#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ri9 n LYS 8 N 0.00 0.17 0.22 5.31 4.01 -1.26 -3.16 118.16 123.45 1ri9 n LYS 8 Ca 0.00 0.12 0.08 0.00 -0.51 0.00 0.00 58.31 58.00 1ri9 n LYS 8 Cb 0.00 -1.68 0.49 0.00 -0.51 0.00 0.00 35.03 33.33 1ri9 n LYS 8 CO 0.00 0.00 0.00 0.93 -1.11 0.00 0.00 177.40 177.22 1ri9 h GLU 9 N 0.00 0.00 -0.13 1.97 4.39 -1.96 -2.52 114.58 116.34 1ri9 h GLU 9 Ca 0.00 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 1ri9 h GLU 9 Cb 0.65 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.29 1ri9 h GLU 9 CO 0.00 0.26 -0.00 1.49 -1.16 0.00 0.00 179.01 179.59 1ri9 h GLU 10 N 0.00 0.18 -0.19 2.33 4.81 -1.60 -0.61 114.58 119.49 1ri9 h GLU 10 Ca -0.00 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.14 1ri9 h GLU 10 Cb 0.66 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.99 1ri9 h GLU 10 CO 0.03 0.20 -0.18 0.87 -0.73 0.00 0.00 179.01 179.21 1ri9 h LYS 11 N 0.18 0.33 -0.80 1.92 1.79 -1.66 -1.79 116.57 116.53 1ri9 h LYS 11 Ca 0.04 -0.09 -0.03 0.00 -2.18 0.00 0.00 60.65 58.39 1ri9 h LYS 11 Cb 0.14 -0.03 -0.04 0.00 -1.58 0.00 0.00 32.23 30.71 1ri9 h LYS 11 CO 0.00 0.50 0.38 0.22 -1.08 0.00 0.00 179.45 179.47 1ri9 h ASP 12 N 0.30 1.05 0.15 0.86 1.82 -1.20 0.12 116.42 119.52 1ri9 h ASP 12 Ca 0.06 -0.13 -0.01 0.00 -0.39 0.00 0.00 57.03 56.56 1ri9 h ASP 12 Cb 0.49 -0.27 0.00 0.00 0.68 0.00 0.00 39.33 40.23 1ri9 h ASP 12 CO 0.03 0.89 -0.07 0.15 -1.61 0.00 0.00 179.24 178.63 1ri9 h PHE 13 N 1.15 -0.19 -0.03 0.28 3.04 -1.26 -2.95 116.94 116.98 1ri9 h PHE 13 Ca 0.28 -0.00 0.01 0.00 3.98 0.00 0.00 57.97 62.23 1ri9 h PHE 13 Cb 0.12 0.06 -0.00 0.00 2.56 0.00 0.00 35.95 38.69 1ri9 h PHE 13 CO 0.01 0.18 0.03 -0.09 -2.02 0.00 0.00 178.31 176.42 1ri9 h ARG 14 N -0.59 0.00 0.41 1.11 2.43 -1.19 2.18 114.38 118.73 1ri9 h ARG 14 Ca -0.02 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 1ri9 h ARG 14 Cb 0.45 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.97 1ri9 h ARG 14 CO 0.03 0.00 -0.48 -0.22 -1.51 0.00 0.00 179.97 177.80 1ri9 h LYS 15 N 0.00 -0.88 0.00 0.20 3.11 -0.58 0.30 116.57 118.72 1ri9 h LYS 15 Ca 0.01 0.06 -0.25 0.00 -2.81 0.00 0.00 60.65 57.67 1ri9 h LYS 15 Cb 0.07 0.20 -0.04 0.00 -1.00 0.00 0.00 32.23 31.46 1ri9 h LYS 15 CO -0.00 -0.59 -1.34 -0.22 -2.81 0.00 0.00 179.45 174.50 1ri9 h LYS 16 N -0.92 0.00 -0.99 1.90 1.63 -1.41 -3.28 116.57 113.50 1ri9 h LYS 16 Ca -0.04 0.00 -0.20 0.00 -0.85 0.00 0.00 60.65 59.56 1ri9 h LYS 16 Cb 0.82 0.00 -0.12 0.00 -0.60 0.00 0.00 32.23 32.33 1ri9 