.47 3.14 0.21 -4.87 118.33 115.64 2k6s n VAL 38 Ca 0.32 -0.76 -0.43 0.00 -2.96 0.00 0.00 64.34 60.51 2k6s n VAL 38 Cb 0.42 0.79 -0.02 0.00 -1.06 0.00 0.00 33.84 33.96 2k6s n VAL 38 CO 0.00 0.00 0.00 -0.60 -6.46 0.00 0.00 176.83 169.77 2k6s s ARG 39 N -2.07 4.20 0.00 1.45 6.06 -1.26 -4.85 118.95 122.49 2k6s s ARG 39 Ca 0.14 1.71 -0.08 0.00 -2.50 0.00 0.00 55.73 55.00 2k6s s ARG 39 Cb -0.04 -3.80 -0.05 0.00 0.06 0.00 0.00 34.95 31.12 2k6s s ARG 39 CO 0.09 -0.75 0.28 0.14 -2.50 0.00 0.00 175.30 172.56 2k6s s VAL 40 N 3.64 5.27 -0.73 7.11 -7.23 -1.26 -4.93 120.40 122.27 2k6s s VAL 40 Ca 0.57 0.26 0.06 0.00 -1.81 0.00 0.00 61.98 61.06 2k6s s VAL 40 Cb -0.23 -3.57 0.05 0.00 0.56 0.00 0.00 36.38 33.19 2k6s s VAL 40 CO 0.17 0.40 0.68 1.15 -0.31 0.00 0.00 175.10 177.19