#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 0.25 0.01 3.44 4.01 -1.26 -3.48 118.16 121.13 1ri9 n LYS 8 Ca 0.00 0.15 0.03 0.00 -0.51 0.00 0.00 58.31 57.97 1ri9 n LYS 8 Cb 0.00 -1.73 0.38 0.00 -0.51 0.00 0.00 35.03 33.17 1ri9 n LYS 8 CO 0.00 0.00 0.00 0.93 -1.11 0.00 0.00 177.40 177.22 1ri9 h GLU 9 N 0.00 0.50 -0.14 1.97 4.39 -1.94 -1.09 114.58 118.27 1ri9 h GLU 9 Ca 0.00 -0.06 -0.05 0.00 0.34 0.00 0.00 59.36 59.59 1ri9 h GLU 9 Cb 0.72 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.26 1ri9 h GLU 9 CO 0.00 0.42 -0.14 1.49 -1.16 0.00 0.00 179.01 179.61 1ri9 h GLU 10 N 0.50 0.23 -0.27 2.33 4.81 -1.57 -1.84 114.58 118.78 1ri9 h GLU 10 Ca 0.13 -0.05 -0.11 0.00 -0.13 0.00 0.00 59.36 59.19 1ri9 h GLU 10 Cb 0.10 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 1ri9 h GLU 10 CO -0.01 0.38 -0.30 0.87 -0.73 0.00 0.00 179.01 179.22 1ri9 h LYS 11 N 0.22 0.55 -0.86 1.92 1.79 -1.39 0.59 116.57 119.39 1ri9 h LYS 11 Ca 0.04 -0.24 0.01 0.00 -2.18 0.00 0.00 60.65 58.29 1ri9 h LYS 11 Cb 0.39 -0.02 -0.04 0.00 -1.58 0.00 0.00 32.23 30.98 1ri9 h LYS 11 CO 0.02 0.79 0.57 0.22 -1.08 0.00 0.00 179.45 179.98 1ri9 h ASP 12 N 0.48 0.98 0.00 0.86 3.58 -1.07 0.98 116.42 122.23 1ri9 h ASP 12 Ca 0.06 -0.02 -0.07 0.00 0.42 0.00 0.00 57.03 57.42 1ri9 h ASP 12 Cb 0.76 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 41.56 1ri9 h ASP 12 CO 0.06 0.70 -0.39 0.15 -2.88 0.00 0.00 179.24 176.88 1ri9 h PHE 13 N 1.15 0.00 -0.62 0.28 3.04 -1.26 -3.31 116.94 116.22 1ri9 h PHE 13 Ca 0.32 -0.00 0.03 0.00 3.98 0.00 0.00 57.97 62.30 1ri9 h PHE 13 Cb -0.11 -0.00 -0.03 0.00 2.56 0.00 0.00 35.95 38.37 1ri9 h PHE 13 CO -0.00 1.15 0.41 -0.09 -2.02 0.00 0.00 178.31 177.76 1ri9 h ARG 14 N -1.00 0.71 0.04 1.11 2.43 0.29 3.44 114.38 121.40 1ri9 h ARG 14 Ca -0.11 -0.04 0.03 0.00 -0.81 0.00 0.00 59.98 59.05 1ri9 h ARG 14 Cb 1.10 -0.16 -0.05 0.00 -0.42 0.00 0.00 29.97 30.43 1ri9 h ARG 14 CO -0.06 0.47 -0.43 1.57 -1.51 0.00 0.00 179.97 180.01 1ri9 h LYS 15 N 0.73 -0.59 0.09 0.20 5.09 0.90 0.94 116.57 123.92 1ri9 h LYS 15 Ca 0.25 0.04 -0.28 0.00 0.09 0.00 0.00 60.65 60.75 1ri9 h LYS 15 Cb 0.08 0.13 -0.01 0.00 0.10 0.00 0.00 32.23 32.53 1ri9 h LYS 15 CO -0.07 -0.39 -1.38 -0.22 -2.09 0.00 0.00 179.45 175.30 1ri9 h LYS 16 N -0.61 0.18 -1.00 0.07 1.63 -1.53 -3.26 116.57 112.05 1ri9 h