#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 0.16 0.28 5.31 5.02 -1.26 -3.37 118.16 124.30 1ri9 n LYS 8 Ca 0.00 0.10 0.13 0.00 -2.02 0.00 0.00 58.31 56.52 1ri9 n LYS 8 Cb 0.00 -1.65 0.80 0.00 -0.02 0.00 0.00 35.03 34.15 1ri9 n LYS 8 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1ri9 h GLU 9 N 0.00 0.00 -0.10 1.97 4.39 -1.95 -0.63 114.58 118.25 1ri9 h GLU 9 Ca 0.00 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.62 1ri9 h GLU 9 Cb 0.64 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.28 1ri9 h GLU 9 CO 0.00 0.06 -0.32 1.49 -1.16 0.00 0.00 179.01 179.08 1ri9 h GLU 10 N 0.00 0.19 -0.08 2.33 4.81 -1.58 -2.17 114.58 118.09 1ri9 h GLU 10 Ca -0.00 -0.07 -0.08 0.00 -0.13 0.00 0.00 59.36 59.08 1ri9 h GLU 10 Cb 0.14 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 1ri9 h GLU 10 CO 0.01 0.50 -0.32 0.87 -0.73 0.00 0.00 179.01 179.34 1ri9 h LYS 11 N 0.17 0.15 -1.00 1.92 6.56 -1.33 0.29 116.57 123.33 1ri9 h LYS 11 Ca 0.02 -0.05 0.01 0.00 -1.06 0.00 0.00 60.65 59.57 1ri9 h LYS 11 Cb 0.65 -0.01 -0.05 0.00 -0.57 0.00 0.00 32.23 32.25 1ri9 h LYS 11 CO 0.05 0.46 0.66 0.22 -2.06 0.00 0.00 179.45 178.78 1ri9 h ASP 12 N 0.13 1.15 0.00 0.86 1.82 -1.35 0.96 116.42 119.99 1ri9 h ASP 12 Ca 0.02 -0.03 -0.06 0.00 -0.39 0.00 0.00 57.03 56.57 1ri9 h ASP 12 Cb 0.63 -0.29 -0.01 0.00 0.68 0.00 0.00 39.33 40.35 1ri9 h ASP 12 CO 0.05 0.83 -0.31 0.15 -1.61 0.00 0.00 179.24 178.36 1ri9 h PHE 13 N 1.36 0.00 -0.76 0.28 3.04 -1.40 -3.30 116.94 116.16 1ri9 h PHE 13 Ca 0.37 -0.00 0.05 0.00 3.98 0.00 0.00 57.97 62.36 1ri9 h PHE 13 Cb -0.16 -0.00 -0.04 0.00 2.56 0.00 0.00 35.95 38.31 1ri9 h PHE 13 CO 0.00 1.12 0.50 -0.09 -2.02 0.00 0.00 178.31 177.82 1ri9 h ARG 14 N -1.00 0.85 0.03 1.11 2.43 -0.36 4.10 114.38 121.54 1ri9 h ARG 14 Ca -0.08 -0.05 0.03 0.00 -0.81 0.00 0.00 59.98 59.06 1ri9 h ARG 14 Cb 1.07 -0.19 -0.05 0.00 -0.42 0.00 0.00 29.97 30.38 1ri9 h ARG 14 CO -0.05 0.56 -0.42 1.57 -1.51 0.00 0.00 179.97 180.12 1ri9 h LYS 15 N 0.87 -0.58 0.13 0.20 5.09 0.84 1.04 116.57 124.17 1ri9 h LYS 15 Ca 0.31 0.04 -0.29 0.00 0.09 0.00 0.00 60.65 60.80 1ri9 h LYS 15 Cb 0.13 0.13 -0.00 0.00 0.10 0.00 0.00 32.23 32.59 1ri9 h LYS 15 CO -0.10 -0.38 -1.41 -0.22 -2.09 0.00 0.00 179.45 175.25 1ri9 h LYS 16 N -0.60 0.27 -1.04 0.07 1.63 -1.51 -3.26 116.57 112.13 1ri9 h LYS 16 Ca 0.04 -0.45 -0.20 0.00 -0.85 0.00 0.00 60.65 59.19 1ri9 h LYS 16 Cb 0.66 0.17 -0.11 0.00 -0.60 0.00 0.00 32.23 32.35 1ri9 