#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 3.49 -0.00 -1.26 -3.52 118.16 116.83 1ri9 n LYS 8 Ca 0.00 0.10 -0.03 0.00 -0.00 0.00 0.00 58.31 58.39 1ri9 n LYS 8 Cb 0.00 -1.66 0.16 0.00 -0.00 0.00 0.00 35.03 33.53 1ri9 n LYS 8 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 1ri9 h GLU 9 N 0.00 1.02 -0.59 -1.58 5.08 -1.96 -1.88 114.58 114.67 1ri9 h GLU 9 Ca 0.00 -0.15 -0.02 0.00 -1.00 0.00 0.00 59.36 58.19 1ri9 h GLU 9 Cb 0.65 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.69 1ri9 h GLU 9 CO 0.00 0.80 0.27 1.49 -1.00 0.00 0.00 179.01 180.57 1ri9 h GLU 10 N 1.01 0.84 -0.19 2.33 4.81 -1.64 -0.88 114.58 120.84 1ri9 h GLU 10 Ca 0.24 -0.11 -0.08 0.00 -0.13 0.00 0.00 59.36 59.28 1ri9 h GLU 10 Cb 0.13 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 1ri9 h GLU 10 CO -0.03 0.66 -0.23 0.87 -0.73 0.00 0.00 179.01 179.55 1ri9 h LYS 11 N 0.83 0.35 -0.39 1.92 6.56 -1.54 0.60 116.57 124.91 1ri9 h LYS 11 Ca 0.20 -0.12 -0.14 0.00 -1.06 0.00 0.00 60.65 59.54 1ri9 h LYS 11 Cb 0.11 -0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 31.74 1ri9 h LYS 11 CO -0.02 0.56 -0.31 -0.44 -2.06 0.00 0.00 179.45 177.18 1ri9 h ASP 12 N 0.31 0.94 0.15 0.86 3.32 -0.70 -0.75 116.42 120.56 1ri9 h ASP 12 Ca 0.05 -0.45 -0.01 0.00 0.02 0.00 0.00 57.03 56.65 1ri9 h ASP 12 Cb 0.58 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.87 1ri9 h ASP 12 CO 0.04 1.19 -0.07 0.15 -1.72 0.00 0.00 179.24 178.83 1ri9 h PHE 13 N 0.71 -0.19 -0.01 4.55 3.57 -0.77 -2.92 116.94 121.88 1ri9 h PHE 13 Ca 0.07 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.57 1ri9 h PHE 13 Cb 0.89 0.06 -0.00 0.00 2.79 0.00 0.00 35.95 39.70 1ri9 h PHE 13 CO 0.06 0.16 0.01 -0.09 -2.23 0.00 0.00 178.31 176.22 1ri9 h ARG 14 N -0.56 0.00 0.40 1.11 2.43 -0.92 2.13 114.38 118.97 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 0.43 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.95 1ri9 h ARG 14 CO 0.03 0.00 -0.47 -0.22 -1.51 0.00 0.00 179.97 177.80 1ri9 h LYS 15 N 0.00 -0.87 0.03 0.20 3.11 -0.93 0.43 116.57 118.54 1ri9 h LYS 15 Ca 0.01 0.06 -0.26 0.00 -2.81 0.00 0.00 60.65 57.64 1ri9 h LYS 15 Cb 0.02 0.20 -0.03 0.00 -1.00 0.00 0.00 32.23 31.42 1ri9 h LYS 15 CO -0.00 -0.58 -1.37 -0.22 -2.81 0.00 0.00 179.45 174.47 1ri9 h LYS 16 N -0.90 0.07 -1.00 1.90 1.63 -1.40 -3.28 116.57 113.60 1ri9 h LYS 16 Ca -0.04 -0.12 -0.20 0.00 -0.85 0.00 0.00 60.65 59.43 