LYS 16 Ca 0.04 -0.31 -0.19 0.00 -0.85 0.00 0.00 60.65 59.34 1ri9 h LYS 16 Cb 0.67 0.11 -0.11 0.00 -0.60 0.00 0.00 32.23 32.30 1ri9 h LYS 16 CO -0.30 1.05 0.24 1.19 -3.45 0.00 0.00 179.45 178.19 1ri9 n PHE 17 N -3.41 1.14 0.00 1.91 3.01 1.14 -4.61 117.46 116.64 1ri9 n PHE 17 Ca -0.11 -0.99 0.00 0.00 1.01 0.00 0.00 57.45 57.36 1ri9 n PHE 17 Cb 1.02 -0.51 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 -0.11 0.00 -1.89 -1.08 0.00 0.32 -4.41 118.16 110.99 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 35.08 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 -0.19 1.95 -0.61 5.64 5.04 -1.26 -4.95 117.35 122.98 1ri9 s TYR 19 Ca 0.00 0.06 -0.16 0.00 -2.44 0.00 0.00 57.07 54.53 1ri9 s TYR 19 Cb 0.00 -4.03 0.15 0.00 0.35 0.00 0.00 41.96 38.43 1ri9 s TYR 19 CO 0.00 -4.33 0.57 -0.51 -1.34 0.00 0.00 175.55 169.94 1ri9 s ASP 20 N 3.29 6.31 0.00 4.32 1.11 -1.26 -4.99 116.67 125.45 1ri9 s ASP 20 Ca 0.78 -1.95 0.00 0.00 0.18 0.00 0.00 52.55 51.55 1ri9 s ASP 20 Cb -0.38 -2.22 0.00 0.00 1.07 0.00 0.00 42.92 41.39 1ri9 s ASP 20 CO 0.34 -0.82 0.00 0.61 1.18 0.00 0.00 175.17 176.48 1ri9 n GLY 21 N 5.00 3.17 3.28 0.21 0.00 -1.26 -5.11 105.19 110.49 1ri9 n GLY 21 Ca -0.08 -1.37 -0.45 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 3.26 -0.37 1.61 2.12 -1.26 -5.02 118.70 117.12 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 -4.27 -0.02 0.00 0.26 0.00 0.00 34.13 30.10 1ri9 s GLU 22 CO 0.00 -1.27 1.81 0.42 -0.54 0.00 0.00 175.26 175.67 1ri9 s ILE 23 N 0.49 3.46 -0.24 -3.70 1.01 -1.26 -4.89 121.20 116.08 1ri9 s ILE 23 Ca 0.14 0.45 -0.05 0.00 0.00 0.00 0.00 60.65 61.19 1ri9 s ILE 23 Cb -0.17 -3.68 0.12 0.00 0.01 0.00 0.00 42.46 38.75 1ri9 s ILE 23 CO -0.05 -0.47 0.47 -0.60 0.00 0.00 0.00 174.94 174.28 1ri9 s ARG 24 N 5.85 0.40 -0.56 2.79 3.00 -1.26 -5.10 118.95 124.07 1ri9 s ARG 24 Ca 0.78 0.96 -0.26 0.00 -1.00 0.00 0.00 55.73 56.21 1ri9 s ARG 24 Cb -0.21 0.23 -0.04 0.00 0.00 0.00 0.00 34.95 34.93 1ri9 s ARG 24 CO 0.32 -0.39 2.07 0.08 0.00 0.00 0.00 175.30 177.38 1ri9 s VAL 25 N 2.67 3.22 -0.21 7.11 1.01 -1.26 -4.62 120.40 128.32 1ri9 s VAL 25 Ca 0.04 0.13 -0.20 0.00 0.00 0.00 0.00 61.98 61.95 1ri9 s VAL 25 Cb -0.13 -3.57 -0.19 0.00 0.00 0.00 0.00 36.38 32.48 1ri9 s VAL 25 CO -0.16 -0.55 0.18 -0.11 0.00 0.00 0.00 175.10 174.47 1ri9 n LEU 26 