#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b4o s THR 2 N 0.00 4.98 -1.17 0.00 -4.23 -1.26 -4.83 115.64 109.12 1b4o s THR 2 Ca 0.00 0.38 -0.20 0.00 -1.18 0.00 0.00 61.69 60.69 1b4o s THR 2 Cb 0.00 -3.62 0.06 0.00 1.34 0.00 0.00 72.50 70.28 1b4o s THR 2 CO 0.00 -0.05 1.61 0.68 -0.54 0.00 0.00 174.62 176.32 1b4o s VAL 3 N -1.78 4.03 -0.18 2.29 -7.23 -1.22 -4.84 120.40 111.46 1b4o s VAL 3 Ca 0.46 -1.39 -0.19 0.00 -1.81 0.00 0.00 61.98 59.05 1b4o s VAL 3 Cb -0.11 -5.13 -0.03 0.00 0.56 0.00 0.00 36.38 31.66 1b4o s VAL 3 CO 0.22 -1.99 0.54 -0.54 -0.31 0.00 0.00 175.10 173.02 1b4o s LYS 4 N 4.56 4.23 0.00 4.82 1.02 -1.26 -4.12 119.74 128.99 1b4o s LYS 4 Ca 0.50 0.47 0.00 0.00 0.02 0.00 0.00 55.97 56.96 1b4o s LYS 4 Cb 0.02 -3.54 0.00 0.00 -0.52 0.00 0.00 37.83 33.79 1b4o s LYS 4 CO -0.00 -0.10 0.00 1.19 -0.92 0.00 0.00 175.35 175.52 1b4o n PHE 5 N 4.59 0.00 -2.89 3.18 3.72 -1.26 -4.90 117.46 119.90 1b4o n PHE 5 Ca -0.04 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.29 1b4o n PHE 5 Cb 0.51 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 39.05 1b4o n PHE 5 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1b4o n LYS 6 N 0.00 -2.61 -0.05 -1.08 4.76 -1.26 -5.02 118.16 112.89 1b4o n LYS 6 Ca 0.00 2.21 -0.01 0.00 -2.87 0.00 0.00 58.31 57.64 1b4o n LYS 6 Cb 0.00 -4.73 -0.00 0.00 -1.84 0.00 0.00 35.03 28.46 1b4o n LYS 6 CO 0.00 0.00 0.00 1.88 -1.37 0.00 0.00 177.40 177.91 1b4o h TYR 7 N 2.63 0.00 0.00 2.13 0.05 -1.92 -3.47 116.97 116.39 1b4o h TYR 7 Ca -0.05 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.73 1b4o h TYR 7 Cb 0.61 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.35 1b4o h TYR 7 CO 0.04 0.00 -0.53 1.63 -1.05 0.00 0.00 178.16 178.26 1b4o n LYS 8 N -4.58 0.30 -0.00 4.88 5.02 -1.26 -5.02 118.16 117.50 1b4o n LYS 8 Ca -0.02 0.18 -0.00 0.00 -2.02 0.00 0.00 58.31 56.45 1b4o n LYS 8 Cb 0.07 -1.09 -0.00 0.00 -0.02 0.00 0.00 35.03 33.99 1b4o n LYS 8 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1b4o n GLY 9 N 1.51 -0.26 3.77 0.72 0.00 -1.26 -5.07 105.19 104.61 1b4o n GLY 9 Ca -0.07 -0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 1b4o n GLY 9 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1b4o s GLU 10 N -1.10 4.26 0.15 1.61 2.56 -1.26 -4.98 118.70 119.93 1b4o s GLU 10 Ca -0.01 2.35 -0.04 