#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 1.79 -1.91 -3.21 116.57 118.55 1ri9 h LYS 8 Ca 0.00 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.44 1ri9 h LYS 8 Cb 0.00 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1ri9 h LYS 8 CO 0.00 0.00 -0.12 0.93 -1.08 0.00 0.00 179.45 179.18 1ri9 h GLU 9 N 0.00 0.00 -0.83 3.15 3.07 -1.94 -2.23 114.58 115.80 1ri9 h GLU 9 Ca 0.00 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1ri9 h GLU 9 Cb 0.76 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.63 1ri9 h GLU 9 CO 0.00 0.12 0.50 1.49 -1.40 0.00 0.00 179.01 179.73 1ri9 h GLU 10 N 0.00 1.12 0.00 2.33 4.81 -1.55 0.31 114.58 121.61 1ri9 h GLU 10 Ca -0.00 -0.10 -0.10 0.00 -0.13 0.00 0.00 59.36 59.03 1ri9 h GLU 10 Cb 0.32 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 1ri9 h GLU 10 CO 0.02 0.79 -0.49 0.87 -0.73 0.00 0.00 179.01 179.47 1ri9 h LYS 11 N 1.14 0.00 -0.01 1.92 6.56 -1.63 -2.49 116.57 122.05 1ri9 h LYS 11 Ca 0.30 0.00 -0.17 0.00 -1.06 0.00 0.00 60.65 59.72 1ri9 h LYS 11 Cb -0.05 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.60 1ri9 h LYS 11 CO -0.06 0.49 -0.77 0.22 -2.06 0.00 0.00 179.45 177.27 1ri9 h ASP 12 N 0.00 0.17 0.12 0.86 3.58 -1.06 -2.84 116.42 117.25 1ri9 h ASP 12 Ca -0.00 -0.13 -0.01 0.00 0.42 0.00 0.00 57.03 57.31 1ri9 h ASP 12 Cb 0.89 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.89 1ri9 h ASP 12 CO 0.06 0.87 -0.06 0.15 -2.88 0.00 0.00 179.24 177.39 1ri9 h PHE 13 N 0.09 -0.15 -0.00 0.28 3.04 -0.00 -2.69 116.94 117.51 1ri9 h PHE 13 Ca -0.02 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.92 1ri9 h PHE 13 Cb 1.35 0.05 -0.00 0.00 2.56 0.00 0.00 35.95 39.90 1ri9 h PHE 13 CO 0.02 0.10 0.00 -0.09 -2.02 0.00 0.00 178.31 176.32 1ri9 h ARG 14 N -0.38 0.00 0.32 1.11 2.43 -1.51 2.39 114.38 118.74 1ri9 h ARG 14 Ca -0.02 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1ri9 h ARG 14 Cb 0.31 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.83 1ri9 h ARG 14 CO 0.03 0.00 -0.43 -0.22 -1.51 0.00 0.00 179.97 177.84 1ri9 h LYS 15 N 0.00 -0.77 0.04 0.20 3.11 -1.22 0.39 116.57 118.31 1ri9 h LYS 15 Ca 0.00 0.05 -0.27 0.00 -2.81 0.00 0.00 60.65 57.63 1ri9 h LYS 15 Cb 0.01 0.17 -0.03 0.00 -1.00 0.00 0.00 32.23 31.38 1ri9 h LYS 15 CO -0.00 -0.51 -1.38 -0.22 -2.81 0.00 0.00 179.45 174.53 1ri9 h LYS 16 N -0.80 0.08 -1.01 1.90 1.63 -1.34 -3.28 116.57 113.76 1ri9 h LYS 16 Ca -0.02 -0.14 -0.19 0.00 -0.85 0.00 0.00 60.65 59.45 1ri9 h LYS 16 Cb 0.74 0.05 -0.11 0.00 -0.60 0.00 0.00 32.23 32.31 1ri9 h LYS 16 CO -0.13 0.89 0.25 1.19 -3.45 0.00 0.00 179.45 178.19 1ri9 n PHE 17 N -3.29 1.14 0.00 1.91 3.01 0.80 -4.61 117.46 116.42 1ri9 n PHE 17 Ca -0.10 -1.01 0.00 0.00 1.01 0.00 0.00 57.45 57.35 1ri9 n PHE 17 Cb 1.01 -0.51 0.00 0.00 -0.01 0.00 0.00 39.48 39.96 1ri9 n PHE 17 CO 0.00 0.00 0.00 0.36 1.01 0.00 0.00 176.76 178.13 1ri9 n LYS 18 N -0.10 0.00 -1.93 -1.08 0.00 0.13 -4.40 118.16 110.78 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 0.93 -0.85 -0.03 0.00 -0.00 0.00 0.00 35.03 35.09 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 -0.24 2.09 -0.59 5.58 5.04 -1.26 -4.95 117.35 123.02 1ri9 s TYR 19 Ca 0.00 0.17 -0.15 0.00 -2.44 0.00 0.00 57.07 54.66 1ri9 s TYR 19 Cb 0.00 -3.97 0.15 0.00 0.35 0.00 0.00 41.96 38.48 1ri9 s TYR 19 CO 0.00 -4.06 0.53 -0.51 -1.34 0.00 0.00 175.55 170.18 1ri9 s ASP 20 N 3.06 6.23 0.00 4.32 1.11 -1.26 -5.00 116.67 125.13 1ri9 s ASP 20 Ca 0.75 -1.99 0.00 0.00 0.18 0.00 0.00 52.55 51.49 1ri9 s ASP 20 Cb -0.37 -2.18 0.00 0.00 1.07 0.00 0.00 42.92 41.43 1ri9 s ASP 20 CO 0.32 -0.78 0.00 0.61 1.18 0.00 0.00 175.17 176.50 1ri9 n GLY 21 N 4.94 3.19 3.27 0.21 0.00 -1.26 -5.11 105.19 110.44 1ri9 n GLY 21 Ca -0.08 -1.37 -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 3.22 -0.35 1.61 2.12 -1.26 -5.02 118.70 117.12 1ri9 s GLU 22 Ca 0.00 -2.30 -0.28 0.00 0.36 0.00 0.00 54.97 52.75 1ri9 s GLU 22 Cb 0.00 -4.24 -0.02 0.00 0.26 0.00 0.00 34.13 30.13 1ri9 s GLU 22 CO 0.00 -1.27 1.87 0.42 -0.54 0.00 0.00 175.26 175.74 1ri9 s ILE 23 N 0.45 3.40 -0.24 -3.70 1.01 -1.26 -4.92 121.20 115.94 1ri9 s ILE 23 Ca 0.14 0.39 -0.07 0.00 0.00 0.00 0.00 60.65 61.11 1ri9 s ILE 23 Cb -0.16 -3.59 0.11 0.00 0.01 0.00 0.00 42.46 38.83 1ri9 s ILE 23 CO -0.05 -0.41 0.49 -0.60 0.00 0.00 0.00 174.94 174.37 1ri9 s ARG 24 N 5.97 0.41 -0.59 2.79 6.06 -1.26 -5.09 118.95 127.23 1ri9 s ARG 24 Ca 0.81 1.11 -0.26 0.00 -2.50 0.00 0.00 55.73 54.89 1ri9 s ARG 24 Cb -0.22 0.43 -0.05 0.00 0.06 0.00 0.00 34.95 35.17 1ri9 s ARG 24 CO 0.32 -0.29 2.10 0.54 -2.50 0.00 0.00 175.30 175.47 1ri9 s VAL 25 N 2.70 3.21 -0.20 7.11 0.11 -1.26 -4.64 120.40 127.43 1ri9 s VAL 25 Ca -0.00 0.08 -0.17 0.00 -2.93 0.00 0.00 61.98 58.95 1ri9 s VAL 25 Cb -0.12 -3.54 -0.20 0.00 -1.53 0.00 0.00 36.38 30.98 1ri9 s VAL 25 CO -0.15 -0.53 0.17 -0.11 -3.33 0.00 0.00 175.10 171.15 1ri9 n LEU 26 N 14.36 2.06 -3.79 2.54 0.00 -1.21 -4.74 117.00 126.22 1ri9 n LEU 26 Ca 0.29 0.35 -0.29 0.00 0.00 0.00 0.00 56.01 56.36 1ri9 n LEU 26 Cb 0.52 -0.98 -0.13 0.00 0.00 0.00 0.00 43.42 42.83 1ri9 n LEU 26 CO 0.69 0.45 -0.21 -0.72 0.00 0.00 0.00 177.39 177.60 1ri9 s TYR 27 N -2.42 2.44 -0.39 1.96 1.13 -1.25 -5.07 117.35 113.75 1ri9 s TYR 27 Ca -0.29 -2.72 -0.29 0.00 -1.41 0.00 0.00 57.07 52.36 1ri9 s TYR 27 Cb 0.07 -2.21 0.00 0.00 -1.10 0.00 0.00 41.96 38.72 1ri9 s TYR 27 CO 0.62 -0.75 1.49 -1.54 -2.51 0.00 0.00 175.55 172.85 1ri9 s SER 28 N 0.01 6.26 0.42 -0.18 1.04 -1.26 -4.05 113.70 115.95 1ri9 s SER 28 Ca 0.18 0.95 -0.05 0.00 0.48 0.00 0.00 55.95 57.52 1ri9 s SER 28 Cb -0.23 -2.54 -0.04 0.00 0.10 0.00 0.00 66.02 63.32 1ri9 s SER 28 CO -0.02 -1.47 0.70 0.28 0.98 0.00 0.00 173.24 173.72 1ri9 s THR 29 N 5.67 4.95 -0.12 2.02 -1.32 -1.24 -4.78 115.64 120.81 1ri9 s THR 29 Ca 0.65 0.09 -0.05 0.00 -1.21 0.00 0.00 61.69 61.16 1ri9 s THR 29 Cb -0.16 -3.83 -0.04 0.00 -1.51 0.00 0.00 72.50 66.96 1ri9 s THR 29 CO 0.32 -0.68 0.08 -0.54 -2.21 0.00 0.00 174.62 171.59 1ri9 s LYS 30 N -4.38 3.43 0.43 7.08 1.02 -1.26 -3.42 119.74 122.63 1ri9 s LYS 30 Ca 0.46 -0.27 -0.23 0.00 0.02 0.00 0.00 55.97 55.94 1ri9 s LYS 30 Cb -0.10 -3.07 -0.08 0.00 -0.52 0.00 0.00 37.83 34.06 1ri9 s LYS 30 CO 0.39 0.63 1.10 0.08 -0.92 0.00 0.00 175.35 176.63 1ri9 s VAL 31 N -0.63 3.47 0.68 3.17 1.01 0.74 -3.92 120.40 124.92 1ri9 s VAL 31 Ca 0.12 1.11 0.04 0.00 0.00 0.00 0.00 61.98 63.24 1ri9 s VAL 31 Cb -0.12 -3.56 0.12 0.00 0.00 0.00 0.00 36.38 32.82 1ri9 s VAL 31 CO 0.02 -0.01 0.94 0.28 0.00 0.00 0.00 175.10 176.33 1ri9 s THR 32 N -1.63 2.06 -0.14 3.92 -1.32 -1.26 -3.35 115.64 113.92 1ri9 s THR 32 Ca 0.61 -0.76 0.15 0.00 -1.21 0.00 0.00 61.69 60.47 1ri9 s THR 32 Cb -0.24 -2.30 0.04 0.00 -1.51 0.00 0.00 72.50 68.49 1ri9 s THR 32 CO 0.30 0.00 1.40 0.00 -2.21 0.00 0.00 174.62 174.11 1ri9 h THR 33 N -0.31 0.88 -0.39 5.08 1.03 -1.94 1.60 112.91 118.86 1ri9 h THR 33 Ca -0.33 -2.25 0.00 0.00 -0.01 0.00 0.00 66.41 63.82 1ri9 h THR 33 Cb 1.27 2.42 0.00 0.00 -1.07 0.00 0.00 68.15 70.77 1ri9 h THR 33 CO 0.39 0.50 0.00 -0.24 -0.01 0.00 0.00 175.52 176.16 1ri9 n SER 34 N -3.21 2.93 -4.46 0.00 2.88 -1.26 -4.71 