N 13.96 1.93 -3.77 3.92 0.00 -1.21 -4.74 117.00 127.08 1ri9 n LEU 26 Ca 0.27 0.40 -0.29 0.00 0.00 0.00 0.00 56.01 56.38 1ri9 n LEU 26 Cb 0.53 -0.97 -0.13 0.00 0.00 0.00 0.00 43.42 42.85 1ri9 n LEU 26 CO 0.71 0.34 -0.21 -0.72 0.00 0.00 0.00 177.39 177.51 1ri9 s TYR 27 N -2.39 2.39 -0.35 1.96 1.13 -1.25 -5.08 117.35 113.77 1ri9 s TYR 27 Ca -0.29 -2.70 -0.29 0.00 -1.41 0.00 0.00 57.07 52.38 1ri9 s TYR 27 Cb 0.07 -2.14 -0.01 0.00 -1.10 0.00 0.00 41.96 38.78 1ri9 s TYR 27 CO 0.60 -0.75 1.58 -1.54 -2.51 0.00 0.00 175.55 172.93 1ri9 s SER 28 N -0.03 6.20 0.53 -0.18 1.04 -1.26 -4.05 113.70 115.94 1ri9 s SER 28 Ca 0.19 1.13 -0.07 0.00 0.48 0.00 0.00 55.95 57.68 1ri9 s SER 28 Cb -0.21 -2.53 -0.04 0.00 0.10 0.00 0.00 66.02 63.34 1ri9 s SER 28 CO -0.03 -1.49 0.88 0.28 0.98 0.00 0.00 173.24 173.85 1ri9 s THR 29 N 5.88 4.80 -0.15 2.02 -1.32 -1.22 -4.76 115.64 120.88 1ri9 s THR 29 Ca 0.69 0.43 -0.07 0.00 -1.21 0.00 0.00 61.69 61.53 1ri9 s THR 29 Cb -0.19 -3.86 -0.04 0.00 -1.51 0.00 0.00 72.50 66.91 1ri9 s THR 29 CO 0.32 -0.94 0.10 -0.75 -2.21 0.00 0.00 174.62 171.14 1ri9 s LYS 30 N -4.90 3.70 -0.11 7.08 2.36 -1.26 -3.29 119.74 123.31 1ri9 s LYS 30 Ca 0.50 -0.24 -0.30 0.00 -2.55 0.00 0.00 55.97 53.39 1ri9 s LYS 30 Cb -0.11 -3.21 -0.03 0.00 -1.05 0.00 0.00 37.83 33.44 1ri9 s LYS 30 CO 0.48 0.53 1.38 0.08 1.55 0.00 0.00 175.35 179.37 1ri9 s VAL 31 N -0.33 4.02 1.08 4.02 1.01 0.60 -3.82 120.40 126.99 1ri9 s VAL 31 Ca 0.10 1.26 -0.18 0.00 0.00 0.00 0.00 61.98 63.17 1ri9 s VAL 31 Cb -0.12 -3.82 0.25 0.00 0.00 0.00 0.00 36.38 32.69 1ri9 s VAL 31 CO 0.01 -0.09 1.25 0.28 0.00 0.00 0.00 175.10 176.55 1ri9 s THR 32 N 3.45 1.82 -0.67 3.92 -1.32 -1.26 -0.84 115.64 120.73 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 -0.26 -2.80 0.27 0.00 -1.51 0.00 0.00 72.50 68.21 1ri9 s THR 32 CO 0.20 0.00 1.71 0.00 -2.21 0.00 0.00 174.62 174.32 1ri9 h THR 33 N -2.09 0.00 -0.55 5.08 1.03 -1.93 1.70 112.91 116.15 1ri9 h THR 33 Ca -0.44 -0.56 0.00 0.00 -0.01 0.00 0.00 66.41 65.40 1ri9 h THR 33 Cb 1.25 1.52 0.00 0.00 -1.07 0.00 0.00 68.15 69.85 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 -2.38 3.73 -4.54 0.00 2.88 -1.26 -4.74 113.62 107.30 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 0.45 -0.48 0.19 0.00 -0.75 0.00 0.00 64.21 63.61 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 -1.61 1.94 -0.17 2.46 -1.16 -1.14 -4.65 121.20 116.87 1ri9 s ILE 35 Ca 0.41 0.00 -0.29 0.00 -0.51 0.00 0.00 60.65 60.26 1ri9 s ILE 35 Cb 0.25 -2.52 -0.03 0.00 0.61 0.00 0.00 42.46 40.77 1ri9 s ILE 35 CO 0.22 0.00 1.54 0.28 -2.81 0.00 0.00 174.94 174.17 1ri9 s THR 36 N -3.02 3.81 -0.01 4.00 -1.32 -1.25 -4.60 115.64 113.25 1ri9 s THR 36 Ca 0.66 0.94 0.01 0.00 -1.21 0.00 0.00 61.69 62.10 1ri9 s THR 36 Cb -0.17 -3.73 -0.02 0.00 -1.51 0.00 0.00 72.50 67.08 1ri9 s THR 36 CO 0.57 -0.21 0.01 -0.24 -2.21 0.00 0.00 174.62 172.53 1ri9 n SER 37 N 7.69 4.69 -0.11 8.08 2.88 -1.26 -4.40 113.62 131.20 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 0.45 0.66 -0.08 0.00 -0.75 0.00 0.00 64.21 64.49 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 0.46 -2.09 -1.46 2.85 -1.26 -4.94 118.16 109.80 1ri9 n LYS 38 Ca -0.02 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 4.25 -0.08 -1.58 2.47 -1.26 -4.99 119.74 116.15 1ri9 s LYS 39 Ca -0.30 2.13 -0.04 0.00 -1.56 0.00 0.00 55.97 56.20 1ri9 s LYS 39 Cb 0.11 -3.56 0.04 0.00 -1.46 0.00 0.00 37.83 32.96 1ri9 s LYS 39 CO 0.39 -0.63 0.17 -1.58 0.16 0.00 0.00 175.35 173.86 1ri9 s TRP 40 N 2.40 -0.21 0.27 4.03 0.23 -1.26 -4.85 118.94 119.55 1ri9 s TRP 40 Ca 0.68 0.56 0.11 0.00 -2.03 0.00 0.00 56.10 55.42 1ri9 s TRP 40 Cb -0.35 -0.04 -0.05 0.00 0.03 0.00 0.00 33.47 33.05 1ri9 s TRP 40 CO 0.29 -0.18 -0.16 0.20 0.96 0.00 0.00 176.95 178.06 1ri9 s GLY 41 N 1.14 1.83 0.38 0.98 0.00 -1.26 -4.98 107.32 105.41 1ri9 s GLY 41 Ca -0.09 -1.82 0.09 0.00 0.00 0.00 0.00 44.72 42.90 1ri9 s GLY 41 CO -0.06 -1.90 1.94 0.00 0.00 0.00 0.00 173.10 173.08 1ri9 h THR 42 N 2.26 0.94 -0.45 0.90 1.03 -2.01 0.35 112.91 115.92 1ri9 h THR 42 Ca -0.41 -0.22 0.00 0.00 -0.01 0.00 0.00 66.41 65.77 1ri9 h THR 42 Cb 1.25 0.25 0.00 0.00 -1.07 0.00 0.00 68.15 68.58 1ri9 h THR 42 CO 0.59 0.12 0.00 0.54 -0.01 0.00 0.00 175.52 176.76 1ri9 n ARG 43 N -4.49 2.33 -3.93 0.00 1.74 -1.26 -4.91 116.66 106.13 1ri9 n ARG 43 Ca 0.12 -2.03 -0.21 0.00 -0.77 0.00 0.00 57.85 54.95 1ri9 n ARG 43 Cb 0.33 -1.47 -0.03 0.00 -1.02 0.00 0.00 32.46 30.26 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 -1.27 5.56 0.18 0.55 2.15 0.12 -1.22 116.67 122.74 1ri9 s ASP 44 Ca 0.38 -0.30 0.01 0.00 0.43 0.00 0.00 52.55 53.07 1ri9 s ASP 44 Cb 0.21 -1.28 -0.04 0.00 -0.30 0.00 0.00 42.92 41.51 1ri9 s ASP 44 CO 0.29 -0.19 0.35 -0.22 -0.17 0.00 0.00 175.17 175.23 1ri9 s LEU 45 N -3.94 4.27 -0.21 -1.34 2.96 -1.20 -4.57 118.68 114.64 1ri9 s LEU 45 Ca 0.37 0.31 0.02 0.00 -0.22 0.00 0.00 54.13 54.61 1ri9 s LEU 45 Cb -0.07 -3.07 0.30 0.00 0.50 0.00 0.00 46.19 43.85 1ri9 s LEU 45 CO 0.26 -0.01 1.45 1.67 -1.32 0.00 0.00 176.35 178.41 1ri9 n GLN 46 N -0.63 1.58 -0.90 1.98 7.27 -1.26 -4.82 117.38 120.60 1ri9 n GLN 46 Ca -0.06 -1.38 -0.31 0.00 0.07 0.00 0.00 57.00 55.33 1ri9 n GLN 46 Cb 0.54 -1.54 0.14 0.00 2.41 0.00 0.00 30.24 31.79 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 -1.54 2.51 0.20 1.69 -7.23 -1.26 -5.04 120.40 109.72 1ri9 s VAL 47 Ca 0.26 0.17 0.09 0.00 -1.81 0.00 0.00 61.98 60.69 1ri9 s VAL 47 Cb 0.22 -2.35 -0.04 0.00 0.56 0.00 0.00 36.38 34.76 1ri9 s VAL 47 CO 0.05 -0.22 -0.09 -0.54 -0.31 0.00 0.00 175.10 173.99 1ri9 s LYS 48 N -4.74 2.05 -0.01 4.82 3.01 -1.26 -4.62 119.74 118.99 1ri9 s LYS 48 Ca 0.65 -1.32 -0.30 0.00 -1.01 0.00 0.00 55.97 53.98 1ri9 s LYS 48 Cb -0.21 -2.13 -0.04 0.00 -1.01 0.00 0.00 37.83 34.44 1ri9 s LYS 48 CO 0.57 0.42 1.20 -1.25 0.51 0.00 0.00 175.35 176.80 1ri9 s PRO 49 N -2.97 4.38 0.00 -1.68 0.04 -1.26 -2.95 135.00 130.56 1ri9 s PRO 49 Ca 0.26 1.71 0.00 0.00 0.04 0.00 0.00 61.00 63.01 1ri9 s PRO 49 Cb -0.08 -3.49 0.00 0.00 0.04 0.00 0.00 34.50 30.97 1ri9 s PRO 49 CO 0.16 -0.38 0.00 0.41 0.04 0.00 0.00 177.00 177.23 1ri9 n GLY 50 N 3.31 1.03 3.89 0.56 0.00 0.58 -4.58 105.19 109.99 1ri9 n GLY 50 Ca 0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.81 2.47 -0.12 1.61 8.01 -0.81 -4.88 118.70 124.17 1ri9 s GLU 51 Ca 0.00 -1.63 -0.00 0.00 0.01 0.00 0.00 54.97 53.35 1ri9 s GLU 51 Cb 0.00 -2.35 -0.02 0.00 -4.31 0.00 0.00 34.13 27.45 1ri9 s GLU 51 CO 0.00 -0.31 -0.11 -1.54 0.01 0.00 0.00 175.26 173.30 1ri9 s SER 52 N -4.19 4.16 0.04 -0.19 1.04 -1.26 0.22 113.70 113.52 1ri9 s SER 52 Ca 0.47 -0.27 -0.01 0.00 0.48 0.00 0.00 55.95 56.61 1ri9 s SER 52 Cb -0.03 -1.55 -0.03 0.00 0.10 0.00 0.00 66.02 64.51 1ri9 s SER 52 CO 0.28 0.19 -0.01 -1.48 0.98 0.00 0.00 173.24 173.19 1ri9 s LEU 53 N 0.20 2.35 0.11 2.42 2.34 -1.21 -4.91 118.68 119.99 1ri9 s LEU 53 Ca -0.07 -0.84 -0.29 0.00 0.06 0.00 0.00 54.13 53.00 1ri9 s LEU 53 Cb -0.15 0.23 -0.06 0.00 -0.56 0.00 0.00 46.19 45.65 