#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r9t n THR 26 N 0.00 0.00 -4.39 0.00 -1.04 -1.26 -5.24 114.28 102.36 1r9t n THR 26 Ca 0.00 0.00 -0.20 0.00 -2.04 0.00 0.00 64.05 61.81 1r9t n THR 26 Cb 0.00 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.41 1r9t n THR 26 CO 0.00 0.00 0.00 -1.48 -0.64 0.00 0.00 175.07 172.95 1r9t s LEU 27 N 0.00 2.44 0.00 -4.42 2.34 -1.26 -5.08 118.68 112.69 1r9t s LEU 27 Ca 0.00 -1.16 0.00 0.00 0.06 0.00 0.00 54.13 53.03 1r9t s LEU 27 Cb 0.00 -0.56 0.00 0.00 -0.56 0.00 0.00 46.19 45.07 1r9t s LEU 27 CO 0.00 -0.34 0.00 0.29 -1.06 0.00 0.00 176.35 175.24 1r9t n LYS 28 N -0.50 0.00 0.00 1.48 5.02 -1.24 -4.99 118.16 117.93 1r9t n LYS 28 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.23 1r9t n LYS 28 Cb 0.63 -0.01 0.00 0.00 -0.02 0.00 0.00 35.03 35.63 1r9t n LYS 28 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1r9t n TYR 29 N -2.08 0.00 -3.62 2.13 4.02 -0.61 -4.31 117.16 112.69 1r9t n TYR 29 Ca 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 57.86 1r9t n TYR 29 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.27 1r9t n TYR 29 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1r9t s ILE 30 N 0.04 -0.47 0.77 -0.72 1.01 -0.96 -3.80 121.20 117.07 1r9t s ILE 30 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 60.65 60.58 1r9t s ILE 30 Cb 0.00 -1.00 0.11 0.00 0.01 0.00 0.00 42.46 41.58 1r9t s ILE 30 CO 0.00 0.00 1.08 0.00 0.00 0.00 0.00 174.94 176.02 1r9t h ALA 32 N -0.81 -0.13 0.05 0.00 0.00 -1.91 -3.29 119.26 113.17 1r9t h ALA 32 Ca -0.42 -0.84 -0.00 0.00 0.00 0.00 0.00 54.91 53.64 1r9t h ALA 32 Cb 1.28 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.26 1r9t h ALA 32 CO 0.50 0.64 -0.03 0.93 0.00 0.00 0.00 179.25 181.29 1r9t h GLU 33 N 0.03 -0.07 0.00 0.00 4.39 -1.92 -3.42 114.58 113.59 1r9t h GLU 33 Ca -0.24 0.00 -0.39 0.00 0.34 0.00 0.00 59.36 59.08 1r9t h GLU 33 Cb 2.05 0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 30.66 1r9t h GLU 33 CO 0.24 0.54 -2.11 0.00 -1.16 0.00 0.00 179.01 176.52 1r9t n SER 35 N -4.31 0.00 -4.76 0.00 7.64 -1.24 -5.10 113.62 105.86 1r9t n SER 35 Ca -0.47 0.00 -0.40 0.00 1.01 0.00 0.00 58.87 59.01 1r9t n SER 35 Cb 0.82 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.96 1r9t n SER 35 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1r9t s SER 36 N -1.24 7.20 -0.80 6.43 0.15 -1.24 -4.86 113.70 119.34 1r9t s SER 36 Ca 0.00 1.43 -0.25 0.00 0.70 0.00 0.00 55.95 57.83 1r9t s SER 36 Cb 0.00 -2.45 0.04 0.00 -1.71 0.00 0.00 66.02 61.90 1r9t s SER 36 CO 0.00 0.07 1.28 -0.54 1.20 0.00 0.00 173.24 175.25 1r9t s LYS 37 N -0.31 3.29 0.90 5.44 1.02 -1.26 -3.25 119.74 125.56 1r9t s LYS 37 Ca 0.37 -0.56 -0.13 0.00 0.02 0.00 0.00 55.97 55.66 1r9t s LYS 37 Cb -0.21 -4.48 0.17 0.00 -0.52 0.00 0.00 37.83 32.79 1r9t s LYS 37 CO 0.23 -2.11 1.25 -0.51 -0.92 0.00 0.00 175.35 173.28 1r9t s LEU 38 N 5.27 2.71 0.00 3.17 1.02 -1.25 -4.90 118.68 124.70 1r9t s LEU 38 Ca 0.36 0.31 0.00 0.00 0.02 0.00 0.00 54.13 54.82 1r9t s LEU 38 Cb -0.07 -2.48 0.00 0.00 0.02 0.00 0.00 46.19 43.65 1r9t s LEU 38 CO 0.08 -2.45 0.00 -0.24 0.02 0.00 0.00 176.35 173.76 1r9t n SER 39 N -3.56 0.00 -3.28 2.29 2.88 -1.26 -1.57 113.62 109.12 1r9t n SER 39 Ca 0.14 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.56 1r9t n SER 39 Cb 0.60 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.04 1r9t n SER 39 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1r9t s LEU 40 N 0.00 0.55 -0.26 2.46 1.43 -1.26 -4.94 118.68 116.65 1r9t s LEU 40 Ca 0.00 -1.27 -0.10 0.00 -1.03 0.00 0.00 54.13 51.73 1r9t s LEU 40 Cb 0.00 1.99 -0.05 0.00 0.03 0.00 0.00 46.19 48.17 1r9t s LEU 40 CO 0.00 -1.40 0.16 -0.94 0.23 0.00 0.00 176.35 174.40 1r9t s SER 41 N -3.14 5.89 -0.27 2.29 1.04 -1.26 -4.98 113.70 113.27 1r9t s SER 41 Ca 0.24 -0.00 -0.31 0.00 0.48 0.00 0.00 55.95 56.35 1r9t s SER 41 Cb -0.02 -2.08 -0.14 0.00 0.10 0.00 0.00 66.02 63.88 1r9t s SER 41 CO 0.15 -0.01 1.02 -2.11 0.98 0.00 0.00 173.24 173.28 1r9t n ARG 42 N 4.76 0.00 -0.87 4.02 -4.01 -1.26 -0.42 116.66 118.89 1r9t n ARG 42 Ca -0.15 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.66 1r9t n ARG 42 Cb 0.52 -1.04 0.00 0.00 -3.04 0.00 0.00 32.46 28.90 1r9t n ARG 42 CO 0.00 0.00 0.00 2.41 -3.04 0.00 0.00 177.63 177.00 1r9t n THR 43 N 2.38 0.00 -0.95 8.89 -1.04 -1.26 -4.82 114.28 117.48 1r9t n THR 43 Ca 0.20 0.00 0.08 0.00 -2.04 0.00 0.00 64.05 62.29 1r9t n THR 43 Cb -0.02 0.00 0.33 0.00 -1.82 0.00 0.00 70.33 68.82 1r9t n THR 43 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1r9t n ASP 44 N 0.00 4.75 0.00 8.00 -0.08 0.44 -5.03 116.55 124.63 1r9t n ASP 44 Ca 0.00 -2.98 0.00 0.00 -1.51 0.00 0.00 54.79 50.30 1r9t n ASP 44 Cb 0.00 -0.61 0.00 0.00 2.34 0.00 0.00 41.12 42.85 1r9t n ASP 44 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1r9t n ALA 45 N 0.01 0.00 0.00 -1.67 0.00 -1.26 -4.49 120.51 113.11 1r9t n ALA 45 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.68 1r9t n ALA 45 Cb 1.04 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.49 1r9t n ALA 45 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1r9t n VAL 46 N 0.00 0.00 0.00 0.00 0.31 -1.26 -5.02 118.33 112.36 1r9t n VAL 46 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1r9t n VAL 46 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 1r9t n VAL 46 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1r9t n ARG 47 N -0.33 0.00 0.00 5.55 0.63 -1.26 -4.87 116.66 116.38 1r9t n ARG 47 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1r9t n ARG 47 