#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 0.12 -0.26 3.49 2.85 -1.26 -1.59 118.16 121.51 1ri9 n LYS 8 Ca 0.00 0.54 -0.03 0.00 -1.05 0.00 0.00 58.31 57.77 1ri9 n LYS 8 Cb 0.00 -1.83 0.15 0.00 -0.65 0.00 0.00 35.03 32.69 1ri9 n LYS 8 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 1ri9 h GLU 9 N 0.00 1.10 -0.11 -1.58 5.08 -1.93 -0.97 114.58 116.17 1ri9 h GLU 9 Ca 0.00 -0.14 -0.10 0.00 -1.00 0.00 0.00 59.36 58.12 1ri9 h GLU 9 Cb 0.10 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 1ri9 h GLU 9 CO 0.00 0.82 -0.40 1.49 -1.00 0.00 0.00 179.01 179.93 1ri9 h GLU 10 N 1.10 0.24 -0.19 2.33 4.81 -1.13 -2.58 114.58 119.14 1ri9 h GLU 10 Ca 0.27 -0.11 -0.13 0.00 -0.13 0.00 0.00 59.36 59.27 1ri9 h GLU 10 Cb 0.07 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 1ri9 h GLU 10 CO -0.04 0.60 -0.42 0.87 -0.73 0.00 0.00 179.01 179.30 1ri9 h LYS 11 N 0.20 0.46 -0.92 1.92 1.79 -1.41 0.43 116.57 119.04 1ri9 h LYS 11 Ca 0.02 -0.23 0.02 0.00 -2.18 0.00 0.00 60.65 58.28 1ri9 h LYS 11 Cb 0.79 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 31.40 1ri9 h LYS 11 CO 0.06 0.80 0.61 0.22 -1.08 0.00 0.00 179.45 180.06 1ri9 h ASP 12 N 0.38 1.03 0.00 0.86 3.58 -0.81 1.03 116.42 122.49 1ri9 h ASP 12 Ca 0.03 -0.02 -0.06 0.00 0.42 0.00 0.00 57.03 57.41 1ri9 h ASP 12 Cb 0.89 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 41.68 1ri9 h ASP 12 CO 0.08 0.73 -0.31 0.15 -2.88 0.00 0.00 179.24 177.00 1ri9 h PHE 13 N 1.21 0.00 -0.73 0.28 3.04 -1.34 -3.30 116.94 116.10 1ri9 h PHE 13 Ca 0.35 0.00 0.05 0.00 3.98 0.00 0.00 57.97 62.35 1ri9 h PHE 13 Cb -0.07 0.00 -0.04 0.00 2.56 0.00 0.00 35.95 38.40 1ri9 h PHE 13 CO -0.00 1.06 0.48 -0.09 -2.02 0.00 0.00 178.31 177.73 1ri9 h ARG 14 N -1.00 0.81 0.03 1.11 2.43 -0.05 3.87 114.38 121.58 1ri9 h ARG 14 Ca -0.08 -0.05 0.03 0.00 -0.81 0.00 0.00 59.98 59.07 1ri9 h ARG 14 Cb 1.02 -0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 30.33 1ri9 h ARG 14 CO -0.05 0.53 -0.41 1.57 -1.51 0.00 0.00 179.97 180.10 1ri9 h LYS 15 N 0.83 -0.57 0.11 0.20 5.09 0.10 1.00 116.57 123.33 1ri9 h LYS 15 Ca 0.30 0.04 -0.28 0.00 0.09 0.00 0.00 60.65 60.79 1ri9 h LYS 15 Cb 0.14 0.13 -0.01 0.00 0.10 0.00 0.00 32.23 32.59 1ri9 h LYS 15 CO -0.09 -0.38 -1.38 -0.22 -2.09 0.00 0.00 179.45 175.29 1ri9 h LYS 16 N -0.59 0.23 -1.00 0.07 1.63 -1.51 -3.26 