#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 0.73 -3.48 1.61 7.64 -1.26 -4.64 113.62 114.23 2k6s n SER 2 Ca 0.00 -0.63 -0.38 0.00 1.01 0.00 0.00 58.87 58.87 2k6s n SER 2 Cb 0.00 1.32 -0.02 0.00 -1.01 0.00 0.00 64.21 64.50 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 -1.72 6.90 0.00 -3.43 -0.00 -1.26 -3.39 117.00 114.10 2k6s n LEU 3 Ca 0.01 -3.87 0.00 0.00 -0.00 0.00 0.00 56.01 52.16 2k6s n LEU 3 Cb 0.38 -1.46 0.00 0.00 -0.00 0.00 0.00 43.42 42.34 2k6s n LEU 3 CO 0.41 1.19 0.00 0.35 -0.00 0.00 0.00 177.39 179.34 2k6s n THR 4 N 4.53 0.00 -0.33 1.47 -2.24 -1.26 -4.97 114.28 111.49 2k6s n THR 4 Ca 0.60 0.00 0.27 0.00 -2.27 0.00 0.00 64.05 62.66 2k6s n THR 4 Cb 0.29 0.00 0.52 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 0.87 0.00 4.78 3.20 -1.96 0.83 116.97 124.69 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 -0.21 0.00 0.00 1.54 0.00 0.00 36.73 38.06 2k6s h TYR 5 CO 0.00 -0.31 0.00 0.93 -1.64 0.00 0.00 178.16 177.14 2k6s h GLU 6 N 0.18 0.00 0.10 1.82 5.08 -1.96 -1.94 114.58 117.85 2k6s h GLU 6 Ca 0.78 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 59.00 2k6s h GLU 6 Cb 1.92 0.00 0.02 0.00 0.50 0.00 0.00 28.75 31.18 2k6s h GLU 6 CO -0.68 0.00 -0.63 1.49 -1.00 0.00 0.00 179.01 178.18 2k6s h GLU 7 N 0.00 0.25 -0.10 2.33 4.22 0.68 -3.26 114.58 118.71 2k6s h GLU 7 Ca 0.00 -0.41 -0.18 0.00 0.08 0.00 0.00 59.36 58.85 2k6s h GLU 7 Cb 0.46 0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.86 2k6s h GLU 7 CO 0.00 1.18 -0.70 -0.24 -2.18 0.00 0.00 179.01 177.07 2k6s h VAL 8 N -0.46 1.36 -0.08 0.32 3.04 -1.45 -3.22 116.25 115.76 2k6s h VAL 8 Ca -0.11 -2.06 0.04 0.00 -1.01 0.00 0.00 66.70 63.56 2k6s h VAL 8 Cb 1.48 2.04 -0.05 0.00 -2.01 0.00 0.00 31.29 32.74 2k6s h VAL 8 CO 0.12 0.62 -0.23 0.25 -1.01 0.00 0.00 177.57 177.33 2k6s h LEU 9 N 0.32 -0.68 -2.56 3.16 6.46 -1.48 -0.59 115.31 119.95 2k6s h LEU 9 Ca -0.03 0.11 -0.00 0.00 -0.12 0.00 0.00 57.88 57.84 2k6s h LEU 9 Cb 1.27 0.30 -0.00 0.00 -0.73 0.00 0.00 40.66 41.50 2k6s h LEU 9 CO 0.12 -0.28 -0.01 1.56 -0.62 0.00 0.00 178.44 179.21 2k6s h GLN 10 N -0.31 0.00 0.00 1.25 1.08 -1.62 -0.95 115.11 114.55 2k6s h GLN 10 Ca 0.08 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.20 2k6s h GLN 10 Cb 0.43 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.85 2k6s h GLN 10 CO -0.26 0.01 -0.42 0.93 -0.95 0.00 0.00 178.83 178.15 2k6s h GLU 11 N 0.00 0.00 -0.01 1.46 5.08 -1.13 -2.02 114.58 117.97 2k6s h GLU 11 Ca -0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2k6s h GLU 11 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2k6s h GLU 11 CO 0.00 0.42 -0.05 1.25 -1.00 0.00 0.00 179.01 179.63 2k6s h LEU 12 