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 1r9t n ARG 47 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1r9t n LYS 49 N 0.00 1.81 0.00 0.00 4.76 -1.26 -4.93 118.16 118.54 1r9t n LYS 49 Ca 0.00 -3.98 0.00 0.00 -2.87 0.00 0.00 58.31 51.46 1r9t n LYS 49 Cb 0.00 -1.84 0.00 0.00 -1.84 0.00 0.00 35.03 31.35 1r9t n LYS 49 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1r9t n ASP 50 N 0.46 0.00 -4.34 4.39 4.64 -1.26 -5.03 116.55 115.41 1r9t n ASP 50 Ca 0.27 0.00 -0.31 0.00 -1.38 0.00 0.00 54.79 53.37 1r9t n ASP 50 Cb 0.52 0.00 -0.07 0.00 -1.04 0.00 0.00 41.12 40.53 1r9t n ASP 50 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1r9t n GLY 52 N 5.52 -0.20 3.56 0.00 0.00 -1.26 -3.79 105.19 109.03 1r9t n GLY 52 Ca 0.46 -0.02 -0.41 0.00 0.00 0.00 0.00 46.02 46.05 1r9t n GLY 52 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1r9t s HIS 53 N -2.00 2.28 0.00 1.61 3.76 -1.26 -3.64 115.29 116.04 1r9t s HIS 53 Ca 0.04 0.28 0.00 0.00 -0.15 0.00 0.00 55.06 55.22 1r9t s HIS 53 Cb 0.02 -4.48 0.00 0.00 1.11 0.00 0.00 32.58 29.22 1r9t s HIS 53 CO 0.03 -1.98 0.05 0.54 -0.85 0.00 0.00 174.74 172.52 1r9t n ARG 54 N 8.98 0.00 0.00 1.40 1.74 -1.26 -3.69 116.66 123.82 1r9t n ARG 54 Ca 0.09 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.17 1r9t n ARG 54 Cb 0.49 -0.37 0.00 0.00 -1.02 0.00 0.00 32.46 31.56 1r9t n ARG 54 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 1r9t n ILE 55 N -0.15 0.00 -0.40 0.55 -5.35 -1.26 -4.79 119.36 107.96 1r9t n ILE 55 Ca 0.00 0.20 0.00 0.00 -0.27 0.00 0.00 62.75 62.68 1r9t n ILE 55 Cb 0.05 -1.10 0.00 0.00 -1.74 0.00 0.00 39.64 36.84 1r9t n ILE 55 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1r9t n LEU 56 N 0.00 -2.61 -4.26 7.28 4.77 -1.24 -4.92 117.00 116.01 1r9t n LEU 56 Ca 0.00 0.71 -0.15 0.00 -0.03 0.00 0.00 56.01 56.54 1r9t n LEU 56 Cb 0.00 0.09 -0.10 0.00 -2.33 0.00 0.00 43.42 41.08 1r9t n LEU 56 CO 0.00 -0.09 -0.21 -0.76 -1.33 0.00 0.00 177.39 175.00 1r9t s LEU 57 N -1.46 1.43 0.00 2.23 1.43 -0.99 -4.91 118.68 116.41 1r9t s LEU 57 Ca 0.00 -1.49 0.24 0.00 -1.03 0.00 0.00 54.13 51.85 1r9t s LEU 57 Cb 0.00 0.31 0.40 0.00 0.03 0.00 0.00 46.19 46.93 1r9t s LEU 57 CO 0.00 -0.87 1.38 1.17 0.23 0.00 0.00 176.35 178.26 1r9t n LYS 58 N -0.43 2.26 0.00 1.70 4.81 -1.26 -2.26 118.16 122.99 1r9t n LYS 58 Ca 0.02 -1.86 0.00 0.00 -0.87 0.00 0.00 58.31 55.60 1r9t n LYS 58 Cb 0.65 -1.47 0.00 0.00 0.02 0.00 0.00 35.03 34.23 1r9t n LYS 58 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1r9t n ALA 59 N 1.18 0.00 -3.00 3.14 0.00 -1.26 -4.73 120.51 115.84 1r9t n ALA 59 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.60 1r9t n ALA 59 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.01 1r9t n ALA 59 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1r9t