116.57 112.14 1ri9 h LYS 16 Ca 0.04 -0.39 -0.19 0.00 -0.85 0.00 0.00 60.65 59.27 1ri9 h LYS 16 Cb 0.65 0.14 -0.11 0.00 -0.60 0.00 0.00 32.23 32.32 1ri9 h LYS 16 CO -0.30 1.12 0.24 1.19 -3.45 0.00 0.00 179.45 178.25 1ri9 n PHE 17 N -3.46 1.12 0.00 1.91 3.01 1.27 -4.61 117.46 116.71 1ri9 n PHE 17 Ca -0.12 -0.98 0.00 0.00 1.01 0.00 0.00 57.45 57.36 1ri9 n PHE 17 Cb 1.03 -0.50 0.00 0.00 -0.01 0.00 0.00 39.48 40.00 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 -0.10 0.00 -1.85 -1.08 4.76 0.34 -4.43 118.16 115.81 1ri9 n LYS 18 Ca 0.22 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 55.24 1ri9 n LYS 18 Cb 0.93 -0.84 -0.03 0.00 -1.84 0.00 0.00 35.03 33.25 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 -0.13 1.88 -0.60 2.13 5.04 -1.26 -4.94 117.35 119.45 1ri9 s TYR 19 Ca 0.00 -0.01 -0.16 0.00 -2.44 0.00 0.00 57.07 54.46 1ri9 s TYR 19 Cb 0.00 -4.06 0.14 0.00 0.35 0.00 0.00 41.96 38.39 1ri9 s TYR 19 CO 0.00 -4.51 0.58 -0.51 -1.34 0.00 0.00 175.55 169.77 1ri9 s ASP 20 N 3.41 6.30 0.00 4.32 1.01 -1.26 -4.99 116.67 125.46 1ri9 s ASP 20 Ca 0.79 -1.91 0.00 0.00 0.71 0.00 0.00 52.55 52.14 1ri9 s ASP 20 Cb -0.39 -2.22 0.00 0.00 1.01 0.00 0.00 42.92 41.31 1ri9 s ASP 20 CO 0.35 -0.84 0.00 0.61 0.21 0.00 0.00 175.17 175.49 1ri9 n GLY 21 N 5.03 3.20 3.27 0.21 0.00 -1.26 -5.11 105.19 110.53 1ri9 n GLY 21 Ca -0.08 -1.38 -0.44 0.00 0.00 0.00 0.00 46.02 44.12 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 -1.92 3.21 -0.37 1.61 2.12 -1.26 -5.02 118.70 117.06 1ri9 s GLU 22 Ca 0.00 -2.29 -0.28 0.00 0.36 0.00 0.00 54.97 52.75 1ri9 s GLU 22 Cb 0.00 -4.23 -0.01 0.00 0.26 0.00 0.00 34.13 30.15 1ri9 s GLU 22 CO 0.00 -1.27 1.67 0.42 -0.54 0.00 0.00 175.26 175.55 1ri9 s ILE 23 N 0.46 3.61 -0.23 -3.70 1.01 -1.26 -4.87 121.20 116.22 1ri9 s ILE 23 Ca 0.14 0.61 -0.05 0.00 0.00 0.00 0.00 60.65 61.35 1ri9 s ILE 23 Cb -0.17 -3.84 0.11 0.00 0.01 0.00 0.00 42.46 38.58 1ri9 s ILE 23 CO -0.05 -0.55 0.43 -0.60 0.00 0.00 0.00 174.94 174.17 1ri9 s ARG 24 N 5.47 0.36 -0.59 2.79 6.06 -1.26 -5.09 118.95 126.69 1ri9 s ARG 24 Ca 0.73 0.89 -0.26 0.00 -2.50 0.00 0.00 55.73 54.58 1ri9 s ARG 24 Cb -0.19 0.10 -0.04 0.00 0.06 0.00 0.00 34.95 34.88 1ri9 s ARG 24 CO 0.33 -0.41 2.08 0.08 -2.50 0.00 0.00 175.30 174.88 1ri9 s VAL 25 N 2.62 3.22 -0.21 7.11 1.01 -1.26 -4.60 120.40 128.29 1ri9 s VAL 