113.62 105.79 1ri9 n SER 34 Ca 0.01 -2.23 -0.29 0.00 -1.33 0.00 0.00 58.87 55.03 1ri9 n SER 34 Cb 0.75 -0.43 0.19 0.00 -0.75 0.00 0.00 64.21 63.98 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 -1.68 1.90 -0.15 2.46 -1.16 -1.17 -4.81 121.20 116.59 1ri9 s ILE 35 Ca 0.30 0.00 -0.29 0.00 -0.51 0.00 0.00 60.65 60.15 1ri9 s ILE 35 Cb 0.19 -2.50 -0.04 0.00 0.61 0.00 0.00 42.46 40.72 1ri9 s ILE 35 CO 0.15 0.00 1.59 0.28 -2.81 0.00 0.00 174.94 174.15 1ri9 s THR 36 N -3.00 3.72 -0.01 4.00 -1.32 -1.26 -4.67 115.64 113.11 1ri9 s THR 36 Ca 0.67 0.85 0.01 0.00 -1.21 0.00 0.00 61.69 62.01 1ri9 s THR 36 Cb -0.16 -3.64 -0.01 0.00 -1.51 0.00 0.00 72.50 67.17 1ri9 s THR 36 CO 0.57 -0.18 0.01 -1.54 -2.21 0.00 0.00 174.62 171.27 1ri9 n SER 37 N 7.72 4.75 -0.12 8.08 3.41 -1.26 -4.45 113.62 131.75 1ri9 n SER 37 Ca 0.18 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 58.55 1ri9 n SER 37 Cb 0.44 0.63 -0.09 0.00 -0.26 0.00 0.00 64.21 64.93 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 -1.93 0.52 -2.07 4.33 2.85 -1.26 -4.93 118.16 115.68 1ri9 n LYS 38 Ca -0.01 0.20 -0.42 0.00 -1.05 0.00 0.00 58.31 57.03 1ri9 n LYS 38 Cb 0.43 -1.38 -0.03 0.00 -0.65 0.00 0.00 35.03 33.40 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 -2.44 4.22 -0.07 -1.58 2.47 -1.26 -4.98 119.74 116.10 1ri9 s LYS 39 Ca -0.33 2.14 -0.03 0.00 -1.56 0.00 0.00 55.97 56.19 1ri9 s LYS 39 Cb 0.12 -3.72 0.04 0.00 -1.46 0.00 0.00 37.83 32.81 1ri9 s LYS 39 CO 0.45 -0.72 0.15 -1.58 0.16 0.00 0.00 175.35 173.81 1ri9 s TRP 40 N 3.04 -0.16 0.27 4.03 0.23 -1.26 -4.87 118.94 120.21 1ri9 s TRP 40 Ca 0.70 0.49 0.12 0.00 -2.03 0.00 0.00 56.10 55.37 1ri9 s TRP 40 Cb -0.34 -0.09 -0.05 0.00 0.03 0.00 0.00 33.47 33.02 1ri9 s TRP 40 CO 0.29 -0.17 -0.17 0.20 0.96 0.00 0.00 176.95 178.05 1ri9 s GLY 41 N 1.21 1.83 0.37 0.98 0.00 -1.26 -4.98 107.32 105.47 1ri9 s GLY 41 Ca -0.09 -1.81 0.08 0.00 0.00 0.00 0.00 44.72 42.90 1ri9 s GLY 41 CO -0.06 -1.89 1.93 0.00 0.00 0.00 0.00 173.10 173.08 1ri9 h THR 42 N 2.32 0.95 -0.49 0.90 1.03 -2.01 0.31 112.91 115.92 1ri9 h THR 42 Ca -0.41 -0.24 0.00 0.00 -0.01 0.00 0.00 66.41 65.75 1ri9 h THR 42 Cb 1.25 0.19 0.00 0.00 -1.07 0.00 0.00 68.15 68.53 1ri9 h THR 42 CO 0.59 0.13 0.00 0.54 -0.01 0.00 0.00 175.52 176.76 1ri9 n ARG 43 N -4.50 2.39 -3.84 0.00 1.74 -1.26 -4.92 116.66 106.28 1ri9 n ARG 43 Ca 0.13 -2.13 -0.21 0.00 -0.77 0.00 0.00 57.85 54.86 1ri9 n ARG 43 Cb 0.32 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.24 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 5.62 0.09 0.55 2.15 0.11 0.17 116.67 124.11 1ri9 s ASP 44 Ca 0.40 -0.30 -0.04 0.00 0.43 0.00 0.00 52.55 53.04 1ri9 s ASP 44 Cb 0.22 -1.25 -0.05 0.00 -0.30 0.00 0.00 42.92 41.54 1ri9 s ASP 44 CO 0.30 -0.25 0.31 -0.22 -0.17 0.00 0.00 175.17 175.13 1ri9 s LEU 45 N -3.99 4.32 -0.20 -1.34 2.96 -1.15 -4.57 118.68 114.70 1ri9 s LEU 45 Ca 0.39 0.50 0.01 0.00 -0.22 0.00 0.00 54.13 54.81 1ri9 s LEU 45 Cb -0.07 -3.07 0.26 0.00 0.50 0.00 0.00 46.19 43.81 1ri9 s LEU 45 CO 0.27 0.13 1.47 1.67 -1.32 0.00 0.00 176.35 178.57 1ri9 n GLN 46 N 0.38 1.54 -0.92 1.98 7.27 -1.26 -4.82 117.38 121.55 1ri9 n GLN 46 Ca -0.05 -1.25 -0.31 0.00 0.07 0.00 0.00 57.00 55.46 1ri9 n GLN 46 Cb 0.52 -1.49 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 2.56 0.24 1.69 -7.23 -1.26 -5.04 120.40 109.92 1ri9 s VAL 47 Ca 0.24 0.18 0.09 0.00 -1.81 0.00 0.00 61.98 60.68 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 0.01 -0.54 -0.31 0.00 0.00 175.10 174.06 1ri9 s LYS 48 N -4.75 2.38 -0.08 4.82 3.01 -1.26 -4.65 119.74 119.21 1ri9 s LYS 48 Ca 0.65 -1.30 -0.30 0.00 -1.01 0.00 0.00 55.97 54.01 1ri9 s LYS 48 Cb -0.21 -2.25 -0.03 0.00 -1.01 0.00 0.00 37.83 34.34 1ri9 s LYS 48 CO 0.57 0.39 1.23 -1.25 0.51 0.00 0.00 175.35 176.81 1ri9 s PRO 49 N -3.49 4.32 0.00 -1.68 0.04 -1.26 -2.88 135.00 130.05 1ri9 s PRO 49 Ca 0.30 1.70 0.00 0.00 0.04 0.00 0.00 61.00 63.04 1ri9 s PRO 49 Cb -0.07 -3.61 0.00 0.00 0.04 0.00 0.00 34.50 30.86 1ri9 s PRO 49 CO 0.20 -0.52 0.00 0.41 0.04 0.00 0.00 177.00 177.13 1ri9 n GLY 50 N 3.45 1.03 3.91 0.56 0.00 0.54 -4.60 105.19 110.08 1ri9 n GLY 50 Ca 0.12 0.00 -0.21 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 -0.52 2.54 -0.05 1.61 8.01 -1.14 -4.89 118.70 124.26 1ri9 s GLU 51 Ca 0.00 -1.53 0.01 0.00 0.01 0.00 0.00 54.97 53.46 1ri9 s GLU 51 Cb 0.00 -2.43 0.02 0.00 -4.31 0.00 0.00 34.13 27.41 1ri9 s GLU 51 CO 0.00 -0.28 -0.08 -1.54 0.01 0.00 0.00 175.26 173.38 1ri9 s SER 52 N -4.21 1.32 0.20 -0.19 1.04 -1.26 0.26 113.70 110.87 1ri9 s SER 52 Ca 0.49 -0.20 -0.02 0.00 0.48 0.00 0.00 55.95 56.70 1ri9 s SER 52 Cb -0.04 -0.61 -0.04 0.00 0.10 0.00 0.00 66.02 65.43 1ri9 s SER 52 CO 0.29 -0.02 0.16 -1.48 0.98 0.00 0.00 173.24 173.17 