n ARG 60 N 0.00 3.90 -4.35 0.00 3.00 -1.26 -5.02 116.66 112.93 1r9t n ARG 60 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 57.85 57.66 1r9t n ARG 60 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 32.46 32.36 1r9t n ARG 60 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 1r9t s THR 61 N 0.98 1.77 -2.90 5.15 2.01 -1.26 -5.06 115.64 116.33 1r9t s THR 61 Ca 0.00 -2.22 0.24 0.00 0.31 0.00 0.00 61.69 60.02 1r9t s THR 61 Cb 0.00 -2.06 0.25 0.00 0.01 0.00 0.00 72.50 70.70 1r9t s THR 61 CO 0.00 -0.59 1.32 0.29 -0.69 0.00 0.00 174.62 174.95 1r9t n LYS 62 N -0.39 2.29 -0.77 4.92 4.01 -1.26 -4.53 118.16 122.43 1r9t n LYS 62 Ca -0.08 -1.88 -0.15 0.00 -0.51 0.00 0.00 58.31 55.69 1r9t n LYS 62 Cb 0.60 -1.47 0.08 0.00 -0.51 0.00 0.00 35.03 33.74 1r9t n LYS 62 CO 0.00 0.00 0.00 2.89 -1.11 0.00 0.00 177.40 179.18 1r9t n ARG 63 N 1.26 1.77 0.00 1.97 1.85 -1.26 -4.89 116.66 117.36 1r9t n ARG 63 Ca 0.15 -1.72 0.00 0.00 -1.00 0.00 0.00 57.85 55.28 1r9t n ARG 63 Cb 0.58 -1.68 0.00 0.00 -1.05 0.00 0.00 32.46 30.31 1r9t n ARG 63 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1r9t n LEU 64 N -0.25 0.00 -4.11 2.89 4.77 -1.26 -4.75 117.00 114.28 1r9t n LEU 64 Ca 0.34 0.00 -0.27 0.00 -0.03 0.00 0.00 56.01 56.05 1r9t n LEU 64 Cb 0.99 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.92 1r9t n LEU 64 CO 0.37 0.00 -0.50 0.68 -1.33 0.00 0.00 177.39 176.61 1r9t s VAL 65 N 0.00 1.46 -0.29 4.08 -7.23 -1.26 -5.10 120.40 112.06 1r9t s VAL 65 Ca 0.00 -0.69 -0.11 0.00 -1.81 0.00 0.00 61.98 59.37 1r9t s VAL 65 Cb 0.00 -1.28 -0.04 0.00 0.56 0.00 0.00 36.38 35.61 1r9t s VAL 65 CO 0.00 0.42 0.19 -1.58 -0.31 0.00 0.00 175.10 173.83 1r9t s GLN 66 N 0.39 3.87 0.09 4.82 -0.44 -1.26 -5.05 119.66 122.08 1r9t s GLN 66 Ca -0.12 -0.37 0.05 0.00 -2.50 0.00 0.00 55.36 52.41 1r9t s GLN 66 Cb -0.15 -3.67 -0.04 0.00 -1.64 0.00 0.00 33.01 27.51 1r9t s GLN 66 CO 0.05 -0.22 -0.01 -0.06 0.50 0.00 0.00 175.29 175.54 1r9t s PHE 67 N 1.75 2.96 -0.08 1.67 2.99 -1.26 -5.08 117.98 120.93 1r9t s PHE 67 Ca 0.07 -0.04 -0.26 0.00 0.00 0.00 0.00 56.93 56.70 1r9t s PHE 67 Cb -0.16 -1.53 -0.03 0.00 0.00 0.00 0.00 43.02 41.30 1r9t s PHE 67 CO 0.11 0.47 0.82 -1.83 -0.00 0.00 0.00 175.22 174.79 1r9t s GLU 68 N -2.27 4.43 -0.77 0.44 4.04 -1.26 -5.01 118.70 118.30 1r9t s GLU 68 Ca 0.25 1.08 -0.04 0.00 0.04 0.00 0.00 54.97 56.30 1r9t s GLU 68 Cb -0.12 -3.49 0.20 0.00 0.02 0.00 0.00 34.13 30.74 1r9t s GLU 68 CO 0.17 -0.09 0.64 0.00 -1.84 0.00 0.00 175.26 174.14 1r9t s ALA 69 N 1.28 3.94 0.00 -0.84 0.00 -1.26 -5.34 121.76 119.54 1r9t s ALA 69 Ca 0.42 -3.52 0.00 0.00 0.00 0.00 0.00 51.96 48.86 1r9t s ALA 69 Cb -0.18 -2.87 0.00 0.00 0.00 0.00 0.00 23.12 20.07 1r9t s ALA 69 CO 0.19 -2.15 0.39 0.54 0.00 0.00 0.00 175.76 174.73