#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ri9 h LYS 8 N 0.00 0.00 0.00 5.31 2.10 -1.92 -3.18 116.57 118.88 1ri9 h LYS 8 Ca 0.00 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.63 1ri9 h LYS 8 Cb 0.00 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1ri9 h LYS 8 CO 0.00 0.00 -0.10 1.49 -2.00 0.00 0.00 179.45 178.84 1ri9 h GLU 9 N 0.00 0.00 -0.93 0.07 4.57 -1.96 -2.02 114.58 114.31 1ri9 h GLU 9 Ca 0.00 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 1ri9 h GLU 9 Cb 0.76 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.31 1ri9 h GLU 9 CO 0.00 0.10 0.55 1.49 -1.18 0.00 0.00 179.01 179.97 1ri9 h GLU 10 N 0.00 1.28 -0.05 1.92 4.22 -1.64 0.16 114.58 120.46 1ri9 h GLU 10 Ca -0.00 -0.12 -0.06 0.00 0.08 0.00 0.00 59.36 59.25 1ri9 h GLU 10 Cb 0.26 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1ri9 h GLU 10 CO 0.01 0.90 -0.26 0.87 -2.18 0.00 0.00 179.01 178.35 1ri9 h LYS 11 N 1.29 0.09 0.01 1.92 1.57 -1.59 -1.45 116.57 118.42 1ri9 h LYS 11 Ca 0.33 -0.03 -0.20 0.00 -1.87 0.00 0.00 60.65 58.89 1ri9 h LYS 11 Cb -0.04 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 1ri9 h LYS 11 CO -0.06 0.35 -0.89 0.22 -0.57 0.00 0.00 179.45 178.50 1ri9 h ASP 12 N 0.08 0.22 0.21 0.86 1.82 -1.15 -2.78 116.42 115.68 1ri9 h ASP 12 Ca 0.01 -0.18 -0.01 0.00 -0.39 0.00 0.00 57.03 56.46 1ri9 h ASP 12 Cb 0.51 -0.07 0.00 0.00 0.68 0.00 0.00 39.33 40.45 1ri9 h ASP 12 CO 0.04 1.00 -0.10 0.15 -1.61 0.00 0.00 179.24 178.71 1ri9 h PHE 13 N 0.09 -0.26 -0.00 0.28 3.57 0.07 -2.83 116.94 117.86 1ri9 h PHE 13 Ca -0.04 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.45 1ri9 h PHE 13 Cb 1.52 0.09 -0.00 0.00 2.79 0.00 0.00 35.95 40.35 1ri9 h PHE 13 CO 0.03 0.04 0.00 0.07 -2.23 0.00 0.00 178.31 176.22 1ri9 h ARG 14 N -0.56 0.00 0.41 1.11 0.11 -1.37 2.54 114.38 116.62 1ri9 h ARG 14 Ca -0.03 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.04 1ri9 h ARG 14 Cb 0.41 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.47 1ri9 h ARG 14 CO 0.05 0.00 -0.49 -0.22 0.10 0.00 0.00 179.97 179.41 1ri9 h LYS 15 N 0.00 -0.89 0.09 0.08 3.11 -1.24 0.92 116.57 118.64 1ri9 h LYS 15 Ca 0.00 0.06 -0.29 0.00 -2.81 0.00 0.00 60.65 57.61 1ri9 h LYS 15 Cb 0.01 0.20 -0.02 0.00 -1.00 0.00 0.00 32.23 31.43 1ri9 h LYS 15 CO -0.00 -0.59 -1.49 -0.22 -2.81 0.00 0.00 179.45 174.33 1ri9 h LYS 16 N -0.92 0.18 -0.96 1.90 1.63 -1.36 -3.28 116.57 113.76 1ri9 h LYS 16 Ca -0.04 -0.31 -0.15 0.00 -0.85 0.00 