#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ix5 s VAL 5 N 0.00 1.97 0.24 1.12 1.01 -1.24 -4.96 120.40 118.54 1ix5 s VAL 5 Ca 0.00 -1.96 0.01 0.00 0.00 0.00 0.00 61.98 60.03 1ix5 s VAL 5 Cb 0.00 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.41 1ix5 s VAL 5 CO 0.00 -0.27 0.13 -1.81 0.00 0.00 0.00 175.10 173.16 1ix5 s ASP 6 N -2.69 0.73 -0.40 3.32 1.11 -1.26 -4.51 116.67 112.97 1ix5 s ASP 6 Ca 0.17 -1.43 -0.27 0.00 0.18 0.00 0.00 52.55 51.20 1ix5 s ASP 6 Cb -0.06 0.32 -0.27 0.00 1.07 0.00 0.00 42.92 43.98 1ix5 s ASP 6 CO 0.08 -0.83 1.76 2.29 1.18 0.00 0.00 175.17 179.65 1ix5 n LYS 7 N -0.39 0.69 0.00 8.23 2.85 -1.26 -1.06 118.16 127.22 1ix5 n LYS 7 Ca 0.02 -1.43 0.00 0.00 -1.05 0.00 0.00 58.31 55.85 1ix5 n LYS 7 Cb 0.66 -2.76 0.00 0.00 -0.65 0.00 0.00 35.03 32.28 1ix5 n LYS 7 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1ix5 n GLY 8 N 4.86 0.00 3.13 2.58 0.00 -1.26 -4.19 105.19 110.31 1ix5 n GLY 8 Ca 0.48 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.23 1ix5 n GLY 8 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ix5 s VAL 9 N 0.00 1.51 0.33 1.61 1.01 -0.22 -4.87 120.40 119.77 1ix5 s VAL 9 Ca 0.00 -0.74 -0.10 0.00 0.00 0.00 0.00 61.98 61.14 1ix5 s VAL 9 Cb 0.00 -1.32 -0.07 0.00 0.00 0.00 0.00 36.38 34.99 1ix5 s VAL 9 CO 0.00 0.44 0.68 -0.75 0.00 0.00 0.00 175.10 175.46 1ix5 s LYS 10 N 0.24 3.80 -0.27 2.72 2.20 -1.26 -3.16 119.74 124.00 1ix5 s LYS 10 Ca -0.09 0.38 -0.23 0.00 -0.36 0.00 0.00 55.97 55.66 1ix5 s LYS 10 Cb -0.14 -2.50 0.08 0.00 -1.51 0.00 0.00 37.83 33.76 1ix5 s LYS 10 CO 0.04 0.12 0.74 0.96 -0.36 0.00 0.00 175.35 176.85 1ix5 s ILE 11 N -2.14 0.00 -0.58 5.43 -4.36 0.15 -0.97 121.20 118.74 1ix5 s ILE 11 Ca 0.50 0.00 -0.18 0.00 -0.26 0.00 0.00 60.65 60.70 1ix5 s ILE 11 Cb -0.11 -1.00 0.11 0.00 1.25 0.00 0.00 42.46 42.72 1ix5 s ILE 11 CO 0.26 0.00 0.65 -0.75 0.24 0.00 0.00 174.94 175.35 1ix5 s LYS 12 N 0.62 3.03 0.17 0.37 2.20 -1.12 -0.91 119.74 124.11 1ix5 s LYS 12 Ca -0.02 -1.43 0.11 0.00 -0.36 0.00 0.00 55.97 54.27 1ix5 s LYS 12 Cb -0.05 -4.28 -0.04 0.00 -1.51 0.00 0.00 37.83 31.95 1ix5 s LYS 12 CO -0.04 -1.49 -0.24 0.14 -0.36 0.00 0.00 175.35 173.36 1ix5 s VAL 13 N 2.39 2.37 -0.36 4.02 -7.23 -0.45 -1.99 120.40 119.16 1ix5 s VAL 13 Ca 0.09 -1.91 -0.01 0.00 -1.81 0.00 0.00 61.98 58.35 1ix5 s VAL 13 Cb -0.26 -2.11 0.09 0.00 0.56 0.00 0.00 36.38 34.67 1ix5 s VAL 13 CO 0.05 -0.04 0.10 1.51 -0.31 0.00 0.00 175.10 176.42 1ix5 s ASP 14 N -2.45 5.02 0.15 4.85 1.47 -0.51 -2.15 116.67 123.05 1ix5 s ASP 14 Ca 0.18 -1.84 -0.03 0.00 1.18 0.00 0.00 52.55 52.05 1ix5 s ASP 14 Cb -0.09 -1.74 -0.05 0.00 -0.34 0.00 0.00 42.92 40.70 1ix5 s ASP 14 CO 0.09 -0.42 0.36 -0.72 0.68 0.00 0.00 175.17 175.16 1ix5 s TYR 15 N 1.11 3.48 -0.70 2.11 1.13 -1.26 -3.22 117.35 120.01 1ix5 s TYR 15 Ca 0.05 0.43 0.05 0.00 -1.41 0.00 0.00 57.07 56.19 1ix5 s TYR 15 Cb -0.21 -1.91 0.19 0.00 -1.10 0.00 0.00 41.96 38.92 1ix5 s TYR 15 CO -0.04 0.44 0.56 -0.89 -2.51 0.00 0.00 175.55 173.10 1ix5 n ILE 16 N -0.15 1.84 -1.85 -3.49 5.41 -0.14 -2.41 119.36 118.56 1ix5 n ILE 16 Ca -0.04 -4.96 -0.42 0.00 1.00 0.00 0.00 62.75 58.34 1ix5 n ILE 16 Cb 0.52 -2.17 -0.03 0.00 -0.71 0.00 0.00 39.64 37.25 1ix5 n ILE 16 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 1ix5 s GLY 17 N -1.67 1.49 0.04 7.39 0.00 0.73 -2.65 107.32 112.64 1ix5 s GLY 17 Ca 0.28 1.46 0.07 0.00 0.00 0.00 0.00 44.72 46.53 1ix5 s GLY 17 CO -0.14 2.70 -0.19 0.54 0.00 0.00 0.00 173.10 176.01 1ix5 s LYS 18 N 1.02 1.33 1.13 2.90 1.02 -0.91 -1.31 119.74 124.93 1ix5 s LYS 18 Ca 0.71 -0.88 -0.13 0.00 0.02 0.00 0.00 55.97 55.69 1ix5 s LYS 18 Cb -0.46 -1.41 0.26 0.00 -0.52 0.00 0.00 37.83 35.70 1ix5 s LYS 18 CO 0.33 0.36 1.04 -0.51 -0.92 0.00 0.00 175.35 175.65 1ix5 s LEU 19 N -1.08 0.94 -0.06 3.17 1.43 0.17 0.11 118.68 123.35 1ix5 s LEU 19 Ca 0.07 1.36 -0.03 0.00 -1.03 0.00 0.00 54.13 54.49 1ix5 s LEU 19 Cb -0.08 -3.31 -0.11 0.00 0.03 0.00 0.00 46.19 42.71 1ix5 s LEU 19 CO 0.01 -3.95 1.85 1.21 0.23 0.00 0.00 176.35 175.70 1ix5 n GLU 20 N -4.74 0.92 0.00 1.70 2.13 -1.26 -1.31 120.64 118.09 1ix5 n GLU 20 Ca 0.03 -0.50 0.00 0.00 0.66 0.00 0.00 57.16 57.35 1ix5 n GLU 20 Cb 0.55 -1.77 0.00 0.00 0.27 0.00 0.00 31.44 30.50 1ix5 n GLU 20 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 1ix5 n SER 21 N 2.92 0.00 0.00 4.31 3.41 -1.26 -4.99 113.62 118.01 1ix5 n SER 21 Ca 0.20 -0.82 0.00 0.00 -0.26 0.00 0.00 58.87 57.99 1ix5 n SER 21 Cb 0.37 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.32 1ix5 n SER 21 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ix5 n GLY 22 N 0.00 0.65 3.56 5.00 0.00 -0.42 -5.04 105.19 108.93 1ix5 n GLY 22 Ca 0.00 -0.72 -0.40 0.00 0.00 0.00 0.00 46.02 44.90 1ix5 n GLY 22 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ix5 s ASP 23 N -2.69 6.20 -0.20 1.61 1.11 -1.25 -4.86 116.67 116.60 1ix5 s ASP 23 Ca 0.00 -0.11 -0.29 0.00 0.18 0.00 0.00 52.55 52.33 1ix5 s ASP 23 Cb 0.00 -2.20 -0.03 0.00 1.07 0.00 0.00 42.92 41.76 1ix5 s ASP 23 CO 0.00 -0.31 1.68 -0.69 1.18 0.00 0.00 175.17 177.03 1ix5 s VAL 24 N 2.05 3.61 -0.20 -1.27 