25 Ca 0.05 0.10 -0.18 0.00 0.00 0.00 0.00 61.98 61.95 1ri9 s VAL 25 Cb -0.13 -3.58 -0.19 0.00 0.00 0.00 0.00 36.38 32.47 1ri9 s VAL 25 CO -0.15 -0.56 0.13 -0.11 0.00 0.00 0.00 175.10 174.41 1ri9 n LEU 26 N 14.14 2.00 -3.74 3.92 0.00 -1.24 -4.76 117.00 127.34 1ri9 n LEU 26 Ca 0.28 0.37 -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 0.70 0.42 -0.22 -0.72 0.00 0.00 0.00 177.39 177.57 1ri9 s TYR 27 N -2.42 2.26 -0.40 1.96 1.13 -1.26 -5.08 117.35 113.55 1ri9 s TYR 27 Ca -0.30 -2.63 -0.28 0.00 -1.41 0.00 0.00 57.07 52.45 1ri9 s TYR 27 Cb 0.08 -2.02 -0.00 0.00 -1.10 0.00 0.00 41.96 38.91 1ri9 s TYR 27 CO 0.60 -0.75 1.57 -1.54 -2.51 0.00 0.00 175.55 172.92 1ri9 s SER 28 N 0.01 6.12 0.51 -0.18 1.04 -1.26 -4.09 113.70 115.84 1ri9 s SER 28 Ca 0.20 0.95 -0.07 0.00 0.48 0.00 0.00 55.95 57.51 1ri9 s SER 28 Cb -0.19 -2.53 -0.04 0.00 0.10 0.00 0.00 66.02 63.35 1ri9 s SER 28 CO -0.04 -1.59 0.84 0.28 0.98 0.00 0.00 173.24 173.71 1ri9 s THR 29 N 6.15 4.86 -0.14 2.02 -1.32 -1.23 -4.76 115.64 121.22 1ri9 s THR 29 Ca 0.68 0.38 -0.07 0.00 -1.21 0.00 0.00 61.69 61.47 1ri9 s THR 29 Cb -0.17 -3.86 -0.04 0.00 -1.51 0.00 0.00 72.50 66.93 1ri9 s THR 29 CO 0.32 -0.89 0.10 -0.75 -2.21 0.00 0.00 174.62 171.19 1ri9 s LYS 30 N -4.76 3.56 -0.07 7.08 2.20 -1.26 -3.26 119.74 123.23 1ri9 s LYS 30 Ca 0.49 -0.23 -0.30 0.00 -0.36 0.00 0.00 55.97 55.58 1ri9 s LYS 30 Cb -0.10 -3.16 -0.04 0.00 -1.51 0.00 0.00 37.83 33.01 1ri9 s LYS 30 CO 0.46 0.61 1.45 0.08 -0.36 0.00 0.00 175.35 177.59 1ri9 s VAL 31 N -0.57 3.84 1.07 4.02 1.01 0.68 -3.90 120.40 126.55 1ri9 s VAL 31 Ca 0.12 1.09 -0.18 0.00 0.00 0.00 0.00 61.98 63.01 1ri9 s VAL 31 Cb -0.12 -3.70 0.25 0.00 0.00 0.00 0.00 36.38 32.81 1ri9 s VAL 31 CO 0.02 -0.07 1.25 0.28 0.00 0.00 0.00 175.10 176.59 1ri9 s THR 32 N 3.33 1.83 -0.49 3.92 -1.32 -1.26 -0.84 115.64 120.80 1ri9 s THR 32 Ca 0.65 0.00 0.24 0.00 -1.21 0.00 0.00 61.69 61.36 1ri9 s THR 32 Cb -0.29 -2.80 0.32 0.00 -1.51 0.00 0.00 72.50 68.21 1ri9 s THR 32 CO 0.24 0.00 1.63 0.00 -2.21 0.00 0.00 174.62 174.28 1ri9 h THR 33 N -2.08 0.00 -0.45 5.08 1.03 -1.93 1.95 112.91 116.52 1ri9 h THR 33 Ca -0.44 -0.89 0.00 0.00 -0.01 0.00 0.00 66.41 65.07 1ri9 h THR 33 Cb 1.25 1.88 0.00 0.00 -1.07 0.00 0.00 68.15 70.20 1ri9 h THR 33 CO 0.33 0.00 0.00 -0.24 -0.01 0.00 0.00 175.52 175.60 1ri9 n SER 34 N -2.92 