0.00 60.65 59.29 1ri9 h LYS 16 Cb 0.83 0.12 -0.09 0.00 -0.60 0.00 0.00 32.23 32.48 1ri9 h LYS 16 CO -0.11 1.02 0.20 1.19 -3.45 0.00 0.00 179.45 178.30 1ri9 n PHE 17 N -3.39 1.13 0.00 1.91 3.01 0.85 -4.60 117.46 116.37 1ri9 n PHE 17 Ca -0.15 -0.85 0.00 0.00 1.01 0.00 0.00 57.45 57.47 1ri9 n PHE 17 Cb 1.03 -0.46 0.00 0.00 -0.01 0.00 0.00 39.48 40.04 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 -0.05 0.00 -1.83 -1.08 0.00 0.32 -4.44 118.16 111.07 1ri9 n LYS 18 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 58.31 58.10 1ri9 n LYS 18 Cb 0.88 -0.87 -0.03 0.00 0.00 0.00 0.00 35.03 35.02 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 -0.10 1.89 -0.59 5.64 5.04 -1.26 -4.94 117.35 123.03 1ri9 s TYR 19 Ca 0.00 -0.02 -0.14 0.00 -2.44 0.00 0.00 57.07 54.47 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 0.53 0.34 -1.34 0.00 0.00 175.55 170.51 1ri9 s ASP 20 N 3.35 6.22 0.00 4.32 2.15 -1.26 -5.00 116.67 126.46 1ri9 s ASP 20 Ca 0.80 -2.00 0.00 0.00 0.43 0.00 0.00 52.55 51.77 1ri9 s ASP 20 Cb -0.40 -2.18 0.00 0.00 -0.30 0.00 0.00 42.92 40.04 1ri9 s ASP 20 CO 0.35 -0.77 0.00 0.61 -0.17 0.00 0.00 175.17 175.19 1ri9 n GLY 21 N 4.92 3.24 3.28 2.66 0.00 -1.26 -5.11 105.19 112.92 1ri9 n GLY 21 Ca -0.07 -1.40 -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 -0.54 0.00 0.00 0.00 173.32 172.78 1ri9 s GLU 22 N -1.94 3.30 -0.33 1.61 0.41 -1.26 -5.02 118.70 115.47 1ri9 s GLU 22 Ca 0.00 -2.36 -0.28 0.00 -0.41 0.00 0.00 54.97 51.92 1ri9 s GLU 22 Cb 0.00 -4.27 -0.02 0.00 -1.78 0.00 0.00 34.13 28.06 1ri9 s GLU 22 CO 0.00 -1.27 1.87 0.42 -0.49 0.00 0.00 175.26 175.79 1ri9 s ILE 23 N 0.33 3.40 -0.22 -1.63 1.01 -1.26 -4.90 121.20 117.93 1ri9 s ILE 23 Ca 0.16 0.40 -0.05 0.00 0.00 0.00 0.00 60.65 61.15 1ri9 s ILE 23 Cb -0.15 -3.56 0.11 0.00 0.01 0.00 0.00 42.46 38.87 1ri9 s ILE 23 CO -0.06 -0.37 0.42 -0.60 0.00 0.00 0.00 174.94 174.32 1ri9 s ARG 24 N 5.85 0.35 -0.55 2.79 3.00 -1.26 -5.10 118.95 124.03 1ri9 s ARG 24 Ca 0.82 0.88 -0.26 0.00 -1.00 0.00 0.00 55.73 56.17 1ri9 s ARG 24 Cb -0.23 0.09 -0.04 0.00 0.00 0.00 0.00 34.95 34.77 1ri9 s ARG 24 CO 0.33 -0.40 2.07 0.08 0.00 0.00 0.00 175.30 177.39 1ri9 s VAL 25 N 2.61 3.22 -0.21 7.11 1.01 -1.26 -4.60 120.40 128.28 1ri9 s VAL 25 Ca 0.04 0.13 -0.18 0.00 0.00 0.00 0.00 61.98 61.97 1ri9 s VAL 25 Cb -0.13 -3.56 -0.19 0.00 0.00 0.00 0.00 36.38 32.50 1ri9 s VAL 25 CO -0.14 -0.53 0.14 -0.11 0.00 0.00 0.00 175.10 174.46 1ri9 n