h LYS 16 CO -0.30 1.16 0.25 1.19 -3.45 0.00 0.00 179.45 178.31 1ri9 n PHE 17 N -3.49 1.14 0.00 1.91 3.01 1.35 -4.62 117.46 116.76 1ri9 n PHE 17 Ca -0.13 -1.04 0.00 0.00 1.01 0.00 0.00 57.45 57.29 1ri9 n PHE 17 Cb 1.04 -0.53 0.00 0.00 -0.01 0.00 0.00 39.48 39.98 1ri9 n PHE 17 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 1ri9 n LYS 18 N -0.07 0.00 -1.83 -1.08 0.00 0.36 -4.43 118.16 111.10 1ri9 n LYS 18 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 58.31 58.11 1ri9 n LYS 18 Cb 0.91 -0.84 -0.03 0.00 0.00 0.00 0.00 35.03 35.07 1ri9 n LYS 18 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.40 176.93 1ri9 s TYR 19 N -0.13 1.88 -0.59 5.64 5.04 -1.26 -4.94 117.35 122.98 1ri9 s TYR 19 Ca 0.00 -0.02 -0.15 0.00 -2.44 0.00 0.00 57.07 54.45 1ri9 s TYR 19 Cb 0.00 -4.08 0.15 0.00 0.35 0.00 0.00 41.96 38.38 1ri9 s TYR 19 CO 0.00 -4.57 0.54 -0.51 -1.34 0.00 0.00 175.55 169.67 1ri9 s ASP 20 N 3.38 6.27 0.00 4.32 1.01 -1.26 -5.00 116.67 125.40 1ri9 s ASP 20 Ca 0.80 -1.96 0.00 0.00 0.71 0.00 0.00 52.55 52.09 1ri9 s ASP 20 Cb -0.40 -2.20 0.00 0.00 1.01 0.00 0.00 42.92 41.33 1ri9 s ASP 20 CO 0.35 -0.80 0.00 0.61 0.21 0.00 0.00 175.17 175.54 1ri9 n GLY 21 N 5.00 3.20 3.28 0.21 0.00 -1.26 -5.11 105.19 110.52 1ri9 n GLY 21 Ca -0.09 -1.39 -0.45 0.00 0.00 0.00 0.00 46.02 44.10 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 -1.95 3.29 -0.37 1.61 -6.30 -1.26 -5.02 118.70 108.70 1ri9 s GLU 22 Ca 0.00 -2.32 -0.28 0.00 -2.50 0.00 0.00 54.97 49.87 1ri9 s GLU 22 Cb 0.00 -4.28 -0.01 0.00 0.00 0.00 0.00 34.13 29.84 1ri9 s GLU 22 CO 0.00 -1.27 1.70 0.42 0.02 0.00 0.00 175.26 176.13 1ri9 s ILE 23 N 0.42 3.58 -0.19 -3.70 1.01 -1.26 -4.88 121.20 116.18 1ri9 s ILE 23 Ca 0.15 0.57 -0.11 0.00 0.00 0.00 0.00 60.65 61.26 1ri9 s ILE 23 Cb -0.16 -3.82 0.06 0.00 0.01 0.00 0.00 42.46 38.56 1ri9 s ILE 23 CO -0.06 -0.54 0.47 -0.60 0.00 0.00 0.00 174.94 174.20 1ri9 s ARG 24 N 5.57 0.47 -0.72 2.79 3.00 -1.26 -5.10 118.95 123.70 1ri9 s ARG 24 Ca 0.74 0.84 -0.26 0.00 -1.00 0.00 0.00 55.73 56.04 1ri9 s ARG 24 Cb -0.19 0.05 -0.00 0.00 0.00 0.00 0.00 34.95 34.81 1ri9 s ARG 24 CO 0.32 -0.14 1.64 0.54 0.00 0.00 0.00 175.30 177.66 1ri9 s VAL 25 N 1.25 3.54 -0.22 7.11 0.11 -1.26 -4.57 120.40 126.35 1ri9 s VAL 25 Ca -0.08 0.13 -0.18 0.00 -2.93 0.00 0.00 61.98 58.92 1ri9 s VAL 25 Cb -0.07 -4.38 -0.18 0.00 -1.53 0.00 0.00 36.38 30.23 1ri9 s VAL 25 CO -0.12 -1.33 0.07 -0.11 -3.33 0.00 0.00 175.10 170.28 