N 0.00 0.05 -0.64 1.33 7.12 -0.72 -2.18 115.31 120.27 2k6s h LEU 12 Ca -0.00 -0.72 0.00 0.00 0.13 0.00 0.00 57.88 57.29 2k6s h LEU 12 Cb 1.12 -0.02 0.00 0.00 -0.53 0.00 0.00 40.66 41.24 2k6s h LEU 12 CO 0.05 0.76 0.00 0.55 -0.13 0.00 0.00 178.44 179.67 2k6s n VAL 13 N -4.70 0.85 -0.07 1.05 3.14 -1.13 -2.16 118.33 115.32 2k6s n VAL 13 Ca -0.09 0.24 -0.11 0.00 -2.96 0.00 0.00 64.34 61.42 2k6s n VAL 13 Cb 0.38 -1.16 -0.09 0.00 -1.06 0.00 0.00 33.84 31.91 2k6s n VAL 13 CO 0.00 0.00 0.00 0.50 -6.46 0.00 0.00 176.83 170.87 2k6s h LYS 14 N 0.00 0.00 0.42 1.45 3.64 -1.31 -3.18 116.57 117.58 2k6s h LYS 14 Ca 0.00 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 2k6s h LYS 14 Cb 0.34 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 2k6s h LYS 14 CO 0.00 0.70 -0.29 0.45 -2.27 0.00 0.00 179.45 178.04 2k6s h HIS 15 N -1.00 -0.79 -0.89 1.91 3.86 -1.29 -0.68 115.15 116.27 2k6s h HIS 15 Ca -0.04 -0.00 0.24 0.00 -1.16 0.00 0.00 60.37 59.40 2k6s h HIS 15 Cb 0.76 0.29 -0.15 0.00 1.06 0.00 0.00 27.41 29.37 2k6s h HIS 15 CO 0.16 -0.42 0.14 0.87 0.86 0.00 0.00 177.93 179.54 2k6s h LYS 16 N -0.67 0.12 -0.18 2.45 1.57 -1.63 0.18 116.57 118.40 2k6s h LYS 16 Ca -0.06 -0.01 -0.16 0.00 -1.87 0.00 0.00 60.65 58.56 2k6s h LYS 16 Cb 0.55 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 2k6s h LYS 16 CO 0.03 0.08 -0.55 1.49 -0.57 0.00 0.00 179.45 179.93 2k6s h GLU 17 N 0.12 0.55 -0.74 3.15 4.22 -1.51 -1.95 114.58 118.41 2k6s h GLU 17 Ca 0.55 -0.34 -0.06 0.00 0.08 0.00 0.00 59.36 59.58 2k6s h GLU 17 Cb 1.11 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.37 2k6s h GLU 17 CO -0.74 0.95 0.22 -0.07 -2.18 0.00 0.00 179.01 177.19 2k6s h LEU 18 N 0.42 1.08 -0.91 1.64 3.38 0.84 -2.05 115.31 119.71 2k6s h LEU 18 Ca 0.01 -0.21 -0.10 0.00 0.09 0.00 0.00 57.88 57.66 2k6s h LEU 18 Cb 1.09 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 2k6s h LEU 18 CO 0.10 1.01 -0.33 -0.07 0.09 0.00 0.00 178.44 179.24 2k6s h LEU 19 N 1.10 0.41 0.77 1.67 3.38 -0.82 -2.96 115.31 118.86 2k6s h LEU 19 Ca 0.24 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 2k6s h LEU 19 Cb 0.32 -0.11 0.01 0.00 0.09 0.00 0.00 40.66 40.97 2k6s h LEU 19 CO -0.01 0.72 -0.37 -0.09 0.09 0.00 0.00 178.44 178.78 2k6s h ARG 20 N 0.34 -1.00 -0.99 1.13 2.43 -0.80 -3.10 114.38 112.40 2k6s h ARG 20 Ca 0.04 0.07 0.21 0.00 -0.81 0.00 0.00 59.98 59.49 2k6s h ARG 20 Cb 0.75 0.23 -0.11 0.00 -0.42 0.00 0.00 29.97 30.42 2k6s h ARG 20 CO 0.06 -0.66 0.58 0.00 -1.51 0.00 0.00 179.97 178.44 2k6s h ARG 21 N -1.22 0.66 -0.35 0.20 3.08 -1.44 -1.32 114.38 113.99 2k6s h ARG 21 Ca -0.11 -0.04 0.07 0.00 0.07 0.00 0.00 59.98 59.98 2k6s h ARG 21 Cb 0.79 -0.15 -0.07 0.00 