#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 0.70 -3.45 1.61 7.64 -1.26 -4.50 113.62 114.36 2k6s n SER 2 Ca 0.00 0.27 -0.36 0.00 1.01 0.00 0.00 58.87 59.79 2k6s n SER 2 Cb 0.00 0.70 -0.03 0.00 -1.01 0.00 0.00 64.21 63.88 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 -2.62 6.14 0.00 -3.43 -0.00 -1.26 -3.31 117.00 112.53 2k6s n LEU 3 Ca -0.02 -3.56 0.00 0.00 -0.00 0.00 0.00 56.01 52.43 2k6s n LEU 3 Cb 0.58 -1.35 0.00 0.00 -0.00 0.00 0.00 43.42 42.64 2k6s n LEU 3 CO 0.41 0.86 0.00 0.35 -0.00 0.00 0.00 177.39 179.01 2k6s n THR 4 N 4.71 0.00 -0.30 1.47 -2.24 -1.26 -4.96 114.28 111.70 2k6s n THR 4 Ca 0.56 0.00 0.18 0.00 -2.27 0.00 0.00 64.05 62.52 2k6s n THR 4 Cb 0.29 0.00 0.34 0.00 -2.10 0.00 0.00 70.33 68.85 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 0.71 0.39 4.78 9.36 -1.26 0.14 117.16 131.27 2k6s n TYR 5 Ca 0.00 1.07 0.13 0.00 3.32 0.00 0.00 57.90 62.43 2k6s n TYR 5 Cb 0.00 -1.26 0.52 0.00 -0.63 0.00 0.00 39.34 37.98 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 0.00 0.03 2.98 5.08 -1.95 -2.78 114.58 117.94 2k6s h GLU 6 Ca 0.61 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.90 2k6s h GLU 6 Cb 1.38 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.63 2k6s h GLU 6 CO -0.80 0.00 -0.29 1.49 -1.00 0.00 0.00 179.01 178.41 2k6s h GLU 7 N 0.00 0.13 -0.18 2.33 4.22 0.12 -3.29 114.58 117.92 2k6s h GLU 7 Ca 0.00 -0.19 -0.08 0.00 0.08 0.00 0.00 59.36 59.17 2k6s h GLU 7 Cb 0.44 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 2k6s h GLU 7 CO 0.00 1.02 -0.26 -0.24 -2.18 0.00 0.00 179.01 177.35 2k6s h VAL 8 N -0.66 1.25 0.29 0.32 3.04 -1.50 -3.21 116.25 115.79 2k6s h VAL 8 Ca -0.05 -1.20 0.00 0.00 -1.01 0.00 0.00 66.70 64.45 2k6s h VAL 8 Cb 1.15 1.41 -0.03 0.00 -2.01 0.00 0.00 31.29 31.81 2k6s h VAL 8 CO 0.05 0.37 -0.41 -0.07 -1.01 0.00 0.00 177.57 176.50 2k6s h LEU 9 N 0.30 -1.16 -2.65 3.16 3.38 -1.59 -1.62 115.31 115.12 2k6s h LEU 9 Ca 0.05 0.11 0.01 0.00 0.09 0.00 0.00 57.88 58.13 2k6s h LEU 9 Cb 0.62 0.41 -0.00 0.00 0.09 0.00 0.00 40.66 41.78 2k6s h LEU 9 CO 0.04 -0.53 0.08 1.56 0.09 0.00 0.00 178.44 179.68 2k6s h GLN 10 N -0.76 0.00 0.00 1.13 1.08 -1.62 -0.15 115.11 114.79 2k6s h GLN 10 Ca -0.01 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.14 2k6s h GLN 10 Cb 0.72 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.14 2k6s h GLN 10 CO -0.14 0.00 -0.23 0.93 -0.95 0.00 0.00 178.83 178.44 2k6s h GLU 11 N 0.00 0.00 0.20 1.46 5.08 -1.30 -2.76 114.58 117.26 2k6s h GLU 11 Ca 0.01 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 2k6s h GLU 11 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 2k6s h GLU 11 CO -0.00 0.23 -0.09 -0.07 -1.00 0.00 0.00 179.01 178.08 