1ri9 h LYS 16 Cb 0.81 0.04 -0.12 0.00 -0.60 0.00 0.00 32.23 32.36 1ri9 h LYS 16 CO -0.11 0.87 0.26 1.19 -3.45 0.00 0.00 179.45 178.22 1ri9 n PHE 17 N -3.28 1.22 0.00 1.91 3.01 0.72 -4.62 117.46 116.42 1ri9 n PHE 17 Ca -0.10 -1.03 0.00 0.00 1.01 0.00 0.00 57.45 57.33 1ri9 n PHE 17 Cb 1.00 -0.53 0.00 0.00 -0.01 0.00 0.00 39.48 39.95 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 -0.15 0.00 -1.93 -1.08 4.76 0.15 -4.40 118.16 115.51 1ri9 n LYS 18 Ca 0.24 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 55.26 1ri9 n LYS 18 Cb 0.97 -0.85 -0.03 0.00 -1.84 0.00 0.00 35.03 33.28 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 -0.22 2.02 -0.59 2.13 5.04 -1.26 -4.95 117.35 119.51 1ri9 s TYR 19 Ca 0.00 0.14 -0.15 0.00 -2.44 0.00 0.00 57.07 54.61 1ri9 s TYR 19 Cb 0.00 -3.98 0.15 0.00 0.35 0.00 0.00 41.96 38.47 1ri9 s TYR 19 CO 0.00 -4.12 0.54 -0.51 -1.34 0.00 0.00 175.55 170.12 1ri9 s ASP 20 N 3.18 6.27 0.00 4.32 1.11 -1.26 -4.99 116.67 125.30 1ri9 s ASP 20 Ca 0.76 -1.99 0.00 0.00 0.18 0.00 0.00 52.55 51.50 1ri9 s ASP 20 Cb -0.37 -2.20 0.00 0.00 1.07 0.00 0.00 42.92 41.42 1ri9 s ASP 20 CO 0.32 -0.79 0.00 0.61 1.18 0.00 0.00 175.17 176.50 1ri9 n GLY 21 N 4.96 3.16 3.27 0.21 0.00 -1.26 -5.11 105.19 110.43 1ri9 n GLY 21 Ca -0.08 -1.36 -0.44 0.00 0.00 0.00 0.00 46.02 44.13 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 -1.90 3.21 -0.40 1.61 2.12 -1.26 -5.02 118.70 117.05 1ri9 s GLU 22 Ca 0.00 -2.28 -0.28 0.00 0.36 0.00 0.00 54.97 52.77 1ri9 s GLU 22 Cb 0.00 -4.24 -0.02 0.00 0.26 0.00 0.00 34.13 30.14 1ri9 s GLU 22 CO 0.00 -1.27 1.78 0.42 -0.54 0.00 0.00 175.26 175.65 1ri9 s ILE 23 N 0.48 3.49 -0.26 -3.70 1.01 -1.26 -4.86 121.20 116.10 1ri9 s ILE 23 Ca 0.14 0.46 -0.06 0.00 0.00 0.00 0.00 60.65 61.19 1ri9 s ILE 23 Cb -0.17 -3.76 0.13 0.00 0.01 0.00 0.00 42.46 38.67 1ri9 s ILE 23 CO -0.05 -0.55 0.53 -0.60 0.00 0.00 0.00 174.94 174.26 1ri9 s ARG 24 N 5.93 0.46 -0.56 2.79 3.00 -1.26 -5.10 118.95 124.21 1ri9 s ARG 24 Ca 0.75 1.11 -0.26 0.00 -1.00 0.00 0.00 55.73 56.33 1ri9 s ARG 24 Cb -0.19 0.46 -0.04 0.00 0.00 0.00 0.00 34.95 35.17 1ri9 s ARG 24 CO 0.31 -0.35 2.11 0.08 0.00 0.00 0.00 175.30 177.44 1ri9 s VAL 25 N 2.75 3.20 -0.20 7.11 1.01 -1.26 -4.54 120.40 128.47 1ri9 s VAL 25 Ca 0.03 0.11 -0.19 0.00 0.00 0.00 0.00 61.98 61.93 1ri9 s VAL 25 Cb -0.13 -3.53 -0.20 0.00 0.00 0.00 0.00 36.38 32.52 1ri9 s VAL 25 CO -0.17 -0.51 0.22 -0.11 0.00 0.00 0.00 175.10 174.52 1ri9 n LEU 26 N 14.19 1.98 -3.75 3.92 0.00 -1.23 -4.73 117.00 127.38 1ri9 n LEU 26 Ca 0.28 0.39 -0.29 0.00 0.00 0.00 0.00 56.01 56.39 1ri9 n LEU 26 Cb 0.53 -0.99 -0.13 0.00 0.00 0.00 0.00 43.42 42.84 1ri9 n LEU 26 CO 0.71 0.37 -0.20 -0.72 0.00 0.00 0.00 177.39 177.55 1ri9 s TYR 27 N -2.40 2.41 -0.37 1.96 1.13 -1.25 -5.07 117.35 113.76 1ri9 s TYR 27 Ca -0.28 -2.73 -0.29 0.00 -1.41 0.00 0.00 57.07 52.36 1ri9 s TYR 27 Cb 0.06 -2.10 -0.00 0.00 -1.10 0.00 0.00 41.96 38.82 1ri9 s TYR 27 CO 0.61 -0.73 1.58 -1.54 -2.51 0.00 0.00 175.55 172.96 1ri9 s SER 28 N -0.18 6.15 0.47 -0.18 1.04 -1.26 -4.08 113.70 115.67 1ri9 s SER 28 Ca 0.21 1.04 -0.04 0.00 0.48 0.00 0.00 55.95 57.64 1ri9 s SER 28 Cb -0.17 -2.53 -0.03 0.00 0.10 0.00 0.00 66.02 63.39 1ri9 s SER 28 CO -0.06 -1.54 0.75 0.28 0.98 0.00 0.00 173.24 173.65 1ri9 s THR 29 N 6.02 4.73 -0.14 2.02 -1.32 -1.23 -4.75 115.64 120.98 1ri9 s THR 29 Ca 0.69 0.00 -0.08 0.00 -1.21 0.00 0.00 61.69 61.10 1ri9 s THR 29 Cb -0.18 -3.79 -0.04 0.00 -1.51 0.00 0.00 72.50 66.98 1ri9 s THR 29 CO 0.33 -0.72 0.14 -0.75 -2.21 0.00 0.00 174.62 171.42 1ri9 s LYS 30 N -4.68 3.65 -0.08 7.08 2.36 -1.26 -3.36 119.74 123.45 1ri9 s LYS 30 Ca 0.47 -0.14 -0.30 0.00 -2.55 0.00 0.00 55.97 53.45 1ri9 s LYS 30 Cb -0.10 -3.25 -0.04 0.00 -1.05 0.00 0.00 37.83 33.39 1ri9 s LYS 30 CO 0.43 0.65 1.36 0.08 1.55 0.00 0.00 175.35 179.42 1ri9 s VAL 31 N -0.65 4.00 1.06 4.02 1.01 0.50 -4.15 120.40 126.19 1ri9 s VAL 31 Ca 0.13 1.28 -0.18 0.00 0.00 0.00 0.00 61.98 63.22 1ri9 s VAL 31 Cb -0.12 -3.82 0.24 0.00 0.00 0.00 0.00 36.38 32.68 1ri9 s VAL 31 CO 0.03 -0.07 1.25 0.28 0.00 0.00 0.00 175.10 176.59 1ri9 s THR 32 N 3.11 1.84 -0.65 3.92 -1.32 -1.26 -1.26 115.64 120.03 1ri9 s THR 32 Ca 0.61 0.00 0.25 0.00 -1.21 0.00 0.00 61.69 61.34 1ri9 s THR 32 Cb -0.27 -2.82 0.28 0.00 -1.51 0.00 0.00 72.50 68.19 1ri9 s THR 32 CO 0.22 0.00 1.70 0.00 -2.21 0.00 0.00 174.62 174.32 1ri9 h THR 33 N -2.03 0.00 -0.53 5.08 1.03 -1.93 1.79 112.91 116.33 1ri9 h THR 33 Ca -0.44 -0.62 0.00 0.00 -0.01 0.00 0.00 66.41 65.34 1ri9 h THR 33 Cb 1.25 1.59 0.00 0.00 -1.07 0.00 0.00 68.15 69.92 1ri9 h THR 33 CO 0.34 0.00 0.00 -0.24 -0.01 0.00 0.00 175.52 175.61 1ri9 n SER 34 N -2.47 3.60 -4.50 0.00 2.88 -1.26 -4.72 113.62 107.15 1ri9 n SER 34 Ca 0.05 -2.25 -0.29 0.00 -1.33 0.00 0.00 58.87 55.05 1ri9 n SER 34 Cb 