h LYS 16 CO -0.10 0.73 0.25 1.19 -3.45 0.00 0.00 179.45 178.07 1ri9 n PHE 17 N -3.19 1.22 0.00 1.91 3.01 0.73 -4.61 117.46 116.52 1ri9 n PHE 17 Ca -0.08 -1.01 0.00 0.00 1.01 0.00 0.00 57.45 57.37 1ri9 n PHE 17 Cb 0.99 -0.52 0.00 0.00 -0.01 0.00 0.00 39.48 39.94 1ri9 n PHE 17 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1ri9 n LYS 18 N -0.14 0.00 -1.94 -1.08 4.76 0.10 -4.40 118.16 115.45 1ri9 n LYS 18 Ca 0.23 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 55.25 1ri9 n LYS 18 Cb 0.96 -0.86 -0.03 0.00 -1.84 0.00 0.00 35.03 33.26 1ri9 n LYS 18 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 1ri9 s TYR 19 N -0.23 2.16 -0.58 2.13 5.04 -1.26 -4.95 117.35 119.66 1ri9 s TYR 19 Ca 0.00 0.22 -0.14 0.00 -2.44 0.00 0.00 57.07 54.71 1ri9 s TYR 19 Cb 0.00 -3.96 0.14 0.00 0.35 0.00 0.00 41.96 38.49 1ri9 s TYR 19 CO 0.00 -3.97 0.52 -0.51 -1.34 0.00 0.00 175.55 170.25 1ri9 s ASP 20 N 2.93 6.18 0.01 4.32 1.11 -1.26 -5.00 116.67 124.95 1ri9 s ASP 20 Ca 0.75 -2.00 -0.00 0.00 0.18 0.00 0.00 52.55 51.48 1ri9 s ASP 20 Cb -0.37 -2.16 0.00 0.00 1.07 0.00 0.00 42.92 41.45 1ri9 s ASP 20 CO 0.32 -0.77 0.02 0.61 1.18 0.00 0.00 175.17 176.53 1ri9 n GLY 21 N 4.92 3.13 3.31 0.21 0.00 -1.26 -5.10 105.19 110.40 1ri9 n GLY 21 Ca -0.07 -1.39 -0.46 0.00 0.00 0.00 0.00 46.02 44.09 1ri9 n GLY 21 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ri9 s GLU 22 N -2.03 3.40 -0.40 1.61 2.12 -1.26 -5.02 118.70 117.13 1ri9 s GLU 22 Ca 0.01 -2.27 -0.28 0.00 0.36 0.00 0.00 54.97 52.79 1ri9 s GLU 22 Cb -0.00 -4.36 -0.01 0.00 0.26 0.00 0.00 34.13 30.02 1ri9 s GLU 22 CO 0.01 -1.29 1.67 0.42 -0.54 0.00 0.00 175.26 175.52 1ri9 s ILE 23 N 0.52 3.61 -0.23 -3.70 1.01 -1.26 -4.92 121.20 116.24 1ri9 s ILE 23 Ca 0.14 0.59 -0.08 0.00 0.00 0.00 0.00 60.65 61.30 1ri9 s ILE 23 Cb -0.16 -3.89 0.10 0.00 0.01 0.00 0.00 42.46 38.52 1ri9 s ILE 23 CO -0.06 -0.61 0.49 -0.60 0.00 0.00 0.00 174.94 174.16 1ri9 s ARG 24 N 5.59 0.41 -0.59 2.79 6.06 -1.26 -5.10 118.95 126.86 1ri9 s ARG 24 Ca 0.71 1.14 -0.26 0.00 -2.50 0.00 0.00 55.73 54.82 1ri9 s ARG 24 Cb -0.18 0.44 -0.04 0.00 0.06 0.00 0.00 34.95 35.23 1ri9 s ARG 24 CO 0.31 -0.23 2.05 0.54 -2.50 0.00 0.00 175.30 175.47 1ri9 s VAL 25 N 2.55 3.24 -0.20 7.11 0.11 -1.26 -4.61 120.40 127.34 1ri9 s VAL 25 Ca -0.04 0.12 -0.18 0.00 -2.93 0.00 0.00 61.98 58.95 1ri9 s VAL 25 Cb -0.11 -3.64 -0.20 0.00 -1.53 0.00 0.00 36.38 30.90 1ri9 s VAL 25 CO -0.15 -0.62 0.18 -0.11 -3.33 0.00 0.00 175.10 171.08 1ri9 n LEU 26 N 13.90 2.03 -3.78 2.54 