0.00 0.00 0.00 0.00 54.97 57.27 1b4o s GLU 10 Cb 0.00 -3.03 -0.03 0.00 2.00 0.00 0.00 34.13 33.06 1b4o s GLU 10 CO 0.02 -0.32 1.36 1.49 -0.56 0.00 0.00 175.26 177.25 1b4o h GLU 11 N 3.29 0.45 -6.35 4.30 4.57 -1.98 -3.46 114.58 115.39 1b4o h GLU 11 Ca -0.50 -0.42 -0.55 0.00 -1.18 0.00 0.00 59.36 56.72 1b4o h GLU 11 Cb 1.23 0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.91 1b4o h GLU 11 CO 0.65 1.06 0.80 0.15 -1.18 0.00 0.00 179.01 180.49 1b4o s LYS 12 N -3.48 4.30 0.15 1.92 3.01 -1.26 -5.02 119.74 119.36 1b4o s LYS 12 Ca -0.06 1.88 -0.30 0.00 -1.01 0.00 0.00 55.97 56.48 1b4o s LYS 12 Cb 0.09 -3.57 -0.07 0.00 -1.01 0.00 0.00 37.83 33.28 1b4o s LYS 12 CO 0.86 -0.54 0.94 1.14 0.51 0.00 0.00 175.35 178.26 1b4o s GLN 13 N 2.36 4.73 -0.19 1.68 -2.07 -1.26 -4.81 119.66 120.11 1b4o s GLN 13 Ca 0.61 1.44 -0.08 0.00 -1.82 0.00 0.00 55.36 55.52 1b4o s GLN 13 Cb -0.29 -3.35 -0.04 0.00 -1.09 0.00 0.00 33.01 28.24 1b4o s GLN 13 CO 0.25 0.31 0.08 0.08 -1.32 0.00 0.00 175.29 174.69 1b4o s VAL 14 N -0.37 4.96 0.49 3.63 1.01 -1.26 -5.07 120.40 123.79 1b4o s VAL 14 Ca 0.45 0.03 -0.19 0.00 0.00 0.00 0.00 61.98 62.27 1b4o s VAL 14 Cb -0.24 -3.25 -0.09 0.00 0.00 0.00 0.00 36.38 32.81 1b4o s VAL 14 CO 0.30 0.45 0.99 -1.81 0.00 0.00 0.00 175.10 175.03 1b4o s ASP 15 N 0.39 6.60 0.22 3.32 1.01 -1.26 -3.43 116.67 123.52 1b4o s ASP 15 Ca 0.04 1.70 0.22 0.00 0.71 0.00 0.00 52.55 55.23 1b4o s ASP 15 Cb -0.12 -2.53 0.92 0.00 1.01 0.00 0.00 42.92 42.20 1b4o s ASP 15 CO -0.00 -0.60 1.66 0.00 0.21 0.00 0.00 175.17 176.44 1b4o n ILE 16 N -1.17 0.89 0.01 0.77 0.00 -1.26 -3.70 119.36 114.89 1b4o n ILE 16 Ca 0.07 0.27 -0.13 0.00 0.00 0.00 0.00 62.75 62.97 1b4o n ILE 16 Cb 0.54 -1.18 -0.09 0.00 0.00 0.00 0.00 39.64 38.90 1b4o n ILE 16 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 176.55 177.32 1b4o h SER 17 N 0.00 -0.05 -2.87 9.51 4.64 -1.99 -3.43 113.55 119.36 1b4o h SER 17 Ca 0.00 -0.44 -0.64 0.00 -0.47 0.00 0.00 61.79 60.24 1b4o h SER 17 Cb 0.32 0.01 -0.15 0.00 -0.31 0.00 0.00 62.40 62.27 1b4o h SER 17 CO 0.00 0.42 0.41 -0.54 -0.87 0.00 0.00 176.83 176.26 1b4o s LYS 18 N -4.25 3.14 -0.14 4.77 -0.14 -1.24 -4.99 119.74 116.90 1b4o s LYS 18 Ca -0.15 -0.82 -0.05 0.00 -1.36 0.00 0.00 55.97 53.59 1b4o s LYS 18 Cb 0.02 -4.19 0.07 0.00 -1.68 0.00 0.00 37.83 32.05 1b4o