1.01 -1.26 0.43 120.40 124.76 1ix5 s VAL 24 Ca 0.13 0.69 0.05 0.00 0.00 0.00 0.00 61.98 62.84 1ix5 s VAL 24 Cb -0.16 -3.62 -0.15 0.00 0.00 0.00 0.00 36.38 32.45 1ix5 s VAL 24 CO 0.11 -0.25 -0.13 2.22 0.00 0.00 0.00 175.10 177.05 1ix5 n PHE 25 N 8.56 0.00 -4.09 5.22 -1.74 -0.43 -4.94 117.46 120.04 1ix5 n PHE 25 Ca 0.19 0.00 -0.17 0.00 -0.56 0.00 0.00 57.45 56.91 1ix5 n PHE 25 Cb 0.45 -0.81 -0.16 0.00 1.52 0.00 0.00 39.48 40.49 1ix5 n PHE 25 CO 0.00 0.00 0.00 0.34 -0.56 0.00 0.00 176.76 176.54 1ix5 s ASP 26 N -5.80 0.65 -0.20 5.98 -1.08 -1.05 -5.03 116.67 110.13 1ix5 s ASP 26 Ca -0.24 -0.08 -0.12 0.00 -0.52 0.00 0.00 52.55 51.59 1ix5 s ASP 26 Cb 0.07 -0.24 0.06 0.00 -1.46 0.00 0.00 42.92 41.35 1ix5 s ASP 26 CO 0.53 -0.03 0.49 0.28 0.52 0.00 0.00 175.17 176.96 1ix5 s THR 27 N 0.57 -0.02 -0.25 1.71 -1.32 -1.26 -0.19 115.64 114.89 1ix5 s THR 27 Ca -0.06 0.06 0.18 0.00 -1.21 0.00 0.00 61.69 60.65 1ix5 s THR 27 Cb -0.10 -0.72 0.17 0.00 -1.51 0.00 0.00 72.50 70.34 1ix5 s THR 27 CO -0.00 0.02 1.52 0.28 -2.21 0.00 0.00 174.62 174.23 1ix5 h SER 28 N 6.81 0.00 -3.47 8.08 0.02 -1.69 -3.43 113.55 119.86 1ix5 h SER 28 Ca -0.34 0.00 -0.60 0.00 -0.84 0.00 0.00 61.79 60.02 1ix5 h SER 28 Cb 1.19 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 63.64 1ix5 h SER 28 CO 0.25 0.32 0.55 -0.63 -1.14 0.00 0.00 176.83 176.17 1ix5 s ILE 29 N -3.07 4.63 0.60 3.27 1.01 -1.26 -1.08 121.20 125.30 1ix5 s ILE 29 Ca 0.05 1.18 0.38 0.00 0.00 0.00 0.00 60.65 62.26 1ix5 s ILE 29 Cb 0.07 -4.29 0.41 0.00 0.01 0.00 0.00 42.46 38.65 1ix5 s ILE 29 CO 0.71 -0.47 2.30 -0.08 0.00 0.00 0.00 174.94 177.40 1ix5 h GLU 30 N 8.39 0.00 0.75 2.79 4.81 -1.78 -2.77 114.58 126.77 1ix5 h GLU 30 Ca -0.23 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 58.96 1ix5 h GLU 30 Cb 1.08 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.47 1ix5 h GLU 30 CO 0.96 0.01 -0.36 1.49 -0.73 0.00 0.00 179.01 180.38 1ix5 h GLU 31 N 0.00 -0.97 -0.93 1.92 4.81 -1.90 -2.64 114.58 114.86 1ix5 h GLU 31 Ca -0.00 0.07 0.12 0.00 -0.13 0.00 0.00 59.36 59.41 1ix5 h GLU 31 Cb 0.05 0.22 -0.08 0.00 0.63 0.00 0.00 28.75 29.57 1ix5 h GLU 31 CO 0.00 -0.65 0.56 0.28 -0.73 0.00 0.00 179.01 178.48 1ix5 h VAL 32 N -1.03 0.90 -1.02 0.32 2.07 -1.92 0.20 116.25 115.77 1ix5 h VAL 32 Ca -0.10 -0.31 0.26 0.00 0.82 0.00 0.00 66.70 67.37 1ix5 h VAL 32 Cb 0.77 -0.08 -0.12 0.00 -1.52 0.00 0.00 31.29 30.34 1ix5 h VAL 32 CO 0.17 0.16 0.61 0.00 0.02 0.00 0.00 177.57 178.54 1ix5 h ALA 33 N 1.52 1.91 0.00 1.67 0.00 -1.31 1.37 119.26 124.42 1ix5 h ALA 33 Ca 0.46 0.12 -0.08 0.00 0.00 0.00 0.00 54.91 55.41 1ix5 h ALA 33 Cb 0.47 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1ix5 h ALA 33 CO -0.27 -0.39 -0.38 0.87 0.00 0.00 0.00 179.25 179.09 1ix5 h LYS 34 N 0.52 0.00 0.00 0.00 1.57 -0.61 1.04 116.57 119.09 1ix5 h LYS 34 Ca 0.65 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.43 1ix5 h LYS 34 Cb 1.34 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.65 1ix5 h LYS 34 CO -0.45 0.38 -0.28 -1.91 -0.57 0.00 0.00 179.45 176.62 1ix5 n GLU 35 N -3.27 0.17 -0.00 3.15 2.13 0.42 -3.45 120.64 119.79 1ix5 n GLU 35 Ca 0.02 0.09 0.05 0.00 0.66 0.00 0.00 57.16 57.98 1ix5 n GLU 35 Cb 0.63 -1.65 -0.06 0.00 0.27 0.00 0.00 31.44 30.63 1ix5 n GLU 35 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1ix5 n ALA 36 N -1.69 3.36 -2.37 4.31 0.00 0.16 -5.01 120.51 119.28 1ix5 n ALA 36 Ca 0.05 -0.30 -0.01 0.00 0.00 0.00 0.00 53.44 53.18 1ix5 n ALA 36 Cb 0.40 -0.39 0.00 0.00 0.00 0.00 0.00 19.45 19.46 1ix5 n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ix5 n GLY 37 N 1.28 0.68 0.31 0.00 0.00 -0.08 -4.96 105.19 102.43 1ix5 n GLY 37 Ca 0.02 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.48 1ix5 n GLY 37 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1ix5 n ILE 38 N -2.06 0.00 0.25 -0.61 -5.35 0.34 -4.85 119.36 107.08 1ix5 n ILE 38 Ca -0.01 0.00 0.04 0.00 -0.27 0.00 0.00 62.75 62.52 1ix5 n ILE 38 Cb 0.51 0.68 0.23 0.00 -1.74 0.00 0.00 39.64 39.32 1ix5 n ILE 38 CO 0.00 0.00 0.00 0.22 -1.76 0.00 0.00 176.55 175.01 1ix5 h TYR 39 N 0.00 0.00 -1.78 4.28 3.20 -1.57 -3.46 116.97 117.63 1ix5 h TYR 39 Ca 0.00 0.00 0.10 0.00 3.14 0.00 0.00 58.73 61.97 1ix5 h TYR 39 Cb 1.25 0.00 -0.05 0.00 1.54 0.00 0.00 36.73 39.47 1ix5 h TYR 39 CO 0.06 0.00 -0.57 0.00 -1.64 0.00 0.00 178.16 176.02 1ix5 n ALA 40 N -1.52 -1.58 -1.00 1.82 0.00 -1.26 -4.62 120.51 112.35 1ix5 n ALA 40 Ca -0.01 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.80 1ix5 n ALA 40 Cb 0.67 -0.87 0.00 0.00 0.00 0.00 0.00 19.45 19.25 1ix5 n ALA 40 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1ix5 n PRO 41 N -2.67 0.00 0.03 0.00 -0.04 -1.26 -4.55 135.00 126.51 1ix5 n PRO 41 Ca -0.03 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.55 1ix5 n PRO 41 Cb 0.29 -0.45 0.05 0.00 -0.04 0.00 0.00 33.50 33.36 1ix5 n PRO 41 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1ix5 n ASP 42 N -0.26 0.63 -4.76 3.54 5.75 -1.26 -4.90 116.55 115.29 1ix5 n ASP 42 Ca 0.00 -0.17 -0.40 0.00 -0.01 0.00 0.00 54.79 54.21 1ix5 n ASP 42 Cb 0.00 0.68 -0.05 0.00 -1.03 0.00 0.00 41.12 40.72 1ix5 n ASP 42 CO 0.00 0.00 0.00 -0.60 -0.11 0.00 0.00 177.20 176.49 1ix5 s ARG 43 N -3.18 4.73 0.53 0.11 3.52 -1.26 -5.06 118.95 118.34 1ix5 s ARG 43 Ca 0.04 1.61 0.03 0.00 -0.13 0.00 0.00 55.73 57.28 1ix5 s ARG 43 Cb 0.14 -3.18 0.02 0.00 -1.56 0.00 0.00 34.95 30.37 1ix5 s ARG 43 CO 0.79 0.35 0.20 -1.21 -0.81 0.00 0.00 175.30 174.62 1ix5 s GLU 44 N -1.40 2.23 -0.20 5.12 2.02 -1.26 -4.43 118.70 120.78 1ix5 s GLU 44 Ca 0.44 -2.24 -0.03 0.00 0.02 0.00 0.00 54.97 53.16 1ix5 s GLU 44 Cb -0.28 -1.79 0.06 0.00 0.10 0.00 0.00 34.13 32.22 1ix5 s GLU 44 CO 0.35 -0.51 0.03 0.71 0.02 0.00 0.00 175.26 175.86 1ix5 s TYR 45 N -2.84 1.13 0.47 1.61 2.02 -1.26 -5.01 117.35 113.47 1ix5 s TYR 45 Ca 0.18 -0.93 0.04 0.00 -0.37 0.00 0.00 57.07 55.99 1ix5 s TYR 45 Cb -0.01 -1.07 -0.03 0.00 -0.40 0.00 0.00 41.96 40.45 1ix5 s TYR 45 CO 0.11 -0.62 0.09 -1.83 -1.57 0.00 0.00 175.55 171.73 1ix5 s GLU 46 N 1.82 2.15 -0.04 -0.62 1.03 -0.24 -2.67 118.70 120.13 1ix5 s GLU 46 Ca -0.01 -2.17 -0.30 0.00 0.03 0.00 0.00 54.97 52.52 1ix5 s GLU 46 Cb -0.17 -1.72 -0.04 0.00 -0.80 0.00 0.00 34.13 31.39 1ix5 s GLU 46 CO -0.08 -0.27 1.34 -1.25 -1.33 0.00 0.00 175.26 173.67 1ix5 s PRO 47 N -3.90 4.29 -0.15 -4.83 0.04 -1.26 -4.46 135.00 124.73 1ix5 s PRO 47 Ca 0.24 1.86 -0.23 0.00 0.04 0.00 0.00 61.00 62.90 1ix5 s PRO 47 Cb 0.04 -3.63 -0.02 0.00 0.04 0.00 0.00 34.50 30.93 1ix5 s PRO 47 CO 0.13 -0.58 0.73 -1.17 0.04 0.00 0.00 177.00 176.15 1ix5 s LEU 48 N 2.63 4.20 -0.66 -3.56 2.96 -0.91 -4.77 118.68 118.57 1ix5 s LEU 48 Ca 0.61 1.05 -0.20 0.00 -0.22 0.00 0.00 54.13 55.37 1ix5 s LEU 48 Cb -0.28 -3.07 0.10 0.00 0.50 0.00 0.00 46.19 43.43 1ix5 s LEU 48 CO 0.24 -0.28 0.84 -1.83 -1.32 0.00 0.00 176.35 174.00 1ix5 s GLU 49 N 1.73 3.14 0.44 1.98 -1.05 -1.26 -1.34 118.70 122.34 1ix5 s GLU 49 Ca 0.35 -1.22 0.08 0.00 -0.15 0.00 0.00 54.97 54.02 1ix5 s GLU 49 Cb -0.17 -4.32 0.02 0.00 -0.44 0.00 0.00 34.13 29.22 1ix5 s GLU 49 CO 0.13 -1.66 0.60 -0.59 0.95 0.00 0.00 175.26 174.69 1ix5 s PHE 50 N 3.11 2.65 -0.24 4.83 -0.71 -0.09 -4.77 117.98 122.78 1ix5 s PHE 50 Ca 0.18 -0.42 -0.03 0.00 -1.04 0.00 0.00 56.93 55.62 1ix5 s PHE 50 Cb -0.19 -2.38 0.08 0.00 -1.21 0.00 0.00 43.02 39.32 1ix5 s PHE 50 CO 0.06 -0.52 0.07 0.08 -1.34 0.00 0.00 175.22 173.56 1ix5 s VAL 51 N -2.40 0.49 -0.40 -2.49 1.01 -1.26 -0.67 120.40 114.67 1ix5 s VAL 51 Ca 0.56 -0.77 0.01 0.00 0.00 0.00 0.00 61.98 61.77 1ix5 s VAL 51 Cb -0.10 -1.16 0.01 0.00 0.00 0.00 0.00 36.38 35.14 1ix5 s VAL 51 CO 0.34 -0.40 0.76 0.52 0.00 0.00 0.00 175.10 176.31 1ix5 n VAL 52 N 5.04 0.85 -3.01 2.92 0.31 -1.19 -1.36 118.33 121.90 1ix5 n VAL 52 Ca -0.07 0.52 -0.29 0.00 -0.01 0.00 0.00 64.34 64.49 1ix5 n VAL 52 Cb 0.45 -1.52 -0.04 0.00 -0.91 0.00 0.00 33.84 31.82 1ix5 n VAL 52 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ix5 n GLY 53 N -1.23 5.51 0.00 2.92 0.00 -1.26 -4.12 105.19 107.01 1ix5 n GLY 53 Ca -0.00 -2.76 0.00 0.00 0.00 0.00 0.00 46.02 43.26 1ix5 n GLY 53 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ix5 n GLU 54 N 0.03 0.00 -0.88 1.61 1.02 -0.46 -4.49 120.64 117.47 1ix5 n GLU 54 Ca 0.32 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.46 1ix5 n GLU 54 Cb 0.38 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.80 1ix5 n GLU 54 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ix5 n GLY 55 N -0.00 0.69 0.00 0.62 0.00 -1.25 -4.97 105.19 100.28 1ix5 n GLY 55 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1ix5 n GLY 55 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1ix5 n GLN 56 N -2.58 0.00 -0.63 1.61 7.27 -1.26 -4.63 117.38 117.15 1ix5 n GLN 56 Ca 0.00 0.52 -0.13 0.00 0.07 0.00 0.00 57.00 57.46 1ix5 n GLN 56 Cb 0.00 -1.07 0.10 0.00 2.41 0.00 0.00 30.24 31.68 1ix5 n GLN 56 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1ix5 n LEU 57 N -1.22 0.00 -4.79 1.69 7.99 -1.26 -5.02 117.00 114.39 1ix5 n LEU 57 Ca 0.00 -0.56 -0.37 0.00 -0.01 0.00 0.00 56.01 55.07 1ix5 n LEU 57 Cb 0.00 -0.43 -0.06 0.00 -0.11 0.00 0.00 43.42 42.81 1ix5 n LEU 57 CO 0.00 -1.20 0.56 0.27 -1.51 0.00 0.00 177.39 175.51 1ix5 s ILE 58 N -2.05 4.34 0.24 -0.08 -0.00 -1.26 -4.87 121.20 117.51 1ix5 s ILE 58 Ca 0.31 1.64 -0.14 0.00 -0.00 0.00 0.00 60.65 62.47 1ix5 s ILE 58 Cb -0.02 -3.98 0.31 0.00 -0.00 0.00 0.00 42.46 38.78 1ix5 s ILE 58 CO 0.23 0.20 1.57 1.56 -0.00 0.00 0.00 174.94 178.50 1ix5 h GLN 59 N 3.36 -0.02 0.00 0.37 4.20 -1.79 0.25 115.11 121.47 1ix5 h GLN 59 Ca -0.47 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.24 1ix5 h GLN 59 Cb 1.19 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.98 1ix5 h GLN 59 CO 0.65 -0.02 0.00 0.41 -0.67 0.00 0.00 178.83 179.21 1ix5 n GLY 60 N -1.53 -3.53 0.38 3.46 0.00 -1.26 0.87 105.19 103.59 1ix5 n GLY 60 Ca 0.11 0.67 0.23 0.00 0.00 0.00 0.00 46.02 47.03 1ix5 n GLY 60 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1ix5 h PHE 61 N 0.00 0.79 0.00 1.61 3.04 -1.80 1.88 116.94 122.47 1ix5 h PHE 61 Ca 0.00 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 61.97 1ix5 h PHE 61 Cb 0.00 -0.22 -0.00 0.00 2.56 0.00 0.00 35.95 38.28 