2k6s h LEU 12 N 0.00 -0.22 -1.79 1.33 -0.00 -0.85 -1.49 115.31 112.29 2k6s h LEU 12 Ca -0.00 -0.25 0.00 0.00 -0.00 0.00 0.00 57.88 57.63 2k6s h LEU 12 Cb 0.82 0.06 0.00 0.00 -0.00 0.00 0.00 40.66 41.54 2k6s h LEU 12 CO 0.03 0.16 0.00 1.62 -0.00 0.00 0.00 178.44 180.25 2k6s h VAL 13 N -0.64 0.00 0.06 1.22 3.04 -1.63 -0.80 116.25 117.49 2k6s h VAL 13 Ca -0.03 -0.25 -0.00 0.00 -1.01 0.00 0.00 66.70 65.41 2k6s h VAL 13 Cb 0.46 1.15 0.00 0.00 -2.01 0.00 0.00 31.29 30.89 2k6s h VAL 13 CO 0.04 0.00 -0.03 0.50 -1.01 0.00 0.00 177.57 177.08 2k6s h LYS 14 N 0.00 -0.07 -0.54 4.17 3.64 -1.29 -2.06 116.57 120.42 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 0.28 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.09 2k6s h LYS 14 CO 0.00 0.45 0.25 0.45 -2.27 0.00 0.00 179.45 178.32 2k6s h HIS 15 N -0.95 0.76 0.31 1.91 3.86 -1.12 0.50 115.15 120.42 2k6s h HIS 15 Ca -0.01 -0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.16 2k6s h HIS 15 Cb 0.55 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 28.79 2k6s h HIS 15 CO 0.13 0.57 -0.15 0.87 0.86 0.00 0.00 177.93 180.21 2k6s h LYS 16 N 0.76 -0.41 -0.53 2.45 1.57 -1.24 -2.05 116.57 117.13 2k6s h LYS 16 Ca 0.19 0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.96 2k6s h LYS 16 Cb 0.10 0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.48 2k6s h LYS 16 CO -0.02 -0.12 0.19 1.49 -0.57 0.00 0.00 179.45 180.42 2k6s h GLU 17 N -0.69 0.78 -0.38 3.15 4.81 -1.21 -1.20 114.58 119.85 2k6s h GLU 17 Ca -0.04 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.06 2k6s h GLU 17 Cb 0.48 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.70 2k6s h GLU 17 CO 0.07 0.66 0.25 -0.07 -0.73 0.00 0.00 179.01 179.19 2k6s h LEU 18 N 0.76 0.44 -0.96 1.64 3.38 -0.85 -1.44 115.31 118.28 2k6s h LEU 18 Ca 0.18 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 58.04 2k6s h LEU 18 Cb 0.19 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2k6s h LEU 18 CO -0.01 0.32 -0.35 -0.07 0.09 0.00 0.00 178.44 178.42 2k6s h LEU 19 N 0.52 0.33 0.81 1.67 3.38 -1.03 -2.67 115.31 118.32 2k6s h LEU 19 Ca 0.14 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 2k6s h LEU 19 Cb -0.06 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 40.61 2k6s h LEU 19 CO -0.03 0.66 -0.39 0.03 0.09 0.00 0.00 178.44 178.80 2k6s h ARG 20 N 0.28 -1.05 -0.99 1.13 3.08 -0.61 -3.08 114.38 113.12 2k6s h ARG 20 Ca 0.03 0.07 0.15 0.00 0.07 0.00 0.00 59.98 60.31 2k6s h ARG 20 Cb 0.75 0.24 -0.09 0.00 0.08 0.00 0.00 29.97 30.95 2k6s h ARG 20 CO 0.06 -0.70 0.62 -0.09 -1.07 0.00 0.00 179.97 178.79 2k6s h ARG 21 N -1.18 0.85 -0.99 0.04 2.43 -1.32 -2.12 114.38 112.08 2k6s h ARG 21 Ca -0.11 -0.05 0.24 0.00 -0.81 0.00 0.00 