s LYS 18 CO 0.64 -1.64 0.28 0.42 -0.76 0.00 0.00 175.35 174.29 1b4o s ILE 19 N 3.64 -0.42 -0.42 2.17 -1.09 -1.26 -4.09 121.20 119.72 1b4o s ILE 19 Ca 0.21 0.27 0.23 0.00 -2.23 0.00 0.00 60.65 59.12 1b4o s ILE 19 Cb -0.18 -0.46 0.32 0.00 -1.58 0.00 0.00 42.46 40.56 1b4o s ILE 19 CO 0.11 0.11 1.59 0.11 -1.23 0.00 0.00 174.94 175.63 1b4o h LYS 20 N 8.23 0.00 -2.17 2.79 1.79 -1.75 -3.43 116.57 122.03 1b4o h LYS 20 Ca -0.15 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.32 1b4o h LYS 20 Cb 1.11 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.76 1b4o h LYS 20 CO 0.14 0.03 0.00 1.17 -1.08 0.00 0.00 179.45 179.71 1b4o n LYS 21 N -3.10 0.00 0.00 3.15 0.00 -1.25 -5.02 118.16 111.94 1b4o n LYS 21 Ca 0.04 0.49 0.00 0.00 0.00 0.00 0.00 58.31 58.84 1b4o n LYS 21 Cb 0.54 -0.60 0.00 0.00 0.00 0.00 0.00 35.03 34.98 1b4o n LYS 21 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1b4o n VAL 22 N 0.06 0.00 -3.50 3.15 0.31 -1.26 -5.02 118.33 112.07 1b4o n VAL 22 Ca 0.00 0.00 -0.22 0.00 -0.01 0.00 0.00 64.34 64.11 1b4o n VAL 22 Cb 0.00 -0.18 0.07 0.00 -0.91 0.00 0.00 33.84 32.82 1b4o n VAL 22 CO 0.00 0.00 0.00 0.79 -1.32 0.00 0.00 176.83 176.30 1b4o n TRP 23 N -0.62 -2.63 0.00 3.52 5.03 -1.26 -4.88 117.44 116.59 1b4o n TRP 23 Ca 0.00 0.93 0.00 0.00 3.03 0.00 0.00 57.50 61.46 1b4o n TRP 23 Cb 0.00 -4.73 0.00 0.00 -1.03 0.00 0.00 31.31 25.55 1b4o n TRP 23 CO 0.00 0.00 0.00 0.54 -0.03 0.00 0.00 177.69 178.20 1b4o n ARG 24 N -4.61 0.00 -2.29 -0.99 1.74 -1.26 -5.13 116.66 104.12 1b4o n ARG 24 Ca -0.01 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.65 1b4o n ARG 24 Cb 0.56 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.97 1b4o n ARG 24 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1b4o s VAL 25 N -0.69 3.94 0.00 1.55 0.11 -1.26 -4.91 120.40 119.14 1b4o s VAL 25 Ca 0.00 1.25 0.00 0.00 -2.93 0.00 0.00 61.98 60.30 1b4o s VAL 25 Cb 0.00 -3.80 0.00 0.00 -1.53 0.00 0.00 36.38 31.05 1b4o s VAL 25 CO 0.00 -0.05 0.00 0.61 -3.33 0.00 0.00 175.10 172.33 1b4o n GLY 26 N 3.65 -1.48 0.07 6.54 0.00 -1.26 -4.40 105.19 108.31 1b4o n GLY 26 Ca 0.13 -1.31 -0.11 0.00 0.00 0.00 0.00 46.02 44.74 1b4o n GLY 26 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1b4o h LYS 27 N 0.00 -0.03 -6.55 1.61 1.57 -1.98 -3.42 116.57 107.77 1b4o h LYS 27 Ca 0.00 