1ri9 s LEU 53 N 0.84 1.08 0.14 2.42 2.34 -1.22 -4.94 118.68 119.34 1ri9 s LEU 53 Ca -0.12 -1.35 -0.30 0.00 0.06 0.00 0.00 54.13 52.42 1ri9 s LEU 53 Cb -0.15 0.50 -0.07 0.00 -0.56 0.00 0.00 46.19 45.91 1ri9 s LEU 53 CO 0.01 -0.87 1.04 -1.61 -1.06 0.00 0.00 176.35 173.87 1ri9 s GLU 54 N -4.14 4.63 -0.13 1.48 8.01 -1.19 -3.65 118.70 123.71 1ri9 s GLU 54 Ca 0.38 1.59 -0.04 0.00 0.01 0.00 0.00 54.97 56.91 1ri9 s GLU 54 Cb 0.06 -3.33 -0.03 0.00 -4.31 0.00 0.00 34.13 26.52 1ri9 s GLU 54 CO 0.12 0.12 0.01 0.08 0.01 0.00 0.00 175.26 175.60 1ri9 s VAL 55 N -0.03 4.39 0.00 2.63 1.01 -1.26 0.03 120.40 127.17 1ri9 s VAL 55 Ca 0.49 -0.20 0.00 0.00 0.00 0.00 0.00 61.98 62.27 1ri9 s VAL 55 Cb -0.26 -2.91 0.00 0.00 0.00 0.00 0.00 36.38 33.21 1ri9 s VAL 55 CO 0.32 0.53 0.00 -0.38 0.00 0.00 0.00 175.10 175.57 1ri9 n ILE 56 N 2.91 0.00 -3.67 2.22 5.41 0.96 -3.33 119.36 123.85 1ri9 n ILE 56 Ca -0.18 0.00 -0.24 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 3.18 3.48 0.10 0.38 -1.52 -1.26 -4.67 119.66 119.35 1ri9 s GLN 57 Ca 0.00 -0.47 -0.31 0.00 -1.95 0.00 0.00 55.36 52.63 1ri9 s GLN 57 Cb 0.00 -2.79 -0.08 0.00 -0.22 0.00 0.00 33.01 29.92 1ri9 s GLN 57 CO 0.00 0.32 1.45 0.95 -0.25 0.00 0.00 175.29 177.76 1ri9 s THR 58 N -2.06 3.20 0.00 -0.19 -4.23 -1.26 -2.95 115.64 108.15 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 0.32 0.05 0.69 0.41 -0.54 0.00 0.00 174.62 175.54 1ri9 n THR 59 N 4.13 0.00 0.00 3.99 -1.04 0.13 -4.87 114.28 116.62 1ri9 n THR 59 Ca 0.13 1.17 0.00 0.00 -2.04 0.00 0.00 64.05 63.31 1ri9 n THR 59 Cb 0.42 -2.14 0.00 0.00 -1.82 0.00 0.00 70.33 66.79 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 -1.19 0.00 0.02 8.00 2.03 -1.26 -5.02 116.55 119.12 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 0.88 -3.45 1.67 9.92 -1.26 -4.87 116.55 119.44 1ri9 n ASP 61 Ca 0.00 0.12 -0.31 0.00 -0.53 0.00 0.00 54.79 54.07 1ri9 n ASP 61 Cb 0.00 -0.29 -0.05 0.00 -0.64 0.00 0.00 41.12 40.14 1ri9 n ASP 61 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 1ri9 n THR 62 N -3.45 3.23 -3.65 -3.53 -1.04 -1.26 -4.98 114.28 99.59 1ri9 n THR 62 Ca -0.03 -5.46 -0.08 0.00 -2.04 0.00 0.00 64.05 56.44 1ri9 n THR 62 Cb 0.23 -1.95 -0.08 0.00 -1.82 0.00 0.00 70.33 66.71 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 -2.82 0.63 -0.12 -2.82 2.47 -1.26 -2.72 119.74 113.11 1ri9 s LYS 63 Ca 