0.46 -0.47 0.19 0.00 -0.75 0.00 0.00 64.21 63.63 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 -1.62 1.92 -0.15 2.46 -1.16 -1.14 -4.68 121.20 116.83 1ri9 s ILE 35 Ca 0.39 0.00 -0.29 0.00 -0.51 0.00 0.00 60.65 60.24 1ri9 s ILE 35 Cb 0.24 -2.53 -0.03 0.00 0.61 0.00 0.00 42.46 40.75 1ri9 s ILE 35 CO 0.21 0.00 1.55 0.28 -2.81 0.00 0.00 174.94 174.17 1ri9 s THR 36 N -3.03 3.79 -0.01 4.00 -1.32 -1.25 -4.59 115.64 113.22 1ri9 s THR 36 Ca 0.67 0.93 0.01 0.00 -1.21 0.00 0.00 61.69 62.09 1ri9 s THR 36 Cb -0.16 -3.69 -0.01 0.00 -1.51 0.00 0.00 72.50 67.13 1ri9 s THR 36 CO 0.57 -0.18 0.01 -0.24 -2.21 0.00 0.00 174.62 172.57 1ri9 n SER 37 N 7.54 4.75 -0.11 8.08 2.88 -1.26 -4.38 113.62 131.11 1ri9 n SER 37 Ca 0.17 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.49 1ri9 n SER 37 Cb 0.44 0.64 -0.08 0.00 -0.75 0.00 0.00 64.21 64.46 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 0.48 -2.07 -1.46 2.85 -1.26 -4.94 118.16 109.84 1ri9 n LYS 38 Ca -0.01 0.19 -0.42 0.00 -1.05 0.00 0.00 58.31 57.01 1ri9 n LYS 38 Cb 0.42 -1.31 -0.03 0.00 -0.65 0.00 0.00 35.03 33.46 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 -2.41 4.23 -0.07 -1.58 2.47 -1.26 -4.99 119.74 116.14 1ri9 s LYS 39 Ca -0.30 2.15 -0.03 0.00 -1.56 0.00 0.00 55.97 56.22 1ri9 s LYS 39 Cb 0.11 -3.66 0.04 0.00 -1.46 0.00 0.00 37.83 32.86 1ri9 s LYS 39 CO 0.41 -0.69 0.16 -1.58 0.16 0.00 0.00 175.35 173.80 1ri9 s TRP 40 N 2.80 -0.18 0.28 4.03 0.23 -1.26 -4.86 118.94 119.98 1ri9 s TRP 40 Ca 0.69 0.50 0.12 0.00 -2.03 0.00 0.00 56.10 55.38 1ri9 s TRP 40 Cb -0.35 -0.05 -0.05 0.00 0.03 0.00 0.00 33.47 33.05 1ri9 s TRP 40 CO 0.29 -0.16 -0.18 0.20 0.96 0.00 0.00 176.95 178.06 1ri9 s GLY 41 N 1.02 1.87 0.36 0.98 0.00 -1.26 -4.98 107.32 105.31 1ri9 s GLY 41 Ca -0.08 -1.86 0.07 0.00 0.00 0.00 0.00 44.72 42.85 1ri9 s GLY 41 CO -0.05 -1.95 1.94 -0.91 0.00 0.00 0.00 173.10 172.13 1ri9 h THR 42 N 2.24 0.97 -0.47 0.90 1.35 -2.00 0.28 112.91 116.18 1ri9 h THR 42 Ca -0.40 -0.25 0.00 0.00 -0.55 0.00 0.00 66.41 65.21 1ri9 h THR 42 Cb 1.26 0.18 0.00 0.00 -1.73 0.00 0.00 68.15 67.86 1ri9 h THR 42 CO 0.60 0.13 0.00 0.54 -0.25 0.00 0.00 175.52 176.54 1ri9 n ARG 43 N -4.49 2.34 -3.85 4.72 1.74 -1.26 -4.92 116.66 110.95 1ri9 n ARG 43 Ca 0.12 -2.06 -0.21 0.00 -0.77 0.00 0.00 57.85 54.93 1ri9 n ARG 43 Cb 0.29 -1.48 -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 -1.25 5.60 0.16 