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.21 1b4o h LYS 27 Cb 0.00 0.01 -0.08 0.00 0.08 0.00 0.00 32.23 32.24 1b4o h LYS 27 CO 0.00 0.69 0.84 -1.64 -0.57 0.00 0.00 179.45 178.78 1b4o s MET 28 N -2.44 3.72 -0.33 3.15 -1.94 -1.26 -4.77 119.30 115.43 1b4o s MET 28 Ca -0.15 0.52 -0.09 0.00 -1.71 0.00 0.00 55.69 54.26 1b4o s MET 28 Cb -0.02 -3.89 0.01 0.00 2.01 0.00 0.00 34.83 32.93 1b4o s MET 28 CO 0.55 -1.30 0.15 0.42 -0.01 0.00 0.00 175.02 174.83 1b4o s ILE 29 N 4.23 4.48 -0.04 2.53 1.01 -1.26 -4.84 121.20 127.31 1b4o s ILE 29 Ca 0.45 -0.60 -0.30 0.00 0.00 0.00 0.00 60.65 60.21 1b4o s ILE 29 Cb -0.08 -3.35 -0.05 0.00 0.01 0.00 0.00 42.46 38.98 1b4o s ILE 29 CO 0.29 -0.02 1.48 -0.55 0.00 0.00 0.00 174.94 176.14 1b4o s SER 30 N 1.58 6.79 -0.29 3.58 0.15 -1.26 -3.49 113.70 120.75 1b4o s SER 30 Ca 0.03 2.12 -0.21 0.00 0.70 0.00 0.00 55.95 58.59 1b4o s SER 30 Cb -0.18 -2.55 -0.01 0.00 -1.71 0.00 0.00 66.02 61.57 1b4o s SER 30 CO 0.06 -0.80 0.65 0.00 1.20 0.00 0.00 173.24 174.35 1b4o s ALA 31 N 3.07 3.55 -0.12 5.45 0.00 -1.11 -4.26 121.76 128.34 1b4o s ALA 31 Ca 0.66 -0.56 0.00 0.00 0.00 0.00 0.00 51.96 52.06 1b4o s ALA 31 Cb -0.31 -3.11 0.02 0.00 0.00 0.00 0.00 23.12 19.72 1b4o s ALA 31 CO 0.26 -1.02 -0.10 0.95 0.00 0.00 0.00 175.76 175.84 1b4o s THR 32 N 2.63 1.24 -0.02 0.00 -4.23 -1.26 -2.59 115.64 111.42 1b4o s THR 32 Ca 0.26 -0.43 0.03 0.00 -1.18 0.00 0.00 61.69 60.38 1b4o s THR 32 Cb -0.15 -1.21 -0.01 0.00 1.34 0.00 0.00 72.50 72.47 1b4o s THR 32 CO 0.11 0.40 -0.12 -0.72 -0.54 0.00 0.00 174.62 173.75 1b4o s TYR 33 N 1.55 1.12 -0.41 3.99 -0.85 -1.26 -2.36 117.35 119.12 1b4o s TYR 33 Ca 0.03 -0.24 -0.29 0.00 -0.52 0.00 0.00 57.07 56.06 1b4o s TYR 33 Cb -0.13 -0.74 0.02 0.00 0.38 0.00 0.00 41.96 41.49 1b4o s TYR 33 CO -0.08 -0.05 1.18 0.34 -1.52 0.00 0.00 175.55 175.41 1b4o s ASP 34 N -0.14 6.67 -0.08 -0.18 2.15 -1.26 -3.35 116.67 120.48 1b4o s ASP 34 Ca 0.02 0.73 -0.02 0.00 0.43 0.00 0.00 52.55 53.71 1b4o s ASP 34 Cb -0.06 -2.55 -0.01 0.00 -0.30 0.00 0.00 42.92 40.00 1b4o s ASP 34 CO -0.00 -1.17 0.10 -0.08 -0.17 0.00 0.00 175.17 173.85 1b4o h GLU 35 N 9.16 -0.08 0.00 4.34 4.22 -1.94 -3.44 114.58 126.85 1b4o h GLU 35 Ca -0.23 0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.21 1b4o h GLU 35 Cb 1.07 