0.00 -1.21 -4.74 117.00 125.74 1ri9 n LEU 26 Ca 0.27 0.37 -0.29 0.00 0.00 0.00 0.00 56.01 56.35 1ri9 n LEU 26 Cb 0.53 -0.98 -0.13 0.00 0.00 0.00 0.00 43.42 42.84 1ri9 n LEU 26 CO 0.70 0.42 -0.21 -0.72 0.00 0.00 0.00 177.39 177.59 1ri9 s TYR 27 N -2.42 2.44 -0.41 1.96 1.13 -1.25 -5.07 117.35 113.74 1ri9 s TYR 27 Ca -0.29 -2.73 -0.29 0.00 -1.41 0.00 0.00 57.07 52.36 1ri9 s TYR 27 Cb 0.07 -2.19 0.00 0.00 -1.10 0.00 0.00 41.96 38.74 1ri9 s TYR 27 CO 0.61 -0.75 1.49 0.45 -2.51 0.00 0.00 175.55 174.85 1ri9 s SER 28 N -0.02 6.23 0.39 -0.18 0.15 -1.26 -4.05 113.70 114.95 1ri9 s SER 28 Ca 0.19 0.89 0.00 0.00 0.70 0.00 0.00 55.95 57.73 1ri9 s SER 28 Cb -0.22 -2.54 -0.02 0.00 -1.71 0.00 0.00 66.02 61.53 1ri9 s SER 28 CO -0.02 -1.51 0.60 0.28 1.20 0.00 0.00 173.24 173.78 1ri9 s THR 29 N 5.78 4.76 -0.12 6.45 -1.32 -1.24 -4.79 115.64 125.16 1ri9 s THR 29 Ca 0.65 -0.44 -0.06 0.00 -1.21 0.00 0.00 61.69 60.63 1ri9 s THR 29 Cb -0.15 -3.75 -0.04 0.00 -1.51 0.00 0.00 72.50 67.06 1ri9 s THR 29 CO 0.32 -0.51 0.10 -0.75 -2.21 0.00 0.00 174.62 171.58 1ri9 s LYS 30 N -4.41 3.37 0.29 7.08 2.36 -1.26 -3.51 119.74 123.65 1ri9 s LYS 30 Ca 0.43 -0.21 -0.29 0.00 -2.55 0.00 0.00 55.97 53.34 1ri9 s LYS 30 Cb -0.10 -3.10 -0.10 0.00 -1.05 0.00 0.00 37.83 33.49 1ri9 s LYS 30 CO 0.37 0.72 1.17 0.08 1.55 0.00 0.00 175.35 179.25 1ri9 s VAL 31 N -0.89 3.26 0.02 4.02 1.01 0.69 -3.90 120.40 124.61 1ri9 s VAL 31 Ca 0.14 1.24 -0.25 0.00 0.00 0.00 0.00 61.98 63.11 1ri9 s VAL 31 Cb -0.12 -3.79 -0.05 0.00 0.00 0.00 0.00 36.38 32.42 1ri9 s VAL 31 CO 0.03 0.29 0.78 -0.89 0.00 0.00 0.00 175.10 175.31 1ri9 s THR 32 N -1.05 4.80 -0.21 3.92 2.01 -1.26 -2.89 115.64 120.96 1ri9 s THR 32 Ca 0.47 1.65 0.03 0.00 0.31 0.00 0.00 61.69 64.15 1ri9 s THR 32 Cb -0.34 -4.13 0.03 0.00 0.01 0.00 0.00 72.50 68.06 1ri9 s THR 32 CO 0.44 0.32 0.82 1.07 -0.69 0.00 0.00 174.62 176.58 1ri9 n THR 33 N 3.13 0.64 -0.65 -0.82 5.66 -1.26 0.40 114.28 121.37 1ri9 n THR 33 Ca -0.01 0.58 0.08 0.00 -3.05 0.00 0.00 64.05 61.65 1ri9 n THR 33 Cb 0.50 -1.58 0.31 0.00 -1.55 0.00 0.00 70.33 68.02 1ri9 n THR 33 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 1ri9 n SER 34 N -1.43 4.41 -4.25 1.09 2.88 -1.26 -4.50 113.62 110.56 1ri9 n SER 34 Ca -0.00 -2.53 -0.29 0.00 -1.33 0.00 0.00 58.87 54.71 1ri9 n SER 34 Cb 0.36 -0.53 0.21 0.00 -0.75 0.00 0.00 64.21 63.51 1ri9 n SER 34 CO 0.00 0.00 0.00 -0.51 -1.23 0.00 0.00 175.04 173.30 1ri9 s ILE 35 N -1.99 1.81 -0.09 2.46 -1.16 1.31 -4.89 121.20 118.65 1ri9 s ILE 