0.55 -1.08 0.98 -0.20 116.67 121.43 1ri9 s ASP 44 Ca 0.39 -0.30 0.00 0.00 -0.52 0.00 0.00 52.55 52.12 1ri9 s ASP 44 Cb 0.21 -1.24 -0.04 0.00 -1.46 0.00 0.00 42.92 40.39 1ri9 s ASP 44 CO 0.29 -0.25 0.33 -0.22 0.52 0.00 0.00 175.17 175.84 1ri9 s LEU 45 N -3.99 4.28 -0.22 -1.34 2.96 -1.18 -4.58 118.68 114.61 1ri9 s LEU 45 Ca 0.39 0.32 0.01 0.00 -0.22 0.00 0.00 54.13 54.63 1ri9 s LEU 45 Cb -0.07 -3.06 0.30 0.00 0.50 0.00 0.00 46.19 43.85 1ri9 s LEU 45 CO 0.27 0.02 1.51 1.67 -1.32 0.00 0.00 176.35 178.50 1ri9 n GLN 46 N -0.45 1.61 -0.90 1.98 7.27 -1.26 -4.81 117.38 120.82 1ri9 n GLN 46 Ca -0.05 -1.41 -0.31 0.00 0.07 0.00 0.00 57.00 55.29 1ri9 n GLN 46 Cb 0.53 -1.55 0.14 0.00 2.41 0.00 0.00 30.24 31.77 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 -1.63 2.51 0.20 1.69 -7.23 -1.26 -5.04 120.40 109.64 1ri9 s VAL 47 Ca 0.27 0.16 0.10 0.00 -1.81 0.00 0.00 61.98 60.70 1ri9 s VAL 47 Cb 0.22 -2.36 -0.04 0.00 0.56 0.00 0.00 36.38 34.76 1ri9 s VAL 47 CO 0.04 -0.21 -0.11 -0.54 -0.31 0.00 0.00 175.10 173.97 1ri9 s LYS 48 N -4.74 2.00 -0.03 4.82 3.01 -1.26 -4.62 119.74 118.92 1ri9 s LYS 48 Ca 0.65 -1.36 -0.30 0.00 -1.01 0.00 0.00 55.97 53.95 1ri9 s LYS 48 Cb -0.21 -2.09 -0.04 0.00 -1.01 0.00 0.00 37.83 34.48 1ri9 s LYS 48 CO 0.58 0.41 1.21 -1.25 0.51 0.00 0.00 175.35 176.81 1ri9 s PRO 49 N -2.99 4.36 0.00 -1.68 0.04 -1.26 -3.02 135.00 130.45 1ri9 s PRO 49 Ca 0.26 1.70 0.00 0.00 0.04 0.00 0.00 61.00 63.00 1ri9 s PRO 49 Cb -0.08 -3.53 0.00 0.00 0.04 0.00 0.00 34.50 30.93 1ri9 s PRO 49 CO 0.15 -0.42 0.00 0.41 0.04 0.00 0.00 177.00 177.18 1ri9 n GLY 50 N 3.36 1.02 3.79 0.56 0.00 0.61 -4.56 105.19 109.97 1ri9 n GLY 50 Ca 0.11 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.34 2.27 -0.17 1.61 8.01 -0.80 -4.91 118.70 124.38 1ri9 s GLU 51 Ca 0.00 -1.87 -0.06 0.00 0.01 0.00 0.00 54.97 53.05 1ri9 s GLU 51 Cb 0.00 -2.03 -0.04 0.00 -4.31 0.00 0.00 34.13 27.75 1ri9 s GLU 51 CO 0.00 -0.24 0.04 -1.54 0.01 0.00 0.00 175.26 173.53 1ri9 s SER 52 N -4.00 5.46 0.01 -0.19 1.04 -1.26 0.19 113.70 114.94 1ri9 s SER 52 Ca 0.38 0.05 -0.01 0.00 0.48 0.00 0.00 55.95 56.86 1ri9 s SER 52 Cb 0.02 -1.90 -0.01 0.00 0.10 0.00 0.00 66.02 64.23 1ri9 s SER 52 CO 0.22 0.19 0.01 -1.48 0.98 0.00 0.00 173.24 173.16 1ri9 s LEU 53 N 0.24 2.04 -0.00 2.42 0.05 -1.21 -4.88 118.68 117.34 1ri9 s LEU 53 Ca 0.02 -0.27 -0.30 0.00 0.05 0.00 0.00 54.13 53.64 1ri9 s LEU 