#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 1.09 -3.84 1.61 7.64 -1.26 -4.62 113.62 114.25 2k6s n SER 2 Ca 0.00 0.17 -0.39 0.00 1.01 0.00 0.00 58.87 59.66 2k6s n SER 2 Cb 0.00 -0.01 -0.08 0.00 -1.01 0.00 0.00 64.21 63.11 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 -3.10 3.00 0.00 -3.43 -0.00 -1.26 -3.51 117.00 108.70 2k6s n LEU 3 Ca -0.29 -2.60 0.00 0.00 -0.00 0.00 0.00 56.01 53.12 2k6s n LEU 3 Cb 1.07 -1.13 0.00 0.00 -0.00 0.00 0.00 43.42 43.36 2k6s n LEU 3 CO 0.41 -1.24 0.00 0.35 -0.00 0.00 0.00 177.39 176.91 2k6s n THR 4 N 6.78 0.00 -0.35 1.47 -2.24 -1.26 -4.96 114.28 113.71 2k6s n THR 4 Ca 0.48 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 62.18 2k6s n THR 4 Cb 0.42 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.60 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 -0.28 0.11 4.78 9.36 -1.26 0.72 117.16 130.60 2k6s n TYR 5 Ca 0.00 1.05 0.13 0.00 3.32 0.00 0.00 57.90 62.40 2k6s n TYR 5 Cb 0.00 -0.63 0.64 0.00 -0.63 0.00 0.00 39.34 38.73 2k6s n TYR 5 CO 0.00 0.00 0.00 1.49 0.22 0.00 0.00 176.86 178.57 2k6s h GLU 6 N 0.00 0.05 0.00 2.98 4.81 -1.97 -0.59 114.58 119.86 2k6s h GLU 6 Ca 0.17 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 2k6s h GLU 6 Cb 0.38 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.75 2k6s h GLU 6 CO -0.80 0.03 0.00 1.49 -0.73 0.00 0.00 179.01 179.00 2k6s h GLU 7 N 0.05 0.00 0.00 1.92 4.22 0.26 -3.11 114.58 117.91 2k6s h GLU 7 Ca 0.13 0.00 -0.23 0.00 0.08 0.00 0.00 59.36 59.35 2k6s h GLU 7 Cb 0.48 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.69 2k6s h GLU 7 CO -0.01 0.00 -1.41 -0.24 -2.18 0.00 0.00 179.01 175.17 2k6s h VAL 8 N 0.00 0.90 0.69 0.32 3.04 -0.62 -3.23 116.25 117.35 2k6s h VAL 8 Ca 0.00 -2.59 -0.03 0.00 -1.01 0.00 0.00 66.70 63.08 2k6s h VAL 8 Cb 0.67 2.38 -0.01 0.00 -2.01 0.00 0.00 31.29 32.32 2k6s h VAL 8 CO 0.00 0.51 -0.50 -0.07 -1.01 0.00 0.00 177.57 176.50 2k6s h LEU 9 N 0.00 -1.29 -0.48 3.16 3.38 -1.44 -1.71 115.31 116.94 2k6s h LEU 9 Ca -0.18 0.08 0.07 0.00 0.09 0.00 0.00 57.88 57.94 2k6s h LEU 9 Cb 1.80 0.40 -0.06 0.00 0.09 0.00 0.00 40.66 42.89 2k6s h LEU 9 CO 0.08 -0.72 0.16 1.56 0.09 0.00 0.00 178.44 179.60 2k6s h GLN 10 N -1.14 0.32 -1.05 1.13 1.08 -1.74 -1.68 115.11 112.04 2k6s h GLN 10 Ca -0.09 -0.02 0.27 0.00 -1.45 0.00 0.00 58.65 57.36 2k6s h GLN 10 Cb 0.93 -0.07 -0.11 0.00 -0.05 0.00 0.00 27.48 28.19 2k6s h GLN 10 CO 0.05 0.21 0.66 0.93 -0.95 0.00 0.00 178.83 179.72 2k6s h GLU 11 N 0.33 0.41 0.00 1.46 4.39 -1.50 -1.17 114.58 118.50 2k6s h GLU 11 Ca 0.23 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.90 2k6s h GLU 11 Cb 0.24 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 