35 Ca 0.45 0.00 -0.30 0.00 -0.51 0.00 0.00 60.65 60.30 1ri9 s ILE 35 Cb 0.31 -2.50 -0.05 0.00 0.61 0.00 0.00 42.46 40.83 1ri9 s ILE 35 CO 0.19 0.00 1.58 0.28 -2.81 0.00 0.00 174.94 174.19 1ri9 s THR 36 N -3.00 3.72 -0.03 4.00 -1.32 -1.26 -4.58 115.64 113.16 1ri9 s THR 36 Ca 0.68 0.86 0.04 0.00 -1.21 0.00 0.00 61.69 62.06 1ri9 s THR 36 Cb -0.14 -3.57 -0.05 0.00 -1.51 0.00 0.00 72.50 67.23 1ri9 s THR 36 CO 0.57 -0.09 0.04 -1.54 -2.21 0.00 0.00 174.62 171.38 1ri9 n SER 37 N 7.14 4.08 -0.12 8.08 3.41 -1.26 -4.42 113.62 130.53 1ri9 n SER 37 Ca 0.17 0.00 -0.24 0.00 -0.26 0.00 0.00 58.87 58.54 1ri9 n SER 37 Cb 0.43 0.78 -0.09 0.00 -0.26 0.00 0.00 64.21 65.07 1ri9 n SER 37 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 1ri9 n LYS 38 N -1.98 0.50 -2.02 4.33 2.85 -1.26 -4.93 118.16 115.64 1ri9 n LYS 38 Ca -0.04 0.21 -0.42 0.00 -1.05 0.00 0.00 58.31 57.00 1ri9 n LYS 38 Cb 0.46 -1.34 -0.03 0.00 -0.65 0.00 0.00 35.03 33.47 1ri9 n LYS 38 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 1ri9 s LYS 39 N -2.43 4.22 -0.06 -1.58 2.47 -1.26 -4.99 119.74 116.12 1ri9 s LYS 39 Ca -0.32 2.21 -0.05 0.00 -1.56 0.00 0.00 55.97 56.25 1ri9 s LYS 39 Cb 0.12 -3.61 0.01 0.00 -1.46 0.00 0.00 37.83 32.90 1ri9 s LYS 39 CO 0.42 -0.69 0.15 -1.58 0.16 0.00 0.00 175.35 173.81 1ri9 s TRP 40 N 2.62 -0.17 0.29 4.03 0.23 -1.26 -4.85 118.94 119.83 1ri9 s TRP 40 Ca 0.71 0.41 0.11 0.00 -2.03 0.00 0.00 56.10 55.30 1ri9 s TRP 40 Cb -0.37 0.06 -0.05 0.00 0.03 0.00 0.00 33.47 33.14 1ri9 s TRP 40 CO 0.30 -0.08 -0.17 0.20 0.96 0.00 0.00 176.95 178.16 1ri9 s GLY 41 N 0.08 1.93 0.34 0.98 0.00 -1.26 -4.99 107.32 104.39 1ri9 s GLY 41 Ca -0.00 -1.90 0.03 0.00 0.00 0.00 0.00 44.72 42.85 1ri9 s GLY 41 CO 0.00 -1.97 1.96 -0.84 0.00 0.00 0.00 173.10 172.25 1ri9 h THR 42 N 2.21 1.08 -0.66 0.90 2.02 -2.01 0.94 112.91 117.39 1ri9 h THR 42 Ca -0.41 -0.30 0.00 0.00 0.77 0.00 0.00 66.41 66.47 1ri9 h THR 42 Cb 1.26 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.78 1ri9 h THR 42 CO 0.62 0.16 0.00 0.54 0.37 0.00 0.00 175.52 177.21 1ri9 n ARG 43 N -4.47 2.56 -3.80 6.66 1.74 -1.26 -4.93 116.66 113.17 1ri9 n ARG 43 Ca 0.11 -2.42 -0.20 0.00 -0.77 0.00 0.00 57.85 54.56 1ri9 n ARG 43 Cb 0.17 -1.52 -0.02 0.00 -1.02 0.00 0.00 32.46 30.06 1ri9 n ARG 43 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1ri9 s ASP 44 N -1.03 5.90 0.18 0.55 -1.08 0.32 -1.40 116.67 120.12 1ri9 s ASP 44 Ca 0.45 -0.16 0.01 0.00 -0.52 0.00 0.00 52.55 52.32 1ri9 s ASP 44 Cb 0.23 -1.43 -0.04 0.00 -1.46 