1ri9 s LEU 53 CO 0.05 -0.52 0.91 -1.61 -1.06 0.00 0.00 176.35 174.11 1ri9 s GLU 54 N -3.23 4.67 -0.19 1.48 8.01 -1.24 -3.46 118.70 124.74 1ri9 s GLU 54 Ca 0.01 1.37 -0.07 0.00 0.01 0.00 0.00 54.97 56.28 1ri9 s GLU 54 Cb 0.03 -3.36 -0.04 0.00 -4.31 0.00 0.00 34.13 26.45 1ri9 s GLU 54 CO -0.07 0.27 0.05 0.08 0.01 0.00 0.00 175.26 175.59 1ri9 s VAL 55 N -0.17 4.56 0.00 2.63 1.01 -1.26 -1.48 120.40 125.70 1ri9 s VAL 55 Ca 0.44 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.31 1ri9 s VAL 55 Cb -0.23 -3.06 0.00 0.00 0.00 0.00 0.00 36.38 33.09 1ri9 s VAL 55 CO 0.29 0.44 0.00 -0.38 0.00 0.00 0.00 175.10 175.44 1ri9 n ILE 56 N 3.82 0.00 -3.44 2.22 5.41 0.32 -3.36 119.36 124.34 1ri9 n ILE 56 Ca -0.17 0.00 -0.28 0.00 1.00 0.00 0.00 62.75 63.31 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 3.11 3.59 -0.03 0.38 -1.52 -1.26 -4.67 119.66 119.25 1ri9 s GLN 57 Ca 0.00 -0.12 -0.30 0.00 -1.95 0.00 0.00 55.36 52.99 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 0.26 1.61 0.95 -0.25 0.00 0.00 175.29 177.86 1ri9 s THR 58 N -2.05 3.53 0.00 -0.19 -4.23 -1.25 -3.34 115.64 108.11 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 70.26 1ri9 s THR 58 CO 0.30 -0.05 0.77 0.41 -0.54 0.00 0.00 174.62 175.51 1ri9 n THR 59 N 5.26 0.00 0.00 3.99 -1.04 0.82 -4.81 114.28 118.50 1ri9 n THR 59 Ca 0.16 1.27 0.00 0.00 -2.04 0.00 0.00 64.05 63.44 1ri9 n THR 59 Cb 0.43 -2.13 0.00 0.00 -1.82 0.00 0.00 70.33 66.80 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 -1.52 0.00 0.02 8.00 2.03 -1.26 -5.02 116.55 118.80 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 0.94 -3.42 1.67 9.92 -1.26 -4.88 116.55 119.51 1ri9 n ASP 61 Ca 0.00 0.13 -0.28 0.00 -0.53 0.00 0.00 54.79 54.10 1ri9 n ASP 61 Cb 0.00 -0.30 -0.07 0.00 -0.64 0.00 0.00 41.12 40.11 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 -3.48 2.75 -3.67 -3.53 -1.04 -1.26 -5.00 114.28 99.05 1ri9 n THR 62 Ca -0.03 -5.34 -0.09 0.00 -2.04 0.00 0.00 64.05 56.55 1ri9 n THR 62 Cb 0.19 -2.02 -0.09 0.00 -1.82 0.00 0.00 70.33 66.59 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 -2.64 0.54 -0.10 -2.82 2.20 -1.26 -2.95 119.74 112.70 1ri9 s LYS 63 Ca 0.40 0.96 0.04 0.00 -0.36 0.00 0.00 55.97 57.01 1ri9 s LYS 63 Cb 0.16 0.07 0.00 0.00 -1.51 0.00 0.00 37.83 36.55 1ri9 s LYS 63 CO -0.02 -0.15 -0.24 0.14 -0.36 0.00 0.00 175.35 174.73 1ri9 s VAL 64 N 1.39 2.06 -0.09 4.02 -7.23 -1.09 -0.13 120.40 119.32 1ri9 s VAL 64 Ca -0.09 -1.01 -0.22 0.00 -1.81 0.00 0.00 61.98 58.85 1ri9 s VAL 64 Cb -0.07 -1.78 -0.04 0.00 0.56 0.00 0.00 36.38 35.06 1ri9 s VAL 64 CO -0.14 0.56 0.65 -0.22 -0.31 0.00 0.00 175.10 175.63 1ri9 s LEU 65 N 0.39 4.29 0.34 1.32 2.96 -1.21 -2.38 118.68 124.39 1ri9 s LEU 65 Ca -0.18 1.07 -0.06 0.00 -0.22 0.00 0.00 54.13 54.74 1ri9 s LEU 65 Cb -0.18 -2.98 -0.05 0.00 0.50 0.00 0.00 46.19 43.48 1ri9 s LEU 65 CO 0.08 -0.11 0.63 0.00 -1.32 0.00 0.00 176.35 175.63 1ri9 s ARG 67 N -3.81 0.26 -0.03 0.00 3.52 -0.55 -2.03 118.95 116.30 1ri9 s ARG 67 Ca 0.46 -0.01 0.07 0.00 -0.13 0.00 0.00 55.73 56.11 1ri9 s ARG 67 Cb -0.10 -0.35 -0.01 0.00 -1.56 0.00 0.00 34.95 32.93 1ri9 s ARG 67 CO 0.32 -0.04 -0.23 0.54 -0.81 0.00 0.00 175.30 175.09 1ri9 s ASN 68 N 0.47 2.73 0.05 -2.12 4.22 -0.94 -3.68 114.94 115.68 1ri9 s ASN 68 Ca -0.05 -0.43 0.03 0.00 -2.14 0.00 0.00 52.86 50.27 1ri9 s ASN 68 Cb -0.07 -0.47 0.15 0.00 1.28 0.00 0.00 41.25 42.14 1ri9 s ASN 68 CO -0.01 0.26 0.99 1.21 -2.04 0.00 0.00 177.10 177.51 1ri9 n GLU 69 N 2.69 0.02 0.00 3.55 0.00 -1.26 -0.88 120.64 124.76 1ri9 n GLU 69 Ca -0.16 0.43 0.02 0.00 0.00 0.00 0.00 57.16 57.45 1ri9 n GLU 69 Cb 0.52 -1.67 0.10 0.00 0.00 0.00 0.00 31.44 30.39 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 -1.52 0.03 -0.69 5.31 4.07 -1.26 -4.76 120.64 121.82 1ri9 n GLU 70 Ca -0.00 0.34 0.00 0.00 -0.06 0.00 0.00 57.16 57.44 1ri9 n GLU 70 Cb 0.11 -1.50 0.00 0.00 -0.06 0.00 0.00 31.44 29.99 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 -0.97 0.65 3.44 8.31 0.00 -0.06 -4.98 105.19 111.58 1ri9 n GLY 71 Ca 0.02 -0.03 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.36 1.58 0.34 1.61 2.20 -1.20 -2.99 119.74 120.92 1ri9 s LYS 72 Ca 0.00 -1.63 0.07 0.00 -0.36 0.00 0.00 55.97 54.04 1ri9 s LYS 72 Cb 0.00 -1.80 -0.07 0.00 -1.51 0.00 0.00 37.83 34.45 1ri9 s LYS 72 CO 0.00 0.37 -0.02 0.71 -0.36 0.00 0.00 175.35 176.05 1ri9 s TYR 73 N -2.05 2.21 0.11 4.03 1.51 -1.26 -2.22 117.35 119.68 1ri9 s TYR 73 Ca 0.25 -0.72 -0.21 0.00 -1.01 0.00 0.00 57.07 55.38 1ri9 s TYR 73 Cb -0.07 -1.41 0.06 0.00 -0.11 0.00 0.00 41.96 40.43 1ri9 s TYR 73 CO 0.12 0.32 0.53 0.20 -1.11 0.00 0.00 175.55 175.61 1ri9 s GLY 74 N -3.57 -0.47 