#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 0.39 -3.57 1.61 7.64 -1.26 -4.59 113.62 113.85 2k6s n SER 2 Ca 0.00 0.18 -0.40 0.00 1.01 0.00 0.00 58.87 59.66 2k6s n SER 2 Cb 0.00 0.65 -0.04 0.00 -1.01 0.00 0.00 64.21 63.81 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 -2.81 4.87 0.00 -3.43 -0.00 -1.26 -3.36 117.00 111.01 2k6s n LEU 3 Ca -0.22 -3.17 0.00 0.00 -0.00 0.00 0.00 56.01 52.62 2k6s n LEU 3 Cb 1.02 -1.22 0.00 0.00 -0.00 0.00 0.00 43.42 43.22 2k6s n LEU 3 CO 0.44 0.13 0.00 0.35 -0.00 0.00 0.00 177.39 178.31 2k6s n THR 4 N 5.50 0.00 -0.35 1.47 -2.24 -1.26 -4.97 114.28 112.42 2k6s n THR 4 Ca 0.50 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 62.23 2k6s n THR 4 Cb 0.36 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.56 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 -0.18 0.02 4.78 9.36 -1.26 0.11 117.16 129.98 2k6s n TYR 5 Ca 0.00 1.08 0.22 0.00 3.32 0.00 0.00 57.90 62.52 2k6s n TYR 5 Cb 0.00 -0.69 0.73 0.00 -0.63 0.00 0.00 39.34 38.74 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 0.00 0.03 2.98 4.81 -1.95 -1.79 114.58 118.66 2k6s h GLU 6 Ca 0.22 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.45 2k6s h GLU 6 Cb 0.44 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.82 2k6s h GLU 6 CO -0.84 0.00 -0.01 1.49 -0.73 0.00 0.00 179.01 178.91 2k6s h GLU 7 N 0.00 -0.04 -0.30 1.92 4.22 0.84 -3.28 114.58 117.95 2k6s h GLU 7 Ca 0.25 0.00 0.09 0.00 0.08 0.00 0.00 59.36 59.78 2k6s h GLU 7 Cb 1.13 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.37 2k6s h GLU 7 CO -0.00 0.61 0.23 -0.24 -2.18 0.00 0.00 179.01 177.42 2k6s h VAL 8 N -0.95 0.77 0.94 0.32 3.04 -0.80 -2.43 116.25 117.14 2k6s h VAL 8 Ca -0.00 0.00 -0.05 0.00 -1.01 0.00 0.00 66.70 65.64 2k6s h VAL 8 Cb 0.66 0.84 0.01 0.00 -2.01 0.00 0.00 31.29 30.79 2k6s h VAL 8 CO 0.01 0.00 -0.45 -0.07 -1.01 0.00 0.00 177.57 176.04 2k6s h LEU 9 N 0.00 -1.07 -1.13 3.16 3.38 -1.44 -2.90 115.31 115.32 2k6s h LEU 9 Ca 0.14 0.04 0.17 0.00 0.09 0.00 0.00 57.88 58.32 2k6s h LEU 9 Cb 0.60 0.28 -0.09 0.00 0.09 0.00 0.00 40.66 41.53 2k6s h LEU 9 CO -0.00 -0.74 0.61 1.56 0.09 0.00 0.00 178.44 179.96 2k6s h GLN 10 N -1.33 0.73 -0.73 1.13 1.08 -1.52 -0.17 115.11 114.30 2k6s h GLN 10 Ca -0.13 -0.04 0.21 0.00 -1.45 0.00 0.00 58.65 57.24 2k6s h GLN 10 Cb 0.97 -0.16 -0.03 0.00 -0.05 0.00 0.00 27.48 28.21 2k6s h GLN 10 CO 0.21 0.48 0.54 0.93 -0.95 0.00 0.00 178.83 180.05 2k6s h GLU 11 N 0.75 0.00 0.33 1.46 5.08 -1.24 -1.70 114.58 119.26 2k6s h GLU 11 Ca 0.53 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.87 2k6s h GLU 11 Cb 0.83 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.09 2k6s h GLU 