0.00 0.00 42.92 40.23 1ri9 s ASP 44 CO 0.31 -0.23 0.35 -0.22 0.52 0.00 0.00 175.17 175.89 1ri9 s LEU 45 N -4.03 4.27 -0.23 -1.34 2.96 -1.17 -4.62 118.68 114.52 1ri9 s LEU 45 Ca 0.39 0.31 0.01 0.00 -0.22 0.00 0.00 54.13 54.61 1ri9 s LEU 45 Cb -0.08 -3.06 0.27 0.00 0.50 0.00 0.00 46.19 43.82 1ri9 s LEU 45 CO 0.29 -0.00 1.58 1.67 -1.32 0.00 0.00 176.35 178.56 1ri9 n GLN 46 N -0.61 1.61 -1.63 1.98 7.27 -1.26 -4.83 117.38 119.91 1ri9 n GLN 46 Ca -0.06 -1.38 -0.35 0.00 0.07 0.00 0.00 57.00 55.29 1ri9 n GLN 46 Cb 0.54 -1.54 0.07 0.00 2.41 0.00 0.00 30.24 31.72 1ri9 n GLN 46 CO 0.00 0.00 0.00 0.14 0.07 0.00 0.00 177.06 177.27 1ri9 s VAL 47 N -1.66 2.50 0.19 1.69 -7.23 -1.26 -5.03 120.40 109.60 1ri9 s VAL 47 Ca 0.26 0.26 0.05 0.00 -1.81 0.00 0.00 61.98 60.75 1ri9 s VAL 47 Cb 0.22 -2.89 -0.04 0.00 0.56 0.00 0.00 36.38 34.23 1ri9 s VAL 47 CO 0.03 -0.12 0.19 -0.54 -0.31 0.00 0.00 175.10 174.35 1ri9 s LYS 48 N -3.77 3.02 0.01 4.82 3.01 -1.26 -4.69 119.74 120.87 1ri9 s LYS 48 Ca 0.74 -0.87 -0.30 0.00 -1.01 0.00 0.00 55.97 54.53 1ri9 s LYS 48 Cb -0.29 -2.69 -0.04 0.00 -1.01 0.00 0.00 37.83 33.80 1ri9 s LYS 48 CO 0.41 0.47 1.19 -1.25 0.51 0.00 0.00 175.35 176.68 1ri9 s PRO 49 N -3.35 4.40 0.00 -1.68 0.04 -1.26 -2.90 135.00 130.25 1ri9 s PRO 49 Ca 0.32 1.71 0.00 0.00 0.04 0.00 0.00 61.00 63.07 1ri9 s PRO 49 Cb -0.10 -3.45 0.00 0.00 0.04 0.00 0.00 34.50 31.00 1ri9 s PRO 49 CO 0.25 -0.33 0.00 0.41 0.04 0.00 0.00 177.00 177.37 1ri9 n GLY 50 N 3.27 0.94 4.01 0.56 0.00 -1.10 -4.46 105.19 108.42 1ri9 n GLY 50 Ca 0.10 -0.03 -0.18 0.00 0.00 0.00 0.00 46.02 45.91 1ri9 n GLY 50 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ri9 s GLU 51 N -0.74 2.71 -0.07 1.61 8.01 -1.14 -4.84 118.70 124.24 1ri9 s GLU 51 Ca 0.00 -1.30 0.01 0.00 0.01 0.00 0.00 54.97 53.69 1ri9 s GLU 51 Cb 0.00 -2.72 0.02 0.00 -4.31 0.00 0.00 34.13 27.12 1ri9 s GLU 51 CO 0.00 -0.41 -0.07 -1.54 0.01 0.00 0.00 175.26 173.25 1ri9 s SER 52 N -4.42 1.56 0.21 -0.19 1.04 -1.26 0.25 113.70 110.88 1ri9 s SER 52 Ca 0.57 -0.21 -0.02 0.00 0.48 0.00 0.00 55.95 56.76 1ri9 s SER 52 Cb -0.09 -0.65 -0.04 0.00 0.10 0.00 0.00 66.02 65.34 1ri9 s SER 52 CO 0.34 -0.06 0.16 -1.48 0.98 0.00 0.00 173.24 173.18 1ri9 s LEU 53 N 1.15 1.09 0.08 2.42 2.34 -1.23 -4.96 118.68 119.58 1ri9 s LEU 53 Ca -0.06 -1.36 -0.30 0.00 0.06 0.00 0.00 54.13 52.47 1ri9 s LEU 53 Cb -0.14 0.49 -0.05 0.00 -0.56 0.00 0.00 46.19 45.93 1ri9 s LEU 53 CO -0.01 -0.87 1.08 -1.61 -1.06 0.00 0.00 176.35 173.88 1ri9 s GLU 54 N -4.14 4.55 -0.16 1.48 8.01 -1.20 -3.70 118.70 123.53 1ri9 s GLU 54 Ca 0.38 1.61 -0.07 0.00 0.01 0.00 0.00 54.97 56.90 1ri9 s GLU 54 Cb 0.06 -3.36 -0.04 0.00 -4.31 0.00 0.00 34.13 26.48 1ri9 s GLU 54 CO 0.12 -0.04 0.07 0.08 0.01 0.00 0.00 175.26 175.49 1ri9 s VAL 55 N 0.55 4.84 0.00 2.63 1.01 -1.26 -0.57 120.40 127.60 1ri9 s VAL 55 Ca 0.53 -0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.48 1ri9 s VAL 55 Cb -0.26 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 32.97 1ri9 s VAL 55 CO 0.30 0.50 0.00 -0.38 0.00 0.00 0.00 175.10 175.53 1ri9 n ILE 56 N 3.12 0.00 -3.66 2.22 5.41 0.61 -3.29 119.36 123.76 1ri9 n ILE 56 Ca -0.17 0.00 -0.25 0.00 1.00 0.00 0.00 62.75 63.33 1ri9 n ILE 56 Cb 0.53 0.00 -0.02 0.00 -0.71 0.00 0.00 39.64 39.44 1ri9 n ILE 56 CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 1ri9 s GLN 57 N 2.85 3.49 0.09 0.38 1.11 -1.26 -4.67 119.66 121.64 1ri9 s GLN 57 Ca 0.00 -0.44 -0.31 0.00 0.01 0.00 0.00 55.36 54.62 1ri9 s GLN 57 Cb 0.00 -2.79 -0.08 0.00 -1.01 0.00 0.00 33.01 29.13 1ri9 s GLN 57 CO 0.00 0.33 1.47 0.95 0.01 0.00 0.00 175.29 178.05 1ri9 s THR 58 N -2.04 3.24 0.00 -0.19 -4.23 -1.25 -2.75 115.64 108.42 1ri9 s THR 58 Ca 0.38 0.81 0.00 0.00 -1.18 0.00 0.00 61.69 61.70 1ri9 s THR 58 Cb -0.10 -3.52 0.00 0.00 1.34 0.00 0.00 72.50 70.22 1ri9 s THR 58 CO 0.31 0.04 0.72 0.41 -0.54 0.00 0.00 174.62 175.56 1ri9 n THR 59 N 4.26 0.00 0.00 3.99 -1.04 0.20 -4.85 114.28 116.84 1ri9 n THR 59 Ca 0.13 1.22 0.00 0.00 -2.04 0.00 0.00 64.05 63.36 1ri9 n THR 59 Cb 0.42 -2.18 0.00 0.00 -1.82 0.00 0.00 70.33 66.74 1ri9 n THR 59 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1ri9 n ASP 60 N -1.21 0.00 0.02 8.00 2.03 -1.26 -5.02 116.55 119.11 1ri9 n ASP 60 Ca 0.00 0.00 -0.02 0.00 0.52 0.00 0.00 54.79 55.29 1ri9 n ASP 60 Cb 0.00 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.39 1ri9 n ASP 60 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1ri9 n ASP 61 N 0.00 0.86 -3.43 1.67 8.00 -1.26 -4.87 116.55 117.52 1ri9 n ASP 61 Ca 0.00 0.12 -0.31 0.00 0.71 0.00 0.00 54.79 55.31 1ri9 n ASP 61 Cb 0.00 -0.28 -0.05 0.00 -0.02 0.00 0.00 41.12 40.77 1ri9 n ASP 61 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1ri9 n THR 62 N -3.44 3.33 -3.65 -3.53 -1.04 -1.26 -4.98 114.28 99.71 1ri9 n THR 62 Ca -0.03 -5.49 -0.08 0.00 -2.04 0.00 0.00 64.05 56.41 1ri9 n THR 62 Cb 0.22 -1.90 -0.08 0.00 -1.82 0.00 0.00 70.33 66.75 1ri9 n THR 62 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1ri9 s LYS 63 N -2.90 0.68 -0.08 -2.82 2.20 -1.26 -2.84 119.74 112.71 1ri9 s LYS 63 Ca 0.40 1.14 0.04 0.00 -0.36 0.00 0.00 55.97 57.18 1ri9 s LYS 63 Cb 0.16 0.15 0.00 0.00 -1.51 0.00 0.00 37.83 36.63 1ri9 s LYS 63 CO -0.03 -0.14 -0.20 0.14 -0.36 0.00 0.00 175.35 174.76 1ri9 s VAL 64 N 1.46 1.72 -0.27 4.02 -7.23 -1.09 0.60 120.40 119.62 1ri9 s VAL 64 Ca -0.09 -0.83 -0.22 0.00 -1.81 0.00 0.00 61.98 59.04 1ri9 s VAL 64 Cb -0.05 -1.50 -0.01 0.00 0.56 0.00 0.00 36.38 35.37 1ri9 s VAL 64 CO -0.17 0.48 0.70 -0.22 -0.31 0.00 0.00 175.10 175.59 1ri9 s LEU 65 N 0.40 4.08 0.26 1.32 2.96 -1.11 -2.15 118.68 124.43 1ri9 s LEU 65 Ca -0.16 0.75 0.02 0.00 -0.22 0.00 0.00 54.13 54.52 1ri9 s LEU 65 Cb -0.17 -2.96 -0.04 0.00 0.50 0.00 0.00 46.19 43.52 1ri9 s LEU 65 CO 0.07 -0.46 0.42 0.00 -1.32 0.00 0.00 176.35 175.06 1ri9 s ARG 67 N -3.83 0.60 -0.02 0.00 3.52 0.26 -1.93 118.95 117.56 1ri9 s ARG 67 Ca 0.37 -0.53 0.07 0.00 -0.13 0.00 0.00 55.73 55.52 1ri9 s ARG 67 Cb -0.10 -0.51 -0.02 0.00 -1.56 0.00 0.00 34.95 32.75 1ri9 s ARG 67 CO 0.31 0.12 -0.24 0.54 -0.81 0.00 0.00 175.30 175.22 1ri9 s ASN 68 N -0.88 3.22 0.29 -2.12 4.22 -0.92 -3.28 114.94 115.47 1ri9 s ASN 68 Ca -0.02 -0.44 0.15 0.00 -2.14 0.00 0.00 52.86 50.40 1ri9 s ASN 68 Cb -0.06 -0.41 0.80 0.00 1.28 0.00 0.00 41.25 42.86 1ri9 s ASN 68 CO 0.00 0.32 1.38 1.21 -2.04 0.00 0.00 177.10 177.97 1ri9 n GLU 69 N 2.33 0.10 0.00 3.55 0.00 -1.26 -0.81 120.64 124.55 1ri9 n GLU 69 Ca -0.16 0.57 0.00 0.00 0.00 0.00 0.00 57.16 57.57 1ri9 n GLU 69 Cb 0.51 -2.01 0.00 0.00 0.00 0.00 0.00 31.44 29.95 1ri9 n GLU 69 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1ri9 n GLU 70 N -2.06 0.00 -0.69 5.31 4.07 -1.26 -4.74 120.64 121.27 1ri9 n GLU 70 Ca -0.01 0.46 0.00 0.00 -0.06 0.00 0.00 57.16 57.55 1ri9 n GLU 70 Cb 0.21 -1.52 0.00 0.00 -0.06 0.00 0.00 31.44 30.06 1ri9 n GLU 70 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1ri9 n GLY 71 N -1.46 0.61 3.38 8.31 0.00 0.01 -4.88 105.19 111.16 1ri9 n GLY 71 Ca 0.00 -0.38 -0.23 0.00 0.00 0.00 0.00 46.02 45.40 1ri9 n GLY 71 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ri9 s LYS 72 N -0.85 1.41 0.28 1.61 2.20 -1.20 -3.61 119.74 119.58 1ri9 s LYS 72 Ca 0.00 -1.51 0.10 0.00 -0.36 0.00 0.00 55.97 54.20 1ri9 s LYS 72 Cb 0.00 -1.54 -0.05 0.00 -1.51 0.00 0.00 37.83 34.74 1ri9 s LYS 72 CO 0.00 0.31 -0.04 0.71 -0.36 0.00 0.00 175.35 175.97 1ri9 s TYR 73 N -2.08 2.59 0.12 4.03 1.51 -1.26 -2.17 117.35 120.09 1ri9 s TYR 73 Ca 0.20 -0.27 -0.20 0.00 -1.01 0.00 0.00 57.07 55.79 1ri9 s TYR 73 Cb -0.06 -1.18 