1ri9 n LEU 26 N 11.41 1.95 -3.68 2.54 0.00 -1.23 -4.78 117.00 123.21 1ri9 n LEU 26 Ca 0.17 0.38 -0.29 0.00 0.00 0.00 0.00 56.01 56.27 1ri9 n LEU 26 Cb 0.50 -0.94 -0.13 0.00 0.00 0.00 0.00 43.42 42.86 1ri9 n LEU 26 CO 0.69 0.40 -0.24 -0.72 0.00 0.00 0.00 177.39 177.52 1ri9 s TYR 27 N -2.42 1.94 -0.34 1.96 1.13 -1.25 -5.08 117.35 113.29 1ri9 s TYR 27 Ca -0.31 -2.44 -0.29 0.00 -1.41 0.00 0.00 57.07 52.62 1ri9 s TYR 27 Cb 0.08 -1.79 -0.01 0.00 -1.10 0.00 0.00 41.96 39.15 1ri9 s TYR 27 CO 0.58 -0.77 1.60 -1.54 -2.51 0.00 0.00 175.55 172.91 1ri9 s SER 28 N 0.21 6.17 0.41 -0.18 1.04 -1.26 -4.12 113.70 115.97 1ri9 s SER 28 Ca 0.20 1.18 -0.01 0.00 0.48 0.00 0.00 55.95 57.79 1ri9 s SER 28 Cb -0.19 -2.53 -0.03 0.00 0.10 0.00 0.00 66.02 63.37 1ri9 s SER 28 CO -0.03 -1.50 0.65 0.28 0.98 0.00 0.00 173.24 173.61 1ri9 s THR 29 N 5.95 4.76 -0.12 2.02 -1.32 -1.24 -4.81 115.64 120.88 1ri9 s THR 29 Ca 0.71 -0.30 -0.07 0.00 -1.21 0.00 0.00 61.69 60.83 1ri9 s THR 29 Cb -0.19 -3.76 -0.04 0.00 -1.51 0.00 0.00 72.50 66.99 1ri9 s THR 29 CO 0.32 -0.58 0.12 -0.75 -2.21 0.00 0.00 174.62 171.52 1ri9 s LYS 30 N -4.50 3.46 -0.10 7.08 2.36 -1.26 -3.42 119.74 123.37 1ri9 s LYS 30 Ca 0.44 -0.18 -0.30 0.00 -2.55 0.00 0.00 55.97 53.38 1ri9 s LYS 30 Cb -0.10 -3.16 -0.04 0.00 -1.05 0.00 0.00 37.83 33.49 1ri9 s LYS 30 CO 0.39 0.71 1.48 0.08 1.55 0.00 0.00 175.35 179.56 1ri9 s VAL 31 N -0.83 3.87 0.12 4.02 1.01 0.74 -3.95 120.40 125.37 1ri9 s VAL 31 Ca 0.14 1.07 -0.30 0.00 0.00 0.00 0.00 61.98 62.88 1ri9 s VAL 31 Cb -0.12 -3.69 -0.06 0.00 0.00 0.00 0.00 36.38 32.51 1ri9 s VAL 31 CO 0.03 -0.09 1.12 -0.89 0.00 0.00 0.00 175.10 175.27 1ri9 s THR 32 N 3.72 4.02 0.66 3.92 2.01 -1.26 -1.89 115.64 126.82 1ri9 s THR 32 Ca 0.65 1.61 0.08 0.00 0.31 0.00 0.00 61.69 64.34 1ri9 s THR 32 Cb -0.28 -4.03 0.09 0.00 0.01 0.00 0.00 72.50 68.29 1ri9 s THR 32 CO 0.23 0.21 1.23 0.00 -0.69 0.00 0.00 174.62 175.60 1ri9 h THR 33 N 4.09 0.01 -0.33 -0.82 1.03 -1.91 4.98 112.91 119.95 1ri9 h THR 33 Ca -0.43 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 65.97 1ri9 h THR 33 Cb 1.21 0.15 0.00 0.00 -1.07 0.00 0.00 68.15 68.45 1ri9 h THR 33 CO 0.75 0.00 0.00 -0.24 -0.01 0.00 0.00 175.52 176.02 1ri9 n SER 34 N -2.64 2.46 -4.32 0.00 2.88 -1.26 -4.55 113.62 106.18 1ri9 n SER 34 Ca 0.01 -2.17 -0.29 0.00 -1.33 0.00 0.00 58.87 55.09 1ri9 n SER 34 Cb 0.89 -0.37 0.20 0.00 -0.75 0.00 0.00 64.21 64.17 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 -1.65 1.85 -0.10 2.46 -1.16 1.63 -4.64 121.20 119.59 1ri9 s ILE 35 Ca 0.25 0.00 -0.29 0.00 -0.51 0.00 0.00 60.65 60.10 1ri9 s ILE 35 Cb 0.16 -2.57 -0.04 0.00 0.61 0.00 0.00 42.46 40.62 1ri9 s ILE 35 CO 0.13 0.00 1.47 0.28 -2.81 0.00 0.00 174.94 174.01 1ri9 s THR 36 N -3.10 3.90 -0.01 4.00 -1.32 -1.25 -4.64 115.64 113.22 1ri9 s THR 36 Ca 0.68 1.09 0.01 0.00 -1.21 0.00 0.00 61.69 62.27 1ri9 s THR 36 Cb -0.14 -3.71 -0.02 0.00 -1.51 0.00 0.00 72.50 67.13 1ri9 s THR 36 CO 0.56 -0.09 0.01 -0.24 -2.21 0.00 0.00 174.62 172.65 1ri9 n SER 37 N 6.82 4.67 -0.11 8.08 2.88 -1.26 -4.38 113.62 130.31 1ri9 n SER 37 Ca 0.16 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.48 1ri9 n SER 37 Cb 0.44 0.66 -0.08 0.00 -0.75 0.00 0.00 64.21 64.48 1ri9 n SER 37 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 1ri9 n LYS 38 N -1.93 0.47 -2.06 -1.46 2.85 -1.26 -4.94 118.16 109.83 1ri9 n LYS 38 Ca -0.02 0.18 -0.42 0.00 -1.05 0.00 0.00 58.31 57.00 1ri9 n LYS 38 Cb 0.42 -1.30 -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 -2.40 4.23 -0.08 -1.58 2.36 -1.26 -4.99 119.74 116.02 1ri9 s LYS 39 Ca -0.30 2.17 -0.04 0.00 -2.55 0.00 0.00 55.97 55.26 1ri9 s LYS 39 Cb 0.11 -3.60 0.04 0.00 -1.05 0.00 0.00 37.83 33.33 1ri9 s LYS 39 CO 0.40 -0.67 0.18 -1.58 1.55 0.00 0.00 175.35 175.23 1ri9 s TRP 40 N 2.57 -0.22 0.27 4.03 0.23 -1.26 -4.86 118.94 119.70 1ri9 s TRP 40 Ca 0.70 0.60 0.11 0.00 -2.03 0.00 0.00 56.10 55.48 1ri9 s TRP 40 Cb -0.36 -0.04 -0.05 0.00 0.03 0.00 0.00 33.47 33.05 1ri9 s TRP 40 CO 0.30 -0.20 -0.16 0.20 0.96 0.00 0.00 176.95 178.05 1ri9 s GLY 41 N 1.25 1.84 0.38 0.98 0.00 -1.26 -4.98 107.32 105.52 1ri9 s GLY 41 Ca -0.09 -1.82 0.08 0.00 0.00 0.00 0.00 44.72 42.89 1ri9 s GLY 41 CO -0.07 -1.90 1.95 0.00 0.00 0.00 0.00 173.10 173.08 1ri9 h THR 42 N 2.24 0.97 -0.43 0.90 1.03 -2.01 0.29 112.91 115.90 1ri9 h THR 42 Ca -0.41 -0.23 0.00 0.00 -0.01 0.00 0.00 66.41 65.76 1ri9 h THR 42 Cb 1.26 0.24 0.00 0.00 -1.07 0.00 0.00 68.15 68.57 1ri9 h THR 42 CO 0.59 0.12 0.00 0.54 -0.01 0.00 0.00 175.52 176.77 1ri9 n ARG 43 N -4.49 2.32 -3.86 0.00 1.74 -1.26 -4.92 116.66 106.20 1ri9 n ARG 43 Ca 0.11 -2.02 -0.21 0.00 -0.77 0.00 0.00 57.85 54.97 1ri9 n ARG 43 Cb 0.29 -1.47 -0.03 0.00 -1.02 0.00 0.00 32.46 30.23 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 -1.32 5.67 0.13 0.55 -1.08 0.10 -2.04 116.67 118.68 1ri9 s ASP 44 Ca 0.38 -0.27 -0.02 0.00 -0.52 0.00 0.00 52.55 52.13 1ri9 s ASP 