LEU 26 N 13.85 1.98 -3.73 3.92 0.00 -1.24 -4.76 117.00 127.03 1ri9 n LEU 26 Ca 0.27 0.38 -0.29 0.00 0.00 0.00 0.00 56.01 56.36 1ri9 n LEU 26 Cb 0.53 -0.96 -0.13 0.00 0.00 0.00 0.00 43.42 42.86 1ri9 n LEU 26 CO 0.71 0.40 -0.23 -0.72 0.00 0.00 0.00 177.39 177.55 1ri9 s TYR 27 N -2.41 2.16 -0.35 1.96 1.13 -1.25 -5.08 117.35 113.51 1ri9 s TYR 27 Ca -0.30 -2.56 -0.29 0.00 -1.41 0.00 0.00 57.07 52.51 1ri9 s TYR 27 Cb 0.07 -1.98 -0.00 0.00 -1.10 0.00 0.00 41.96 38.95 1ri9 s TYR 27 CO 0.60 -0.76 1.54 -1.54 -2.51 0.00 0.00 175.55 172.88 1ri9 s SER 28 N 0.12 6.25 0.47 -0.18 1.04 -1.26 -4.08 113.70 116.06 1ri9 s SER 28 Ca 0.19 1.12 -0.04 0.00 0.48 0.00 0.00 55.95 57.70 1ri9 s SER 28 Cb -0.21 -2.53 -0.03 0.00 0.10 0.00 0.00 66.02 63.35 1ri9 s SER 28 CO -0.03 -1.45 0.75 0.28 0.98 0.00 0.00 173.24 173.78 1ri9 s THR 29 N 5.71 4.76 -0.13 2.02 -1.32 -1.23 -4.76 115.64 120.69 1ri9 s THR 29 Ca 0.68 0.03 -0.07 0.00 -1.21 0.00 0.00 61.69 61.12 1ri9 s THR 29 Cb -0.18 -3.80 -0.04 0.00 -1.51 0.00 0.00 72.50 66.97 1ri9 s THR 29 CO 0.32 -0.74 0.14 -0.75 -2.21 0.00 0.00 174.62 171.38 1ri9 s LYS 30 N -4.69 3.53 -0.23 7.08 2.36 -1.26 -3.41 119.74 123.12 1ri9 s LYS 30 Ca 0.47 -0.14 -0.29 0.00 -2.55 0.00 0.00 55.97 53.46 1ri9 s LYS 30 Cb -0.10 -3.22 -0.02 0.00 -1.05 0.00 0.00 37.83 33.44 1ri9 s LYS 30 CO 0.43 0.72 1.57 0.08 1.55 0.00 0.00 175.35 179.70 1ri9 s VAL 31 N -0.85 3.76 0.19 4.02 1.01 0.32 -3.81 120.40 125.05 1ri9 s VAL 31 Ca 0.14 0.86 -0.30 0.00 0.00 0.00 0.00 61.98 62.68 1ri9 s VAL 31 Cb -0.12 -3.77 -0.08 0.00 0.00 0.00 0.00 36.38 32.41 1ri9 s VAL 31 CO 0.03 -0.32 1.14 -0.89 0.00 0.00 0.00 175.10 175.07 1ri9 s THR 32 N 5.06 3.69 0.48 3.92 2.01 -1.26 -0.83 115.64 128.70 1ri9 s THR 32 Ca 0.69 1.47 0.08 0.00 0.31 0.00 0.00 61.69 64.24 1ri9 s THR 32 Cb -0.24 -3.94 0.08 0.00 0.01 0.00 0.00 72.50 68.41 1ri9 s THR 32 CO 0.28 0.26 1.17 0.00 -0.69 0.00 0.00 174.62 175.64 1ri9 h THR 33 N 3.65 0.00 -0.39 -0.82 1.03 -1.91 4.31 112.91 118.78 1ri9 h THR 33 Ca -0.45 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 65.95 1ri9 h THR 33 Cb 1.21 0.18 0.00 0.00 -1.07 0.00 0.00 68.15 68.47 1ri9 h THR 33 CO 0.72 0.00 0.00 -0.24 -0.01 0.00 0.00 175.52 175.99 1ri9 n SER 34 N -2.32 2.74 -4.33 0.00 2.88 -1.26 -4.60 113.62 106.73 1ri9 n SER 34 Ca -0.01 -2.18 -0.29 0.00 -1.33 0.00 0.00 58.87 55.06 1ri9 n SER 34 Cb 0.71 -0.39 0.20 0.00 -0.75 0.00 0.00 64.21 63.97 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 -1.63 1.85 -0.12 2.46 -1.16 1.42 -4.56 121.20 119.46 1ri9 s ILE 35 Ca 0.29 0.00 -0.29 0.00 -0.51 0.00 0.00 60.65 60.14 1ri9 s ILE 35 Cb 0.18 -2.58 -0.03 0.00 0.61 0.00 0.00 42.46 40.64 1ri9 s ILE 35 CO 0.16 0.00 1.45 0.28 -2.81 0.00 0.00 174.94 174.01 1ri9 s THR 36 N -3.11 3.96 -0.01 4.00 -1.32 -1.25 -4.61 115.64 113.29 1ri9 s THR 36 Ca 0.68 1.15 0.02 0.00 -1.21 0.00 0.00 61.69 62.33 1ri9 s THR 36 Cb -0.13 -3.76 -0.02 0.00 -1.51 0.00 0.00 72.50 67.07 1ri9 s THR 36 CO 0.56 -0.12 0.01 -1.54 -2.21 0.00 0.00 174.62 171.32 1ri9 n SER 37 N 6.94 4.55 -0.11 8.08 3.41 -1.26 -4.36 113.62 130.87 1ri9 n SER 37 Ca 0.16 0.00 -0.21 0.00 -0.26 0.00 0.00 58.87 58.55 1ri9 n SER 37 Cb 0.44 0.66 -0.08 0.00 -0.26 0.00 0.00 64.21 64.97 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 -1.96 0.46 -2.07 4.33 2.85 -1.26 -4.94 118.16 115.57 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 0.45 -1.29 -0.03 0.00 -0.65 0.00 0.00 35.03 33.52 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 -2.39 4.23 -0.08 -1.58 2.47 -1.26 -4.99 119.74 116.14 1ri9 s LYS 39 Ca -0.29 2.16 -0.04 0.00 -1.56 0.00 0.00 55.97 56.24 1ri9 s LYS 39 Cb 0.11 -3.62 0.04 0.00 -1.46 0.00 0.00 37.83 32.90 1ri9 s LYS 39 CO 0.39 -0.67 0.17 -1.58 0.16 0.00 0.00 175.35 173.82 1ri9 s TRP 40 N 2.65 -0.21 0.27 4.03 0.23 -1.26 -4.85 118.94 119.80 1ri9 s TRP 40 Ca 0.69 0.58 0.11 0.00 -2.03 0.00 0.00 56.10 55.46 1ri9 s TRP 40 Cb -0.35 -0.07 -0.05 0.00 0.03 0.00 0.00 33.47 33.03 1ri9 s TRP 40 CO 0.29 -0.20 -0.15 0.20 0.96 0.00 0.00 176.95 178.06 1ri9 s GLY 41 N 1.33 1.82 0.37 0.98 0.00 -1.26 -4.98 107.32 105.59 1ri9 s GLY 41 Ca -0.08 -1.81 0.08 0.00 0.00 0.00 0.00 44.72 42.91 1ri9 s GLY 41 CO -0.07 -1.89 1.94 -0.91 0.00 0.00 0.00 173.10 172.18 1ri9 h THR 42 N 2.20 0.96 -0.42 0.90 1.35 -2.01 0.32 112.91 116.21 1ri9 h THR 42 Ca -0.41 -0.23 0.00 0.00 -0.55 0.00 0.00 66.41 65.21 1ri9 h THR 42 Cb 1.26 0.22 0.00 0.00 -1.73 0.00 0.00 68.15 67.89 1ri9 h THR 42 CO 0.60 0.12 0.00 0.54 -0.25 0.00 0.00 175.52 176.53 1ri9 n ARG 43 N -4.49 2.28 -3.90 4.72 1.74 -1.26 -4.91 116.66 110.83 1ri9 n ARG 43 Ca 0.12 -1.96 -0.21 0.00 -0.77 0.00 0.00 57.85 55.03 1ri9 n ARG 43 Cb 0.30 -1.46 -0.03 0.00 -1.02 0.00 0.00 32.46 30.25 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 -1.31 5.61 0.15 0.55 2.15 0.11 -2.05 116.67 121.88 1ri9 s ASP 44 Ca 0.37 -0.28 -0.01 0.00 0.43 0.00 0.00 52.55 53.07 1ri9 s ASP 44 Cb 0.21 -1.30 -0.04 0.00 -0.30 0.00 