0.40 1.12 0.02 0.00 -1.56 0.00 0.00 55.97 55.94 1ri9 s LYS 63 Cb 0.16 0.10 0.01 0.00 -1.46 0.00 0.00 37.83 36.64 1ri9 s LYS 63 CO -0.02 -0.15 -0.16 0.14 0.16 0.00 0.00 175.35 175.32 1ri9 s VAL 64 N 1.56 1.61 -0.24 4.02 -7.23 -1.01 0.22 120.40 119.34 1ri9 s VAL 64 Ca -0.10 -0.70 -0.20 0.00 -1.81 0.00 0.00 61.98 59.17 1ri9 s VAL 64 Cb -0.06 -1.46 -0.02 0.00 0.56 0.00 0.00 36.38 35.39 1ri9 s VAL 64 CO -0.18 0.46 0.60 -0.22 -0.31 0.00 0.00 175.10 175.46 1ri9 s LEU 65 N 1.01 4.09 0.28 1.32 2.96 -1.15 -2.15 118.68 125.03 1ri9 s LEU 65 Ca -0.05 0.71 0.04 0.00 -0.22 0.00 0.00 54.13 54.61 1ri9 s LEU 65 Cb -0.15 -2.82 -0.03 0.00 0.50 0.00 0.00 46.19 43.69 1ri9 s LEU 65 CO -0.03 -0.32 0.42 0.00 -1.32 0.00 0.00 176.35 175.10 1ri9 s ARG 67 N -4.08 0.58 0.03 0.00 3.52 0.10 -2.76 118.95 116.35 1ri9 s ARG 67 Ca 0.37 -0.50 0.09 0.00 -0.13 0.00 0.00 55.73 55.56 1ri9 s ARG 67 Cb -0.09 -0.50 -0.03 0.00 -1.56 0.00 0.00 34.95 32.77 1ri9 s ARG 67 CO 0.31 0.12 -0.25 0.54 -0.81 0.00 0.00 175.30 175.21 1ri9 s ASN 68 N -0.81 3.23 0.30 -2.12 4.22 -1.10 -3.19 114.94 115.47 1ri9 s ASN 68 Ca -0.02 -0.54 0.14 0.00 -2.14 0.00 0.00 52.86 50.30 1ri9 s ASN 68 Cb -0.06 -0.35 0.78 0.00 1.28 0.00 0.00 41.25 42.90 1ri9 s ASN 68 CO 0.00 0.27 1.36 1.21 -2.04 0.00 0.00 177.10 177.90 1ri9 n GLU 69 N 1.90 0.10 0.07 3.55 0.00 -1.26 -0.60 120.64 124.39 1ri9 n GLU 69 Ca -0.17 0.57 0.04 0.00 0.00 0.00 0.00 57.16 57.61 1ri9 n GLU 69 Cb 0.52 -2.03 0.24 0.00 0.00 0.00 0.00 31.44 30.17 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 -2.05 0.06 -0.91 5.31 4.07 -1.26 -4.76 120.64 121.09 1ri9 n GLU 70 Ca -0.01 0.55 0.00 0.00 -0.06 0.00 0.00 57.16 57.64 1ri9 n GLU 70 Cb 0.23 -1.70 0.00 0.00 -0.06 0.00 0.00 31.44 29.91 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 -1.41 0.51 3.29 8.31 0.00 0.23 -4.28 105.19 111.83 1ri9 n GLY 71 Ca -0.01 -0.89 -0.25 0.00 0.00 0.00 0.00 46.02 44.88 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 -1.83 1.20 0.22 1.61 2.36 -1.22 -3.14 119.74 118.94 1ri9 s LYS 72 Ca 0.00 -1.13 0.10 0.00 -2.55 0.00 0.00 55.97 52.39 1ri9 s LYS 72 Cb 0.00 -1.45 -0.04 0.00 -1.05 0.00 0.00 37.83 35.28 1ri9 s LYS 72 CO 0.00 0.35 -0.10 0.71 1.55 0.00 0.00 175.35 177.86 1ri9 s TYR 73 N -1.08 2.57 0.15 4.03 1.51 -1.26 -2.69 117.35 120.58 1ri9 s TYR 73 Ca 0.07 -0.25 -0.20 0.00 -1.01 0.00 0.00 57.07 55.68 1ri9 s TYR 73 