#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 3.67 -2.30 1.61 7.64 -1.26 -4.56 113.62 118.42 2k6s n SER 2 Ca 0.00 -3.31 -0.34 0.00 1.01 0.00 0.00 58.87 56.23 2k6s n SER 2 Cb 0.00 -0.63 0.08 0.00 -1.01 0.00 0.00 64.21 62.65 2k6s n SER 2 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2k6s n LEU 3 N -0.64 7.45 0.00 -3.43 4.77 -1.26 -4.25 117.00 119.63 2k6s n LEU 3 Ca 0.31 -4.32 0.00 0.00 -0.03 0.00 0.00 56.01 51.97 2k6s n LEU 3 Cb 1.07 -0.92 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 2k6s n LEU 3 CO 0.24 1.52 0.00 0.35 -1.33 0.00 0.00 177.39 178.17 2k6s n THR 4 N -0.91 0.00 0.26 -5.08 -2.24 -1.26 -4.97 114.28 100.08 2k6s n THR 4 Ca 0.61 0.00 0.18 0.00 -2.27 0.00 0.00 64.05 62.57 2k6s n THR 4 Cb 0.70 0.00 0.92 0.00 -2.10 0.00 0.00 70.33 69.85 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 0.00 0.00 4.78 3.20 -1.96 0.96 116.97 123.94 2k6s h TYR 5 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2k6s h TYR 5 Cb 0.00 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.27 2k6s h TYR 5 CO 0.00 0.00 0.00 -1.91 -1.64 0.00 0.00 178.16 174.61 2k6s n GLU 6 N -3.48 0.09 -0.11 1.82 2.13 -1.26 -2.91 120.64 116.93 2k6s n GLU 6 Ca -0.00 0.10 -0.13 0.00 0.66 0.00 0.00 57.16 57.79 2k6s n GLU 6 Cb 0.27 -1.50 -0.15 0.00 0.27 0.00 0.00 31.44 30.33 2k6s n GLU 6 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 2k6s n GLU 7 N -1.44 0.68 -0.02 5.31 0.00 0.32 -4.39 120.64 121.10 2k6s n GLU 7 Ca 0.07 0.05 -0.09 0.00 0.00 0.00 0.00 57.16 57.19 2k6s n GLU 7 Cb 0.24 -1.53 0.07 0.00 0.00 0.00 0.00 31.44 30.22 2k6s n GLU 7 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.13 176.89 2k6s h VAL 8 N 0.00 1.30 -0.69 6.31 3.04 -1.49 -3.17 116.25 121.56 2k6s h VAL 8 Ca -0.55 -1.66 0.08 0.00 -1.01 0.00 0.00 66.70 63.56 2k6s h VAL 8 Cb 2.13 1.62 -0.07 0.00 -2.01 0.00 0.00 31.29 32.96 2k6s h VAL 8 CO -0.01 0.52 0.35 -0.07 -1.01 0.00 0.00 177.57 177.35 2k6s h LEU 9 N 0.49 0.47 -1.98 3.16 3.38 -1.74 0.64 115.31 119.73 2k6s h LEU 9 Ca 0.03 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2k6s h LEU 9 Cb 0.99 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.71 2k6s h LEU 9 CO 0.09 0.28 -0.04 1.56 0.09 0.00 0.00 178.44 180.42 2k6s h GLN 10 N 0.61 0.00 0.10 1.13 1.08 -1.75 -2.29 115.11 113.99 2k6s h GLN 10 Ca 0.33 0.00 -0.30 0.00 -1.45 0.00 0.00 58.65 57.23 2k6s h GLN 10 Cb 0.31 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.73 2k6s h GLN 10 CO -0.24 0.04 -1.51 0.93 -0.95 0.00 0.00 178.83 177.09 2k6s h GLU 11 N 0.00 0.22 1.00 1.46 5.08 -0.98 -3.05 114.58 118.32 2k6s h GLU 11 Ca -0.00 -0.37 -0.05 0.00 -1.00 0.00 0.00 59.36 57.94 2k6s h GLU 11 Cb 0.34 0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.74 