#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 0.50 -3.40 1.61 7.64 -1.26 -4.44 113.62 114.27 2k6s n SER 2 Ca 0.00 0.01 -0.37 0.00 1.01 0.00 0.00 58.87 59.52 2k6s n SER 2 Cb 0.00 0.08 -0.02 0.00 -1.01 0.00 0.00 64.21 63.25 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 -1.72 7.34 0.00 -3.43 4.77 -1.26 -3.57 117.00 119.13 2k6s n LEU 3 Ca 0.05 -3.95 0.00 0.00 -0.03 0.00 0.00 56.01 52.08 2k6s n LEU 3 Cb 0.37 -1.47 0.00 0.00 -2.33 0.00 0.00 43.42 40.00 2k6s n LEU 3 CO 0.34 1.43 0.00 0.35 -1.33 0.00 0.00 177.39 178.18 2k6s n THR 4 N 4.20 0.00 -0.39 -5.08 -2.24 -1.26 -4.98 114.28 104.53 2k6s n THR 4 Ca 0.65 0.00 0.31 0.00 -2.27 0.00 0.00 64.05 62.73 2k6s n THR 4 Cb 0.26 0.00 0.59 0.00 -2.10 0.00 0.00 70.33 69.08 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 0.57 0.00 4.78 3.20 -1.94 0.61 116.97 124.19 2k6s h TYR 5 Ca 0.00 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 2k6s h TYR 5 Cb 0.00 -0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.12 2k6s h TYR 5 CO 0.00 -0.09 0.00 0.93 -1.64 0.00 0.00 178.16 177.36 2k6s h GLU 6 N 0.21 0.00 0.17 1.82 5.08 -1.96 -2.25 114.58 117.66 2k6s h GLU 6 Ca 0.72 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.85 2k6s h GLU 6 Cb 2.11 0.00 0.02 0.00 0.50 0.00 0.00 28.75 31.38 2k6s h GLU 6 CO -0.36 0.00 -1.01 1.49 -1.00 0.00 0.00 179.01 178.13 2k6s h GLU 7 N 0.00 0.35 -0.12 2.33 4.22 0.18 -3.29 114.58 118.26 2k6s h GLU 7 Ca 0.00 -0.60 -0.18 0.00 0.08 0.00 0.00 59.36 58.66 2k6s h GLU 7 Cb 0.53 0.22 -0.00 0.00 0.50 0.00 0.00 28.75 30.00 2k6s h GLU 7 CO 0.00 1.29 -0.67 -0.24 -2.18 0.00 0.00 179.01 177.21 2k6s h VAL 8 N -0.25 1.35 -0.02 0.32 3.04 -1.48 -3.04 116.25 116.17 2k6s h VAL 8 Ca -0.18 -2.01 0.03 0.00 -1.01 0.00 0.00 66.70 63.53 2k6s h VAL 8 Cb 1.77 1.99 -0.05 0.00 -2.01 0.00 0.00 31.29 32.99 2k6s h VAL 8 CO 0.18 0.61 -0.29 -0.07 -1.01 0.00 0.00 177.57 176.98 2k6s h LEU 9 N 0.34 -0.88 -1.96 3.16 3.38 -1.53 0.17 115.31 117.99 2k6s h LEU 9 Ca -0.02 0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 2k6s h LEU 9 Cb 1.24 0.36 -0.00 0.00 0.09 0.00 0.00 40.66 42.35 2k6s h LEU 9 CO 0.12 -0.36 -0.04 1.56 0.09 0.00 0.00 178.44 179.81 2k6s h GLN 10 N -0.43 0.00 0.00 1.13 1.08 -1.63 -1.81 115.11 113.46 2k6s h GLN 10 Ca 0.07 0.00 -0.11 0.00 -1.45 0.00 0.00 58.65 57.16 2k6s h GLN 10 Cb 0.53 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.94 2k6s h GLN 10 CO -0.27 0.04 -0.56 1.49 -0.95 0.00 0.00 178.83 178.59 2k6s h GLU 11 N 0.00 0.00 0.25 1.46 4.81 -0.99 -3.11 114.58 117.00 2k6s h GLU 11 Ca -0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2k6s h GLU 11 Cb 0.35 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.73 2k6s h GLU 11 CO 0.01 