1ix5 h PHE 61 CO -0.12 0.01 -0.03 0.93 -2.02 0.00 0.00 178.31 177.07 1ix5 h GLU 62 N 0.42 0.00 0.07 1.11 5.08 0.18 -1.64 114.58 119.80 1ix5 h GLU 62 Ca 0.65 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.69 1ix5 h GLU 62 Cb 1.54 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.76 1ix5 h GLU 62 CO -0.40 0.03 -1.75 0.93 -1.00 0.00 0.00 179.01 176.83 1ix5 h GLU 63 N 0.00 0.15 -0.03 2.33 5.08 0.94 -2.77 114.58 120.28 1ix5 h GLU 63 Ca -0.00 -0.26 -0.05 0.00 -1.00 0.00 0.00 59.36 58.05 1ix5 h GLU 63 Cb 0.15 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1ix5 h GLU 63 CO 0.00 0.90 -0.21 0.00 -1.00 0.00 0.00 179.01 178.71 1ix5 h ALA 64 N 0.56 1.60 0.05 3.43 0.00 -0.31 -2.52 119.26 122.07 1ix5 h ALA 64 Ca -0.32 -0.21 -0.29 0.00 0.00 0.00 0.00 54.91 54.10 1ix5 h ALA 64 Cb 2.02 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.73 1ix5 h ALA 64 CO 0.10 0.30 -1.53 -0.39 0.00 0.00 0.00 179.25 177.73 1ix5 h VAL 65 N 0.04 1.11 -0.97 0.00 -1.51 -1.46 -3.35 116.25 110.11 1ix5 h VAL 65 Ca 0.01 -2.85 0.32 0.00 -1.23 0.00 0.00 66.70 62.94 1ix5 h VAL 65 Cb 0.40 2.63 -0.17 0.00 -2.13 0.00 0.00 31.29 32.02 1ix5 h VAL 65 CO 0.03 0.73 0.30 -0.07 -1.23 0.00 0.00 177.57 177.33 1ix5 h LEU 66 N 0.03 -0.01 -4.79 4.19 3.38 -1.14 0.52 115.31 117.49 1ix5 h LEU 66 Ca -0.23 0.25 -0.68 0.00 0.09 0.00 0.00 57.88 57.31 1ix5 h LEU 66 Cb 1.97 0.33 -0.35 0.00 0.09 0.00 0.00 40.66 42.70 1ix5 h LEU 66 CO 0.12 -0.31 0.14 0.47 0.09 0.00 0.00 178.44 178.94 1ix5 n ASP 67 N -5.31 6.07 -3.65 -0.43 8.00 -1.23 -3.59 116.55 116.40 1ix5 n ASP 67 Ca 0.29 -3.77 -0.15 0.00 0.71 0.00 0.00 54.79 51.86 1ix5 n ASP 67 Cb 0.94 -0.76 -0.14 0.00 -0.02 0.00 0.00 41.12 41.14 1ix5 n ASP 67 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1ix5 s MET 68 N -3.80 0.09 0.00 -1.24 -1.94 0.18 -5.01 119.30 107.58 1ix5 s MET 68 Ca 0.50 0.62 0.00 0.00 -1.71 0.00 0.00 55.69 55.10 1ix5 s MET 68 Cb 0.41 -0.23 0.00 0.00 2.01 0.00 0.00 34.83 37.02 1ix5 s MET 68 CO -0.29 -0.32 0.00 0.39 -0.01 0.00 0.00 175.02 174.78 1ix5 n GLU 69 N 5.34 -0.43 -2.59 2.03 4.71 -1.26 -3.30 120.64 125.14 1ix5 n GLU 69 Ca -0.05 0.00 -0.43 0.00 -0.01 0.00 0.00 57.16 56.67 1ix5 n GLU 69 Cb 0.50 0.00 -0.02 0.00 -1.01 0.00 0.00 31.44 30.91 1ix5 n GLU 69 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 1ix5 s VAL 70 N -0.88 4.34 0.00 2.62 1.01 -1.26 -2.72 120.40 123.51 1ix5 s VAL 70 Ca 0.00 1.48 0.00 0.00 0.00 0.00 0.00 61.98 63.46 1ix5 s VAL 70 Cb 0.00 -4.44 0.00 0.00 0.00 0.00 0.00 36.38 31.94 1ix5 s VAL 70 CO 0.00 -0.67 0.00 0.61 0.00 0.00 0.00 175.10 175.04 1ix5 n GLY 71 N 4.29 0.71 3.75 4.51 0.00 0.34 -4.86 105.19 113.93 1ix5 n GLY 71 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 1ix5 n GLY 71 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ix5 s ASP 72 N -1.77 3.17 -0.14 1.61 1.11 -1.10 -4.65 116.67 114.89 1ix5 s ASP 72 Ca 0.00 1.04 -0.12 0.00 0.18 0.00 0.00 52.55 53.64 1ix5 s ASP 72 Cb 0.00 -1.65 0.04 0.00 1.07 0.00 0.00 42.92 42.38 1ix5 s ASP 72 CO 0.00 -2.78 0.37 -0.70 1.18 0.00 0.00 175.17 173.24 1ix5 s GLU 73 N -5.17 0.42 -0.31 8.23 2.12 -1.26 0.15 118.70 122.89 1ix5 s GLU 73 Ca 0.64 0.52 0.00 0.00 0.36 0.00 0.00 54.97 56.50 1ix5 s GLU 73 Cb -0.16 0.19 0.14 0.00 0.26 0.00 0.00 34.13 34.55 1ix5 s GLU 73 CO 0.55 -0.06 0.31 0.21 -0.54 0.00 0.00 175.26 175.73 1ix5 s LYS 74 N 0.29 0.39 -0.87 4.30 2.20 -1.22 -4.98 119.74 119.85 1ix5 s LYS 74 Ca -0.01 -0.30 -0.17 0.00 -0.36 0.00 0.00 55.97 55.13 1ix5 s LYS 74 Cb -0.03 -0.68 0.16 0.00 -1.51 0.00 0.00 37.83 35.77 1ix5 s LYS 74 CO -0.01 -1.07 0.97 0.99 -0.36 0.00 0.00 175.35 175.88 1ix5 s THR 75 N 2.16 5.06 0.05 3.43 2.01 -1.25 -3.19 115.64 123.91 1ix5 s THR 75 Ca 0.11 -1.87 0.07 0.00 0.31 0.00 0.00 61.69 60.30 1ix5 s THR 75 Cb -0.14 -4.65 -0.02 0.00 0.01 0.00 0.00 72.50 67.69 1ix5 s THR 75 CO -0.27 -1.31 -0.19 -0.69 -0.69 0.00 0.00 174.62 171.48 1ix5 s VAL 76 N 1.75 1.49 -0.31 3.82 1.01 -1.01 -4.86 120.40 122.29 1ix5 s VAL 76 Ca 0.26 -1.17 -0.29 0.00 0.00 0.00 0.00 61.98 60.78 1ix5 s VAL 76 Cb -0.08 -1.32 0.00 0.00 0.00 0.00 0.00 36.38 34.99 1ix5 s VAL 76 CO -0.08 0.11 1.27 -0.75 0.00 0.00 0.00 175.10 175.65 1ix5 s LYS 77 N -1.24 3.93 0.05 2.72 2.20 -1.26 -1.62 119.74 124.52 1ix5 s LYS 77 Ca 0.05 1.21 -0.30 0.00 -0.36 0.00 0.00 55.97 56.57 1ix5 s LYS 77 Cb -0.09 -3.86 -0.05 0.00 -1.51 0.00 0.00 37.83 32.33 1ix5 s LYS 77 CO 0.02 -1.10 1.04 0.42 -0.36 0.00 0.00 175.35 175.37 1ix5 s ILE 78 N 4.28 4.52 0.28 5.43 -1.09 0.49 -4.87 121.20 130.24 1ix5 s ILE 78 Ca 0.55 1.89 -0.29 0.00 -2.23 0.00 0.00 60.65 60.56 1ix5 s ILE 78 Cb -0.16 -4.21 -0.10 0.00 -1.58 0.00 0.00 42.46 36.42 1ix5 s ILE 78 CO 0.22 0.19 1.16 -2.16 -1.23 0.00 0.00 174.94 173.12 1ix5 s PRO 79 N 0.69 4.56 0.30 2.79 0.04 -1.26 -1.78 135.00 140.34 1ix5 s PRO 79 Ca 0.52 1.91 0.12 0.00 0.04 0.00 0.00 61.00 63.59 1ix5 s PRO 79 Cb -0.24 -3.17 0.67 0.00 0.04 0.00 0.00 34.50 31.80 1ix5 s PRO 79 CO 0.29 0.09 1.27 0.00 0.04 0.00 0.00 177.00 178.68 1ix5 n ALA 80 N 1.25 0.63 0.11 8.56 0.00 -1.22 0.75 120.51 130.58 1ix5 n ALA 80 Ca -0.00 0.11 -0.19 0.00 0.00 0.00 0.00 53.44 