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.34 1b4o h GLU 35 CO 1.09 -0.05 0.00 0.41 -2.18 0.00 0.00 179.01 178.28 1b4o n GLY 36 N 1.58 0.31 0.00 1.92 0.00 -1.26 -5.08 105.19 102.67 1b4o n GLY 36 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1b4o n GLY 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b4o n GLY 37 N 0.88 1.31 2.32 -0.02 0.00 -1.26 -4.93 105.19 103.48 1b4o n GLY 37 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 1b4o n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b4o n GLY 38 N 2.81 2.35 2.59 -0.02 0.00 -1.26 -5.06 105.19 106.60 1b4o n GLY 38 Ca 0.00 -1.35 -0.29 0.00 0.00 0.00 0.00 46.02 44.38 1b4o n GLY 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b4o s LYS 39 N -0.46 0.28 -0.08 1.61 1.02 -1.26 -5.10 119.74 115.74 1b4o s LYS 39 Ca 0.34 -0.54 -0.15 0.00 0.02 0.00 0.00 55.97 55.64 1b4o s LYS 39 Cb 0.10 -1.43 -0.05 0.00 -0.52 0.00 0.00 37.83 35.93 1b4o s LYS 39 CO -0.16 -0.94 0.38 0.95 -0.92 0.00 0.00 175.35 174.65 1b4o s THR 40 N 2.02 5.18 -0.50 2.17 -4.23 -1.26 -3.54 115.64 115.48 1b4o s THR 40 Ca 0.08 0.75 -0.22 0.00 -1.18 0.00 0.00 61.69 61.11 1b4o s THR 40 Cb -0.16 -3.70 0.04 0.00 1.34 0.00 0.00 72.50 70.02 1b4o s THR 40 CO -0.30 0.46 0.80 -0.83 -0.54 0.00 0.00 174.62 174.22 1b4o s GLY 41 N -0.18 1.57 0.29 3.99 0.00 -1.21 -4.95 107.32 106.81 1b4o s GLY 41 Ca 0.22 -1.28 -0.29 0.00 0.00 0.00 0.00 44.72 43.37 1b4o s GLY 41 CO 0.09 1.80 1.16 0.50 0.00 0.00 0.00 173.10 176.66 1b4o s ARG 42 N 3.37 4.56 0.00 2.90 0.52 -1.26 -4.11 118.95 124.93 1b4o s ARG 42 Ca 0.26 1.92 0.00 0.00 -0.52 0.00 0.00 55.73 57.39 1b4o s ARG 42 Cb -0.14 -3.16 0.00 0.00 0.52 0.00 0.00 34.95 32.17 1b4o s ARG 42 CO 0.19 0.09 0.00 0.41 0.02 0.00 0.00 175.30 176.00 1b4o n GLY 43 N 1.17 2.91 2.85 -3.53 0.00 -1.07 -4.97 105.19 102.56 1b4o n GLY 43 Ca -0.00 -0.82 -0.15 0.00 0.00 0.00 0.00 46.02 45.05 1b4o n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b4o s ALA 44 N -1.03 -0.12 -0.25 4.61 0.00 -1.26 -2.77 121.76 120.94 1b4o s ALA 44 Ca 0.00 0.53 -0.04 0.00 0.00 0.00 0.00 51.96 52.45 1b4o s ALA 44 Cb 0.00 -0.42 0.09 0.00 0.00 0.00 0.00 23.12 22.79 1b4o s ALA 44 CO 0.00 -0.19 0.16 0.54 0.00 0.00 0.00 175.76 176.27 1b4o s VAL 45 N 1.27 -0.16 -0.06 0.00 0.11 -1.23 -4.71 120.40 115.62 1b4o s VAL 45 Ca -0.08 -0.49 -0.00 0.00 -2.93 0.00 0.00 