44 Cb 0.21 -1.30 -0.05 0.00 -1.46 0.00 0.00 42.92 40.32 1ri9 s ASP 44 CO 0.29 -0.23 0.31 -0.22 0.52 0.00 0.00 175.17 175.85 1ri9 s LEU 45 N -3.98 4.30 -0.19 -1.34 2.96 -1.20 -4.58 118.68 114.64 1ri9 s LEU 45 Ca 0.38 0.41 0.01 0.00 -0.22 0.00 0.00 54.13 54.71 1ri9 s LEU 45 Cb -0.08 -3.13 0.26 0.00 0.50 0.00 0.00 46.19 43.74 1ri9 s LEU 45 CO 0.27 0.07 1.45 1.67 -1.32 0.00 0.00 176.35 178.50 1ri9 n GLN 46 N -0.04 1.53 -0.93 1.98 7.27 -1.26 -4.83 117.38 121.11 1ri9 n GLN 46 Ca -0.04 -1.23 -0.31 0.00 0.07 0.00 0.00 57.00 55.49 1ri9 n GLN 46 Cb 0.52 -1.48 0.14 0.00 2.41 0.00 0.00 30.24 31.82 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 -1.41 2.57 0.19 1.69 -7.23 -1.26 -5.04 120.40 109.91 1ri9 s VAL 47 Ca 0.23 0.18 0.08 0.00 -1.81 0.00 0.00 61.98 60.67 1ri9 s VAL 47 Cb 0.20 -2.39 -0.04 0.00 0.56 0.00 0.00 36.38 34.70 1ri9 s VAL 47 CO 0.04 -0.24 -0.02 -0.54 -0.31 0.00 0.00 175.10 174.03 1ri9 s LYS 48 N -4.75 2.32 0.06 4.82 3.01 -1.26 -4.66 119.74 119.28 1ri9 s LYS 48 Ca 0.65 -1.19 -0.30 0.00 -1.01 0.00 0.00 55.97 54.11 1ri9 s LYS 48 Cb -0.21 -2.29 -0.05 0.00 -1.01 0.00 0.00 37.83 34.28 1ri9 s LYS 48 CO 0.57 0.43 1.17 -1.25 0.51 0.00 0.00 175.35 176.78 1ri9 s PRO 49 N -3.06 4.45 0.00 -1.68 0.04 -1.26 -3.05 135.00 130.44 1ri9 s PRO 49 Ca 0.28 1.72 0.00 0.00 0.04 0.00 0.00 61.00 63.04 1ri9 s PRO 49 Cb -0.09 -3.36 0.00 0.00 0.04 0.00 0.00 34.50 31.09 1ri9 s PRO 49 CO 0.18 -0.22 0.00 0.41 0.04 0.00 0.00 177.00 177.41 1ri9 n GLY 50 N 3.14 0.98 3.93 0.56 0.00 -0.79 -4.60 105.19 108.40 1ri9 n GLY 50 Ca 0.08 -0.01 -0.21 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.80 2.53 -0.08 1.61 2.02 -1.12 -4.88 118.70 117.98 1ri9 s GLU 51 Ca 0.00 -1.55 0.03 0.00 0.02 0.00 0.00 54.97 53.47 1ri9 s GLU 51 Cb 0.00 -2.45 0.01 0.00 0.10 0.00 0.00 34.13 31.79 1ri9 s GLU 51 CO 0.00 -0.35 -0.17 0.45 0.02 0.00 0.00 175.26 175.22 1ri9 s SER 52 N -4.26 2.27 0.16 -0.19 0.15 -1.26 0.26 113.70 110.83 1ri9 s SER 52 Ca 0.49 -0.40 -0.01 0.00 0.70 0.00 0.00 55.95 56.74 1ri9 s SER 52 Cb -0.05 -1.02 -0.04 0.00 -1.71 0.00 0.00 66.02 63.20 1ri9 s SER 52 CO 0.29 0.09 0.07 -0.22 1.20 0.00 0.00 173.24 174.67 1ri9 s LEU 53 N 0.51 1.62 0.08 3.45 2.96 -1.22 -4.92 118.68 121.16 1ri9 s LEU 53 Ca -0.16 -1.26 -0.30 0.00 -0.22 0.00 0.00 54.13 52.19 1ri9 s LEU 53 Cb -0.16 0.29 -0.05 0.00 0.50 0.00 0.00 46.19 46.76 1ri9 s LEU 53 CO 0.06 -0.75 1.03 -0.70 -1.32 0.00 0.00 176.35 174.67 1ri9 s GLU 54 N -4.07 4.59 -0.21 