53.36 1ix5 n ALA 80 Cb 0.44 -0.78 -0.13 0.00 0.00 0.00 0.00 19.45 18.98 1ix5 n ALA 80 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1ix5 h GLU 81 N 0.00 0.43 0.12 0.00 4.81 -1.88 2.56 114.58 120.62 1ix5 h GLU 81 Ca 0.00 -0.64 -0.31 0.00 -0.13 0.00 0.00 59.36 58.27 1ix5 h GLU 81 Cb 0.58 0.23 -0.01 0.00 0.63 0.00 0.00 28.75 30.18 1ix5 h GLU 81 CO 0.00 1.29 -1.59 0.87 -0.73 0.00 0.00 179.01 178.84 1ix5 h LYS 82 N 0.16 0.26 0.00 1.92 1.57 -0.03 -3.02 116.57 117.43 1ix5 h LYS 82 Ca -0.16 -0.44 0.00 0.00 -1.87 0.00 0.00 60.65 58.17 1ix5 h LYS 82 Cb 1.94 0.16 0.00 0.00 0.08 0.00 0.00 32.23 34.41 1ix5 h LYS 82 CO 0.22 1.12 0.00 0.00 -0.57 0.00 0.00 179.45 180.22 1ix5 n ALA 83 N -2.71 0.00 -0.76 3.86 0.00 -0.03 -2.69 120.51 118.18 1ix5 n ALA 83 Ca -0.18 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.34 1ix5 n ALA 83 Cb 1.05 0.00 0.33 0.00 0.00 0.00 0.00 19.45 20.83 1ix5 n ALA 83 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1ix5 n TYR 84 N 0.00 1.46 -1.26 0.00 4.02 -1.15 -4.71 117.16 115.51 1ix5 n TYR 84 Ca 0.00 -0.70 0.00 0.00 -0.01 0.00 0.00 57.90 57.19 1ix5 n TYR 84 Cb 0.00 -0.32 0.00 0.00 -0.02 0.00 0.00 39.34 39.00 1ix5 n TYR 84 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1ix5 n GLY 85 N 0.55 -4.11 3.19 2.72 0.00 0.85 -4.80 105.19 103.58 1ix5 n GLY 85 Ca 0.24 -0.85 -0.38 0.00 0.00 0.00 0.00 46.02 45.03 1ix5 n GLY 85 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ix5 n ASN 86 N -1.50 -3.80 -4.58 1.61 0.23 -0.78 -3.55 115.26 102.89 1ix5 n ASN 86 Ca 0.00 0.61 -0.65 0.00 -0.53 0.00 0.00 54.58 54.01 1ix5 n ASN 86 Cb 0.15 -0.83 -0.09 0.00 -2.08 0.00 0.00 39.78 36.93 1ix5 n ASN 86 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1ix5 n ARG 87 N 1.56 0.00 -2.81 -3.83 1.74 -1.26 -4.50 116.66 107.56 1ix5 n ARG 87 Ca 0.07 0.00 -0.35 0.00 -0.77 0.00 0.00 57.85 56.80 1ix5 n ARG 87 Cb 0.47 -1.45 -0.07 0.00 -1.02 0.00 0.00 32.46 30.39 1ix5 n ARG 87 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1ix5 s ASN 88 N 2.62 7.13 0.19 0.55 2.47 -1.26 -4.92 114.94 121.72 1ix5 s ASN 88 Ca 1.00 1.75 0.01 0.00 0.42 0.00 0.00 52.86 56.05 1ix5 s ASN 88 Cb -1.43 -2.56 0.09 0.00 -1.45 0.00 0.00 41.25 35.90 1ix5 s ASN 88 CO 0.77 -0.21 1.45 -0.08 -3.72 0.00 0.00 177.10 175.31 1ix5 h GLU 89 N 2.54 0.29 0.00 0.43 4.81 -1.98 -2.83 114.58 117.84 1ix5 h GLU 89 Ca -0.48 -0.25 0.00 0.00 -0.13 0.00 0.00 59.36 58.50 1ix5 h GLU 89 Cb 1.19 0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.62 1ix5 h GLU 89 CO 0.63 0.91 0.00 0.52 -0.73 0.00 0.00 179.01 180.34 1ix5 h MET 90 N 0.19 0.00 0.00 1.92 2.86 -2.01 0.76 114.93 118.66 1ix5 h MET 90 Ca -0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 1ix5 h MET 90 Cb 1.32 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.98 1ix5 h MET 90 CO 0.12 0.00 0.00 1.28 1.06 0.00 0.00 176.91 179.37 1ix5 n LEU 91 N -2.69 0.00 -4.60 1.22 4.77 -1.07 -4.70 117.00 109.94 1ix5 n LEU 91 Ca -0.01 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.57 1ix5 n LEU 91 Cb 0.12 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.13 1ix5 n LEU 91 CO 0.18 0.00 0.15 -0.63 -1.33 0.00 0.00 177.39 175.76 1ix5 s ILE 92 N -2.00 5.11 0.44 -0.08 1.01 0.26 0.35 121.20 126.29 1ix5 s ILE 92 Ca 0.46 0.61 0.07 0.00 0.00 0.00 0.00 60.65 61.79 1ix5 s ILE 92 Cb 0.21 -3.79 -0.02 0.00 0.01 0.00 0.00 42.46 38.87 1ix5 s ILE 92 CO 0.35 0.06 0.34 -1.10 0.00 0.00 0.00 174.94 174.59 1ix5 s GLN 93 N 2.20 2.40 -0.42 2.79 1.11 0.68 -4.92 119.66 123.50 1ix5 s GLN 93 Ca 0.17 -1.70 0.04 0.00 0.01 0.00 0.00 55.36 53.88 1ix5 s GLN 93 Cb -0.16 -2.23 0.17 0.00 -1.01 0.00 0.00 33.01 29.78 1ix5 s GLN 93 CO 0.10 -0.26 0.38 0.15 0.01 0.00 0.00 175.29 175.68 1ix5 s LYS 94 N -4.11 0.87 0.54 2.91 3.01 -1.26 -0.22 119.74 121.48 1ix5 s LYS 94 Ca 0.44 -1.80 -0.15 0.00 -1.01 0.00 0.00 55.97 53.45 1ix5 s LYS 94 Cb -0.01 -1.17 -0.07 0.00 -1.01 0.00 0.00 37.83 35.57 1ix5 s LYS 94 CO 0.25 -1.35 1.00 0.96 0.51 0.00 0.00 175.35 176.72 1ix5 s ILE 95 N 0.37 4.55 0.23 2.17 -4.36 -0.96 -4.86 121.20 118.34 1ix5 s ILE 95 Ca 0.30 1.12 -0.30 0.00 -0.26 0.00 0.00 60.65 61.51 1ix5 s ILE 95 Cb -0.01 -3.74 -0.09 0.00 1.25 0.00 0.00 42.46 39.87 1ix5 s ILE 95 CO -0.15 -0.80 1.19 -2.16 0.24 0.00 0.00 174.94 173.26 1ix5 s PRO 96 N -4.35 4.52 0.49 0.37 0.04 -1.26 -2.03 135.00 132.77 1ix5 s PRO 96 Ca 0.58 1.90 0.36 0.00 0.04 0.00 0.00 61.00 63.89 1ix5 s PRO 96 Cb -0.10 -3.20 1.52 0.00 0.04 0.00 0.00 34.50 32.76 1ix5 s PRO 96 CO 0.37 -0.02 1.64 -0.09 0.04 0.00 0.00 177.00 178.94 1ix5 h ARG 97 N 4.60 0.06 -0.43 4.56 9.65 -1.82 2.30 114.38 133.31 1ix5 h ARG 97 Ca -0.46 -0.00 -0.09 0.00 -1.10 0.00 0.00 59.98 58.33 1ix5 h ARG 97 Cb 1.21 -0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 29.76 1ix5 h ARG 97 CO 0.71 0.04 -0.08 -0.44 2.80 0.00 0.00 179.97 183.00 1ix5 h ASP 98 N 0.06 0.74 0.00 -3.80 3.32 -1.90 0.25 116.42 115.09 1ix5 h ASP 98 Ca 0.81 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 57.66 1ix5 h ASP 98 Cb 2.84 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 42.20 1ix5 h ASP 98 CO -0.24 0.86 0.77 0.00 -1.72 0.00 0.00 179.24 