0.50 -0.12 1.25 -0.73 0.00 0.00 179.01 179.91 2k6s h LEU 12 N 0.00 -0.28 -0.13 1.64 7.12 0.14 -3.17 115.31 120.62 2k6s h LEU 12 Ca -0.01 -0.20 0.05 0.00 0.13 0.00 0.00 57.88 57.85 2k6s h LEU 12 Cb 1.40 0.07 -0.06 0.00 -0.53 0.00 0.00 40.66 41.54 2k6s h LEU 12 CO 0.07 0.22 -0.27 1.62 -0.13 0.00 0.00 178.44 179.95 2k6s h VAL 13 N -0.98 0.37 -1.03 1.05 3.04 -1.63 -1.82 116.25 115.25 2k6s h VAL 13 Ca -0.03 0.00 0.28 0.00 -1.01 0.00 0.00 66.70 65.93 2k6s h VAL 13 Cb 0.46 0.37 -0.13 0.00 -2.01 0.00 0.00 31.29 29.98 2k6s h VAL 13 CO 0.06 0.00 0.62 0.11 -1.01 0.00 0.00 177.57 177.34 2k6s h LYS 14 N -0.34 0.45 -0.48 4.17 1.57 -1.66 0.31 116.57 120.59 2k6s h LYS 14 Ca 0.10 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 58.75 2k6s h LYS 14 Cb 0.49 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.68 2k6s h LYS 14 CO -0.32 0.30 -0.10 0.45 -0.57 0.00 0.00 179.45 179.20 2k6s h HIS 15 N 0.46 0.96 -0.12 -1.35 3.86 -1.31 0.05 115.15 117.70 2k6s h HIS 15 Ca 0.67 -0.18 -0.18 0.00 -1.16 0.00 0.00 60.37 59.52 2k6s h HIS 15 Cb 1.45 -0.24 0.01 0.00 1.06 0.00 0.00 27.41 29.68 2k6s h HIS 15 CO -0.01 0.92 -0.61 0.87 0.86 0.00 0.00 177.93 179.96 2k6s h LYS 16 N 0.78 0.64 -0.09 2.45 1.57 -0.22 -2.98 116.57 118.72 2k6s h LYS 16 Ca 0.13 -0.52 -0.12 0.00 -1.87 0.00 0.00 60.65 58.27 2k6s h LYS 16 Cb 0.61 0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.01 2k6s h LYS 16 CO 0.04 1.14 -0.50 1.49 -0.57 0.00 0.00 179.45 181.05 2k6s h GLU 17 N 0.29 0.24 -0.41 3.15 4.81 -0.69 -2.98 114.58 119.00 2k6s h GLU 17 Ca -0.04 -0.14 -0.09 0.00 -0.13 0.00 0.00 59.36 58.96 2k6s h GLU 17 Cb 1.25 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.62 2k6s h GLU 17 CO 0.13 0.69 -0.10 -0.07 -0.73 0.00 0.00 179.01 178.92 2k6s h LEU 18 N 0.20 0.71 -1.41 1.64 3.38 -1.02 -2.48 115.31 116.33 2k6s h LEU 18 Ca 0.01 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.74 2k6s h LEU 18 Cb 0.95 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 2k6s h LEU 18 CO 0.08 0.84 0.04 -0.07 0.09 0.00 0.00 178.44 179.42 2k6s h LEU 19 N 0.66 0.39 0.79 1.67 3.38 -1.37 -2.85 115.31 117.99 2k6s h LEU 19 Ca 0.11 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 2k6s h LEU 19 Cb 0.56 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 41.21 2k6s h LEU 19 CO 0.03 0.43 -0.38 0.03 0.09 0.00 0.00 178.44 178.64 2k6s h ARG 20 N 0.42 -1.02 -0.86 1.13 2.47 -1.38 -3.14 114.38 111.99 2k6s h ARG 20 Ca 0.10 0.07 0.21 0.00 -1.26 0.00 0.00 59.98 59.10 2k6s h ARG 20 Cb 0.22 0.23 -0.13 0.00 -1.65 0.00 0.00 29.97 28.64 2k6s h ARG 20 CO 0.00 -0.68 0.32 -0.09 0.56 0.00 0.00 179.97 180.08 2k6s h ARG 21 N -1.22 0.32 -0.77 0.04 2.43 -1.47 0.09 114.38 113.80 2k6s h ARG 21 Ca -0.11 -0.02 0.15 0.00 -0.81 0.00 0.00 59.98 59.20 2k6s h ARG 21 Cb 0.81 -0.07 -0.15 0.00 -0.42 0.00 0.00 29.97 30.14 2k6s h ARG 21 CO 0.18 0.21 -0.19 -0.22 -1.51 0.00 0.00 179.97 178.44 2k6s h LYS 22 N 0.33 -0.00 0.35 0.20 3.64 -1.46 0.51 116.57 120.14 2k6s h LYS 22 Ca 0.53 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.90 2k6s h LYS 22 Cb 1.02 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 2k6s h LYS 22 CO -0.56 -0.00 -0.17 -0.44 -2.27 0.00 0.00 179.45 176.02 2k6s h ASP 23 N -0.00 -0.39 -1.18 4.20 3.32 -1.05 -3.02 116.42 118.29 2k6s h ASP 23 Ca 0.37 -0.04 0.37 0.00 0.02 0.00 0.00 57.03 57.75 2k6s h ASP 23 Cb 0.56 0.10 -0.12 0.00 0.22 0.00 0.00 39.33 40.10 2k6s h ASP 23 CO -0.80 0.06 0.75 0.74 -1.72 0.00 0.00 179.24 178.28 2k6s h THR 24 N -1.10 0.27 -0.09 0.35 2.02 -0.62 0.14 112.91 113.89 2k6s h THR 24 Ca -0.05 -0.07 -0.18 0.00 0.77 0.00 0.00 66.41 66.88 2k6s h THR 24 Cb 0.41 0.04 0.01 0.00 -1.74 0.00 0.00 68.15 66.87 2k6s h THR 24 CO 0.08 0.04 -0.64 -0.74 0.37 0.00 0.00 175.52 174.62 2k6s h HIS 25 N 0.21 0.82 0.00 3.16 -0.00 -0.07 -0.98 115.15 118.29 2k6s h HIS 25 Ca 0.74 -0.38 0.00 0.00 -0.00 0.00 0.00 60.37 60.72 2k6s h HIS 25 Cb 2.12 -0.12 0.00 0.00 -0.00 0.00 0.00 27.41 29.41 2k6s h HIS 25 CO -0.01 1.19 0.00 -0.84 -0.00 0.00 0.00 177.93 178.27 2k6s h ILE 26 N 0.22 0.00 0.10 6.26 3.07 -0.72 -1.55 117.51 124.89 2k6s h ILE 26 Ca -0.06 -0.38 -0.24 0.00 1.55 0.00 0.00 64.86 65.73 2k6s h ILE 26 Cb 1.30 1.24 -0.00 0.00 -0.27 0.00 0.00 36.82 39.08 2k6s h ILE 26 CO 0.13 0.00 -1.23 -0.09 -1.05 0.00 0.00 178.15 175.92 2k6s h ARG 27 N 0.00 0.21 -0.44 0.16 2.43 -0.72 -2.96 114.38 113.06 2k6s h ARG 27 Ca 0.00 -0.36 -0.06 0.00 -0.81 0.00 0.00 59.98 58.74 2k6s h ARG 27 Cb 0.50 0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.16 2k6s h ARG 27 CO 0.00 1.17 0.02 1.05 -1.51 0.00 0.00 179.97 180.71 2k6s h GLU 28 N -0.42 0.76 0.00 0.20 -0.00 -1.09 -2.06 114.58 111.97 2k6s h GLU 28 Ca -0.27 -0.23 0.00 0.00 -0.00 0.00 0.00 59.36 58.86 2k6s h GLU 28 Cb 1.65 -0.07 0.00 0.00 -0.00 0.00 0.00 28.75 30.33 2k6s h GLU 28 CO 0.04 0.82 0.00 1.25 -0.00 0.00 0.00 179.01 181.12 2k6s h LEU 29 N 0.61 0.00 -0.67 3.06 5.85 -1.43 -2.48 115.31 120.25 2k6s h LEU 29 Ca 0.13 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.70 2k6s h LEU 29 Cb 0.46 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 2k6s h LEU 29 CO 0.02 0.00 -0.60 -0.33 -0.34 0.00 0.00 178.44 177.19 2k6s h GLU 30 N 0.00 0.23 0.00 1.25 4.39 -1.19 -2.42 114.58 116.84 2k6s h GLU 30 Ca 0.00 -0.16 -0.05 0.00 0.34 0.00 0.00 59.36 59.49 2k6s h GLU 30 Cb 0.34 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.01 2k6s h GLU 30 CO 0.00 0.76 -0.45 -0.44 -1.16 0.00 0.00 