0.14 0.71 0.00 -0.86 -4.86 107.32 98.41 1ri9 s GLY 74 Ca 0.33 0.41 0.04 0.00 0.00 0.00 0.00 44.72 45.51 1ri9 s GLY 74 CO 0.15 0.11 0.15 -0.19 0.00 0.00 0.00 173.10 173.32 1ri9 s TYR 75 N -3.27 3.22 -0.07 1.90 2.02 -0.36 0.49 117.35 121.29 1ri9 s TYR 75 Ca -0.01 0.03 -0.03 0.00 -0.37 0.00 0.00 57.07 56.70 1ri9 s TYR 75 Cb -0.00 -1.57 0.04 0.00 -0.40 0.00 0.00 41.96 40.03 1ri9 s TYR 75 CO -0.08 0.52 0.13 0.08 -1.57 0.00 0.00 175.55 174.63 1ri9 s VAL 76 N -1.66 -0.13 0.26 0.71 1.01 -1.00 -3.25 120.40 116.35 1ri9 s VAL 76 Ca 0.31 0.26 -0.29 0.00 0.00 0.00 0.00 61.98 62.26 1ri9 s VAL 76 Cb -0.11 -0.24 -0.09 0.00 0.00 0.00 0.00 36.38 35.94 1ri9 s VAL 76 CO 0.24 0.11 1.00 -0.22 0.00 0.00 0.00 175.10 176.23 1ri9 s LEU 77 N 1.60 4.58 0.67 3.92 0.20 -1.26 -2.69 118.68 125.70 1ri9 s LEU 77 Ca -0.04 2.06 0.39 0.00 0.69 0.00 0.00 54.13 57.23 1ri9 s LEU 77 Cb -0.12 -3.66 2.13 0.00 -0.43 0.00 0.00 46.19 44.11 1ri9 s LEU 77 CO -0.05 0.02 2.20 0.08 -0.29 0.00 0.00 176.35 178.31 1ri9 h ARG 78 N 3.92 0.00 -0.01 1.98 -0.00 -1.92 -2.51 114.38 115.84 1ri9 h ARG 78 Ca -0.46 0.00 0.02 0.00 -0.00 0.00 0.00 59.98 59.55 1ri9 h ARG 78 Cb 1.20 0.00 -0.06 0.00 -0.00 0.00 0.00 29.97 31.12 1ri9 h ARG 78 CO 0.67 0.00 -0.51 1.03 -0.00 0.00 0.00 179.97 181.16 1ri9 h SER 79 N 0.00 -1.58 -3.61 0.08 0.87 -1.90 -3.29 113.55 104.11 1ri9 h SER 79 Ca 0.00 0.18 -0.65 0.00 -1.23 0.00 0.00 61.79 60.09 1ri9 h SER 79 Cb 0.26 0.61 -0.39 0.00 -0.44 0.00 0.00 62.40 62.43 1ri9 h SER 79 CO -0.00 -0.51 -0.46 -0.72 -0.53 0.00 0.00 176.83 174.61 1ri9 s TYR 80 N -5.78 3.52 0.19 2.24 -0.85 -0.95 -5.02 117.35 110.71 1ri9 s TYR 80 Ca -0.16 -3.15 -0.23 0.00 -0.52 0.00 0.00 57.07 53.01 1ri9 s TYR 80 Cb 0.07 -2.91 0.07 0.00 0.38 0.00 0.00 41.96 39.57 1ri9 s TYR 80 CO 0.62 -0.67 0.99 -1.17 -1.52 0.00 0.00 175.55 173.80 1ri9 s LEU 81 N -0.97 -0.07 0.88 -3.49 2.96 -1.24 -3.85 118.68 112.90 1ri9 s LEU 81 Ca 0.22 -0.60 -0.13 0.00 -0.22 0.00 0.00 54.13 53.40 1ri9 s LEU 81 Cb -0.12 2.17 0.13 0.00 0.50 0.00 0.00 46.19 48.86 1ri9 s LEU 81 CO -0.10 -1.01 1.21 0.00 -1.32 0.00 0.00 176.35 175.14 1ri9 s ALA 82 N -2.61 2.34 -1.86 5.97 0.00 -1.25 -4.80 121.76 119.56 1ri9 s ALA 82 Ca 0.18 -0.80 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 20.18 1ri9 s ALA 82 CO 0.05 -2.04 0.46 -0.40 0.00 0.00 0.00 175.76 173.83