178.91 1ix5 h ALA 99 N 1.22 1.76 0.00 3.45 0.00 0.35 0.13 119.26 126.17 1ix5 h ALA 99 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1ix5 h ALA 99 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1ix5 h ALA 99 CO 0.03 -0.76 -0.78 1.19 0.00 0.00 0.00 179.25 178.94 1ix5 n PHE 100 N -2.58 0.00 0.33 0.00 3.01 -0.92 -4.65 117.46 112.65 1ix5 n PHE 100 Ca -0.01 0.00 0.22 0.00 1.01 0.00 0.00 57.45 58.68 1ix5 n PHE 100 Cb 0.79 0.00 1.17 0.00 -0.01 0.00 0.00 39.48 41.43 1ix5 n PHE 100 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 1ix5 h LYS 101 N 0.00 0.00 -0.47 -1.08 3.64 0.20 0.26 116.57 119.11 1ix5 h LYS 101 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1ix5 h LYS 101 Cb 0.78 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 1ix5 h LYS 101 CO 0.00 0.00 0.00 -0.85 -2.27 0.00 0.00 179.45 176.33 1ix5 n GLU 102 N -3.05 3.86 0.00 1.90 -0.00 -0.05 -4.92 120.64 118.38 1ix5 n GLU 102 Ca -0.03 -2.92 0.00 0.00 -0.00 0.00 0.00 57.16 54.21 1ix5 n GLU 102 Cb 0.08 -1.98 0.00 0.00 -0.00 0.00 0.00 31.44 29.55 1ix5 n GLU 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1ix5 n ALA 103 N 0.35 0.00 -0.49 -1.84 0.00 0.90 -5.06 120.51 114.37 1ix5 n ALA 103 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.68 1ix5 n ALA 103 Cb 0.98 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.43 1ix5 n ALA 103 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1ix5 n ASP 104 N 0.00 0.45 0.00 0.00 9.92 -1.26 -5.08 116.55 120.58 1ix5 n ASP 104 Ca 0.00 -0.96 0.00 0.00 -0.53 0.00 0.00 54.79 53.30 1ix5 n ASP 104 Cb 0.00 0.03 0.00 0.00 -0.64 0.00 0.00 41.12 40.51 1ix5 n ASP 104 CO 0.00 0.00 0.00 2.22 0.13 0.00 0.00 177.20 179.55 1ix5 n PHE 105 N -0.03 0.00 -3.64 1.24 1.16 -1.26 -5.18 117.46 109.75 1ix5 n PHE 105 Ca 0.00 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.48 1ix5 n PHE 105 Cb 0.12 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 37.92 1ix5 n PHE 105 CO 0.00 0.00 0.00 -2.00 -1.87 0.00 0.00 176.76 172.89 1ix5 s GLU 106 N 2.06 0.72 0.33 3.97 2.12 -1.26 -4.70 118.70 121.93 1ix5 s GLU 106 Ca 0.00 0.99 -0.28 0.00 0.36 0.00 0.00 54.97 56.04 1ix5 s GLU 106 Cb 0.00 0.28 -0.09 0.00 0.26 0.00 0.00 34.13 34.58 1ix5 s GLU 106 CO 0.00 -0.11 1.14 -1.25 -0.54 0.00 0.00 175.26 174.50 1ix5 s PRO 107 N 0.80 4.42 0.14 4.30 0.04 -1.26 -5.05 135.00 138.39 1ix5 s PRO 107 Ca -0.03 1.85 0.05 0.00 0.04 0.00 0.00 61.00 62.91 1ix5 s PRO 107 Cb -0.05 -2.99 -0.04 0.00 0.04 0.00 0.00 34.50 31.46 1ix5 s PRO 107 CO -0.07 -0.00 -0.12 -1.21 0.04 0.00 0.00 177.00 175.64 1ix5 s GLU 108 N -1.79 1.03 -0.44 4.56 0.41 -1.26 -4.88 118.70 116.33 1ix5 s GLU 108 Ca 0.49 -1.35 -0.17 0.00 -0.41 0.00 0.00 54.97 53.53 1ix5 s GLU 108 Cb -0.32 -0.73 -0.17 0.00 -1.78 0.00 0.00 34.13 31.13 1ix5 s GLU 108 CO 0.41 0.11 1.69 -1.91 -0.49 0.00 0.00 175.26 175.08 1ix5 n GLU 109 N 0.14 0.91 0.00 1.61 2.13 -1.25 -0.63 120.64 123.56 1ix5 n GLU 109 Ca -0.13 -1.28 0.00 0.00 0.66 0.00 0.00 57.16 56.42 1ix5 n GLU 109 Cb 0.59 -2.54 0.00 0.00 0.27 0.00 0.00 31.44 29.76 1ix5 n GLU 109 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ix5 n GLY 110 N 4.41 -0.32 3.57 8.31 0.00 0.16 -4.89 105.19 116.43 1ix5 n GLY 110 Ca 0.39 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.12 1ix5 n GLY 110 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ix5 s MET 111 N 0.00 -0.51 -0.47 1.61 -1.94 0.20 -4.78 119.30 113.40 1ix5 s MET 111 Ca 0.00 0.52 0.06 0.00 -1.71 0.00 0.00 55.69 54.57 1ix5 s MET 111 Cb 0.00 -1.63 0.24 0.00 2.01 0.00 0.00 34.83 35.45 1ix5 s MET 111 CO 0.00 -3.37 0.81 0.28 -0.01 0.00 0.00 175.02 172.73 1ix5 n VAL 112 N -4.62 -0.13 -3.77 -6.03 0.31 -1.26 -2.88 118.33 99.95 1ix5 n VAL 112 Ca 0.05 -1.90 -0.36 0.00 -0.01 0.00 0.00 64.34 62.12 1ix5 n VAL 112 Cb 0.57 0.86 -0.07 0.00 -0.91 0.00 0.00 33.84 34.29 1ix5 n VAL 112 CO 0.00 0.00 0.00 -0.51 -1.32 0.00 0.00 176.83 175.00 1ix5 s ILE 113 N 0.40 5.43 -0.02 2.52 2.07 -1.25 -4.63 121.20 125.72 1ix5 s ILE 113 Ca 0.32 0.26 -0.02 0.00 -1.41 0.00 0.00 60.65 59.80 1ix5 s ILE 113 Cb 0.20 -3.46 -0.04 0.00 0.13 0.00 0.00 42.46 39.29 1ix5 s ILE 113 CO -0.21 0.52 0.10 -0.76 -1.91 0.00 0.00 174.94 172.68 1ix5 s LEU 114 N -0.33 4.01 0.00 8.50 1.02 -1.26 0.95 118.68 131.58 1ix5 s LEU 114 Ca 0.13 0.21 0.25 0.00 0.02 0.00 0.00 54.13 54.74 1ix5 s LEU 114 Cb -0.12 -2.29 0.53 0.00 0.02 0.00 0.00 46.19 44.33 1ix5 s LEU 114 CO 0.02 0.29 1.45 0.00 0.02 0.00 0.00 176.35 178.13 1ix5 n ALA 115 N 1.27 2.50 0.00 4.21 0.00 -1.16 -4.67 120.51 122.65 1ix5 n ALA 115 Ca -0.14 -0.62 0.00 0.00 0.00 0.00 0.00 53.44 52.69 1ix5 n ALA 115 Cb 0.53 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 19.03 1ix5 n ALA 115 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1ix5 n GLU 116 N 0.90 0.00 0.00 0.00 2.13 -1.26 -4.97 120.64 117.44 1ix5 n GLU 116 Ca 0.16 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.98 1ix5 n GLU 116 Cb 0.50 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.21 1ix5 n GLU 116 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ix5 n GLY 117 N 0.00 1.46 3.59 8.31 0.00 -1.26 -5.11 105.19 112.17 1ix5 n