53 Cb -0.13 0.16 -0.03 0.00 -2.05 0.00 0.00 46.19 44.14 1ri9 s LEU 53 CO 0.01 -0.20 1.04 -1.61 -0.55 0.00 0.00 176.35 175.04 1ri9 s GLU 54 N -0.92 4.50 -0.21 1.48 2.02 -1.23 -3.48 118.70 120.86 1ri9 s GLU 54 Ca -0.10 1.51 -0.11 0.00 0.02 0.00 0.00 54.97 56.29 1ri9 s GLU 54 Cb -0.06 -3.45 -0.05 0.00 0.10 0.00 0.00 34.13 30.67 1ri9 s GLU 54 CO -0.00 -0.15 0.18 0.08 0.02 0.00 0.00 175.26 175.39 1ri9 s VAL 55 N 1.22 5.36 0.00 2.63 1.01 -1.26 -1.19 120.40 128.16 1ri9 s VAL 55 Ca 0.53 0.27 0.00 0.00 0.00 0.00 0.00 61.98 62.78 1ri9 s VAL 55 Cb -0.23 -3.52 0.00 0.00 0.00 0.00 0.00 36.38 32.63 1ri9 s VAL 55 CO 0.27 0.38 0.00 -0.38 0.00 0.00 0.00 175.10 175.36 1ri9 n ILE 56 N 3.93 0.00 -3.50 2.22 5.41 0.12 -3.53 119.36 124.01 1ri9 n ILE 56 Ca -0.14 0.00 -0.27 0.00 1.00 0.00 0.00 62.75 63.33 1ri9 n ILE 56 Cb 0.52 0.00 -0.03 0.00 -0.71 0.00 0.00 39.64 39.42 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 3.22 3.56 -0.04 0.38 -1.52 -1.26 -4.63 119.66 119.37 1ri9 s GLN 57 Ca 0.00 -0.21 -0.30 0.00 -1.95 0.00 0.00 55.36 52.91 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 0.28 1.63 0.95 -0.25 0.00 0.00 175.29 177.90 1ri9 s THR 58 N -2.04 3.53 0.00 -0.19 -4.23 -1.26 -3.57 115.64 107.89 1ri9 s THR 58 Ca 0.41 0.71 0.00 0.00 -1.18 0.00 0.00 61.69 61.63 1ri9 s THR 58 Cb -0.11 -3.46 0.00 0.00 1.34 0.00 0.00 72.50 70.28 1ri9 s THR 58 CO 0.31 -0.05 0.73 0.41 -0.54 0.00 0.00 174.62 175.48 1ri9 n THR 59 N 5.34 0.00 0.00 3.99 -1.04 0.16 -4.80 114.28 117.92 1ri9 n THR 59 Ca 0.17 1.23 0.00 0.00 -2.04 0.00 0.00 64.05 63.41 1ri9 n THR 59 Cb 0.43 -2.07 0.00 0.00 -1.82 0.00 0.00 70.33 66.87 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 -1.43 0.00 0.02 8.00 2.03 -1.26 -5.02 116.55 118.89 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 1.02 -3.43 1.67 8.00 -1.26 -4.88 116.55 117.67 1ri9 n ASP 61 Ca 0.00 0.14 -0.28 0.00 0.71 0.00 0.00 54.79 55.36 1ri9 n ASP 61 Cb 0.00 -0.33 -0.07 0.00 -0.02 0.00 0.00 41.12 40.70 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 -3.53 2.59 -3.69 -3.53 -1.04 -1.26 -5.01 114.28 98.82 1ri9 n THR 62 Ca -0.03 -5.29 -0.10 0.00 -2.04 0.00 0.00 64.05 56.58 1ri9 n THR 62 Cb 0.19 -2.06 -0.10 0.00 -1.82 0.00 0.00 70.33 66.53 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 -2.56 0.44 -0.14 -2.82 2.47 -1.26 -3.30 119.74 112.56 1ri9 s LYS 63 Ca 0.40 0.83 0.02 0.00 -1.56 0.00 0.00 55.97 55.66 1ri9 