Cb -0.10 -1.20 0.06 0.00 -0.11 0.00 0.00 41.96 40.61 1ri9 s TYR 73 CO 0.04 0.57 0.52 0.20 -1.11 0.00 0.00 175.55 175.77 1ri9 s GLY 74 N -3.17 -0.48 0.13 0.71 0.00 -1.11 -4.87 107.32 98.53 1ri9 s GLY 74 Ca 0.27 0.27 0.03 0.00 0.00 0.00 0.00 44.72 45.29 1ri9 s GLY 74 CO 0.16 -0.03 0.18 -0.19 0.00 0.00 0.00 173.10 173.22 1ri9 s TYR 75 N -3.77 3.32 -0.07 1.90 2.02 0.13 -1.99 117.35 118.89 1ri9 s TYR 75 Ca 0.02 0.09 -0.00 0.00 -0.37 0.00 0.00 57.07 56.80 1ri9 s TYR 75 Cb 0.00 -1.62 0.02 0.00 -0.40 0.00 0.00 41.96 39.96 1ri9 s TYR 75 CO -0.13 0.53 -0.03 0.08 -1.57 0.00 0.00 175.55 174.43 1ri9 s VAL 76 N -1.64 0.56 0.32 0.71 1.01 -0.91 -2.94 120.40 117.51 1ri9 s VAL 76 Ca 0.32 -0.06 -0.28 0.00 0.00 0.00 0.00 61.98 61.97 1ri9 s VAL 76 Cb -0.11 -0.64 -0.09 0.00 0.00 0.00 0.00 36.38 35.54 1ri9 s VAL 76 CO 0.25 0.27 1.10 -0.22 0.00 0.00 0.00 175.10 176.50 1ri9 s LEU 77 N 1.47 4.42 0.64 3.92 0.20 -1.26 -2.41 118.68 125.66 1ri9 s LEU 77 Ca -0.02 2.22 0.34 0.00 0.69 0.00 0.00 54.13 57.37 1ri9 s LEU 77 Cb -0.13 -3.80 1.89 0.00 -0.43 0.00 0.00 46.19 43.71 1ri9 s LEU 77 CO -0.03 -0.28 2.12 0.08 -0.29 0.00 0.00 176.35 177.95 1ri9 h ARG 78 N 3.37 0.00 -0.03 1.98 -0.00 -1.88 -2.40 114.38 115.42 1ri9 h ARG 78 Ca -0.47 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 0.65 0.00 -0.52 1.03 -0.00 0.00 0.00 179.97 181.14 1ri9 h SER 79 N 0.00 -1.60 -3.21 0.08 0.87 -1.90 -3.27 113.55 104.52 1ri9 h SER 79 Ca 0.03 0.18 -0.64 0.00 -1.23 0.00 0.00 61.79 60.13 1ri9 h SER 79 Cb 0.41 0.62 -0.40 0.00 -0.44 0.00 0.00 62.40 62.58 1ri9 h SER 79 CO -0.00 -0.51 -0.44 -0.72 -0.53 0.00 0.00 176.83 174.63 1ri9 s TYR 80 N -5.77 3.66 -0.25 2.24 -0.85 -0.90 -5.02 117.35 110.46 1ri9 s TYR 80 Ca -0.16 -3.25 -0.26 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 0.00 175.55 173.76 1ri9 s LEU 81 N -1.39 -0.57 1.20 -3.49 1.98 -1.23 -4.30 118.68 110.88 1ri9 s LEU 81 Ca 0.25 1.02 -0.18 0.00 -2.89 0.00 0.00 54.13 52.34 1ri9 s LEU 81 Cb -0.06 2.15 0.23 0.00 0.66 0.00 0.00 46.19 49.17 1ri9 s LEU 81 CO -0.15 -0.24 0.51 0.00 -1.89 0.00 0.00 176.35 174.57 1ri9 n ALA 82 N 2.14 -3.36 0.00 5.97 0.00 -1.25 -4.96 120.51 119.05 1ri9 n ALA 82 Ca -0.13 -1.39 0.00 0.00 0.00 0.00 0.00 53.44 51.92 1ri9 n ALA 82 Cb 0.56 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.54 1ri9 n ALA 82 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25