179.01 177.72 2k6s h ASP 31 N 0.17 0.00 -0.28 1.42 3.32 -1.42 -2.80 116.42 116.83 2k6s h ASP 31 Ca -0.00 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.88 2k6s h ASP 31 Cb 1.09 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.64 2k6s h ASP 31 CO 0.09 0.22 -0.46 1.88 -1.72 0.00 0.00 179.24 179.26 2k6s h TYR 32 N 0.00 1.00 0.00 4.55 0.05 -1.34 -2.80 116.97 118.44 2k6s h TYR 32 Ca -0.02 -0.34 0.00 0.00 0.05 0.00 0.00 58.73 58.42 2k6s h TYR 32 Cb 1.19 -0.19 0.00 0.00 1.01 0.00 0.00 36.73 38.73 2k6s h TYR 32 CO 0.00 1.15 -0.02 -0.89 -1.05 0.00 0.00 178.16 177.35 2k6s n ILE 33 N -4.11 0.08 -0.12 -2.88 5.41 -0.93 -3.46 119.36 113.36 2k6s n ILE 33 Ca -0.04 -0.04 -0.08 0.00 1.00 0.00 0.00 62.75 63.58 2k6s n ILE 33 Cb 0.58 -0.48 0.07 0.00 -0.71 0.00 0.00 39.64 39.09 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 0.86 -1.18 4.38 3.32 -1.21 -3.05 116.42 119.54 2k6s h ASP 34 Ca 0.00 -0.30 0.43 0.00 0.02 0.00 0.00 57.03 57.18 2k6s h ASP 34 Cb 0.53 -0.23 -0.15 0.00 0.22 0.00 0.00 39.33 39.70 2k6s h ASP 34 CO 0.00 1.02 0.71 0.78 -1.72 0.00 0.00 179.24 180.03 2k6s h ASN 35 N 0.75 0.30 -0.09 6.45 2.35 -1.60 0.86 115.58 124.60 2k6s h ASN 35 Ca 0.11 0.19 -0.02 0.00 -0.55 0.00 0.00 56.30 56.03 2k6s h ASN 35 Cb 0.70 0.19 -0.00 0.00 0.05 0.00 0.00 38.32 39.26 2k6s h ASN 35 CO 0.05 -0.29 -0.03 -0.07 -1.65 0.00 0.00 177.43 175.44 2k6s h LEU 36 N 0.06 0.19 -5.36 1.61 3.38 -1.79 -3.33 115.31 110.08 2k6s h LEU 36 Ca 0.84 -0.39 -0.60 0.00 0.09 0.00 0.00 57.88 57.81 2k6s h LEU 36 Cb 2.41 -0.05 -0.41 0.00 0.09 0.00 0.00 40.66 42.69 2k6s h LEU 36 CO -0.58 0.54 -0.54 0.00 0.09 0.00 0.00 178.44 177.94 2k6s n LEU 37 N -4.76 4.66 0.00 1.67 -0.00 0.24 -5.03 117.00 113.78 2k6s n LEU 37 Ca -0.07 -5.67 -0.09 0.00 -0.00 0.00 0.00 56.01 50.18 2k6s n LEU 37 Cb 0.25 -0.60 0.01 0.00 -0.00 0.00 0.00 43.42 43.08 2k6s n LEU 37 CO 0.36 2.34 0.36 0.55 -0.00 0.00 0.00 177.39 181.00 2k6s n VAL 38 N -0.22 0.00 -2.45 1.47 3.14 0.21 -4.86 118.33 115.61 2k6s n VAL 38 Ca 0.32 -1.06 -0.41 0.00 -2.96 0.00 0.00 64.34 60.23 2k6s n VAL 38 Cb 0.38 0.88 -0.03 0.00 -1.06 0.00 0.00 33.84 34.01 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 -2.27 3.21 0.57 1.45 6.06 -1.26 -4.88 118.95 121.84 2k6s s ARG 39 Ca 0.17 0.15 -0.15 0.00 -2.50 0.00 0.00 55.73 53.40 2k6s s ARG 39 Cb -0.03 -4.16 -0.05 0.00 0.06 0.00 0.00 34.95 30.77 2k6s s ARG 39 CO 0.13 -2.08 1.03 0.14 -2.50 0.00 0.00 175.30 172.01 2k6s s VAL 40 N 6.11 4.17 0.00 7.11 -7.23 -1.26 -5.01 120.40 124.29 2k6s s VAL 40 Ca 0.45 0.99 0.00 0.00 -1.81 0.00 0.00 61.98 61.62 2k6s s VAL 40 Cb -0.09 -3.55 0.00 0.00 0.56 0.00 0.00 36.38 33.30 2k6s s VAL 40 CO 0.20 -0.64 0.21 1.15 -0.31 0.00 0.00 175.10 175.71