59.98 59.24 2k6s h ARG 21 Cb 0.84 -0.19 -0.19 0.00 -0.42 0.00 0.00 29.97 30.01 2k6s h ARG 21 CO 0.18 0.56 -0.11 0.87 -1.51 0.00 0.00 179.97 179.97 2k6s h LYS 22 N 0.87 0.00 0.04 0.20 1.57 -1.38 0.74 116.57 118.62 2k6s h LYS 22 Ca 0.53 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.30 2k6s h LYS 22 Cb 0.68 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.99 2k6s h LYS 22 CO -0.30 0.00 -0.02 0.22 -0.57 0.00 0.00 179.45 178.78 2k6s h ASP 23 N 0.00 -0.05 -0.77 0.86 1.82 -1.45 -3.11 116.42 113.72 2k6s h ASP 23 Ca 0.54 -0.62 0.18 0.00 -0.39 0.00 0.00 57.03 56.74 2k6s h ASP 23 Cb 0.99 0.01 -0.13 0.00 0.68 0.00 0.00 39.33 40.88 2k6s h ASP 23 CO -0.97 0.66 0.09 0.74 -1.61 0.00 0.00 179.24 178.14 2k6s h THR 24 N -0.82 0.37 -0.47 2.25 2.02 -0.67 0.16 112.91 115.75 2k6s h THR 24 Ca -0.01 -0.05 -0.02 0.00 0.77 0.00 0.00 66.41 67.10 2k6s h THR 24 Cb 0.67 0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 2k6s h THR 24 CO 0.01 0.03 0.20 -0.74 0.37 0.00 0.00 175.52 175.39 2k6s h HIS 25 N 0.16 0.71 -0.49 3.16 -0.00 0.30 0.15 115.15 119.14 2k6s h HIS 25 Ca 0.44 -0.05 -0.07 0.00 -0.00 0.00 0.00 60.37 60.69 2k6s h HIS 25 Cb 0.80 -0.21 -0.02 0.00 -0.00 0.00 0.00 27.41 27.98 2k6s h HIS 25 CO -0.36 0.59 0.03 -0.84 -0.00 0.00 0.00 177.93 177.36 2k6s h ILE 26 N 0.62 1.26 -0.27 6.26 3.07 -1.12 -1.31 117.51 126.01 2k6s h ILE 26 Ca 0.16 -1.01 -0.00 0.00 1.55 0.00 0.00 64.86 65.55 2k6s h ILE 26 Cb 0.18 0.96 -0.01 0.00 -0.27 0.00 0.00 36.82 37.67 2k6s h ILE 26 CO -0.01 0.36 0.17 -0.09 -1.05 0.00 0.00 178.15 177.52 2k6s h ARG 27 N 0.70 0.37 0.10 0.16 2.43 -0.49 0.18 114.38 117.82 2k6s h ARG 27 Ca 0.14 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.28 2k6s h ARG 27 Cb 0.46 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 2k6s h ARG 27 CO 0.02 0.28 -0.05 1.05 -1.51 0.00 0.00 179.97 179.77 2k6s h GLU 28 N 0.35 -0.12 0.00 0.20 -0.00 -0.61 -2.08 114.58 112.31 2k6s h GLU 28 Ca 0.10 0.01 0.00 0.00 -0.00 0.00 0.00 59.36 59.47 2k6s h GLU 28 Cb 0.01 0.03 0.00 0.00 -0.00 0.00 0.00 28.75 28.78 2k6s h GLU 28 CO -0.02 0.06 0.00 1.25 -0.00 0.00 0.00 179.01 180.30 2k6s h LEU 29 N -0.28 0.00 -0.65 3.06 5.85 -1.15 -1.70 115.31 120.44 2k6s h LEU 29 Ca -0.01 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.57 2k6s h LEU 29 Cb 0.24 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 2k6s h LEU 29 CO 0.02 0.00 -0.64 -0.33 -0.34 0.00 0.00 178.44 177.15 2k6s h GLU 30 N 0.00 0.00 0.00 1.25 4.39 0.08 -2.90 114.58 117.40 2k6s h GLU 30 Ca 0.00 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.64 2k6s h GLU 30 Cb 0.18 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.83 2k6s h GLU 30 CO 0.00 0.64 -0.34 -0.44 -1.16 0.00 0.00 179.01 