3.11 -4.52 0.00 2.88 -1.26 -4.72 113.62 106.19 1ri9 n SER 34 Ca 0.04 -2.21 -0.29 0.00 -1.33 0.00 0.00 58.87 55.08 1ri9 n SER 34 Cb 0.51 -0.43 0.19 0.00 -0.75 0.00 0.00 64.21 63.73 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 1.93 -0.15 2.46 -1.16 -1.14 -4.60 121.20 116.91 1ri9 s ILE 35 Ca 0.33 0.00 -0.29 0.00 -0.51 0.00 0.00 60.65 60.18 1ri9 s ILE 35 Cb 0.20 -2.54 -0.03 0.00 0.61 0.00 0.00 42.46 40.70 1ri9 s ILE 35 CO 0.18 0.00 1.49 0.28 -2.81 0.00 0.00 174.94 174.08 1ri9 s THR 36 N -3.04 3.88 -0.01 4.00 -1.32 -1.25 -4.61 115.64 113.29 1ri9 s THR 36 Ca 0.66 1.04 0.01 0.00 -1.21 0.00 0.00 61.69 62.19 1ri9 s THR 36 Cb -0.16 -3.74 -0.01 0.00 -1.51 0.00 0.00 72.50 67.07 1ri9 s THR 36 CO 0.57 -0.17 0.01 -0.24 -2.21 0.00 0.00 174.62 172.57 1ri9 n SER 37 N 7.32 4.73 -0.11 8.08 2.88 -1.26 -4.38 113.62 130.88 1ri9 n SER 37 Ca 0.16 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.49 1ri9 n SER 37 Cb 0.44 0.65 -0.08 0.00 -0.75 0.00 0.00 64.21 64.47 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 -1.92 0.47 -2.08 -1.46 2.85 -1.26 -4.94 118.16 109.82 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 -1.29 -0.03 0.00 -0.65 0.00 0.00 35.03 33.48 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 4.24 -0.07 -1.58 2.47 -1.26 -4.99 119.74 116.14 1ri9 s LYS 39 Ca -0.30 2.14 -0.03 0.00 -1.56 0.00 0.00 55.97 56.22 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 0.40 -0.67 0.16 -1.58 0.16 0.00 0.00 175.35 173.82 1ri9 s TRP 40 N 2.65 -0.19 0.27 4.03 0.23 -1.26 -4.86 118.94 119.82 1ri9 s TRP 40 Ca 0.69 0.54 0.11 0.00 -2.03 0.00 0.00 56.10 55.42 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 -0.19 -0.16 0.20 0.96 0.00 0.00 176.95 178.06 1ri9 s GLY 41 N 1.27 1.83 0.38 0.98 0.00 -1.26 -4.98 107.32 105.53 1ri9 s GLY 41 Ca -0.08 -1.82 0.08 0.00 0.00 0.00 0.00 44.72 42.90 1ri9 s GLY 41 CO -0.06 -1.90 1.95 0.00 0.00 0.00 0.00 173.10 173.08 1ri9 h THR 42 N 2.20 0.96 -0.44 0.90 1.03 -2.01 0.31 112.91 115.86 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 0.23 0.00 0.00 -1.07 0.00 0.00 68.15 68.57 1ri9 h THR 42 CO 0.60 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 -3.84 0.00 1.74 -1.26 -4.91 116.66 106.21 1ri9 n ARG 43 Ca 0.12 -2.01 -0.21 0.00 -0.77 0.00 0.00 57.85 54.97 1ri9 n ARG 43 Cb 0.31 -1.47 -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 -1.29 5.60 0.14 0.55 -1.08 0.11 -1.57 116.67 119.14 1ri9 s ASP 44 Ca 0.38 -0.31 0.00 0.00 -0.52 0.00 0.00 52.55 52.11 1ri9 s ASP 44 Cb 0.21 -1.23 -0.04 0.00 -1.46 0.00 0.00 42.92 40.40 1ri9 s ASP 44 CO 0.29 -0.26 0.30 -0.22 0.52 0.00 0.00 175.17 175.81 1ri9 s LEU 45 N -3.99 4.31 -0.20 -1.34 2.96 -1.20 -4.59 118.68 114.64 1ri9 s LEU 45 Ca 0.39 0.30 0.01 0.00 -0.22 0.00 0.00 54.13 54.62 1ri9 s LEU 45 Cb -0.07 -3.04 0.28 0.00 0.50 0.00 0.00 46.19 43.85 1ri9 s LEU 45 CO 0.27 0.05 1.44 1.67 -1.32 0.00 0.00 176.35 178.46 1ri9 n GLN 46 N -0.30 1.54 -0.91 1.98 7.27 -1.26 -4.82 117.38 120.88 1ri9 n GLN 46 Ca -0.05 -1.28 -0.31 0.00 0.07 0.00 0.00 57.00 55.43 1ri9 n GLN 46 Cb 0.53 -1.50 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 -1.44 2.53 0.21 1.69 -7.23 -1.26 -5.04 120.40 109.85 1ri9 s VAL 47 Ca 0.24 0.17 0.09 0.00 -1.81 0.00 0.00 61.98 60.68 1ri9 s VAL 47 Cb 0.20 -2.38 -0.04 0.00 0.56 0.00 0.00 36.38 34.72 1ri9 s VAL 47 CO 0.04 -0.22 -0.09 -1.59 -0.31 0.00 0.00 175.10 172.93 1ri9 s LYS 48 N -4.74 2.06 -0.06 4.82 0.00 -1.26 -4.63 119.74 115.92 1ri9 s LYS 48 Ca 0.65 -1.36 -0.30 0.00 0.00 0.00 0.00 55.97 54.96 1ri9 s LYS 48 Cb -0.21 -2.11 -0.03 0.00 0.00 0.00 0.00 37.83 35.48 1ri9 s LYS 48 CO 0.58 0.41 1.22 -1.25 0.00 0.00 0.00 175.35 176.31 1ri9 s PRO 49 N -3.08 4.34 0.00 1.78 0.04 -1.26 -2.83 135.00 133.99 1ri9 s PRO 49 Ca 0.27 1.70 0.00 0.00 0.04 0.00 0.00 61.00 63.00 1ri9 s PRO 49 Cb -0.08 -3.57 0.00 0.00 0.04 0.00 0.00 34.50 30.89 1ri9 s PRO 49 CO 0.16 -0.48 0.00 0.41 0.04 0.00 0.00 177.00 177.14 1ri9 n GLY 50 N 3.41 1.03 3.94 0.56 0.00 0.66 -4.56 105.19 110.23 1ri9 n GLY 50 Ca 0.11 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.92 2.56 -0.14 1.61 2.02 -0.78 -4.87 118.70 118.19 1ri9 s GLU 51 Ca 0.00 -1.51 -0.03 0.00 0.02 0.00 0.00 54.97 53.45 1ri9 s GLU 51 Cb 0.00 -2.50 -0.03 0.00 0.10 0.00 0.00 34.13 31.71 1ri9 s GLU 51 CO 0.00 -0.34 -0.03 -1.54 0.02 0.00 0.00 175.26 173.36 1ri9 s SER 52 N -4.28 4.86 0.03 -0.19 1.04 -1.26 0.25 113.70 114.14 1ri9 s SER 52 Ca 0.51 -0.08 -0.02 0.00 0.48 0.00 0.00 55.95 56.83 1ri9 s SER 52 Cb -0.05 -1.71 -0.02 0.00 0.10 0.00 0.00 66.02 64.34 1ri9 s SER 52 CO 0.30 0.21 0.01 -1.48 0.98 0.00 0.00 173.24 173.26 1ri9 s LEU 53 N 0.14 2.13 0.13 2.42 2.34 -1.20 -4.88 118.68 119.76 1ri9 s LEU 53 Ca -0.01 -0.55 -0.30 0.00 0.06 0.00 0.00 54.13 53.34 1ri9 s LEU 53 Cb -0.14 0.26 -0.06 0.00 -0.56 0.00 0.00 46.19 45.69 1ri9 s LEU 53 CO 0.03 -0.39 0.97 -1.61 -1.06 0.00 0.00 176.35 174.29 1ri9 s GLU 54 N -2.00 4.71 -0.21 1.48 8.01 -1.25 -3.47 118.70 125.97 1ri9 s GLU 54 Ca -0.11 1.47 -0.07 0.00 0.01 0.00 0.00 54.97 56.27 1ri9 s GLU 54 Cb -0.06 -3.36 -0.04 0.00 -4.31 0.00 0.00 34.13 26.37 1ri9 s GLU 54 CO -0.03 0.23 0.06 0.08 0.01 0.00 0.00 175.26 175.61 1ri9 s VAL 55 N -0.11 4.53 0.00 2.63 1.01 -1.26 -1.74 120.40 125.46 1ri9 s VAL 55 Ca 0.47 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.33 1ri9 s VAL 55 Cb -0.24 -3.07 0.00 0.00 0.00 0.00 0.00 36.38 33.07 1ri9 s VAL 55 CO 0.30 0.41 0.00 -0.38 0.00 0.00 0.00 175.10 175.43 1ri9 n ILE 56 N 4.15 0.00 -3.48 2.22 5.41 0.27 -3.60 119.36 124.33 1ri9 n ILE 56 Ca -0.16 0.00 -0.28 0.00 1.00 0.00 0.00 62.75 63.30 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 -1.58 0.00 0.00 0.00 176.55 174.97 1ri9 s GLN 57 N 2.74 3.60 -0.04 0.38 2.00 -1.26 -4.67 119.66 122.41 1ri9 s GLN 57 Ca 0.00 -0.11 -0.30 0.00 -2.00 0.00 0.00 55.36 52.95 1ri9 s GLN 57 Cb 0.00 -2.72 -0.06 0.00 0.80 0.00 0.00 33.01 31.03 1ri9 s GLN 57 CO 0.00 0.30 1.61 0.95 -0.50 0.00 0.00 175.29 177.65 1ri9 s THR 58 N -1.98 3.55 0.00 -0.34 -4.23 -1.26 -3.33 115.64 108.05 1ri9 s THR 58 Ca 0.42 0.74 0.00 0.00 -1.18 0.00 0.00 61.69 61.67 1ri9 s THR 58 Cb -0.11 -3.48 0.00 0.00 1.34 0.00 0.00 72.50 70.25 1ri9 s THR 58 CO 0.29 -0.05 0.74 0.41 -0.54 0.00 0.00 174.62 175.47 1ri9 n THR 59 N 5.29 0.00 0.00 3.99 -1.04 0.83 -4.81 114.28 118.53 1ri9 n THR 59 Ca 0.16 1.24 0.00 0.00 -2.04 0.00 0.00 64.05 63.41 1ri9 n THR 59 Cb 0.43 -2.10 0.00 0.00 -1.82 0.00 0.00 70.33 66.84 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 -1.42 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 0.97 -3.42 1.67 8.00 -1.26 -4.88 116.55 117.63 1ri9 n ASP 61 Ca 0.00 0.13 -0.29 0.00 0.71 0.00 0.00 54.79 55.35 1ri9 n ASP 61 Cb 0.00 -0.32 -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 -3.50 2.78 -3.67 -3.53 -1.04 -1.26 -5.00 114.28 99.06 1ri9 n THR 62 Ca -0.03 -5.35 -0.09 0.00 -2.04 0.00 0.00 64.05 56.54 1ri9 n THR 62 Cb 0.20 -2.01 -0.09 0.00 -1.82 0.00 0.00 70.33 66.60 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 -2.66 0.53 -0.11 -2.82 2.47 -1.26 -3.07 119.74 112.82 1ri9 s LYS 