2k6s h GLU 11 CO 0.01 1.07 -0.48 1.25 -1.00 0.00 0.00 179.01 179.85 2k6s h LEU 12 N 0.06 -1.14 -0.09 1.33 7.12 -0.46 -2.27 115.31 119.86 2k6s h LEU 12 Ca -0.23 0.04 0.04 0.00 0.13 0.00 0.00 57.88 57.85 2k6s h LEU 12 Cb 2.00 0.30 -0.04 0.00 -0.53 0.00 0.00 40.66 42.38 2k6s h LEU 12 CO 0.15 -0.81 -0.15 1.62 -0.13 0.00 0.00 178.44 179.12 2k6s h VAL 13 N -1.36 0.61 -1.01 1.05 3.04 -1.62 -2.32 116.25 114.65 2k6s h VAL 13 Ca -0.14 0.00 0.23 0.00 -1.01 0.00 0.00 66.70 65.78 2k6s h VAL 13 Cb 1.03 0.61 -0.11 0.00 -2.01 0.00 0.00 31.29 30.81 2k6s h VAL 13 CO 0.23 0.00 0.61 0.11 -1.01 0.00 0.00 177.57 177.51 2k6s h LYS 14 N -0.20 0.59 -0.28 4.17 1.57 -1.52 0.45 116.57 121.34 2k6s h LYS 14 Ca 0.08 -0.04 -0.13 0.00 -1.87 0.00 0.00 60.65 58.70 2k6s h LYS 14 Cb 0.32 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 2k6s h LYS 14 CO -0.21 0.39 -0.34 0.45 -0.57 0.00 0.00 179.45 179.16 2k6s h HIS 15 N 0.60 0.73 -0.03 -1.35 3.86 -0.88 -0.36 115.15 117.73 2k6s h HIS 15 Ca 0.62 -0.19 -0.03 0.00 -1.16 0.00 0.00 60.37 59.60 2k6s h HIS 15 Cb 1.17 -0.16 0.00 0.00 1.06 0.00 0.00 27.41 29.48 2k6s h HIS 15 CO -0.00 0.89 -0.09 0.87 0.86 0.00 0.00 177.93 180.45 2k6s h LYS 16 N 0.53 0.11 0.85 2.45 1.57 -0.28 -2.99 116.57 118.81 2k6s h LYS 16 Ca 0.06 -0.08 -0.04 0.00 -1.87 0.00 0.00 60.65 58.71 2k6s h LYS 16 Cb 0.84 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.17 2k6s h LYS 16 CO 0.07 0.71 -0.45 1.49 -0.57 0.00 0.00 179.45 180.71 2k6s h GLU 17 N -0.47 -1.15 -0.98 3.15 4.81 -0.26 -2.33 114.58 117.36 2k6s h GLU 17 Ca -0.00 0.08 0.31 0.00 -0.13 0.00 0.00 59.36 59.62 2k6s h GLU 17 Cb 0.72 0.26 -0.15 0.00 0.63 0.00 0.00 28.75 30.21 2k6s h GLU 17 CO 0.02 -0.76 0.47 -0.07 -0.73 0.00 0.00 179.01 177.94 2k6s h LEU 18 N -1.19 0.34 -0.95 1.64 3.38 -1.19 0.74 115.31 118.08 2k6s h LEU 18 Ca -0.12 0.21 -0.08 0.00 0.09 0.00 0.00 57.88 57.98 2k6s h LEU 18 Cb 0.93 0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.85 2k6s h LEU 18 CO 0.17 -0.19 -0.07 -0.07 0.09 0.00 0.00 178.44 178.37 2k6s h LEU 19 N 0.24 0.66 0.55 1.67 3.38 -1.35 -1.20 115.31 119.26 2k6s h LEU 19 Ca 0.71 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 58.48 2k6s h LEU 19 Cb 1.62 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 42.19 2k6s h LEU 19 CO -0.65 0.78 -0.26 0.03 0.09 0.00 0.00 178.44 178.42 2k6s h ARG 20 N 0.63 -0.71 -0.84 1.13 3.08 0.10 -2.03 114.38 115.74 2k6s h ARG 20 Ca 0.12 0.05 0.03 0.00 0.07 0.00 0.00 59.98 60.25 2k6s h ARG 20 Cb 0.50 0.16 -0.05 0.00 0.08 0.00 0.00 29.97 30.66 2k6s h ARG 20 CO 0.03 -0.43 0.56 -0.09 -1.07 0.00 0.00 179.97 178.96 2k6s h ARG 21 N -0.85 1.03 -0.15 0.04 2.43 -1.34 -0.04 114.38 115.50 2k6s