0.00 42.92 41.49 1ri9 s ASP 44 CO 0.28 -0.20 0.32 -0.22 -0.17 0.00 0.00 175.17 175.19 1ri9 s LEU 45 N -3.96 4.29 -0.21 -1.34 2.96 -1.21 -4.58 118.68 114.64 1ri9 s LEU 45 Ca 0.37 0.36 0.01 0.00 -0.22 0.00 0.00 54.13 54.66 1ri9 s LEU 45 Cb -0.08 -3.09 0.28 0.00 0.50 0.00 0.00 46.19 43.80 1ri9 s LEU 45 CO 0.27 0.04 1.47 1.67 -1.32 0.00 0.00 176.35 178.48 1ri9 n GLN 46 N -0.28 1.57 -0.92 1.98 7.27 -1.26 -4.83 117.38 120.91 1ri9 n GLN 46 Ca -0.05 -1.32 -0.31 0.00 0.07 0.00 0.00 57.00 55.39 1ri9 n GLN 46 Cb 0.53 -1.52 0.14 0.00 2.41 0.00 0.00 30.24 31.80 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 -1.51 2.55 0.16 1.69 -7.23 -1.26 -5.04 120.40 109.76 1ri9 s VAL 47 Ca 0.25 0.18 0.08 0.00 -1.81 0.00 0.00 61.98 60.68 1ri9 s VAL 47 Cb 0.21 -2.40 -0.04 0.00 0.56 0.00 0.00 36.38 34.71 1ri9 s VAL 47 CO 0.04 -0.23 -0.05 -0.54 -0.31 0.00 0.00 175.10 174.00 1ri9 s LYS 48 N -4.75 2.23 0.01 4.82 3.01 -1.26 -4.66 119.74 119.14 1ri9 s LYS 48 Ca 0.65 -1.15 -0.30 0.00 -1.01 0.00 0.00 55.97 54.16 1ri9 s LYS 48 Cb -0.21 -2.28 -0.04 0.00 -1.01 0.00 0.00 37.83 34.29 1ri9 s LYS 48 CO 0.58 0.46 1.19 -1.25 0.51 0.00 0.00 175.35 176.83 1ri9 s PRO 49 N -2.76 4.41 0.00 -1.68 0.04 -1.26 -2.95 135.00 130.80 1ri9 s PRO 49 Ca 0.25 1.71 0.00 0.00 0.04 0.00 0.00 61.00 63.00 1ri9 s PRO 49 Cb -0.09 -3.45 0.00 0.00 0.04 0.00 0.00 34.50 31.00 1ri9 s PRO 49 CO 0.16 -0.33 0.00 0.41 0.04 0.00 0.00 177.00 177.29 1ri9 n GLY 50 N 3.26 0.99 3.89 0.56 0.00 -0.01 -4.50 105.19 109.38 1ri9 n GLY 50 Ca 0.10 -0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.90 1ri9 n GLY 50 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ri9 s GLU 51 N -0.84 2.52 -0.18 1.61 2.56 -1.07 -4.89 118.70 118.42 1ri9 s GLU 51 Ca 0.00 -1.56 -0.07 0.00 0.00 0.00 0.00 54.97 53.34 1ri9 s GLU 51 Cb 0.00 -2.39 -0.04 0.00 2.00 0.00 0.00 34.13 33.70 1ri9 s GLU 51 CO 0.00 -0.25 0.07 -1.12 -0.56 0.00 0.00 175.26 173.40 1ri9 s SER 52 N -4.17 5.72 0.01 -1.70 0.01 -1.26 0.12 113.70 112.43 1ri9 s SER 52 Ca 0.48 0.13 -0.01 0.00 1.31 0.00 0.00 55.95 57.86 1ri9 s SER 52 Cb -0.04 -1.96 -0.01 0.00 0.21 0.00 0.00 66.02 64.22 1ri9 s SER 52 CO 0.28 0.20 0.00 -1.48 0.41 0.00 0.00 173.24 172.65 1ri9 s LEU 53 N 0.22 2.07 0.05 2.44 0.05 -1.22 -4.89 118.68 117.40 1ri9 s LEU 53 Ca 0.05 -0.26 -0.30 0.00 0.05 0.00 0.00 54.13 53.66 1ri9 s LEU 53 Cb -0.12 0.12 -0.04 0.00 -2.05 0.00 0.00 46.19 44.10 1ri9 s LEU 53 CO 0.00 -0.19 1.01 -1.61 -0.55 0.00 0.00 176.35 