GLY 117 Ca 0.00 -0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 1ix5 n GLY 117 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ix5 s ILE 118 N 0.00 4.74 0.65 -0.61 1.01 -1.26 -4.87 121.20 120.86 1ix5 s ILE 118 Ca 0.00 0.91 -0.14 0.00 0.00 0.00 0.00 60.65 61.42 1ix5 s ILE 118 Cb 0.00 -4.20 -0.01 0.00 0.01 0.00 0.00 42.46 38.26 1ix5 s ILE 118 CO 0.00 -0.41 1.08 -2.16 0.00 0.00 0.00 174.94 173.45 1ix5 s PRO 119 N 3.07 2.98 -0.50 2.79 0.04 -1.26 -3.01 135.00 139.12 1ix5 s PRO 119 Ca 0.31 1.22 0.01 0.00 0.04 0.00 0.00 61.00 62.58 1ix5 s PRO 119 Cb -0.13 -1.98 0.13 0.00 0.04 0.00 0.00 34.50 32.55 1ix5 s PRO 119 CO 0.16 -1.09 0.26 0.00 0.04 0.00 0.00 177.00 176.38 1ix5 s ALA 120 N -2.56 3.28 -0.60 8.56 0.00 0.27 -3.78 121.76 126.93 1ix5 s ALA 120 Ca 0.64 -2.99 -0.26 0.00 0.00 0.00 0.00 51.96 49.35 1ix5 s ALA 120 Cb -0.17 -2.33 -0.05 0.00 0.00 0.00 0.00 23.12 20.57 1ix5 s ALA 120 CO 0.43 -1.94 2.15 0.99 0.00 0.00 0.00 175.76 177.39 1ix5 s THR 121 N 0.29 3.18 -0.62 0.00 2.01 0.09 -3.88 115.64 116.71 1ix5 s THR 121 Ca 0.14 0.05 -0.27 0.00 0.31 0.00 0.00 61.69 61.93 1ix5 s THR 121 Cb -0.22 -3.47 -0.02 0.00 0.01 0.00 0.00 72.50 68.80 1ix5 s THR 121 CO -0.03 -0.45 1.82 -0.63 -0.69 0.00 0.00 174.62 174.64 1ix5 s ILE 122 N 11.00 3.38 -0.29 1.82 1.09 -1.14 0.14 121.20 137.20 1ix5 s ILE 122 Ca 0.83 0.22 0.20 0.00 -1.10 0.00 0.00 60.65 60.80 1ix5 s ILE 122 Cb -0.14 -4.00 0.14 0.00 -1.06 0.00 0.00 42.46 37.41 1ix5 s ILE 122 CO 0.20 -0.96 1.36 0.71 -0.10 0.00 0.00 174.94 176.15 1ix5 h THR 123 N 6.83 0.27 -3.54 2.92 1.35 0.38 0.46 112.91 121.60 1ix5 h THR 123 Ca -0.26 -1.42 -0.65 0.00 -0.55 0.00 0.00 66.41 63.54 1ix5 h THR 123 Cb 1.16 2.00 -0.33 0.00 -1.73 0.00 0.00 68.15 69.25 1ix5 h THR 123 CO 1.22 0.16 -0.87 -0.70 -0.25 0.00 0.00 175.52 175.08 1ix5 s GLU 124 N -3.15 2.64 -0.45 4.72 2.56 -1.09 -4.79 118.70 119.14 1ix5 s GLU 124 Ca 0.04 -0.79 0.06 0.00 0.00 0.00 0.00 54.97 54.28 1ix5 s GLU 124 Cb 0.07 -2.07 0.41 0.00 2.00 0.00 0.00 34.13 34.54 1ix5 s GLU 124 CO 0.73 0.20 1.07 1.55 -0.56 0.00 0.00 175.26 178.25 1ix5 n VAL 125 N 3.42 2.29 -2.63 3.70 3.14 -1.26 -1.99 118.33 125.00 1ix5 n VAL 125 Ca -0.19 -4.84 -0.42 0.00 -2.96 0.00 0.00 64.34 55.92 1ix5 n VAL 125 Cb 0.53 -1.08 -0.03 0.00 -1.06 0.00 0.00 33.84 32.20 1ix5 n VAL 125 CO 0.00 0.00 0.00 0.42 -6.46 0.00 0.00 176.83 170.79 1ix5 s THR 126 N -5.10 4.64 -1.34 1.55 -4.23 0.47 -4.85 115.64 106.79 1ix5 s THR 126 Ca 0.46 1.92 0.00 0.00 -1.18 0.00 0.00 61.69 62.89 1ix5 s THR 126 Cb 0.39 -4.23 0.00 0.00 1.34 0.00 0.00 72.50 70.00 1ix5 s THR 126 CO -0.16 0.03 0.24 -0.67 -0.54 0.00 0.00 174.62 173.52 1ix5 n ASP 127 N 4.84 0.00 -0.01 3.99 2.03 -1.26 0.18 116.55 126.32 1ix5 n ASP 127 Ca 0.09 0.00 0.02 0.00 0.52 0.00 0.00 54.79 55.42 1ix5 n ASP 127 Cb 0.48 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.83 1ix5 n ASP 127 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 1ix5 n ASN 128 N -0.69 3.38 -3.63 1.67 0.23 -1.26 -4.83 115.26 110.12 1ix5 n ASN 128 Ca 0.00 0.00 -0.00 0.00 -0.53 0.00 0.00 54.58 54.05 1ix5 n ASN 128 Cb 0.00 1.19 -0.01 0.00 -2.08 0.00 0.00 39.78 38.89 1ix5 n ASN 128 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 1ix5 s GLU 129 N -2.43 0.52 -0.07 -3.83 2.02 0.49 -2.74 118.70 112.66 1ix5 s GLU 129 Ca -0.03 -0.27 -0.01 0.00 0.02 0.00 0.00 54.97 54.68 1ix5 s GLU 129 Cb 0.04 0.18 0.03 0.00 0.10 0.00 0.00 34.13 34.48 1ix5 s GLU 129 CO 0.29 -0.24 -0.01 0.14 0.02 0.00 0.00 175.26 175.46 1ix5 s VAL 130 N -2.57 0.43 -0.99 2.63 -7.23 -0.86 -0.39 120.40 111.42 1ix5 s VAL 130 Ca 0.13 0.05 -0.18 0.00 -1.81 0.00 0.00 61.98 60.16 1ix5 s VAL 130 Cb 0.03 -0.55 0.13 0.00 0.56 0.00 0.00 36.38 36.54 1ix5 s VAL 130 CO -0.03 0.25 1.23 -0.89 -0.31 0.00 0.00 175.10 175.35 1ix5 s THR 131 N 1.68 4.66 0.74 5.32 2.01 -0.84 -2.27 115.64 126.94 1ix5 s THR 131 Ca 0.01 -1.64 -0.11 0.00 0.31 0.00 0.00 61.69 60.25 1ix5 s THR 131 Cb -0.13 -4.84 0.03 0.00 0.01 0.00 0.00 72.50 67.57 1ix5 s THR 131 CO -0.04 -1.59 1.08 -0.76 -0.69 0.00 0.00 174.62 172.62 1ix5 s LEU 132 N 2.84 2.85 -0.32 4.42 1.02 0.69 1.00 118.68 131.18 1ix5 s LEU 132 Ca 0.36 1.35 -0.02 0.00 0.02 0.00 0.00 54.13 55.84 1ix5 s LEU 132 Cb -0.04 -4.10 0.12 0.00 0.02 0.00 0.00 46.19 42.19 1ix5 s LEU 132 CO -0.08 -1.60 0.16 -0.62 0.02 0.00 0.00 176.35 174.24 1ix5 s ASP 133 N -4.01 3.33 0.00 2.29 2.15 0.36 0.25 116.67 121.03 1ix5 s ASP 133 Ca 0.59 -1.66 0.00 0.00 0.43 0.00 0.00 52.55 51.91 1ix5 s ASP 133 Cb -0.13 -0.39 0.00 0.00 -0.30 0.00 0.00 42.92 42.10 1ix5 s ASP 133 CO 0.54 -0.39 0.39 0.49 -0.17 0.00 0.00 175.17 176.03 1ix5 n PHE 134 N 4.75 0.00 -2.62 -5.34 3.72 1.09 -0.73 117.46 118.34 1ix5 n PHE 134 Ca 0.01 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.36 1ix5 n PHE 134 Cb 0.40 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.90 1ix5 n PHE 134 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1ix5 n ASN 135 N -0.84 -1.59 -4.14 4.37 5.03 -1.26 -4.27 115.26 112.56 1ix5 n ASN 135 Ca 0.00 1.36 -0.36 0.00 0.87 0.00 0.00 54.58 56.46 1ix5 n ASN 135 Cb 0.00 -4.95 0.05 0.00 -1.02 0.00 0.00 39.78 33.87 