0.08 0.00 0.00 29.97 30.62 2k6s h ARG 21 CO 0.17 0.43 -0.13 -0.22 -1.07 0.00 0.00 179.97 179.16 2k6s h LYS 22 N 0.68 -0.05 0.00 0.04 3.64 -1.49 0.44 116.57 119.82 2k6s h LYS 22 Ca 0.59 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.98 2k6s h LYS 22 Cb 1.00 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.83 2k6s h LYS 22 CO -0.42 -0.04 0.00 0.22 -2.27 0.00 0.00 179.45 176.94 2k6s h ASP 23 N -0.06 0.00 0.61 4.20 1.82 -1.18 -2.32 116.42 119.50 2k6s h ASP 23 Ca 0.17 0.00 -0.22 0.00 -0.39 0.00 0.00 57.03 56.59 2k6s h ASP 23 Cb 0.32 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 40.29 2k6s h ASP 23 CO -0.39 0.00 -1.54 0.41 -1.61 0.00 0.00 179.24 176.12 2k6s n THR 24 N -2.94 1.36 -0.01 2.25 -1.04 0.06 -3.49 114.28 110.46 2k6s n THR 24 Ca 0.00 -0.73 -0.18 0.00 -2.04 0.00 0.00 64.05 61.10 2k6s n THR 24 Cb 0.25 -0.86 -0.08 0.00 -1.82 0.00 0.00 70.33 67.82 2k6s n THR 24 CO 0.00 0.00 0.00 -0.74 -0.64 0.00 0.00 175.07 173.69 2k6s h HIS 25 N 0.00 1.04 0.00 -1.42 -0.00 0.11 0.03 115.15 114.91 2k6s h HIS 25 Ca -0.21 -0.48 0.00 0.00 -0.00 0.00 0.00 60.37 59.67 2k6s h HIS 25 Cb 1.76 -0.15 0.00 0.00 -0.00 0.00 0.00 27.41 29.02 2k6s h HIS 25 CO 0.00 1.32 0.00 -0.84 -0.00 0.00 0.00 177.93 178.41 2k6s h ILE 26 N 0.47 0.00 0.09 6.26 3.07 -1.58 -1.00 117.51 124.82 2k6s h ILE 26 Ca -0.07 -0.39 -0.34 0.00 1.55 0.00 0.00 64.86 65.60 2k6s h ILE 26 Cb 1.45 1.36 -0.03 0.00 -0.27 0.00 0.00 36.82 39.34 2k6s h ILE 26 CO 0.17 0.00 -1.91 -1.14 -1.05 0.00 0.00 178.15 174.21 2k6s n ARG 27 N -3.01 0.72 -0.01 0.16 0.00 -1.13 -3.40 116.66 110.00 2k6s n ARG 27 Ca 0.00 0.27 -0.12 0.00 -0.00 0.00 0.00 57.85 58.00 2k6s n ARG 27 Cb 0.25 -1.73 -0.08 0.00 0.00 0.00 0.00 32.46 30.90 2k6s n ARG 27 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.63 179.12 2k6s h GLU 28 N 0.05 0.10 0.00 -0.14 4.81 -0.68 -2.31 114.58 116.41 2k6s h GLU 28 Ca -0.38 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.82 2k6s h GLU 28 Cb 2.03 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 31.40 2k6s h GLU 28 CO 0.09 0.34 0.00 -0.07 -0.73 0.00 0.00 179.01 178.64 2k6s h LEU 29 N -0.16 0.00 0.41 1.64 4.07 -1.37 -2.25 115.31 117.65 2k6s h LEU 29 Ca 0.02 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.96 2k6s h LEU 29 Cb 0.29 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.04 2k6s h LEU 29 CO 0.00 0.00 -0.19 -0.08 -1.08 0.00 0.00 178.44 177.09 2k6s h GLU 30 N 0.00 -0.52 -0.19 1.13 4.22 -1.44 -2.05 114.58 115.74 2k6s h GLU 30 Ca 0.00 0.04 0.05 0.00 0.08 0.00 0.00 59.36 59.53 2k6s h GLU 30 Cb 0.22 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 2k6s h GLU 30 CO 0.00 -0.27 0.17 -0.44 -2.18 0.00 0.00 179.01 176.28 