h ARG 21 Ca -0.08 -0.06 0.05 0.00 -0.81 0.00 0.00 59.98 59.08 2k6s h ARG 21 Cb 0.61 -0.23 -0.05 0.00 -0.42 0.00 0.00 29.97 29.88 2k6s h ARG 21 CO 0.12 0.68 -0.16 -0.22 -1.51 0.00 0.00 179.97 178.88 2k6s h LYS 22 N 1.06 -0.18 0.00 0.20 3.64 -1.06 0.52 116.57 120.75 2k6s h LYS 22 Ca 0.33 0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.67 2k6s h LYS 22 Cb 0.01 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 2k6s h LYS 22 CO -0.10 -0.12 -0.25 -0.44 -2.27 0.00 0.00 179.45 176.28 2k6s h ASP 23 N -0.19 0.00 0.55 4.20 5.19 -0.76 -3.22 116.42 122.19 2k6s h ASP 23 Ca 0.10 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 56.49 2k6s h ASP 23 Cb 0.34 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.86 2k6s h ASP 23 CO -0.27 0.25 -0.26 0.74 -3.12 0.00 0.00 179.24 176.58 2k6s h THR 24 N 0.00 0.00 -0.94 0.35 2.02 0.94 -3.21 112.91 112.07 2k6s h THR 24 Ca -0.00 -0.20 0.16 0.00 0.77 0.00 0.00 66.41 67.14 2k6s h THR 24 Cb 0.57 0.00 -0.16 0.00 -1.74 0.00 0.00 68.15 66.82 2k6s h THR 24 CO 0.03 0.00 -0.33 0.45 0.37 0.00 0.00 175.52 176.04 2k6s h HIS 25 N -0.93 -0.87 -0.33 3.16 3.86 -1.10 0.75 115.15 119.69 2k6s h HIS 25 Ca -0.08 0.10 0.09 0.00 -1.16 0.00 0.00 60.37 59.32 2k6s h HIS 25 Cb 0.56 0.52 -0.01 0.00 1.06 0.00 0.00 27.41 29.54 2k6s h HIS 25 CO 0.04 -0.40 0.36 -0.84 0.86 0.00 0.00 177.93 177.95 2k6s h ILE 26 N -0.02 0.41 0.09 2.45 3.07 -1.63 0.65 117.51 122.53 2k6s h ILE 26 Ca 0.37 0.00 -0.33 0.00 1.55 0.00 0.00 64.86 66.45 2k6s h ILE 26 Cb 0.63 0.71 -0.02 0.00 -0.27 0.00 0.00 36.82 37.87 2k6s h ILE 26 CO -0.95 0.00 -1.81 -1.14 -1.05 0.00 0.00 178.15 173.19 2k6s n ARG 27 N -3.74 0.71 -0.18 0.16 0.63 0.23 -3.48 116.66 111.00 2k6s n ARG 27 Ca 0.05 0.35 -0.09 0.00 -0.92 0.00 0.00 57.85 57.23 2k6s n ARG 27 Cb 0.51 -1.72 0.03 0.00 0.45 0.00 0.00 32.46 31.74 2k6s n ARG 27 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 2k6s h GLU 28 N -0.22 1.01 0.00 -0.14 4.81 0.21 -2.03 114.58 118.21 2k6s h GLU 28 Ca -0.41 -0.36 0.00 0.00 -0.13 0.00 0.00 59.36 58.46 2k6s h GLU 28 Cb 1.84 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 31.15 2k6s h GLU 28 CO 0.00 1.05 0.00 -0.11 -0.73 0.00 0.00 179.01 179.22 2k6s n LEU 29 N -4.15 0.00 0.02 1.64 7.94 0.22 -2.88 117.00 119.79 2k6s n LEU 29 Ca 0.02 0.00 -0.08 0.00 -1.11 0.00 0.00 56.01 54.84 2k6s n LEU 29 Cb 0.39 0.00 -0.13 0.00 0.53 0.00 0.00 43.42 44.21 2k6s n LEU 29 CO 0.45 0.00 -0.22 -0.08 -1.11 0.00 0.00 177.39 176.43 2k6s h GLU 30 N 0.00 0.00 0.28 1.96 4.22 -1.40 -3.27 114.58 116.38 2k6s h GLU 30 Ca 0.00 -0.01 -0.01 0.00 0.08 0.00 0.00 59.36 59.42 2k6s h GLU 30 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 2k6s h GLU 30 CO 0.00 0.73 -0.13 