28.80 2k6s h GLU 11 CO -0.24 0.27 0.00 -0.11 -1.16 0.00 0.00 179.01 177.77 2k6s n LEU 12 N -4.72 0.33 -0.33 1.33 -0.00 -0.64 -2.81 117.00 110.17 2k6s n LEU 12 Ca 0.27 0.65 0.25 0.00 -0.00 0.00 0.00 56.01 57.17 2k6s n LEU 12 Cb 0.88 -0.38 0.48 0.00 -0.00 0.00 0.00 43.42 44.39 2k6s n LEU 12 CO 0.22 -0.38 1.05 1.62 -0.00 0.00 0.00 177.39 179.90 2k6s h VAL 13 N 0.00 0.18 0.39 1.96 3.04 -1.46 -0.01 116.25 120.35 2k6s h VAL 13 Ca 0.00 -0.06 -0.00 0.00 -1.01 0.00 0.00 66.70 65.62 2k6s h VAL 13 Cb 0.00 -0.02 -0.02 0.00 -2.01 0.00 0.00 31.29 29.24 2k6s h VAL 13 CO 0.00 0.03 -0.40 0.50 -1.01 0.00 0.00 177.57 176.70 2k6s h LYS 14 N 0.18 -0.78 -0.93 4.17 3.64 -1.31 0.07 116.57 121.61 2k6s h LYS 14 Ca 0.74 0.05 0.24 0.00 -1.27 0.00 0.00 60.65 60.42 2k6s h LYS 14 Cb 1.77 0.18 -0.13 0.00 -0.41 0.00 0.00 32.23 33.63 2k6s h LYS 14 CO -0.69 -0.52 0.45 0.45 -2.27 0.00 0.00 179.45 176.87 2k6s h HIS 15 N -0.81 0.74 0.01 1.91 3.86 -0.83 -1.50 115.15 118.54 2k6s h HIS 15 Ca -0.03 0.04 -0.19 0.00 -1.16 0.00 0.00 60.37 59.03 2k6s h HIS 15 Cb 0.72 -0.18 0.02 0.00 1.06 0.00 0.00 27.41 29.03 2k6s h HIS 15 CO -0.22 -0.06 -0.76 0.87 0.86 0.00 0.00 177.93 178.62 2k6s h LYS 16 N 0.41 0.49 -0.49 2.45 1.57 -1.29 -3.20 116.57 116.50 2k6s h LYS 16 Ca 0.60 -0.55 0.09 0.00 -1.87 0.00 0.00 60.65 58.93 2k6s h LYS 16 Cb 1.18 0.16 -0.03 0.00 0.08 0.00 0.00 32.23 33.63 2k6s h LYS 16 CO -0.54 1.19 0.34 1.05 -0.57 0.00 0.00 179.45 180.91 2k6s h GLU 17 N 0.03 0.26 0.00 3.15 4.11 -0.07 0.23 114.58 122.29 2k6s h GLU 17 Ca -0.10 -0.02 -0.09 0.00 0.07 0.00 0.00 59.36 59.23 2k6s h GLU 17 Cb 1.47 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.65 2k6s h GLU 17 CO 0.15 0.17 -0.41 -0.07 0.07 0.00 0.00 179.01 178.92 2k6s h LEU 18 N 0.26 0.00 0.04 3.06 3.38 -1.35 -1.95 115.31 118.76 2k6s h LEU 18 Ca 0.23 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.96 2k6s h LEU 18 Cb 0.55 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 2k6s h LEU 18 CO -0.05 0.41 -1.15 -0.07 0.09 0.00 0.00 178.44 177.68 2k6s h LEU 19 N 0.00 0.13 0.53 1.67 3.38 -0.63 -2.84 115.31 117.55 2k6s h LEU 19 Ca -0.00 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 2k6s h LEU 19 Cb 0.90 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 41.61 2k6s h LEU 19 CO 0.05 1.11 -0.25 0.03 0.09 0.00 0.00 178.44 179.47 2k6s h ARG 20 N 0.02 -0.69 -0.75 1.13 3.08 -0.81 -3.16 114.38 113.21 2k6s h ARG 20 Ca -0.08 0.05 0.14 0.00 0.07 0.00 0.00 59.98 60.16 2k6s h ARG 20 Cb 1.85 0.16 -0.10 0.00 0.08 0.00 0.00 29.97 31.96 2k6s h ARG 20 CO 0.15 -0.46 0.29 -0.09 -1.07 0.00 0.00 179.97 178.79 2k6s h ARG 21 N -1.15 0.41 -1.02 0.04 2.43 -1.51 -0.37 114.38 113.22 2k6s h ARG 21 Ca -0.07 -0.02 0.27 0.00 -0.81 0.00 0.00 59.98 59.34 2k6s h ARG 21 Cb 0.55 -0.09 -0.12 0.00 -0.42 0.00 0.00 29.97 29.88 2k6s h ARG 21 CO 0.12 0.27 0.61 -0.22 -1.51 0.00 0.00 179.97 179.24 2k6s h LYS 22 N 0.42 0.48 0.25 0.20 3.64 -1.54 0.43 116.57 120.46 2k6s h LYS 22 Ca 0.41 -0.03 -0.34 0.00 -1.27 0.00 0.00 60.65 59.43 2k6s h LYS 22 Cb 0.63 -0.11 0.04 0.00 -0.41 0.00 0.00 32.23 32.38 2k6s h LYS 22 CO -0.41 0.32 -1.48 -0.44 -2.27 0.00 0.00 179.45 175.17 2k6s h ASP 23 N 0.50 0.82 0.33 4.20 5.19 -1.06 -3.14 116.42 123.25 2k6s h ASP 23 Ca 0.66 -0.88 -0.03 0.00 -0.62 0.00 0.00 57.03 56.15 2k6s h ASP 23 Cb 1.38 -0.27 -0.00 0.00 0.18 0.00 0.00 39.33 40.62 2k6s h ASP 23 CO -0.46 1.69 -0.13 0.74 -3.12 0.00 0.00 179.24 177.96 2k6s h THR 24 N 0.14 0.67 -0.01 0.35 2.02 -0.05 0.22 112.91 116.26 2k6s h THR 24 Ca -0.25 -0.56 -0.02 0.00 0.77 0.00 0.00 66.41 66.35 2k6s h THR 24 Cb 2.16 1.34 0.00 0.00 -1.74 0.00 0.00 68.15 69.92 2k6s h THR 24 CO 0.27 0.13 -0.08 -0.74 0.37 0.00 0.00 175.52 175.47 2k6s h HIS 25 N 0.00 0.10 0.00 3.16 6.17 -0.30 0.56 115.15 124.84 2k6s h HIS 25 Ca -0.00 -0.05 -0.05 0.00 0.71 0.00 0.00 60.37 60.99 2k6s h HIS 25 Cb 0.33 -0.01 -0.01 0.00 2.52 0.00 0.00 27.41 30.24 2k6s h HIS 25 CO 0.00 0.80 -0.22 -0.84 0.71 0.00 0.00 177.93 178.38 2k6s h ILE 26 N -0.63 0.73 -0.01 6.26 3.07 -1.46 0.26 117.51 125.71 2k6s h ILE 26 Ca -0.01 -0.91 -0.15 0.00 1.55 0.00 0.00 64.86 65.34 2k6s h ILE 26 Cb 0.82 1.56 0.01 0.00 -0.27 0.00 0.00 36.82 38.94 2k6s h ILE 26 CO 0.02 0.21 -0.59 -0.09 -1.05 0.00 0.00 178.15 176.65 2k6s h ARG 27 N 0.00 0.43 -0.04 0.16 2.43 -0.93 -2.56 114.38 113.86 2k6s h ARG 27 Ca -0.00 -0.44 -0.20 0.00 -0.81 0.00 0.00 59.98 58.53 2k6s h ARG 27 Cb 0.55 0.12 0.01 0.00 -0.42 0.00 0.00 29.97 30.23 2k6s h ARG 27 CO 0.03 1.10 -0.74 1.05 -1.51 0.00 0.00 179.97 179.89 2k6s h GLU 28 N -0.07 0.58 0.00 0.20 -0.00 -0.64 -3.16 114.58 111.49 2k6s h GLU 28 Ca -0.07 -0.57 -0.02 0.00 -0.00 0.00 0.00 59.36 58.71 2k6s h GLU 28 Cb 1.29 0.15 -0.00 0.00 -0.00 0.00 0.00 28.75 30.19 2k6s h GLU 28 CO 0.12 1.19 -0.08 1.25 -0.00 0.00 0.00 179.01 181.48 2k6s h LEU 29 N 0.19 0.00 0.65 3.06 5.85 -0.60 -3.02 115.31 121.43 2k6s h LEU 29 Ca -0.08 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 2k6s h LEU 29 Cb 1.41 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.43 2k6s h LEU 29 CO 0.15 0.08 -0.47 -0.33 -0.34 0.00 0.00 178.44 177.53 2k6s h GLU 30 N 0.00 -1.04 -1.00 1.25 4.39 -1.41 -2.74 114.58 114.04 2k6s h GLU 30 Ca -0.00 0.07 0.36 0.00 0.34 0.00 0.00 59.36 60.13 2k6s h GLU 30 Cb 0.20 0.24 -0.16 0.00 -0.10 0.00 0.00 28.75 28.92 2k6s h GLU 30 CO 0.01 -0.69 0.52 -0.44 -1.16 0.00 0.00 179.01 177.25 2k6s h ASP 31 N -1.08 