11 CO -0.30 0.00 -0.16 1.25 -1.00 0.00 0.00 179.01 178.80 2k6s h LEU 12 N 0.00 -0.37 -1.99 1.33 7.12 -0.98 -3.03 115.31 117.39 2k6s h LEU 12 Ca 0.35 0.01 0.32 0.00 0.13 0.00 0.00 57.88 58.69 2k6s h LEU 12 Cb 1.43 0.10 -0.04 0.00 -0.53 0.00 0.00 40.66 41.61 2k6s h LEU 12 CO -0.00 -0.09 0.80 1.62 -0.13 0.00 0.00 178.44 180.64 2k6s h VAL 13 N -0.79 0.43 0.88 1.05 3.04 -1.47 0.14 116.25 119.54 2k6s h VAL 13 Ca -0.04 0.00 -0.04 0.00 -1.01 0.00 0.00 66.70 65.60 2k6s h VAL 13 Cb 0.34 0.44 0.01 0.00 -2.01 0.00 0.00 31.29 30.06 2k6s h VAL 13 CO 0.07 0.00 -0.42 0.50 -1.01 0.00 0.00 177.57 176.71 2k6s h LYS 14 N 0.00 -1.14 -0.65 4.17 3.64 -1.34 -0.78 116.57 120.47 2k6s h LYS 14 Ca 0.52 0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.98 2k6s h LYS 14 Cb 2.12 0.26 -0.03 0.00 -0.41 0.00 0.00 32.23 34.17 2k6s h LYS 14 CO -0.01 -0.76 0.42 0.45 -2.27 0.00 0.00 179.45 177.28 2k6s h HIS 15 N -1.30 0.83 0.13 1.91 3.86 -1.05 -0.20 115.15 119.34 2k6s h HIS 15 Ca -0.12 0.01 0.01 0.00 -1.16 0.00 0.00 60.37 59.11 2k6s h HIS 15 Cb 0.91 -0.28 -0.04 0.00 1.06 0.00 0.00 27.41 29.06 2k6s h HIS 15 CO 0.01 0.54 -0.47 0.87 0.86 0.00 0.00 177.93 179.74 2k6s h LYS 16 N 0.88 -0.66 -0.32 2.45 1.57 -0.74 -0.32 116.57 119.43 2k6s h LYS 16 Ca 0.24 0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 59.05 2k6s h LYS 16 Cb -0.07 0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 2k6s h LYS 16 CO -0.05 -0.44 0.15 1.49 -0.57 0.00 0.00 179.45 180.03 2k6s h GLU 17 N -0.69 0.44 -0.25 3.15 4.81 -1.05 -1.95 114.58 119.04 2k6s h GLU 17 Ca -0.01 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.15 2k6s h GLU 17 Cb 0.68 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.96 2k6s h GLU 17 CO -0.24 0.35 0.06 -0.07 -0.73 0.00 0.00 179.01 178.37 2k6s h LEU 18 N 0.44 0.33 -0.55 1.64 3.38 -0.10 -0.76 115.31 119.69 2k6s h LEU 18 Ca 0.11 -0.04 -0.10 0.00 0.09 0.00 0.00 57.88 57.95 2k6s h LEU 18 Cb 0.05 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2k6s h LEU 18 CO -0.02 0.34 -0.48 -0.07 0.09 0.00 0.00 178.44 178.31 2k6s h LEU 19 N 0.36 0.00 0.10 1.67 3.38 -0.29 -2.67 115.31 117.86 2k6s h LEU 19 Ca 0.09 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 2k6s h LEU 19 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2k6s h LEU 19 CO -0.00 0.48 -0.05 0.03 0.09 0.00 0.00 178.44 178.99 2k6s h ARG 20 N 0.00 -0.13 -0.27 1.13 3.08 -1.13 -3.24 114.38 113.83 2k6s h ARG 20 Ca -0.00 0.01 0.06 0.00 0.07 0.00 0.00 59.98 60.12 2k6s h ARG 20 Cb 1.14 0.03 -0.07 0.00 0.08 0.00 0.00 29.97 31.15 2k6s h ARG 20 CO 0.06 0.29 -0.17 -0.09 -1.07 0.00 0.00 179.97 179.00 2k6s h ARG 21 N -0.95 -0.14 -1.02 0.04 2.43 -1.26 0.41 114.38 