0.22 -2.18 0.00 0.00 179.01 177.64 2k6s h ASP 31 N 0.00 -0.32 -1.00 1.04 3.58 -1.52 -2.61 116.42 115.59 2k6s h ASP 31 Ca -0.16 0.01 0.38 0.00 0.42 0.00 0.00 57.03 57.68 2k6s h ASP 31 Cb 1.91 0.08 -0.18 0.00 1.72 0.00 0.00 39.33 42.86 2k6s h ASP 31 CO 0.10 -0.06 0.45 1.88 -2.88 0.00 0.00 179.24 178.73 2k6s h TYR 32 N -0.72 0.68 -0.12 0.28 0.05 -1.74 0.39 116.97 115.79 2k6s h TYR 32 Ca -0.04 0.05 -0.02 0.00 0.05 0.00 0.00 58.73 58.76 2k6s h TYR 32 Cb 0.29 -0.13 -0.00 0.00 1.01 0.00 0.00 36.73 37.90 2k6s h TYR 32 CO 0.04 -0.43 -0.01 0.82 -1.05 0.00 0.00 178.16 177.53 2k6s h ILE 33 N 0.05 1.27 -1.28 -2.88 2.04 -1.62 -3.11 117.51 111.98 2k6s h ILE 33 Ca 0.78 -0.89 0.42 0.00 1.00 0.00 0.00 64.86 66.17 2k6s h ILE 33 Cb 1.97 1.62 -0.13 0.00 -0.74 0.00 0.00 36.82 39.54 2k6s h ILE 33 CO -0.77 0.26 0.82 0.44 0.00 0.00 0.00 178.15 178.90 2k6s h ASP 34 N -0.07 0.27 -0.81 1.72 3.32 0.19 -1.38 116.42 119.66 2k6s h ASP 34 Ca 0.03 0.13 0.31 0.00 0.02 0.00 0.00 57.03 57.53 2k6s h ASP 34 Cb 0.40 0.12 -0.15 0.00 0.22 0.00 0.00 39.33 39.92 2k6s h ASP 34 CO 0.01 -0.16 0.35 0.59 -1.72 0.00 0.00 179.24 178.31 2k6s n ASN 35 N -4.70 0.21 0.09 6.45 3.02 -1.16 0.13 115.26 119.30 2k6s n ASN 35 Ca 0.36 1.34 -0.13 0.00 -0.03 0.00 0.00 54.58 56.12 2k6s n ASN 35 Cb 1.37 -0.62 -0.08 0.00 -0.61 0.00 0.00 39.78 39.83 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 -0.18 -5.67 3.41 3.38 -1.49 -3.29 115.31 111.48 2k6s h LEU 36 Ca 0.64 -0.20 -0.68 0.00 0.09 0.00 0.00 57.88 57.74 2k6s h LEU 36 Cb 1.65 0.05 -0.36 0.00 0.09 0.00 0.00 40.66 42.08 2k6s h LEU 36 CO -0.65 0.10 0.03 0.00 0.09 0.00 0.00 178.44 178.02 2k6s n LEU 37 N -5.07 5.65 0.00 1.67 -0.00 0.35 -5.00 117.00 114.61 2k6s n LEU 37 Ca -0.09 -5.56 -0.08 0.00 -0.00 0.00 0.00 56.01 50.28 2k6s n LEU 37 Cb 0.20 -0.80 0.02 0.00 -0.00 0.00 0.00 43.42 42.83 2k6s n LEU 37 CO 0.33 2.23 0.37 0.55 -0.00 0.00 0.00 177.39 180.87 2k6s n VAL 38 N -0.18 0.00 -2.38 1.47 3.14 0.16 -4.85 118.33 115.69 2k6s n VAL 38 Ca 0.38 -0.85 -0.43 0.00 -2.96 0.00 0.00 64.34 60.47 2k6s n VAL 38 Cb 0.34 0.78 -0.02 0.00 -1.06 0.00 0.00 33.84 33.88 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 -2.15 3.68 0.27 1.45 6.06 -1.26 -4.87 118.95 122.13 2k6s s ARG 39 Ca 0.14 1.02 -0.14 0.00 -2.50 0.00 0.00 55.73 54.25 2k6s s ARG 39 Cb -0.03 -3.98 -0.08 0.00 0.06 0.00 0.00 34.95 30.92 2k6s s ARG 39 CO 0.10 -1.42 0.66 0.14 -2.50 0.00 0.00 175.30 172.28 2k6s s VAL 40 N 5.07 4.76 0.00 7.11 -7.23 -1.26 -4.96 120.40 123.90 2k6s s VAL 40 Ca 0.59 0.82 0.00 0.00 -1.81 0.00 0.00 61.98 61.59 2k6s s VAL 40 Cb -0.14 -3.65 0.00 0.00 0.56 0.00 0.00 36.38 33.15 2k6s s VAL 40 CO 0.30 -0.07 0.38 1.15 -0.31 0.00 0.00 175.10 176.54