63 Ca 0.40 0.98 0.04 0.00 -1.56 0.00 0.00 55.97 55.82 1ri9 s LYS 63 Cb 0.16 0.05 -0.00 0.00 -1.46 0.00 0.00 37.83 36.57 1ri9 s LYS 63 CO -0.02 -0.15 -0.23 0.14 0.16 0.00 0.00 175.35 175.25 1ri9 s VAL 64 N 1.49 2.15 -0.16 4.02 -7.23 -1.13 -0.12 120.40 119.42 1ri9 s VAL 64 Ca -0.10 -0.98 -0.23 0.00 -1.81 0.00 0.00 61.98 58.86 1ri9 s VAL 64 Cb -0.07 -1.83 -0.02 0.00 0.56 0.00 0.00 36.38 35.02 1ri9 s VAL 64 CO -0.16 0.56 0.71 -0.22 -0.31 0.00 0.00 175.10 175.68 1ri9 s LEU 65 N 0.38 4.19 0.40 1.32 2.96 -1.21 -2.49 118.68 124.23 1ri9 s LEU 65 Ca -0.17 1.02 -0.04 0.00 -0.22 0.00 0.00 54.13 54.72 1ri9 s LEU 65 Cb -0.18 -3.05 -0.04 0.00 0.50 0.00 0.00 46.19 43.42 1ri9 s LEU 65 CO 0.08 -0.29 0.68 0.00 -1.32 0.00 0.00 176.35 175.50 1ri9 s ARG 67 N -4.33 0.62 -0.10 0.00 3.52 -0.71 -1.42 118.95 116.52 1ri9 s ARG 67 Ca 0.45 -0.52 0.03 0.00 -0.13 0.00 0.00 55.73 55.56 1ri9 s ARG 67 Cb -0.10 -0.53 -0.00 0.00 -1.56 0.00 0.00 34.95 32.75 1ri9 s ARG 67 CO 0.39 0.13 -0.22 1.21 -0.81 0.00 0.00 175.30 176.00 1ri9 s ASN 68 N -0.84 3.26 0.44 -2.12 2.47 -0.39 -3.81 114.94 113.95 1ri9 s ASN 68 Ca -0.02 -0.51 0.21 0.00 0.42 0.00 0.00 52.86 52.96 1ri9 s ASN 68 Cb -0.06 -1.40 1.15 0.00 -1.45 0.00 0.00 41.25 39.48 1ri9 s ASN 68 CO 0.00 0.17 1.60 -0.33 -3.72 0.00 0.00 177.10 174.82 1ri9 h GLU 69 N 6.65 0.00 0.00 0.43 4.39 -2.01 0.65 114.58 124.69 1ri9 h GLU 69 Ca -0.21 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.49 1ri9 h GLU 69 Cb 1.23 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.88 1ri9 h GLU 69 CO 0.49 0.00 0.00 -1.91 -1.16 0.00 0.00 179.01 176.43 1ri9 n GLU 70 N -2.38 0.26 -0.61 2.33 2.13 -1.26 -4.81 120.64 116.29 1ri9 n GLU 70 Ca -0.01 0.11 0.00 0.00 0.66 0.00 0.00 57.16 57.92 1ri9 n GLU 70 Cb 0.28 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.49 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 0.22 0.66 3.22 8.31 0.00 0.23 -4.96 105.19 112.86 1ri9 n GLY 71 Ca 0.09 -0.36 -0.33 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.83 3.15 0.43 1.61 2.20 -1.12 -2.83 119.74 122.35 1ri9 s LYS 72 Ca 0.00 -0.77 0.03 0.00 -0.36 0.00 0.00 55.97 54.87 1ri9 s LYS 72 Cb 0.00 -2.62 0.00 0.00 -1.51 0.00 0.00 37.83 33.70 1ri9 s LYS 72 CO 0.00 -0.06 0.62 0.71 -0.36 0.00 0.00 175.35 176.26 1ri9 s TYR 73 N 0.99 3.10 0.12 4.03 1.51 -1.26 -1.26 117.35 124.58 1ri9 s TYR 73 