0.37 -0.77 1.42 3.32 -1.63 0.58 116.42 118.63 2k6s h ASP 31 Ca -0.08 0.23 -0.06 0.00 0.02 0.00 0.00 57.03 57.14 2k6s h ASP 31 Cb 0.89 0.21 -0.03 0.00 0.22 0.00 0.00 39.33 40.62 2k6s h ASP 31 CO 0.04 -0.28 0.27 1.88 -1.72 0.00 0.00 179.24 179.42 2k6s h TYR 32 N 0.16 1.21 0.00 4.55 0.05 -1.60 -2.43 116.97 118.92 2k6s h TYR 32 Ca 0.77 -0.11 -0.07 0.00 0.05 0.00 0.00 58.73 59.38 2k6s h TYR 32 Cb 1.89 -0.36 -0.01 0.00 1.01 0.00 0.00 36.73 39.27 2k6s h TYR 32 CO -0.04 0.94 -0.32 0.82 -1.05 0.00 0.00 178.16 178.51 2k6s h ILE 33 N 1.14 1.03 -0.29 -2.88 2.04 0.28 -2.94 117.51 115.89 2k6s h ILE 33 Ca 0.25 -1.19 -0.01 0.00 1.00 0.00 0.00 64.86 64.91 2k6s h ILE 33 Cb 0.28 1.68 -0.02 0.00 -0.74 0.00 0.00 36.82 38.02 2k6s h ILE 33 CO -0.01 0.32 0.12 0.44 0.00 0.00 0.00 178.15 179.01 2k6s h ASP 34 N 0.00 0.36 -0.93 1.72 5.19 -0.84 -3.01 116.42 118.90 2k6s h ASP 34 Ca -0.00 -0.03 0.34 0.00 -0.62 0.00 0.00 57.03 56.72 2k6s h ASP 34 Cb 0.65 -0.09 -0.17 0.00 0.18 0.00 0.00 39.33 39.90 2k6s h ASP 34 CO 0.04 0.33 0.33 0.59 -3.12 0.00 0.00 179.24 177.41 2k6s n ASN 35 N -4.42 0.17 -0.00 6.45 3.02 -1.11 0.11 115.26 119.47 2k6s n ASN 35 Ca 0.01 1.56 -0.12 0.00 -0.03 0.00 0.00 54.58 56.01 2k6s n ASN 35 Cb 0.13 -0.69 -0.07 0.00 -0.61 0.00 0.00 39.78 38.54 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 0.09 -5.62 3.41 3.38 -1.76 -3.26 115.31 111.55 2k6s h LEU 36 Ca 0.71 -0.15 -0.65 0.00 0.09 0.00 0.00 57.88 57.88 2k6s h LEU 36 Cb 1.76 -0.02 -0.38 0.00 0.09 0.00 0.00 40.66 42.10 2k6s h LEU 36 CO -0.78 0.22 -0.21 0.00 0.09 0.00 0.00 178.44 177.76 2k6s n LEU 37 N -4.96 5.16 -3.58 1.67 -0.00 0.30 -5.00 117.00 110.59 2k6s n LEU 37 Ca -0.06 -5.59 -0.05 0.00 -0.00 0.00 0.00 56.01 50.30 2k6s n LEU 37 Cb 0.10 -0.73 -0.02 0.00 -0.00 0.00 0.00 43.42 42.77 2k6s n LEU 37 CO 0.34 2.25 0.95 0.54 -0.00 0.00 0.00 177.39 181.46 2k6s s VAL 38 N -4.25 0.00 -0.05 1.47 0.11 0.15 -4.86 120.40 112.96 2k6s s VAL 38 Ca 0.46 0.00 -0.37 0.00 -2.93 0.00 0.00 61.98 59.13 2k6s s VAL 38 Cb 0.24 -1.00 -0.15 0.00 -1.53 0.00 0.00 36.38 33.94 2k6s s VAL 38 CO -0.12 0.00 1.58 -1.14 -3.33 0.00 0.00 175.10 172.09 2k6s n ARG 39 N -0.03 1.41 -4.06 1.54 3.00 -1.26 -4.66 116.66 112.60 2k6s n ARG 39 Ca -0.02 0.51 -0.26 0.00 -0.00 0.00 0.00 57.85 58.08 2k6s n ARG 39 Cb 0.59 -2.21 -0.05 0.00 0.00 0.00 0.00 32.46 30.79 2k6s n ARG 39 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.63 177.77 2k6s s VAL 40 N 2.05 4.62 0.00 5.15 -7.23 -1.26 -4.89 120.40 118.85 2k6s s VAL 40 Ca 0.90 -1.02 0.00 0.00 -1.81 0.00 0.00 61.98 60.05 2k6s s VAL 40 Cb -0.93 -3.36 0.00 0.00 0.56 0.00 0.00 36.38 32.65 2k6s s VAL 40 CO 0.53 -0.11 0.26 1.15 -0.31 0.00 0.00 175.10 176.62