61.98 58.49 1b4o s VAL 45 Cb -0.12 -0.84 -0.00 0.00 -1.53 0.00 0.00 36.38 33.89 1b4o s VAL 45 CO -0.05 -0.51 -0.00 -1.28 -3.33 0.00 0.00 175.10 169.93 1b4o h SER 46 N 8.38 0.00 0.00 3.54 0.87 -1.87 -3.39 113.55 121.08 1b4o h SER 46 Ca -0.17 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.39 1b4o h SER 46 Cb 1.07 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.03 1b4o h SER 46 CO 0.37 0.31 0.00 -1.84 -0.53 0.00 0.00 176.83 175.14 1b4o n GLU 47 N -3.70 0.00 -0.03 2.24 0.28 -1.26 -4.93 120.64 113.24 1b4o n GLU 47 Ca -0.00 0.00 -0.13 0.00 -0.16 0.00 0.00 57.16 56.87 1b4o n GLU 47 Cb 0.00 -0.01 -0.09 0.00 1.43 0.00 0.00 31.44 32.77 1b4o n GLU 47 CO 0.00 0.00 0.00 0.87 -0.16 0.00 0.00 177.13 177.84 1b4o h LYS 48 N 0.00 0.16 0.00 3.44 1.57 -2.03 -3.26 116.57 116.45 1b4o h LYS 48 Ca 0.00 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1b4o h LYS 48 Cb 0.00 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.32 1b4o h LYS 48 CO 0.00 0.63 0.00 -0.25 -0.57 0.00 0.00 179.45 179.26 1b4o n ASP 49 N -4.71 0.00 -4.71 0.86 8.00 -1.26 -4.90 116.55 109.83 1b4o n ASP 49 Ca -0.08 -0.15 -0.42 0.00 0.71 0.00 0.00 54.79 54.85 1b4o n ASP 49 Cb 0.32 -0.25 -0.03 0.00 -0.02 0.00 0.00 41.12 41.14 1b4o n ASP 49 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1b4o s ALA 50 N -2.50 3.36 0.74 2.24 0.00 -1.23 -4.61 121.76 119.76 1b4o s ALA 50 Ca 0.25 0.79 -0.10 0.00 0.00 0.00 0.00 51.96 52.89 1b4o s ALA 50 Cb 0.16 -3.43 0.05 0.00 0.00 0.00 0.00 23.12 19.90 1b4o s ALA 50 CO 0.36 -0.41 1.10 -1.25 0.00 0.00 0.00 175.76 175.56 1b4o s PRO 51 N 1.09 2.38 0.16 0.00 0.04 -1.26 -5.03 135.00 132.38 1b4o s PRO 51 Ca 0.58 0.16 -0.12 0.00 0.04 0.00 0.00 61.00 61.65 1b4o s PRO 51 Cb -0.28 -2.04 0.04 0.00 0.04 0.00 0.00 34.50 32.26 1b4o s PRO 51 CO 0.29 -1.27 1.65 0.87 0.04 0.00 0.00 177.00 178.57 1b4o h LYS 52 N -0.77 0.88 -0.75 4.56 1.57 -1.97 -3.37 116.57 116.73 1b4o h LYS 52 Ca -0.45 -0.24 -0.03 0.00 -1.87 0.00 0.00 60.65 58.06 1b4o h LYS 52 Cb 1.30 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 33.47 1b4o h LYS 52 CO 0.64 0.86 0.36 0.93 -0.57 0.00 0.00 179.45 181.67 1b4o h GLU 53 N 0.77 1.08 -0.89 3.15 5.08 -1.95 -3.03 114.58 118.78 1b4o h GLU 53 Ca 0.16 -0.16 0.06 0.00 -1.00 0.00 0.00 59.36 58.42 1b4o h GLU 53 Cb 0.40 -0.19 -0.06 0.00 0.50 0.00 0.00 