1.98 2.12 -1.20 -3.70 118.70 118.21 1ri9 s GLU 54 Ca 0.29 1.54 -0.09 0.00 0.36 0.00 0.00 54.97 57.07 1ri9 s GLU 54 Cb 0.07 -3.38 -0.04 0.00 0.26 0.00 0.00 34.13 31.04 1ri9 s GLU 54 CO 0.05 0.02 0.10 0.08 -0.54 0.00 0.00 175.26 174.97 1ri9 s VAL 55 N 0.48 4.93 0.00 3.70 1.01 -1.26 -0.77 120.40 128.49 1ri9 s VAL 55 Ca 0.51 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.52 1ri9 s VAL 55 Cb -0.25 -3.27 0.00 0.00 0.00 0.00 0.00 36.38 32.87 1ri9 s VAL 55 CO 0.30 0.40 0.00 -0.38 0.00 0.00 0.00 175.10 175.42 1ri9 n ILE 56 N 4.03 0.00 -3.50 2.22 5.41 0.23 -3.58 119.36 124.17 1ri9 n ILE 56 Ca -0.16 0.00 -0.26 0.00 1.00 0.00 0.00 62.75 63.33 1ri9 n ILE 56 Cb 0.52 0.00 -0.02 0.00 -0.71 0.00 0.00 39.64 39.43 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 2.77 3.53 -0.01 0.38 -1.52 -1.26 -4.72 119.66 118.82 1ri9 s GLN 57 Ca 0.00 -0.27 -0.30 0.00 -1.95 0.00 0.00 55.36 52.84 1ri9 s GLN 57 Cb 0.00 -2.73 -0.06 0.00 -0.22 0.00 0.00 33.01 30.00 1ri9 s GLN 57 CO 0.00 0.26 1.56 0.95 -0.25 0.00 0.00 175.29 177.81 1ri9 s THR 58 N -2.10 3.51 0.00 -0.19 -4.23 -1.25 -3.36 115.64 108.01 1ri9 s THR 58 Ca 0.40 0.80 0.00 0.00 -1.18 0.00 0.00 61.69 61.71 1ri9 s THR 58 Cb -0.10 -3.51 0.00 0.00 1.34 0.00 0.00 72.50 70.22 1ri9 s THR 58 CO 0.32 -0.03 0.80 0.41 -0.54 0.00 0.00 174.62 175.57 1ri9 n THR 59 N 5.04 0.00 0.00 3.99 -1.04 0.11 -4.80 114.28 117.58 1ri9 n THR 59 Ca 0.16 1.30 0.00 0.00 -2.04 0.00 0.00 64.05 63.46 1ri9 n THR 59 Cb 0.42 -2.16 0.00 0.00 -1.82 0.00 0.00 70.33 66.77 1ri9 n THR 59 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1ri9 n ASP 60 N -1.62 0.00 0.02 8.00 9.92 -1.26 -5.02 116.55 126.59 1ri9 n ASP 60 Ca 0.00 0.00 -0.02 0.00 -0.53 0.00 0.00 54.79 54.24 1ri9 n ASP 60 Cb 0.00 0.00 -0.01 0.00 -0.64 0.00 0.00 41.12 40.47 1ri9 n ASP 60 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1ri9 n ASP 61 N 0.00 0.88 -3.47 -2.24 8.00 -1.26 -4.88 116.55 113.57 1ri9 n ASP 61 Ca 0.00 0.12 -0.29 0.00 0.71 0.00 0.00 54.79 55.33 1ri9 n ASP 61 Cb 0.00 -0.28 -0.07 0.00 -0.02 0.00 0.00 41.12 40.75 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 2.70 -3.66 -3.53 -1.04 -1.26 -5.00 114.28 99.05 1ri9 n THR 62 Ca -0.03 -5.31 -0.08 0.00 -2.04 0.00 0.00 64.05 56.59 1ri9 n THR 62 Cb 0.20 -2.08 -0.08 0.00 -1.82 0.00 0.00 70.33 66.55 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 -2.54 0.62 -0.11 -2.82 2.20 -1.26 -2.54 119.74 113.28 1ri9 s LYS 63 Ca 0.39 1.08 0.03 0.00 -0.36 