#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 0.21 -3.69 1.61 7.64 -1.26 -4.63 113.62 113.50 2k6s n SER 2 Ca 0.00 0.10 -0.42 0.00 1.01 0.00 0.00 58.87 59.55 2k6s n SER 2 Cb 0.00 0.86 -0.06 0.00 -1.01 0.00 0.00 64.21 64.00 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 -2.76 3.80 0.00 -3.43 -0.00 -1.26 -3.95 117.00 109.41 2k6s n LEU 3 Ca -0.26 -2.82 0.00 0.00 -0.00 0.00 0.00 56.01 52.93 2k6s n LEU 3 Cb 1.06 -1.12 0.00 0.00 -0.00 0.00 0.00 43.42 43.36 2k6s n LEU 3 CO 0.44 -0.59 0.00 0.35 -0.00 0.00 0.00 177.39 177.59 2k6s n THR 4 N 6.21 0.00 -0.14 1.47 -2.24 -1.26 -5.02 114.28 113.29 2k6s n THR 4 Ca 0.49 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 62.20 2k6s n THR 4 Cb 0.41 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.62 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 0.07 -1.00 0.00 4.78 3.20 -1.95 0.20 116.97 122.28 2k6s h TYR 5 Ca 0.00 0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.93 2k6s h TYR 5 Cb 0.00 0.51 0.00 0.00 1.54 0.00 0.00 36.73 38.78 2k6s h TYR 5 CO 0.00 -0.40 0.22 0.93 -1.64 0.00 0.00 178.16 177.28 2k6s h GLU 6 N -0.25 0.00 0.00 1.82 5.08 -1.96 -2.28 114.58 117.00 2k6s h GLU 6 Ca 0.18 0.00 -0.42 0.00 -1.00 0.00 0.00 59.36 58.12 2k6s h GLU 6 Cb 0.55 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.74 2k6s h GLU 6 CO -0.59 0.00 -2.45 -1.91 -1.00 0.00 0.00 179.01 173.06 2k6s n GLU 7 N -2.17 0.57 -0.35 2.33 0.00 0.50 -4.46 120.64 117.06 2k6s n GLU 7 Ca -0.01 0.22 0.03 0.00 0.00 0.00 0.00 57.16 57.40 2k6s n GLU 7 Cb 0.25 -1.45 0.10 0.00 0.00 0.00 0.00 31.44 30.34 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 -0.71 0.03 -0.38 6.31 3.04 -0.34 0.18 116.25 124.37 2k6s h VAL 8 Ca -0.64 0.00 -0.06 0.00 -1.01 0.00 0.00 66.70 64.99 2k6s h VAL 8 Cb 1.65 0.03 -0.02 0.00 -2.01 0.00 0.00 31.29 30.94 2k6s h VAL 8 CO -0.33 0.00 -0.00 -0.07 -1.01 0.00 0.00 177.57 176.16 2k6s h LEU 9 N -0.01 0.57 -0.58 3.16 4.07 -1.82 -2.84 115.31 117.86 2k6s h LEU 9 Ca 0.42 -0.12 0.08 0.00 0.08 0.00 0.00 57.88 58.34 2k6s h LEU 9 Cb 0.66 -0.15 -0.07 0.00 1.08 0.00 0.00 40.66 42.19 2k6s h LEU 9 CO -0.98 0.64 0.23 1.56 -1.08 0.00 0.00 178.44 178.81 2k6s h GLN 10 N 0.57 0.41 0.00 1.13 1.08 -0.87 0.01 115.11 117.44 2k6s h GLN 10 Ca 0.12 -0.02 -0.05 0.00 -1.45 0.00 0.00 58.65 57.25 2k6s h GLN 10 Cb 0.37 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.70 2k6s h GLN 10 CO 0.01 0.27 -0.23 1.49 -0.95 0.00 0.00 178.83 179.43 2k6s h GLU 11 N 0.42 0.00 0.00 1.46 4.81 -1.27 -3.10 114.58 116.90 2k6s h GLU 11 Ca 0.29 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.52 2k6s h GLU 11 Cb 0.32 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.70 2k6s h GLU 11 CO -0.27 0.23 0.00 -0.11 -0.73 0.00 0.00 179.01 178.13 2k6s n LEU 12 N -3.78 0.10 -0.33 1.64 -0.00 -0.04 -3.12 117.00 111.47 2k6s n LEU 12 Ca -0.02 0.81 0.27 0.00 -0.00 0.00 0.00 56.01 57.07 2k6s n LEU 12 Cb 0.33 -0.43 0.51 0.00 -0.00 0.00 0.00 43.42 43.83 2k6s n LEU 12 CO 0.34 -0.43 1.09 1.62 -0.00 0.00 0.00 177.39 180.01 2k6s h VAL 13 N 0.00 0.20 -0.52 1.96 3.04 -1.57 0.36 116.25 119.72 2k6s h VAL 13 Ca 0.00 -0.07 0.10 0.00 -1.01 0.00 0.00 66.70 65.72 2k6s h VAL 13 Cb 0.00 -0.03 -0.11 0.00 -2.01 0.00 0.00 31.29 29.14 2k6s h VAL 13 CO 0.00 0.04 -0.24 0.11 -1.01 0.00 0.00 177.57 176.47 2k6s h LYS 14 N 0.21 -0.11 0.05 4.17 1.57 -1.55 0.48 116.57 121.39 2k6s h LYS 14 Ca 0.77 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 59.56 2k6s h LYS 14 Cb 1.86 0.03 0.00 0.00 0.08 0.00 0.00 32.23 34.20 2k6s h LYS 14 CO -0.66 -0.07 -0.03 0.45 -0.57 0.00 0.00 179.45 178.57 2k6s h HIS 15 N -0.12 -0.07 -0.40 -1.35 3.86 -0.26 -0.11 115.15 116.70 2k6s h HIS 15 Ca 0.24 -0.00 0.06 0.00 -1.16 0.00 0.00 60.37 59.51 2k6s h HIS 15 Cb 0.49 0.02 -0.09 0.00 1.06 0.00 0.00 27.41 28.90 2k6s h HIS 15 CO -0.53 0.09 -0.48 -0.22 0.86 0.00 0.00 177.93 177.65 2k6s h LYS 16 N -0.21 -0.35 0.00 2.45 3.64 -0.12 0.68 116.57 122.66 2k6s h LYS 16 Ca -0.01 0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.38 2k6s h LYS 16 Cb 0.18 0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.08 2k6s h LYS 16 CO 0.01 -0.23 -0.10 1.05 -2.27 0.00 0.00 179.45 177.91 2k6s h GLU 17 N -0.36 0.00 -0.05 1.90 4.11 -0.11 -2.81 114.58 117.26 2k6s h GLU 17 Ca 0.11 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.48 2k6s h GLU 17 Cb 0.59 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 2k6s h GLU 17 CO -0.58 0.10 -0.28 -0.07 0.07 0.00 0.00 179.01 178.25 2k6s h LEU 18 N 0.00 0.09 0.00 3.06 3.38 0.11 -1.02 115.31 120.92 2k6s h LEU 18 Ca -0.00 -0.02 -0.23 0.00 0.09 0.00 0.00 57.88 57.72 2k6s h LEU 18 Cb 0.59 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.28 2k6s h LEU 18 CO 0.01 0.37 -1.25 -0.07 0.09 0.00 0.00 178.44 177.59 2k6s h LEU 19 N 0.08 0.00 0.59 1.67 3.38 -1.11 -3.01 115.31 116.92 2k6s h LEU 19 Ca 0.01 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 2k6s h LEU 19 Cb 0.54 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.30 2k6s h LEU 19 CO 0.04 0.92 -0.28 0.03 0.09 0.00 0.00 178.44 179.24 2k6s h ARG 20 N 0.00 -0.77 -0.96 1.13 3.08 -1.27 -3.15 114.38 112.44 2k6s h ARG 20 Ca -0.12 0.05 0.14 0.00 0.07 0.00 0.00 59.98 60.12 2k6s h ARG 20 Cb 1.81 0.17 -0.09 0.00 0.08 0.00 0.00 29.97 31.94 2k6s h ARG 20 CO 0.10 -0.51 0.58 -0.09 -1.07 0.00 0.00 179.97 178.98 2k6s h ARG 21 N -1.09 0.82 -0.99 0.04 2.43 -1.36 -1.22 114.38 113.00 2k6s h ARG 21 Ca -0.08 -0.05 0.25 0.00 -0.81 0.00 