175.02 1ri9 s GLU 54 N -0.86 4.58 -0.23 1.48 2.02 -1.24 -3.49 118.70 120.97 1ri9 s GLU 54 Ca -0.09 1.50 -0.10 0.00 0.02 0.00 0.00 54.97 56.29 1ri9 s GLU 54 Cb -0.06 -3.41 -0.05 0.00 0.10 0.00 0.00 34.13 30.71 1ri9 s GLU 54 CO -0.00 -0.00 0.15 0.08 0.02 0.00 0.00 175.26 175.50 1ri9 s VAL 55 N 0.66 5.32 0.00 2.63 1.01 -1.26 -1.66 120.40 127.11 1ri9 s VAL 55 Ca 0.51 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.66 1ri9 s VAL 55 Cb -0.23 -3.47 0.00 0.00 0.00 0.00 0.00 36.38 32.68 1ri9 s VAL 55 CO 0.29 0.37 0.00 -0.38 0.00 0.00 0.00 175.10 175.38 1ri9 n ILE 56 N 4.09 0.00 -3.45 2.22 5.41 0.11 -3.62 119.36 124.13 1ri9 n ILE 56 Ca -0.15 0.00 -0.29 0.00 1.00 0.00 0.00 62.75 63.31 1ri9 n ILE 56 Cb 0.52 0.00 -0.04 0.00 -0.71 0.00 0.00 39.64 39.41 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 3.00 3.63 -0.04 0.38 -1.52 -1.26 -4.66 119.66 119.19 1ri9 s GLN 57 Ca 0.00 -0.04 -0.30 0.00 -1.95 0.00 0.00 55.36 53.07 1ri9 s GLN 57 Cb 0.00 -2.70 -0.06 0.00 -0.22 0.00 0.00 33.01 30.03 1ri9 s GLN 57 CO 0.00 0.29 1.66 0.95 -0.25 0.00 0.00 175.29 177.94 1ri9 s THR 58 N -1.97 3.51 0.00 -0.19 -4.23 -1.26 -3.44 115.64 108.07 1ri9 s THR 58 Ca 0.43 0.67 0.00 0.00 -1.18 0.00 0.00 61.69 61.60 1ri9 s THR 58 Cb -0.11 -3.43 0.00 0.00 1.34 0.00 0.00 72.50 70.30 1ri9 s THR 58 CO 0.28 -0.05 0.77 0.41 -0.54 0.00 0.00 174.62 175.49 1ri9 n THR 59 N 5.38 0.00 0.00 3.99 -1.04 0.70 -4.80 114.28 118.51 1ri9 n THR 59 Ca 0.17 1.27 0.00 0.00 -2.04 0.00 0.00 64.05 63.45 1ri9 n THR 59 Cb 0.42 -2.12 0.00 0.00 -1.82 0.00 0.00 70.33 66.81 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 -1.54 0.00 0.02 8.00 2.03 -1.26 -5.02 116.55 118.78 1ri9 n ASP 60 Ca 0.00 0.00 -0.01 0.00 0.52 0.00 0.00 54.79 55.30 1ri9 n ASP 60 Cb 0.00 0.00 -0.00 0.00 -0.72 0.00 0.00 41.12 40.40 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 0.97 -3.41 1.67 8.00 -1.26 -4.88 116.55 117.63 1ri9 n ASP 61 Ca 0.00 0.13 -0.28 0.00 0.71 0.00 0.00 54.79 55.35 1ri9 n ASP 61 Cb 0.00 -0.31 -0.07 0.00 -0.02 0.00 0.00 41.12 40.72 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 -3.49 2.72 -3.68 -3.53 -1.04 -1.26 -5.00 114.28 99.00 1ri9 n THR 62 Ca -0.02 -5.33 -0.09 0.00 -2.04 0.00 0.00 64.05 56.56 1ri9 n THR 62 Cb 0.17 -2.01 -0.09 0.00 -1.82 0.00 0.00 70.33 66.57 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 -2.65 0.52 -0.09 -2.82 2.20 -1.26 -3.13 119.74 112.51 1ri9 s LYS 63 Ca 0.40 0.94 0.04 0.00 -0.36 0.00 0.00 55.97 