s LYS 63 Cb 0.15 0.01 0.00 0.00 -1.46 0.00 0.00 37.83 36.53 1ri9 s LYS 63 CO -0.01 -0.15 -0.19 0.14 0.16 0.00 0.00 175.35 175.30 1ri9 s VAL 64 N 1.37 2.41 -0.11 4.02 -7.23 -1.01 -0.67 120.40 119.18 1ri9 s VAL 64 Ca -0.09 -0.87 -0.22 0.00 -1.81 0.00 0.00 61.98 58.99 1ri9 s VAL 64 Cb -0.08 -1.98 -0.03 0.00 0.56 0.00 0.00 36.38 34.85 1ri9 s VAL 64 CO -0.13 0.54 0.66 -0.22 -0.31 0.00 0.00 175.10 175.64 1ri9 s LEU 65 N 0.66 4.27 0.35 1.32 2.96 -1.23 -2.03 118.68 124.98 1ri9 s LEU 65 Ca -0.09 1.06 -0.07 0.00 -0.22 0.00 0.00 54.13 54.81 1ri9 s LEU 65 Cb -0.16 -2.99 -0.05 0.00 0.50 0.00 0.00 46.19 43.48 1ri9 s LEU 65 CO 0.02 -0.15 0.66 0.00 -1.32 0.00 0.00 176.35 175.56 1ri9 s ARG 67 N -3.83 0.32 -0.04 0.00 3.52 -0.33 -1.74 118.95 116.86 1ri9 s ARG 67 Ca 0.47 -0.07 0.06 0.00 -0.13 0.00 0.00 55.73 56.06 1ri9 s ARG 67 Cb -0.10 -0.37 -0.01 0.00 -1.56 0.00 0.00 34.95 32.91 1ri9 s ARG 67 CO 0.32 0.01 -0.23 0.54 -0.81 0.00 0.00 175.30 175.13 1ri9 s ASN 68 N 0.28 2.80 0.00 -2.12 4.22 -0.93 -3.53 114.94 115.66 1ri9 s ASN 68 Ca -0.03 -0.45 0.00 0.00 -2.14 0.00 0.00 52.86 50.24 1ri9 s ASN 68 Cb -0.06 -0.55 0.00 0.00 1.28 0.00 0.00 41.25 41.92 1ri9 s ASN 68 CO -0.01 0.25 0.89 1.21 -2.04 0.00 0.00 177.10 177.41 1ri9 n GLU 69 N 2.76 0.00 0.00 3.55 0.00 -1.26 -1.37 120.64 124.32 1ri9 n GLU 69 Ca -0.17 0.40 0.02 0.00 0.00 0.00 0.00 57.16 57.41 1ri9 n GLU 69 Cb 0.52 -1.54 0.12 0.00 0.00 0.00 0.00 31.44 30.54 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 -1.39 0.06 -0.64 5.31 4.07 -1.26 -4.75 120.64 122.03 1ri9 n GLU 70 Ca 0.00 0.27 0.00 0.00 -0.06 0.00 0.00 57.16 57.37 1ri9 n GLU 70 Cb 0.04 -1.50 0.00 0.00 -0.06 0.00 0.00 31.44 29.92 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 -0.90 0.67 3.36 8.31 0.00 -0.47 -5.03 105.19 111.13 1ri9 n GLY 71 Ca 0.02 -0.05 -0.22 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.43 1.36 0.39 1.61 2.20 -1.20 -3.75 119.74 119.92 1ri9 s LYS 72 Ca 0.00 -1.50 0.07 0.00 -0.36 0.00 0.00 55.97 54.18 1ri9 s LYS 72 Cb 0.00 -1.39 -0.07 0.00 -1.51 0.00 0.00 37.83 34.85 1ri9 s LYS 72 CO 0.00 0.27 -0.01 0.71 -0.36 0.00 0.00 175.35 175.96 1ri9 s TYR 73 N -2.26 2.45 0.14 4.03 1.51 -1.26 -2.18 117.35 119.77 1ri9 s TYR 73 Ca 0.19 -0.65 -0.21 0.00 -1.01 0.00 0.00 57.07 55.40 1ri9 s TYR 73 Cb -0.05 -1.64 0.06 0.00 -0.11 0.00 0.00 41.96 40.22 1ri9 s TYR 73 CO 0.08 0.45 0.53 0.20 -1.11 0.00 0.00 175.55 