1ix5 n ASN 135 CO 0.00 0.00 0.00 1.57 -1.83 0.00 0.00 177.26 177.00 1ix5 n HIS 136 N 1.81 -3.97 0.13 3.10 -0.00 -1.26 -4.51 115.22 110.53 1ix5 n HIS 136 Ca -0.36 0.09 0.07 0.00 -0.00 0.00 0.00 57.72 57.52 1ix5 n HIS 136 Cb 0.56 -1.56 0.35 0.00 -0.00 0.00 0.00 29.99 29.35 1ix5 n HIS 136 CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 176.34 175.49 1ix5 n GLU 137 N 1.37 0.09 0.00 1.57 0.28 -1.26 0.13 120.64 122.82 1ix5 n GLU 137 Ca 0.02 0.55 0.03 0.00 -0.16 0.00 0.00 57.16 57.60 1ix5 n GLU 137 Cb 0.54 -1.96 -0.01 0.00 1.43 0.00 0.00 31.44 31.44 1ix5 n GLU 137 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1ix5 n LEU 138 N -1.98 0.90 -4.67 -1.84 4.77 -1.26 -4.86 117.00 108.06 1ix5 n LEU 138 Ca -0.01 -0.73 -0.45 0.00 -0.03 0.00 0.00 56.01 54.79 1ix5 n LEU 138 Cb 0.20 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.26 1ix5 n LEU 138 CO 0.06 0.19 1.09 0.00 -1.33 0.00 0.00 177.39 177.39 1ix5 n ALA 139 N -0.43 1.28 -1.09 -1.18 0.00 0.34 -0.27 120.51 119.17 1ix5 n ALA 139 Ca 0.03 0.42 -0.07 0.00 0.00 0.00 0.00 53.44 53.81 1ix5 n ALA 139 Cb 0.13 -2.31 -0.03 0.00 0.00 0.00 0.00 19.45 17.24 1ix5 n ALA 139 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ix5 n GLY 140 N 2.55 0.68 3.10 0.00 0.00 -1.23 -4.66 105.19 105.63 1ix5 n GLY 140 Ca 0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 1ix5 n GLY 140 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ix5 s LYS 141 N -2.36 2.28 -0.15 1.61 2.36 0.63 -4.80 119.74 119.31 1ix5 s LYS 141 Ca 0.00 -0.61 -0.13 0.00 -2.55 0.00 0.00 55.97 52.68 1ix5 s LYS 141 Cb 0.00 -1.80 -0.05 0.00 -1.05 0.00 0.00 37.83 34.93 1ix5 s LYS 141 CO 0.00 0.08 0.28 -0.51 1.55 0.00 0.00 175.35 176.75 1ix5 s ASP 142 N 0.57 6.44 0.14 1.43 1.01 -1.26 -3.41 116.67 121.59 1ix5 s ASP 142 Ca -0.16 0.52 0.09 0.00 0.71 0.00 0.00 52.55 53.71 1ix5 s ASP 142 Cb -0.17 -2.17 -0.04 0.00 1.01 0.00 0.00 42.92 41.55 1ix5 s ASP 142 CO 0.05 0.13 -0.22 -1.48 0.21 0.00 0.00 175.17 173.87 1ix5 s LEU 143 N 0.29 2.37 0.84 1.23 2.34 -0.73 -4.35 118.68 120.66 1ix5 s LEU 143 Ca 0.16 -0.78 -0.10 0.00 0.06 0.00 0.00 54.13 53.47 1ix5 s LEU 143 Cb -0.13 -0.98 0.10 0.00 -0.56 0.00 0.00 46.19 44.62 1ix5 s LEU 143 CO 0.04 0.06 1.11 -0.69 -1.06 0.00 0.00 176.35 175.82 1ix5 s VAL 144 N -1.48 2.75 -0.35 1.48 1.01 0.30 -0.38 120.40 123.73 1ix5 s VAL 144 Ca 0.13 0.25 0.02 0.00 0.00 0.00 0.00 61.98 62.37 1ix5 s VAL 144 Cb -0.08 -2.53 0.15 0.00 0.00 0.00 0.00 36.38 33.91 1ix5 s VAL 144 CO 0.06 -0.32 0.34 -0.36 0.00 0.00 0.00 175.10 174.82 1ix5 s PHE 145 N -2.79 -0.20 -1.41 5.22 0.08 -0.64 -2.13 117.98 116.10 1ix5 s PHE 145 Ca 0.64 -0.81 -0.08 0.00 0.12 0.00 0.00 56.93 56.80 1ix5 s PHE 145 Cb -0.20 -0.48 0.07 0.00 -0.57 0.00 0.00 43.02 41.84 1ix5 s PHE 145 CO 0.57 -0.94 2.41 2.41 -0.10 0.00 0.00 175.22 179.57 1ix5 n THR 146 N 4.42 4.60 -0.43 0.64 -1.04 -1.08 -2.41 114.28 118.99 1ix5 n THR 146 Ca 0.09 -3.73 -0.29 0.00 -2.04 0.00 0.00 64.05 58.08 1ix5 n THR 146 Cb 0.44 -2.34 0.28 0.00 -1.82 0.00 0.00 70.33 66.89 1ix5 n THR 146 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1ix5 s ILE 147 N 0.56 1.60 -0.30 12.58 1.01 -1.19 -0.96 121.20 134.48 1ix5 s ILE 147 Ca 0.54 0.00 -0.16 0.00 0.00 0.00 0.00 60.65 61.03 1ix5 s ILE 147 Cb 0.16 -2.05 0.18 0.00 0.01 0.00 0.00 42.46 40.76 1ix5 s ILE 147 CO -0.06 0.00 1.18 -0.75 0.00 0.00 0.00 174.94 175.31 1ix5 s LYS 148 N -4.74 0.04 0.40 2.79 2.20 -1.20 -3.38 119.74 115.85 1ix5 s LYS 148 Ca 0.69 0.05 -0.27 0.00 -0.36 0.00 0.00 55.97 56.07 1ix5 s LYS 148 Cb -0.19 0.02 -0.10 0.00 -1.51 0.00 0.00 37.83 36.05 1ix5 s LYS 148 CO 0.62 -0.06 1.47 0.42 -0.36 0.00 0.00 175.35 177.43 1ix5 s ILE 149 N 2.99 2.06 0.00 5.43 -1.09 0.12 -1.42 121.20 129.29 1ix5 s ILE 149 Ca 0.19 0.06 0.00 0.00 -2.23 0.00 0.00 60.65 58.66 1ix5 s ILE 149 Cb -0.03 -3.04 0.00 0.00 -1.58 0.00 0.00 42.46 37.82 1ix5 s ILE 149 CO -0.17 0.01 0.00 -0.38 -1.23 0.00 0.00 174.94 173.17 1ix5 n ILE 150 N 0.23 0.00 -2.83 2.92 5.41 -0.84 -0.51 119.36 123.75 1ix5 n ILE 150 Ca 0.02 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.77 1ix5 n ILE 150 Cb 0.40 -1.09 0.00 0.00 -0.71 0.00 0.00 39.64 38.24 1ix5 n ILE 150 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1ix5 n GLU 151 N -2.77 0.00 -3.86 0.38 2.13 -1.02 -4.33 120.64 111.17 1ix5 n GLU 151 Ca 0.00 0.00 -0.12 0.00 0.66 0.00 0.00 57.16 57.70 1ix5 n GLU 151 Cb 0.43 0.00 -0.13 0.00 0.27 0.00 0.00 31.44 32.01 1ix5 n GLU 151 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1ix5 s VAL 152 N -2.32 0.01 0.00 6.31 1.01 -1.26 -2.77 120.40 121.37 1ix5 s VAL 152 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 61.98 61.89 1ix5 s VAL 152 Cb 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 36.38 36.28 1ix5 s VAL 152 CO 0.00 -0.05 0.00 0.52 0.00 0.00 0.00 175.10 175.57 1ix5 n VAL 153 N 2.90 0.00 -0.77 2.92 0.31 -0.14 -4.85 118.33 118.70 1ix5 n VAL 153 Ca -0.13 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.20 1ix5 n VAL 153 Cb 0.59 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.52 1ix5 n VAL 153 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72