177.71 2k6s h ASP 31 N 0.00 0.00 -0.17 1.42 5.19 -1.16 -2.69 116.42 119.02 2k6s h ASP 31 Ca -0.01 0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 56.21 2k6s h ASP 31 Cb 1.18 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.69 2k6s h ASP 31 CO 0.08 0.28 -0.62 1.88 -3.12 0.00 0.00 179.24 177.74 2k6s h TYR 32 N 0.00 1.00 0.00 4.55 0.05 -1.46 -3.03 116.97 118.09 2k6s h TYR 32 Ca -0.01 -0.39 0.00 0.00 0.05 0.00 0.00 58.73 58.39 2k6s h TYR 32 Cb 1.22 -0.18 0.00 0.00 1.01 0.00 0.00 36.73 38.78 2k6s h TYR 32 CO 0.00 1.20 -0.18 -0.89 -1.05 0.00 0.00 178.16 177.23 2k6s n ILE 33 N -3.97 0.48 0.10 -2.88 5.41 -1.11 -3.58 119.36 113.81 2k6s n ILE 33 Ca -0.05 -0.26 -0.01 0.00 1.00 0.00 0.00 62.75 63.43 2k6s n ILE 33 Cb 0.66 -0.43 0.27 0.00 -0.71 0.00 0.00 39.64 39.43 2k6s n ILE 33 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 2k6s h ASP 34 N 0.00 0.24 -0.86 4.38 1.82 -1.34 -3.19 116.42 117.46 2k6s h ASP 34 Ca 0.00 -0.09 0.35 0.00 -0.39 0.00 0.00 57.03 56.90 2k6s h ASP 34 Cb 0.72 -0.07 -0.16 0.00 0.68 0.00 0.00 39.33 40.51 2k6s h ASP 34 CO 0.00 0.57 0.41 0.59 -1.61 0.00 0.00 179.24 179.20 2k6s n ASN 35 N -4.09 0.25 -0.02 2.28 3.02 -1.23 0.30 115.26 115.76 2k6s n ASN 35 Ca -0.01 1.44 -0.09 0.00 -0.03 0.00 0.00 54.58 55.88 2k6s n ASN 35 Cb 0.42 -0.68 -0.03 0.00 -0.61 0.00 0.00 39.78 38.89 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 -0.82 -5.18 3.41 3.38 -1.83 -3.12 115.31 111.15 2k6s h LEU 36 Ca 0.71 0.14 -0.59 0.00 0.09 0.00 0.00 57.88 58.22 2k6s h LEU 36 Cb 1.83 0.37 -0.42 0.00 0.09 0.00 0.00 40.66 42.53 2k6s h LEU 36 CO -0.69 -0.30 -0.67 0.00 0.09 0.00 0.00 178.44 176.88 2k6s n LEU 37 N -5.38 4.45 0.00 1.67 -0.00 0.15 -5.04 117.00 112.85 2k6s n LEU 37 Ca -0.02 -5.60 -0.12 0.00 -0.00 0.00 0.00 56.01 50.28 2k6s n LEU 37 Cb 0.30 -0.52 -0.02 0.00 -0.00 0.00 0.00 43.42 43.18 2k6s n LEU 37 CO 0.16 2.34 0.16 0.55 -0.00 0.00 0.00 177.39 180.59 2k6s n VAL 38 N -0.27 0.00 -2.60 1.47 3.14 -0.51 -5.00 118.33 114.55 2k6s n VAL 38 Ca 0.32 -1.43 -0.42 0.00 -2.96 0.00 0.00 64.34 59.84 2k6s n VAL 38 Cb 0.44 0.90 -0.02 0.00 -1.06 0.00 0.00 33.84 34.10 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 -2.63 3.57 0.38 1.45 6.06 -1.26 -4.89 118.95 121.63 2k6s s ARG 39 Ca 0.23 0.32 0.01 0.00 -2.50 0.00 0.00 55.73 53.80 2k6s s ARG 39 Cb -0.01 -3.98 -0.02 0.00 0.06 0.00 0.00 34.95 31.00 2k6s s ARG 39 CO 0.17 -1.58 0.57 0.14 -2.50 0.00 0.00 175.30 172.10 2k6s s VAL 40 N 4.75 4.61 0.00 7.11 -7.23 -1.26 -5.00 120.40 123.37 2k6s s VAL 40 Ca 0.44 -0.56 0.00 0.00 -1.81 0.00 0.00 61.98 60.05 2k6s s VAL 40 Cb -0.08 -3.68 0.00 0.00 0.56 0.00 0.00 36.38 33.19 2k6s s VAL 40 CO 0.27 -0.42 0.15 1.15 -0.31 0.00 0.00 175.10 175.94