Ca -0.02 0.02 -0.21 0.00 -1.01 0.00 0.00 57.07 55.85 1ri9 s TYR 73 Cb -0.15 -2.30 0.05 0.00 -0.11 0.00 0.00 41.96 39.46 1ri9 s TYR 73 CO -0.04 -0.35 0.51 0.20 -1.11 0.00 0.00 175.55 174.77 1ri9 s GLY 74 N -4.25 -0.45 0.12 0.71 0.00 -0.50 -4.88 107.32 98.07 1ri9 s GLY 74 Ca 0.49 0.34 0.03 0.00 0.00 0.00 0.00 44.72 45.59 1ri9 s GLY 74 CO 0.36 0.05 0.13 -0.19 0.00 0.00 0.00 173.10 173.44 1ri9 s TYR 75 N -3.39 3.23 -0.06 1.90 2.02 -0.61 0.85 117.35 121.29 1ri9 s TYR 75 Ca -0.00 0.06 -0.03 0.00 -0.37 0.00 0.00 57.07 56.73 1ri9 s TYR 75 Cb 0.00 -1.60 0.04 0.00 -0.40 0.00 0.00 41.96 40.01 1ri9 s TYR 75 CO -0.09 0.53 0.13 0.08 -1.57 0.00 0.00 175.55 174.62 1ri9 s VAL 76 N -1.57 -0.13 0.29 0.71 1.01 -1.04 -3.21 120.40 116.46 1ri9 s VAL 76 Ca 0.31 0.27 -0.28 0.00 0.00 0.00 0.00 61.98 62.27 1ri9 s VAL 76 Cb -0.11 -0.23 -0.09 0.00 0.00 0.00 0.00 36.38 35.95 1ri9 s VAL 76 CO 0.24 0.11 0.98 -0.22 0.00 0.00 0.00 175.10 176.21 1ri9 s LEU 77 N 1.62 4.49 0.66 3.92 0.20 -1.26 -2.82 118.68 125.49 1ri9 s LEU 77 Ca -0.04 1.99 0.38 0.00 0.69 0.00 0.00 54.13 57.15 1ri9 s LEU 77 Cb -0.12 -3.79 2.08 0.00 -0.43 0.00 0.00 46.19 43.92 1ri9 s LEU 77 CO -0.05 -0.03 2.19 0.08 -0.29 0.00 0.00 176.35 178.24 1ri9 h ARG 78 N 3.62 0.00 0.09 1.98 -0.00 -1.93 -2.52 114.38 115.61 1ri9 h ARG 78 Ca -0.46 0.00 0.01 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 0.00 179.97 181.13 1ri9 h SER 79 N 0.00 -1.61 -3.59 0.08 0.87 -1.91 -3.30 113.55 104.10 1ri9 h SER 79 Ca 0.01 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 -0.55 -0.44 -0.72 -0.53 0.00 0.00 176.83 174.60 1ri9 s TYR 80 N -5.73 3.55 0.21 2.24 -0.85 -0.95 -5.01 117.35 110.81 1ri9 s TYR 80 Ca -0.16 -3.14 -0.22 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 0.96 -1.17 -1.52 0.00 0.00 175.55 173.75 1ri9 s LEU 81 N -0.99 -0.06 0.90 -3.49 2.96 -1.24 -3.77 118.68 112.98 1ri9 s LEU 81 Ca 0.23 -0.67 -0.14 0.00 -0.22 0.00 0.00 54.13 53.33 1ri9 s LEU 81 Cb -0.12 2.26 0.14 0.00 0.50 0.00 0.00 46.19 48.97 1ri9 s LEU 81 CO -0.10 -1.10 1.22 0.00 -1.32 0.00 0.00 176.35 175.05 1ri9 s ALA 82 N -2.61 2.28 -1.76 5.97 0.00 -1.25 -4.77 121.76 119.62 1ri9 s ALA 82 Ca 0.17 -0.83 0.00 0.00 0.00 0.00 0.00 51.96 51.30 1ri9 s ALA 82 Cb -0.03 -2.90 0.00 0.00 0.00 0.00 0.00 23.12 20.19 1ri9 s ALA 82 CO 0.05 -2.12 0.44 -0.25 0.00 0.00 0.00 175.76 173.88