0.05 0.00 -0.11 0.00 0.00 41.96 40.66 1ri9 s TYR 73 CO 0.09 0.62 0.49 0.20 -1.11 0.00 0.00 175.55 175.84 1ri9 s GLY 74 N -3.64 -0.42 0.11 0.71 0.00 -0.81 -4.87 107.32 98.40 1ri9 s GLY 74 Ca 0.32 0.26 0.03 0.00 0.00 0.00 0.00 44.72 45.33 1ri9 s GLY 74 CO 0.19 -0.03 0.11 -0.19 0.00 0.00 0.00 173.10 173.18 1ri9 s TYR 75 N -3.49 3.21 -0.06 1.90 2.02 -0.50 -1.03 117.35 119.40 1ri9 s TYR 75 Ca 0.01 0.06 -0.00 0.00 -0.37 0.00 0.00 57.07 56.76 1ri9 s TYR 75 Cb 0.00 -1.60 0.02 0.00 -0.40 0.00 0.00 41.96 39.99 1ri9 s TYR 75 CO -0.10 0.52 -0.02 0.54 -1.57 0.00 0.00 175.55 174.92 1ri9 s VAL 76 N -1.53 0.46 0.35 0.71 0.11 -0.91 -3.07 120.40 116.53 1ri9 s VAL 76 Ca 0.30 -0.01 -0.26 0.00 -2.93 0.00 0.00 61.98 59.08 1ri9 s VAL 76 Cb -0.11 -0.55 -0.09 0.00 -1.53 0.00 0.00 36.38 34.10 1ri9 s VAL 76 CO 0.23 0.24 1.07 -0.22 -3.33 0.00 0.00 175.10 173.09 1ri9 s LEU 77 N 1.38 4.30 0.62 2.54 0.20 -1.26 -2.65 118.68 123.80 1ri9 s LEU 77 Ca -0.04 2.14 0.32 0.00 0.69 0.00 0.00 54.13 57.24 1ri9 s LEU 77 Cb -0.13 -3.96 1.82 0.00 -0.43 0.00 0.00 46.19 43.49 1ri9 s LEU 77 CO -0.03 -0.36 2.13 0.08 -0.29 0.00 0.00 176.35 177.88 1ri9 h ARG 78 N 3.02 0.00 -0.03 1.98 -0.00 -1.89 -2.41 114.38 115.05 1ri9 h ARG 78 Ca -0.48 0.00 0.03 0.00 -0.00 0.00 0.00 59.98 59.53 1ri9 h ARG 78 Cb 1.21 0.00 -0.06 0.00 -0.00 0.00 0.00 29.97 31.13 1ri9 h ARG 78 CO 0.64 0.00 -0.50 1.03 -0.00 0.00 0.00 179.97 181.14 1ri9 h SER 79 N 0.00 -1.56 -3.18 0.08 0.87 -1.90 -3.27 113.55 104.60 1ri9 h SER 79 Ca 0.05 0.18 -0.64 0.00 -1.23 0.00 0.00 61.79 60.15 1ri9 h SER 79 Cb 0.40 0.60 -0.40 0.00 -0.44 0.00 0.00 62.40 62.56 1ri9 h SER 79 CO -0.00 -0.50 -0.44 -0.72 -0.53 0.00 0.00 176.83 174.64 1ri9 s TYR 80 N -5.79 3.67 -0.26 2.24 -0.85 -0.91 -5.02 117.35 110.43 1ri9 s TYR 80 Ca -0.16 -3.26 -0.25 0.00 -0.52 0.00 0.00 57.07 52.88 1ri9 s TYR 80 Cb 0.07 -2.86 0.10 0.00 0.38 0.00 0.00 41.96 39.65 1ri9 s TYR 80 CO 0.62 -0.60 0.89 -1.17 -1.52 0.00 0.00 175.55 173.77 1ri9 s LEU 81 N -1.43 -0.58 1.18 -3.49 1.98 -1.23 -4.32 118.68 110.78 1ri9 s LEU 81 Ca 0.26 1.09 -0.17 0.00 -2.89 0.00 0.00 54.13 52.42 1ri9 s LEU 81 Cb -0.05 2.16 0.20 0.00 0.66 0.00 0.00 46.19 49.16 1ri9 s LEU 81 CO -0.15 -0.22 0.43 0.00 -1.89 0.00 0.00 176.35 174.51 1ri9 n ALA 82 N 2.31 -3.63 0.00 5.97 0.00 -1.25 -4.94 120.51 118.96 1ri9 n ALA 82 Ca -0.13 -1.33 0.00 0.00 0.00 0.00 0.00 53.44 51.98 1ri9 n ALA 82 Cb 0.56 -1.60 0.00 0.00 0.00 0.00 0.00 19.45 18.40 1ri9 n ALA 82 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25