113.89 2k6s h ARG 21 Ca -0.01 0.01 0.26 0.00 -0.81 0.00 0.00 59.98 59.43 2k6s h ARG 21 Cb 0.48 0.03 -0.12 0.00 -0.42 0.00 0.00 29.97 29.94 2k6s h ARG 21 CO 0.02 -0.09 0.61 -0.22 -1.51 0.00 0.00 179.97 178.78 2k6s h LYS 22 N -0.14 0.50 0.22 0.20 3.64 -1.61 0.36 116.57 119.73 2k6s h LYS 22 Ca 0.14 -0.03 -0.32 0.00 -1.27 0.00 0.00 60.65 59.17 2k6s h LYS 22 Cb 0.36 -0.11 0.03 0.00 -0.41 0.00 0.00 32.23 32.10 2k6s h LYS 22 CO -0.36 0.33 -1.41 -0.44 -2.27 0.00 0.00 179.45 175.30 2k6s h ASP 23 N 0.52 0.77 0.20 4.20 5.19 -1.33 -3.18 116.42 122.78 2k6s h ASP 23 Ca 0.65 -0.81 -0.05 0.00 -0.62 0.00 0.00 57.03 56.21 2k6s h ASP 23 Cb 1.34 -0.25 -0.01 0.00 0.18 0.00 0.00 39.33 40.60 2k6s h ASP 23 CO -0.46 1.63 -0.21 0.74 -3.12 0.00 0.00 179.24 177.82 2k6s h THR 24 N 0.15 1.16 0.46 0.35 2.02 0.98 -0.06 112.91 117.97 2k6s h THR 24 Ca -0.23 -0.76 -0.02 0.00 0.77 0.00 0.00 66.41 66.18 2k6s h THR 24 Cb 2.11 1.39 0.00 0.00 -1.74 0.00 0.00 68.15 69.91 2k6s h THR 24 CO 0.26 0.22 -0.22 -0.74 0.37 0.00 0.00 175.52 175.41 2k6s h HIS 25 N 0.02 -0.57 -0.13 3.16 6.17 -0.44 0.65 115.15 124.01 2k6s h HIS 25 Ca 0.00 -0.01 -0.02 0.00 0.71 0.00 0.00 60.37 61.05 2k6s h HIS 25 Cb 0.39 0.19 -0.01 0.00 2.52 0.00 0.00 27.41 30.50 2k6s h HIS 25 CO 0.00 -0.26 -0.01 -0.84 0.71 0.00 0.00 177.93 177.53 2k6s h ILE 26 N -1.02 1.10 -0.40 6.26 -0.00 -1.52 0.20 117.51 122.12 2k6s h ILE 26 Ca -0.06 -0.39 -0.15 0.00 -0.00 0.00 0.00 64.86 64.27 2k6s h ILE 26 Cb 0.57 1.01 -0.01 0.00 -0.00 0.00 0.00 36.82 38.39 2k6s h ILE 26 CO 0.10 0.13 -0.32 -0.09 -0.00 0.00 0.00 178.15 177.97 2k6s h ARG 27 N 0.19 0.90 -0.13 0.16 1.12 -0.97 -2.60 114.38 113.06 2k6s h ARG 27 Ca 0.05 -0.44 -0.19 0.00 -1.11 0.00 0.00 59.98 58.29 2k6s h ARG 27 Cb 0.16 -0.00 0.01 0.00 -0.01 0.00 0.00 29.97 30.12 2k6s h ARG 27 CO 0.00 1.09 -0.65 1.49 -3.11 0.00 0.00 179.97 178.79 2k6s h GLU 28 N 0.75 0.66 0.00 0.20 4.81 -0.00 -3.17 114.58 117.83 2k6s h GLU 28 Ca 0.08 -0.54 -0.00 0.00 -0.13 0.00 0.00 59.36 58.76 2k6s h GLU 28 Cb 0.90 0.11 -0.00 0.00 0.63 0.00 0.00 28.75 30.39 2k6s h GLU 28 CO 0.08 1.16 -0.02 -0.07 -0.73 0.00 0.00 179.01 179.43 2k6s h LEU 29 N 0.34 0.00 -0.96 1.64 4.07 -0.61 -1.75 115.31 118.03 2k6s h LEU 29 Ca -0.04 0.00 -0.11 0.00 0.08 0.00 0.00 57.88 57.81 2k6s h LEU 29 Cb 1.29 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 43.01 2k6s h LEU 29 CO 0.13 0.02 -0.43 -0.33 -1.08 0.00 0.00 178.44 176.76 2k6s h GLU 30 N 0.00 0.20 0.15 1.13 5.08 -1.43 -1.66 114.58 118.05 2k6s h GLU 30 Ca -0.00 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 2k6s h GLU 30 Cb 0.05 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 2k6s h GLU 30 CO 0.00 0.59 -0.07 0.22 -1.00 0.00 0.00 179.01 178.75 2k6s h ASP 31 N 0.17 -0.17 -0.50 1.42 1.82 -1.41 -0.69 116.42 117.06 2k6s h ASP 31 Ca 0.01 -0.23 -0.04 0.00 -0.39 0.00 0.00 57.03 56.38 2k6s h ASP 31 Cb 0.82 0.04 -0.03 0.00 0.68 0.00 0.00 39.33 40.85 2k6s h ASP 31 CO 0.06 0.14 0.17 1.88 -1.61 0.00 0.00 179.24 179.89 2k6s h TYR 32 N -0.50 0.83 0.00 0.28 0.05 -1.54 -2.33 116.97 113.77 2k6s h TYR 32 Ca -0.02 -0.06 -0.09 0.00 0.05 0.00 0.00 58.73 58.61 2k6s h TYR 32 Cb 0.39 -0.25 -0.01 0.00 1.01 0.00 0.00 36.73 37.87 2k6s h TYR 32 CO 0.02 0.68 -0.41 0.82 -1.05 0.00 0.00 178.16 178.22 2k6s h ILE 33 N 0.80 1.11 -0.16 -2.88 2.04 -1.22 -3.05 117.51 114.15 2k6s h ILE 33 Ca 0.18 -1.50 -0.03 0.00 1.00 0.00 0.00 64.86 64.52 2k6s h ILE 33 Cb 0.23 1.85 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 2k6s h ILE 33 CO -0.01 0.40 -0.02 0.44 0.00 0.00 0.00 178.15 178.96 2k6s h ASP 34 N 0.00 0.21 -0.96 1.72 3.32 -0.53 -3.05 116.42 117.12 2k6s h ASP 34 Ca -0.00 -0.03 0.35 0.00 0.02 0.00 0.00 57.03 57.37 2k6s h ASP 34 Cb 0.82 -0.05 -0.18 0.00 0.22 0.00 0.00 39.33 40.14 2k6s h ASP 34 CO 0.05 0.27 0.31 0.59 -1.72 0.00 0.00 179.24 178.75 2k6s n ASN 35 N -4.38 0.15 -0.01 6.45 3.02 -1.15 0.98 115.26 120.31 2k6s n ASN 35 Ca -0.01 1.61 -0.11 0.00 -0.03 0.00 0.00 54.58 56.05 2k6s n ASN 35 Cb 0.18 -0.70 -0.06 0.00 -0.61 0.00 0.00 39.78 38.59 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 -1.77 -3.23 115.31 111.72 2k6s h LEU 36 Ca 0.72 -0.09 -0.65 0.00 0.09 0.00 0.00 57.88 57.95 2k6s h LEU 36 Cb 1.76 -0.03 -0.38 0.00 0.09 0.00 0.00 40.66 42.10 2k6s h LEU 36 CO -0.81 0.19 -0.21 0.00 0.09 0.00 0.00 178.44 177.69 2k6s n LEU 37 N -4.96 5.24 -3.57 1.67 -0.00 0.27 -5.00 117.00 110.65 2k6s n LEU 37 Ca -0.05 -5.60 -0.06 0.00 -0.00 0.00 0.00 56.01 50.30 2k6s n LEU 37 Cb 0.07 -0.71 -0.02 0.00 -0.00 0.00 0.00 43.42 42.76 2k6s n LEU 37 CO 0.34 2.28 0.83 0.54 -0.00 0.00 0.00 177.39 181.37 2k6s s VAL 38 N -4.48 0.00 -0.04 1.47 0.11 0.12 -4.88 120.40 112.71 2k6s s VAL 38 Ca 0.47 -0.07 -0.37 0.00 -2.93 0.00 0.00 61.98 59.07 2k6s s VAL 38 Cb 0.26 -1.16 -0.15 0.00 -1.53 0.00 0.00 36.38 33.80 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 -0.23 1.43 -3.94 1.54 3.00 -1.26 -4.70 116.66 112.49 2k6s n ARG 39 Ca -0.05 0.52 -0.36 0.00 -0.00 0.00 0.00 57.85 57.96 2k6s n ARG 39 Cb 0.60 -2.22 -0.08 0.00 0.00 0.00 0.00 32.46 30.77 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 1.96 5.13 -1.77 5.15 -7.23 -1.26 -4.89 120.40 117.49 2k6s s VAL 40 Ca 0.89 0.08 0.14 0.00 -1.81 0.00 0.00 61.98 61.28 2k6s s VAL 40 Cb -0.92 -3.27 0.11 0.00 0.56 0.00 0.00 36.38 32.86 2k6s s VAL 40 CO 0.52 0.53 0.95 1.15 -0.31 0.00 0.00 175.10 177.94