2k6s h ASP 31 N -1.08 0.00 -0.26 1.04 3.32 -1.24 -0.83 116.42 117.36 2k6s h ASP 31 Ca -0.06 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.91 2k6s h ASP 31 Cb 0.49 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 2k6s h ASP 31 CO 0.09 0.00 -0.18 1.88 -1.72 0.00 0.00 179.24 179.31 2k6s h TYR 32 N 0.00 0.69 0.00 4.55 0.05 -1.34 -2.84 116.97 118.08 2k6s h TYR 32 Ca 0.09 -0.19 0.00 0.00 0.05 0.00 0.00 58.73 58.68 2k6s h TYR 32 Cb 0.42 -0.15 0.00 0.00 1.01 0.00 0.00 36.73 38.01 2k6s h TYR 32 CO 0.00 0.87 0.00 -0.89 -1.05 0.00 0.00 178.16 177.09 2k6s n ILE 33 N -4.40 0.00 0.11 -2.88 5.41 -0.46 -3.42 119.36 113.73 2k6s n ILE 33 Ca -0.04 0.00 -0.02 0.00 1.00 0.00 0.00 62.75 63.69 2k6s n ILE 33 Cb 0.40 -0.50 0.22 0.00 -0.71 0.00 0.00 39.64 39.04 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 0.20 -1.12 4.38 3.32 -0.95 -3.11 116.42 119.14 2k6s h ASP 34 Ca 0.00 -0.09 0.38 0.00 0.02 0.00 0.00 57.03 57.34 2k6s h ASP 34 Cb 0.27 -0.06 -0.14 0.00 0.22 0.00 0.00 39.33 39.62 2k6s h ASP 34 CO 0.00 0.64 0.67 0.78 -1.72 0.00 0.00 179.24 179.61 2k6s h ASN 35 N 0.15 0.37 -0.17 6.45 2.35 -1.66 0.77 115.58 123.84 2k6s h ASN 35 Ca 0.01 0.18 -0.03 0.00 -0.55 0.00 0.00 56.30 55.90 2k6s h ASN 35 Cb 0.88 0.15 -0.01 0.00 0.05 0.00 0.00 38.32 39.40 2k6s h ASN 35 CO 0.07 -0.20 -0.02 -0.07 -1.65 0.00 0.00 177.43 175.55 2k6s h LEU 36 N 0.17 0.32 -5.23 1.61 3.38 -1.82 -3.32 115.31 110.42 2k6s h LEU 36 Ca 0.78 -0.34 -0.59 0.00 0.09 0.00 0.00 57.88 57.82 2k6s h LEU 36 Cb 2.12 -0.09 -0.42 0.00 0.09 0.00 0.00 40.66 42.36 2k6s h LEU 36 CO -0.55 0.59 -0.65 0.00 0.09 0.00 0.00 178.44 177.92 2k6s n LEU 37 N -4.69 4.51 0.00 1.67 -0.00 0.19 -5.03 117.00 113.65 2k6s n LEU 37 Ca -0.05 -5.66 -0.08 0.00 -0.00 0.00 0.00 56.01 50.23 2k6s n LEU 37 Cb 0.25 -0.55 0.02 0.00 -0.00 0.00 0.00 43.42 43.13 2k6s n LEU 37 CO 0.37 2.35 0.39 0.55 -0.00 0.00 0.00 177.39 181.05 2k6s n VAL 38 N -0.27 0.00 -2.18 1.47 3.14 0.21 -4.88 118.33 115.83 2k6s n VAL 38 Ca 0.32 -0.90 -0.43 0.00 -2.96 0.00 0.00 64.34 60.37 2k6s n VAL 38 Cb 0.41 0.81 -0.02 0.00 -1.06 0.00 0.00 33.84 33.98 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 -2.16 3.77 0.09 1.45 6.06 -1.26 -4.86 118.95 122.04 2k6s s ARG 39 Ca 0.14 1.52 -0.16 0.00 -2.50 0.00 0.00 55.73 54.74 2k6s s ARG 39 Cb -0.04 -4.02 -0.07 0.00 0.06 0.00 0.00 34.95 30.89 2k6s s ARG 39 CO 0.11 -1.32 0.52 0.14 -2.50 0.00 0.00 175.30 172.24 2k6s s VAL 40 N 5.19 4.86 0.00 7.11 -7.23 -1.26 -4.95 120.40 124.13 2k6s s VAL 40 Ca 0.69 0.93 0.00 0.00 -1.81 0.00 0.00 61.98 61.79 2k6s s VAL 40 Cb -0.22 -3.78 0.00 0.00 0.56 0.00 0.00 36.38 32.94 2k6s s VAL 40 CO 0.29 0.41 0.44 1.15 -0.31 0.00 0.00 175.10 177.08