0.00 0.00 55.97 57.11 1ri9 s LYS 63 Cb 0.14 0.10 0.01 0.00 -1.51 0.00 0.00 37.83 36.57 1ri9 s LYS 63 CO -0.00 -0.15 -0.22 0.14 -0.36 0.00 0.00 175.35 174.76 1ri9 s VAL 64 N 1.51 1.94 -0.21 4.02 -7.23 -1.09 0.06 120.40 119.39 1ri9 s VAL 64 Ca -0.09 -0.93 -0.21 0.00 -1.81 0.00 0.00 61.98 58.93 1ri9 s VAL 64 Cb -0.06 -1.71 -0.02 0.00 0.56 0.00 0.00 36.38 35.15 1ri9 s VAL 64 CO -0.17 0.53 0.65 -0.22 -0.31 0.00 0.00 175.10 175.58 1ri9 s LEU 65 N 0.59 4.12 0.33 1.32 2.96 -1.21 -2.72 118.68 124.08 1ri9 s LEU 65 Ca -0.13 0.83 -0.04 0.00 -0.22 0.00 0.00 54.13 54.57 1ri9 s LEU 65 Cb -0.17 -2.92 -0.05 0.00 0.50 0.00 0.00 46.19 43.56 1ri9 s LEU 65 CO 0.04 -0.32 0.59 0.00 -1.32 0.00 0.00 176.35 175.35 1ri9 s ARG 67 N -3.91 0.54 0.01 0.00 3.52 0.05 -1.94 118.95 117.21 1ri9 s ARG 67 Ca 0.44 -0.37 0.08 0.00 -0.13 0.00 0.00 55.73 55.75 1ri9 s ARG 67 Cb -0.10 -0.48 -0.02 0.00 -1.56 0.00 0.00 34.95 32.78 1ri9 s ARG 67 CO 0.33 0.12 -0.25 0.54 -0.81 0.00 0.00 175.30 175.24 1ri9 s ASN 68 N -0.51 2.99 0.21 -2.12 4.22 -0.91 -3.25 114.94 115.57 1ri9 s ASN 68 Ca -0.00 -0.50 0.11 0.00 -2.14 0.00 0.00 52.86 50.33 1ri9 s ASN 68 Cb -0.04 -0.31 0.63 0.00 1.28 0.00 0.00 41.25 42.80 1ri9 s ASN 68 CO -0.00 0.28 1.29 1.21 -2.04 0.00 0.00 177.10 177.84 1ri9 n GLU 69 N 2.20 0.08 0.00 3.55 2.13 -1.26 -0.95 120.64 126.39 1ri9 n GLU 69 Ca -0.16 0.54 0.00 0.00 0.66 0.00 0.00 57.16 58.20 1ri9 n GLU 69 Cb 0.52 -1.87 0.02 0.00 0.27 0.00 0.00 31.44 30.38 1ri9 n GLU 69 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1ri9 n GLU 70 N -1.90 0.00 -0.68 5.31 2.13 -1.26 -4.75 120.64 119.49 1ri9 n GLU 70 Ca -0.01 0.46 0.00 0.00 0.66 0.00 0.00 57.16 58.27 1ri9 n GLU 70 Cb 0.13 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.34 1ri9 n GLU 70 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ri9 n GLY 71 N -1.39 0.63 3.39 8.31 0.00 -0.12 -5.01 105.19 111.00 1ri9 n GLY 71 Ca 0.00 -0.30 -0.23 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.74 1.45 0.38 1.61 2.20 -1.21 -3.45 119.74 119.99 1ri9 s LYS 72 Ca 0.00 -1.55 0.08 0.00 -0.36 0.00 0.00 55.97 54.14 1ri9 s LYS 72 Cb 0.00 -1.57 -0.07 0.00 -1.51 0.00 0.00 37.83 34.68 1ri9 s LYS 72 CO 0.00 0.31 -0.03 0.71 -0.36 0.00 0.00 175.35 175.98 1ri9 s TYR 73 N -2.15 2.47 0.12 4.03 1.51 -1.26 -2.14 117.35 119.92 1ri9 s TYR 73 Ca 0.21 -0.59 -0.21 0.00 -1.01 0.00 0.00 57.07 55.48 1ri9 s TYR 73 Cb -0.06 -1.60 0.06 0.00 -0.11 0.00 0.00 41.96 40.25 1ri9 s TYR 73 CO 0.10 