56.99 1ri9 s LYS 63 Cb 0.16 0.06 -0.01 0.00 -1.51 0.00 0.00 37.83 36.53 1ri9 s LYS 63 CO -0.02 -0.15 -0.21 0.14 -0.36 0.00 0.00 175.35 174.75 1ri9 s VAL 64 N 1.40 2.32 -0.12 4.02 -7.23 -1.10 -0.21 120.40 119.47 1ri9 s VAL 64 Ca -0.09 -0.94 -0.24 0.00 -1.81 0.00 0.00 61.98 58.90 1ri9 s VAL 64 Cb -0.07 -1.90 -0.03 0.00 0.56 0.00 0.00 36.38 34.95 1ri9 s VAL 64 CO -0.14 0.56 0.73 -0.22 -0.31 0.00 0.00 175.10 175.71 1ri9 s LEU 65 N 0.18 4.24 0.38 1.32 2.96 -1.22 -2.22 118.68 124.31 1ri9 s LEU 65 Ca -0.12 1.13 -0.07 0.00 -0.22 0.00 0.00 54.13 54.84 1ri9 s LEU 65 Cb -0.16 -3.10 -0.05 0.00 0.50 0.00 0.00 46.19 43.37 1ri9 s LEU 65 CO 0.07 -0.23 0.69 0.00 -1.32 0.00 0.00 176.35 175.56 1ri9 s ARG 67 N -3.92 0.37 -0.08 0.00 3.52 -0.66 -1.02 118.95 117.16 1ri9 s ARG 67 Ca 0.48 -0.48 0.04 0.00 -0.13 0.00 0.00 55.73 55.63 1ri9 s ARG 67 Cb -0.10 -0.17 -0.01 0.00 -1.56 0.00 0.00 34.95 33.10 1ri9 s ARG 67 CO 0.33 0.03 -0.19 -0.80 -0.81 0.00 0.00 175.30 173.86 1ri9 s ASN 68 N -1.00 3.53 0.50 -2.12 -0.87 0.24 -3.63 114.94 111.58 1ri9 s ASN 68 Ca -0.08 -0.39 0.25 0.00 -1.57 0.00 0.00 52.86 51.07 1ri9 s ASN 68 Cb -0.07 -1.07 1.35 0.00 -0.02 0.00 0.00 41.25 41.45 1ri9 s ASN 68 CO -0.00 0.24 1.73 -0.08 -2.57 0.00 0.00 177.10 176.42 1ri9 h GLU 69 N 6.09 0.00 0.00 -0.60 4.57 -2.01 1.06 114.58 123.69 1ri9 h GLU 69 Ca -0.33 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.85 1ri9 h GLU 69 Cb 1.18 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.77 1ri9 h GLU 69 CO 0.50 0.00 0.00 -1.91 -1.18 0.00 0.00 179.01 176.42 1ri9 n GLU 70 N -2.53 0.55 -0.76 1.92 4.07 -1.26 -4.85 120.64 117.79 1ri9 n GLU 70 Ca -0.02 0.01 0.00 0.00 -0.06 0.00 0.00 57.16 57.09 1ri9 n GLU 70 Cb 0.26 -1.50 0.00 0.00 -0.06 0.00 0.00 31.44 30.14 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 1.10 0.81 3.38 8.31 0.00 0.36 -4.43 105.19 114.72 1ri9 n GLY 71 Ca 0.16 -0.57 -0.35 0.00 0.00 0.00 0.00 46.02 45.26 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 -1.67 3.49 0.18 1.61 2.20 -1.09 -3.79 119.74 120.68 1ri9 s LYS 72 Ca 0.00 -0.58 0.05 0.00 -0.36 0.00 0.00 55.97 55.08 1ri9 s LYS 72 Cb 0.00 -3.00 -0.04 0.00 -1.51 0.00 0.00 37.83 33.28 1ri9 s LYS 72 CO 0.00 -0.05 0.20 0.71 -0.36 0.00 0.00 175.35 175.84 1ri9 s TYR 73 N 1.13 3.24 0.15 4.03 1.51 -1.26 0.80 117.35 126.94 1ri9 s TYR 73 Ca 0.02 -0.01 -0.19 0.00 -1.01 0.00 0.00 57.07 55.88 1ri9 s TYR 73 Cb -0.15 -1.53 0.05 0.00 -0.11 0.00 0.00 41.96 40.23 1ri9 s TYR 