28.75 29.41 1b4o h GLU 53 CO 0.01 0.84 0.58 1.25 -1.00 0.00 0.00 179.01 180.69 1b4o h LEU 54 N 1.05 0.91 0.10 1.33 5.85 -1.78 -2.85 115.31 119.92 1b4o h LEU 54 Ca 0.26 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.97 1b4o h LEU 54 Cb 0.12 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 40.96 1b4o h LEU 54 CO -0.03 0.60 -0.05 -0.07 -0.34 0.00 0.00 178.44 178.55 1b4o h LEU 55 N 1.04 -0.11 0.37 2.25 3.38 -1.71 -3.33 115.31 117.20 1b4o h LEU 55 Ca 0.37 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 1b4o h LEU 55 Cb 0.15 0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1b4o h LEU 55 CO -0.13 0.13 -0.18 1.56 0.09 0.00 0.00 178.44 179.91 1b4o h GLN 56 N -0.36 -0.48 -5.08 1.13 4.20 -1.55 -3.38 115.11 109.60 1b4o h GLN 56 Ca -0.01 0.03 -0.67 0.00 0.06 0.00 0.00 58.65 58.06 1b4o h GLN 56 Cb 0.30 0.11 -0.17 0.00 0.30 0.00 0.00 27.48 28.02 1b4o h GLN 56 CO 0.02 -0.32 0.31 -1.64 -0.67 0.00 0.00 178.83 176.53 1b4o s MET 57 N -3.30 3.09 -0.20 1.46 -1.94 -1.08 -4.84 119.30 112.48 1b4o s MET 57 Ca -0.07 -1.04 -0.13 0.00 -1.71 0.00 0.00 55.69 52.73 1b4o s MET 57 Cb 0.01 -4.23 -0.19 0.00 2.01 0.00 0.00 34.83 32.42 1b4o s MET 57 CO 0.22 -1.64 0.10 -0.11 -0.01 0.00 0.00 175.02 173.58 1b4o n LEU 58 N 6.96 2.22 -1.11 -0.03 0.00 -1.25 -4.46 117.00 119.33 1b4o n LEU 58 Ca -0.06 0.28 0.00 0.00 0.00 0.00 0.00 56.01 56.23 1b4o n LEU 58 Cb 0.44 -0.98 0.00 0.00 0.00 0.00 0.00 43.42 42.88 1b4o n LEU 58 CO 0.61 0.57 0.00 -0.62 0.00 0.00 0.00 177.39 177.95 1b4o n GLU 59 N -4.00 0.00 -2.04 1.96 1.02 -1.26 -5.08 120.64 111.24 1b4o n GLU 59 Ca -0.38 0.37 -0.42 0.00 -0.02 0.00 0.00 57.16 56.71 1b4o n GLU 59 Cb 0.86 -0.93 -0.03 0.00 -0.02 0.00 0.00 31.44 31.32 1b4o n GLU 59 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1b4o s LYS 60 N -0.50 4.24 -0.22 3.49 1.02 -1.26 -5.00 119.74 121.50 1b4o s LYS 60 Ca 0.00 2.19 -0.06 0.00 0.02 0.00 0.00 55.97 58.13 1b4o s LYS 60 Cb 0.00 -3.51 -0.02 0.00 -0.52 0.00 0.00 37.83 33.78 1b4o s LYS 60 CO 0.00 -0.64 0.03 -1.14 -0.92 0.00 0.00 175.35 172.67 1b4o s GLN 61 N 2.25 3.61 0.00 1.68 0.74 -1.26 -5.10 119.66 121.59 1b4o s GLN 61 Ca 0.69 -0.51 0.28 0.00 0.05 0.00 0.00 55.36 55.87 1b4o s GLN 61 Cb -0.37 -3.18 1.05 0.00 1.10 0.00 0.00 33.01 31.61 1b4o s GLN 61 CO 0.30 -0.09 1.74 1.63 -0.55 0.00 0.00 175.29 178.33