0.51 0.53 0.20 -1.11 0.00 0.00 175.55 175.77 1ri9 s GLY 74 N -3.67 -0.47 0.14 0.71 0.00 -0.82 -4.87 107.32 98.34 1ri9 s GLY 74 Ca 0.34 0.37 0.04 0.00 0.00 0.00 0.00 44.72 45.48 1ri9 s GLY 74 CO 0.17 0.07 0.13 -0.19 0.00 0.00 0.00 173.10 173.28 1ri9 s TYR 75 N -3.42 3.17 -0.06 1.90 2.02 -0.87 -1.15 117.35 118.94 1ri9 s TYR 75 Ca -0.00 0.01 -0.02 0.00 -0.37 0.00 0.00 57.07 56.68 1ri9 s TYR 75 Cb -0.00 -1.54 0.04 0.00 -0.40 0.00 0.00 41.96 40.06 1ri9 s TYR 75 CO -0.10 0.52 0.12 0.08 -1.57 0.00 0.00 175.55 174.60 1ri9 s VAL 76 N -1.67 -0.12 0.32 0.71 1.01 -1.10 -3.22 120.40 116.33 1ri9 s VAL 76 Ca 0.31 0.27 -0.26 0.00 0.00 0.00 0.00 61.98 62.29 1ri9 s VAL 76 Cb -0.11 -0.22 -0.10 0.00 0.00 0.00 0.00 36.38 35.96 1ri9 s VAL 76 CO 0.23 0.11 0.95 -0.22 0.00 0.00 0.00 175.10 176.18 1ri9 s LEU 77 N 1.60 4.35 0.64 3.92 0.20 -1.26 -2.69 118.68 125.44 1ri9 s LEU 77 Ca -0.04 1.87 0.36 0.00 0.69 0.00 0.00 54.13 57.00 1ri9 s LEU 77 Cb -0.12 -4.00 1.98 0.00 -0.43 0.00 0.00 46.19 43.62 1ri9 s LEU 77 CO -0.05 -0.09 2.18 0.08 -0.29 0.00 0.00 176.35 178.19 1ri9 h ARG 78 N 3.19 0.00 0.02 1.98 0.11 -1.89 -2.49 114.38 115.30 1ri9 h ARG 78 Ca -0.47 0.00 0.02 0.00 0.10 0.00 0.00 59.98 59.63 1ri9 h ARG 78 Cb 1.19 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 32.22 1ri9 h ARG 78 CO 0.65 0.00 -0.51 1.03 0.10 0.00 0.00 179.97 181.24 1ri9 h SER 79 N 0.00 -1.56 -3.61 0.08 0.87 -1.91 -3.29 113.55 104.13 1ri9 h SER 79 Ca 0.02 0.18 -0.65 0.00 -1.23 0.00 0.00 61.79 60.11 1ri9 h SER 79 Cb 0.29 0.59 -0.40 0.00 -0.44 0.00 0.00 62.40 62.45 1ri9 h SER 79 CO -0.00 -0.52 -0.48 -0.72 -0.53 0.00 0.00 176.83 174.59 1ri9 s TYR 80 N -5.79 3.51 0.18 2.24 -0.85 -0.94 -5.02 117.35 110.69 1ri9 s TYR 80 Ca -0.16 -3.17 -0.23 0.00 -0.52 0.00 0.00 57.07 52.98 1ri9 s TYR 80 Cb 0.07 -2.89 0.07 0.00 0.38 0.00 0.00 41.96 39.58 1ri9 s TYR 80 CO 0.62 -0.66 0.96 -1.17 -1.52 0.00 0.00 175.55 173.78 1ri9 s LEU 81 N -0.98 -0.11 0.97 -3.49 2.96 -1.24 -3.92 118.68 112.86 1ri9 s LEU 81 Ca 0.22 -0.55 -0.15 0.00 -0.22 0.00 0.00 54.13 53.43 1ri9 s LEU 81 Cb -0.12 2.21 0.18 0.00 0.50 0.00 0.00 46.19 48.95 1ri9 s LEU 81 CO -0.10 -1.00 1.20 0.00 -1.32 0.00 0.00 176.35 175.13 1ri9 s ALA 82 N -2.89 1.84 -1.70 5.97 0.00 -1.25 -4.74 121.76 118.98 1ri9 s ALA 82 Ca 0.15 -0.85 0.00 0.00 0.00 0.00 0.00 51.96 51.27 1ri9 s ALA 82 Cb -0.02 -2.91 0.00 0.00 0.00 0.00 0.00 23.12 20.19 1ri9 s ALA 82 CO 0.04 -2.49 0.42 -0.25 0.00 0.00 0.00 175.76 173.49