175.71 1ri9 s GLY 74 N -3.67 -0.50 0.10 0.71 0.00 -0.71 -4.94 107.32 98.33 1ri9 s GLY 74 Ca 0.34 0.35 0.03 0.00 0.00 0.00 0.00 44.72 45.44 1ri9 s GLY 74 CO 0.17 0.04 0.14 -0.19 0.00 0.00 0.00 173.10 173.27 1ri9 s TYR 75 N -3.62 3.28 -0.07 1.90 2.02 0.72 0.52 117.35 122.10 1ri9 s TYR 75 Ca 0.01 0.09 -0.03 0.00 -0.37 0.00 0.00 57.07 56.78 1ri9 s TYR 75 Cb -0.00 -1.63 0.04 0.00 -0.40 0.00 0.00 41.96 39.97 1ri9 s TYR 75 CO -0.11 0.53 0.14 0.08 -1.57 0.00 0.00 175.55 174.62 1ri9 s VAL 76 N -1.54 -0.12 0.20 0.71 1.01 -0.86 -3.13 120.40 116.68 1ri9 s VAL 76 Ca 0.31 0.25 -0.30 0.00 0.00 0.00 0.00 61.98 62.24 1ri9 s VAL 76 Cb -0.12 -0.24 -0.08 0.00 0.00 0.00 0.00 36.38 35.94 1ri9 s VAL 76 CO 0.24 0.10 1.14 -0.22 0.00 0.00 0.00 175.10 176.37 1ri9 s LEU 77 N 1.55 4.48 0.62 3.92 0.20 -1.26 -2.40 118.68 125.79 1ri9 s LEU 77 Ca -0.05 2.19 0.33 0.00 0.69 0.00 0.00 54.13 57.29 1ri9 s LEU 77 Cb -0.12 -3.61 1.78 0.00 -0.43 0.00 0.00 46.19 43.81 1ri9 s LEU 77 CO -0.06 -0.27 2.00 0.08 -0.29 0.00 0.00 176.35 177.81 1ri9 h ARG 78 N 4.89 0.00 -0.29 1.98 -0.00 -1.91 -2.38 114.38 116.68 1ri9 h ARG 78 Ca -0.45 0.00 0.05 0.00 -0.00 0.00 0.00 59.98 59.58 1ri9 h ARG 78 Cb 1.21 0.00 -0.08 0.00 -0.00 0.00 0.00 29.97 31.10 1ri9 h ARG 78 CO 0.72 0.00 -0.48 1.03 -0.00 0.00 0.00 179.97 181.24 1ri9 h SER 79 N 0.00 -1.55 -3.67 0.08 0.87 -1.90 -3.24 113.55 104.15 1ri9 h SER 79 Ca 0.00 0.21 -0.67 0.00 -1.23 0.00 0.00 61.79 60.10 1ri9 h SER 79 Cb 0.43 0.64 -0.38 0.00 -0.44 0.00 0.00 62.40 62.65 1ri9 h SER 79 CO 0.00 -0.41 -0.37 -0.72 -0.53 0.00 0.00 176.83 174.79 1ri9 s TYR 80 N -5.79 3.57 0.18 2.24 -0.85 -0.89 -5.02 117.35 110.77 1ri9 s TYR 80 Ca -0.15 -3.05 -0.23 0.00 -0.52 0.00 0.00 57.07 53.12 1ri9 s TYR 80 Cb 0.10 -3.03 0.07 0.00 0.38 0.00 0.00 41.96 39.48 1ri9 s TYR 80 CO 0.63 -0.72 1.00 -1.17 -1.52 0.00 0.00 175.55 173.78 1ri9 s LEU 81 N -0.88 -0.07 0.87 -3.49 0.20 -1.22 -3.94 118.68 110.15 1ri9 s LEU 81 Ca 0.22 -0.57 -0.13 0.00 0.69 0.00 0.00 54.13 54.34 1ri9 s LEU 81 Cb -0.13 2.13 0.12 0.00 -0.43 0.00 0.00 46.19 47.88 1ri9 s LEU 81 CO -0.09 -0.97 1.21 0.00 -0.29 0.00 0.00 176.35 176.22 1ri9 s ALA 82 N -2.63 2.43 -1.63 5.97 0.00 -1.26 -4.86 121.76 119.78 1ri9 s ALA 82 Ca 0.17 -0.79 0.00 0.00 0.00 0.00 0.00 51.96 51.34 1ri9 s ALA 82 Cb -0.02 -2.92 0.00 0.00 0.00 0.00 0.00 23.12 20.19 1ri9 s ALA 82 CO 0.04 -1.96 0.41 -0.25 0.00 0.00 0.00 175.76 173.99