0.00 59.98 59.29 2k6s h ARG 21 Cb 0.61 -0.19 -0.13 0.00 -0.42 0.00 0.00 29.97 29.85 2k6s h ARG 21 CO 0.13 0.54 0.56 -0.22 -1.51 0.00 0.00 179.97 179.48 2k6s h LYS 22 N 0.85 0.51 0.13 0.20 3.64 -1.52 0.45 116.57 120.83 2k6s h LYS 22 Ca 0.51 -0.03 -0.29 0.00 -1.27 0.00 0.00 60.65 59.57 2k6s h LYS 22 Cb 0.63 -0.12 0.02 0.00 -0.41 0.00 0.00 32.23 32.36 2k6s h LYS 22 CO -0.32 0.34 -1.25 -0.44 -2.27 0.00 0.00 179.45 175.51 2k6s h ASP 23 N 0.53 0.70 0.77 4.20 3.32 -1.20 -3.17 116.42 121.57 2k6s h ASP 23 Ca 0.65 -0.68 0.00 0.00 0.02 0.00 0.00 57.03 57.02 2k6s h ASP 23 Cb 1.26 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.59 2k6s h ASP 23 CO -0.50 1.50 0.00 0.74 -1.72 0.00 0.00 179.24 179.26 2k6s h THR 24 N 0.19 0.00 0.15 0.35 2.02 -0.43 0.29 112.91 115.48 2k6s h THR 24 Ca -0.17 -0.36 -0.25 0.00 0.77 0.00 0.00 66.41 66.40 2k6s h THR 24 Cb 1.93 1.29 0.03 0.00 -1.74 0.00 0.00 68.15 69.66 2k6s h THR 24 CO 0.23 0.00 -1.06 -0.74 0.37 0.00 0.00 175.52 174.31 2k6s h HIS 25 N 0.00 0.79 0.00 3.16 6.17 -0.22 -0.06 115.15 125.00 2k6s h HIS 25 Ca 0.00 -0.53 -0.18 0.00 0.71 0.00 0.00 60.37 60.37 2k6s h HIS 25 Cb 0.39 -0.05 -0.02 0.00 2.52 0.00 0.00 27.41 30.25 2k6s h HIS 25 CO 0.00 1.40 -0.83 -0.84 0.71 0.00 0.00 177.93 178.37 2k6s h ILE 26 N -0.04 1.55 -0.19 6.26 3.07 -1.48 -2.47 117.51 124.21 2k6s h ILE 26 Ca -0.17 -2.71 -0.13 0.00 1.55 0.00 0.00 64.86 63.39 2k6s h ILE 26 Cb 1.80 2.48 0.00 0.00 -0.27 0.00 0.00 36.82 40.83 2k6s h ILE 26 CO 0.20 0.78 -0.41 -0.09 -1.05 0.00 0.00 178.15 177.58 2k6s h ARG 27 N 0.04 0.61 0.00 0.16 2.43 -1.00 -1.22 114.38 115.40 2k6s h ARG 27 Ca -0.02 -0.40 -0.07 0.00 -0.81 0.00 0.00 59.98 58.68 2k6s h ARG 27 Cb 1.45 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 31.05 2k6s h ARG 27 CO 0.11 1.02 -0.33 1.05 -1.51 0.00 0.00 179.97 180.32 2k6s h GLU 28 N 0.28 0.00 0.05 0.20 -0.00 -1.01 -3.08 114.58 111.02 2k6s h GLU 28 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 59.36 59.36 2k6s h GLU 28 Cb 1.01 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.76 2k6s h GLU 28 CO 0.09 0.33 -0.02 1.25 -0.00 0.00 0.00 179.01 180.65 2k6s h LEU 29 N 0.00 -0.06 -1.39 3.06 5.85 -1.36 -3.27 115.31 118.14 2k6s h LEU 29 Ca -0.00 -0.58 0.46 0.00 0.84 0.00 0.00 57.88 58.60 2k6s h LEU 29 Cb 0.58 0.01 -0.14 0.00 0.37 0.00 0.00 40.66 41.49 2k6s h LEU 29 CO 0.04 0.60 0.88 -0.33 -0.34 0.00 0.00 178.44 179.29 2k6s h GLU 30 N -0.76 0.03 0.50 1.25 4.39 -1.13 0.26 114.58 119.13 2k6s h GLU 30 Ca -0.01 -0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.67 2k6s h GLU 30 Cb 0.63 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.28 2k6s h GLU 30 CO 0.01 0.02 -0.24 -0.44 -1.16 0.00 0.00 179.01 177.20 2k6s h ASP 31 N 0.03 -0.57 -0.57 1.42 5.19 -1.60 0.84 116.42 121.17 2k6s h ASP 31 Ca 0.86 -0.05 0.06 0.00 -0.62 0.00 0.00 57.03 57.28 2k6s h ASP 31 Cb 2.75 0.15 -0.03 0.00 0.18 0.00 0.00 39.33 42.38 2k6s h ASP 31 CO -0.45 -0.28 0.38 1.88 -3.12 0.00 0.00 179.24 177.64 2k6s h TYR 32 N -0.86 0.53 0.00 4.55 0.05 -0.64 -1.23 116.97 119.37 2k6s h TYR 32 Ca -0.07 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.72 2k6s h TYR 32 Cb 0.59 -0.17 0.00 0.00 1.01 0.00 0.00 36.73 38.16 2k6s h TYR 32 CO -0.01 0.28 -0.36 0.44 -1.05 0.00 0.00 178.16 177.47 2k6s n ILE 33 N -4.47 0.16 0.17 -2.88 -5.35 -0.50 -3.83 119.36 102.65 2k6s n ILE 33 Ca 0.08 -0.10 0.02 0.00 -0.27 0.00 0.00 62.75 62.48 2k6s n ILE 33 Cb 0.24 -0.12 0.29 0.00 -1.74 0.00 0.00 39.64 38.32 2k6s n ILE 33 CO 0.00 0.00 0.00 -0.78 -1.76 0.00 0.00 176.55 174.01 2k6s h ASP 34 N 0.00 0.00 -0.92 7.28 1.82 0.44 -3.02 116.42 122.03 2k6s h ASP 34 Ca 0.00 0.00 0.15 0.00 -0.39 0.00 0.00 57.03 56.79 2k6s h ASP 34 Cb 0.59 0.00 -0.08 0.00 0.68 0.00 0.00 39.33 40.53 2k6s h ASP 34 CO 0.00 0.46 0.59 0.78 -1.61 0.00 0.00 179.24 179.46 2k6s h ASN 35 N 0.00 0.69 -0.79 2.28 2.35 -1.66 0.39 115.58 118.83 2k6s h ASN 35 Ca -0.00 0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.78 2k6s h ASN 35 Cb 0.88 -0.09 -0.04 0.00 0.05 0.00 0.00 38.32 39.12 2k6s h ASN 35 CO 0.06 0.34 0.45 -0.07 -1.65 0.00 0.00 177.43 176.57 2k6s h LEU 36 N 0.73 0.98 -5.18 1.61 3.38 -1.78 -3.13 115.31 111.93 2k6s h LEU 36 Ca 0.47 -0.08 -0.59 0.00 0.09 0.00 0.00 57.88 57.76 2k6s h LEU 36 Cb 0.72 -0.25 -0.42 0.00 0.09 0.00 0.00 40.66 40.81 2k6s h LEU 36 CO -0.23 0.78 -0.66 0.00 0.09 0.00 0.00 178.44 178.42 2k6s n LEU 37 N -4.44 4.50 0.00 1.67 -0.00 0.55 -5.01 117.00 114.27 2k6s n LEU 37 Ca 0.08 -5.61 0.00 0.00 -0.00 0.00 0.00 56.01 50.48 2k6s n LEU 37 Cb 0.08 -0.53 0.00 0.00 -0.00 0.00 0.00 43.42 42.97 2k6s n LEU 37 CO 0.38 2.34 0.00 0.55 -0.00 0.00 0.00 177.39 180.66 2k6s n VAL 38 N -0.28 0.00 -1.80 1.47 3.14 0.10 -4.89 118.33 116.07 2k6s n VAL 38 Ca 0.32 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 61.28 2k6s n VAL 38 Cb 0.43 0.00 -0.03 0.00 -1.06 0.00 0.00 33.84 33.18 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 -2.00 4.15 0.42 1.45 3.52 -1.26 -4.59 118.95 120.64 2k6s s ARG 39 Ca 0.00 2.52 0.07 0.00 -0.13 0.00 0.00 55.73 58.19 2k6s s ARG 39 Cb 0.00 -3.13 0.01 0.00 -1.56 0.00 0.00 34.95 30.27 2k6s s ARG 39 CO 0.00 -0.71 0.58 0.14 -0.81 0.00 0.00 175.30 174.50 2k6s s VAL 40 N 1.25 3.16 0.00 7.11 -7.23 -1.26 -4.76 120.40 118.66 2k6s s VAL 40 Ca 0.73 -0.96 0.00 0.00 -1.81 0.00 0.00 61.98 59.95 2k6s s VAL 40 Cb -0.48 -3.07 0.00 0.00 0.56 0.00 0.00 36.38 33.39 2k6s s VAL 40 CO 0.32 -0.03 0.00 1.15 -0.31 0.00 0.00 175.10 176.23