73 CO 0.00 0.51 0.50 0.20 -1.11 0.00 0.00 175.55 175.65 1ri9 s GLY 74 N -3.34 -0.43 0.07 0.71 0.00 -0.19 -4.90 107.32 99.25 1ri9 s GLY 74 Ca 0.32 0.19 0.02 0.00 0.00 0.00 0.00 44.72 45.25 1ri9 s GLY 74 CO 0.25 -0.09 0.14 -0.19 0.00 0.00 0.00 173.10 173.21 1ri9 s TYR 75 N -3.78 3.34 -0.03 1.90 2.02 -0.87 0.17 117.35 120.10 1ri9 s TYR 75 Ca 0.02 0.16 -0.01 0.00 -0.37 0.00 0.00 57.07 56.87 1ri9 s TYR 75 Cb 0.00 -1.68 0.03 0.00 -0.40 0.00 0.00 41.96 39.91 1ri9 s TYR 75 CO -0.12 0.55 0.04 0.08 -1.57 0.00 0.00 175.55 174.54 1ri9 s VAL 76 N -1.44 -0.08 0.29 0.71 1.01 -0.94 -3.28 120.40 116.66 1ri9 s VAL 76 Ca 0.32 0.32 -0.28 0.00 0.00 0.00 0.00 61.98 62.33 1ri9 s VAL 76 Cb -0.13 -0.12 -0.09 0.00 0.00 0.00 0.00 36.38 36.04 1ri9 s VAL 76 CO 0.25 0.13 0.99 -0.22 0.00 0.00 0.00 175.10 176.25 1ri9 s LEU 77 N 1.61 4.49 0.67 3.92 0.20 -1.26 -2.73 118.68 125.58 1ri9 s LEU 77 Ca -0.02 2.00 0.39 0.00 0.69 0.00 0.00 54.13 57.18 1ri9 s LEU 77 Cb -0.13 -3.78 2.10 0.00 -0.43 0.00 0.00 46.19 43.95 1ri9 s LEU 77 CO -0.03 -0.04 2.18 0.08 -0.29 0.00 0.00 176.35 178.26 1ri9 h ARG 78 N 3.64 0.00 0.07 1.98 -0.00 -1.94 -2.52 114.38 115.61 1ri9 h ARG 78 Ca -0.46 0.00 0.02 0.00 -0.00 0.00 0.00 59.98 59.53 1ri9 h ARG 78 Cb 1.20 0.00 -0.05 0.00 -0.00 0.00 0.00 29.97 31.12 1ri9 h ARG 78 CO 0.66 0.00 -0.53 1.03 -0.00 0.00 0.00 179.97 181.14 1ri9 h SER 79 N 0.00 -1.61 -3.63 0.08 0.87 -1.90 -3.30 113.55 104.07 1ri9 h SER 79 Ca 0.00 0.17 -0.66 0.00 -1.23 0.00 0.00 61.79 60.08 1ri9 h SER 79 Cb 0.28 0.60 -0.39 0.00 -0.44 0.00 0.00 62.40 62.45 1ri9 h SER 79 CO -0.00 -0.54 -0.44 -0.72 -0.53 0.00 0.00 176.83 174.60 1ri9 s TYR 80 N -5.71 3.53 0.19 2.24 -0.85 -0.95 -5.03 117.35 110.78 1ri9 s TYR 80 Ca -0.16 -3.13 -0.23 0.00 -0.52 0.00 0.00 57.07 53.03 1ri9 s TYR 80 Cb 0.06 -2.94 0.07 0.00 0.38 0.00 0.00 41.96 39.53 1ri9 s TYR 80 CO 0.60 -0.68 0.98 -1.17 -1.52 0.00 0.00 175.55 173.75 1ri9 s LEU 81 N -0.95 -0.08 0.89 -3.49 2.96 -1.24 -3.82 118.68 112.95 1ri9 s LEU 81 Ca 0.22 -0.60 -0.14 0.00 -0.22 0.00 0.00 54.13 53.39 1ri9 s LEU 81 Cb -0.13 2.20 0.14 0.00 0.50 0.00 0.00 46.19 48.91 1ri9 s LEU 81 CO -0.10 -1.03 1.23 0.00 -1.32 0.00 0.00 176.35 175.14 1ri9 s ALA 82 N -2.70 2.37 -1.73 5.97 0.00 -1.25 -4.74 121.76 119.68 1ri9 s ALA 82 Ca 0.17 -0.88 0.00 0.00 0.00 0.00 0.00 51.96 51.25 1ri9 s ALA 82 Cb -0.02 -2.89 0.00 0.00 0.00 0.00 0.00 23.12 20.21 1ri9 s ALA 82 CO 0.05 -2.09 0.43 -0.25 0.00 0.00 0.00 175.76 173.90