#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qou s ILE 4 N 0.00 0.05 -0.04 -0.18 -5.25 -1.26 -5.15 121.20 109.36 2qou s ILE 4 Ca 0.00 -0.37 -0.19 0.00 -0.99 0.00 0.00 60.65 59.09 2qou s ILE 4 Cb 0.00 -0.88 -0.05 0.00 2.95 0.00 0.00 42.46 44.48 2qou s ILE 4 CO 0.00 -0.21 0.54 -0.13 -1.79 0.00 0.00 174.94 173.35 2qou s ARG 5 N -1.99 4.28 0.20 0.37 1.81 -1.26 -5.08 118.95 117.28 2qou s ARG 5 Ca -0.08 0.61 0.05 0.00 -1.72 0.00 0.00 55.73 54.59 2qou s ARG 5 Cb -0.02 -3.36 -0.05 0.00 -0.45 0.00 0.00 34.95 31.07 2qou s ARG 5 CO 0.01 0.32 -0.06 0.99 -0.68 0.00 0.00 175.30 175.89 2qou s THR 6 N 0.01 1.23 -0.16 0.02 2.01 -1.26 -4.54 115.64 112.95 2qou s THR 6 Ca 0.29 -2.07 -0.06 0.00 0.31 0.00 0.00 61.69 60.15 2qou s THR 6 Cb -0.17 -2.15 0.07 0.00 0.01 0.00 0.00 72.50 70.26 2qou s THR 6 CO 0.15 -0.50 0.33 -0.76 -0.69 0.00 0.00 174.62 173.15 2qou s LEU 7 N -3.27 -0.33 -0.39 4.42 1.43 -0.17 -4.93 118.68 115.44 2qou s LEU 7 Ca 0.24 0.76 -0.16 0.00 -1.03 0.00 0.00 54.13 53.94 2qou s LEU 7 Cb 0.04 1.01 0.01 0.00 0.03 0.00 0.00 46.19 47.28 2qou s LEU 7 CO 0.06 -0.22 0.38 0.00 0.23 0.00 0.00 176.35 176.80 2qou s GLN 8 N 2.26 3.24 0.30 1.70 -2.07 -1.26 0.34 119.66 124.16 2qou s GLN 8 Ca -0.02 -0.69 0.03 0.00 -1.82 0.00 0.00 55.36 52.86 2qou s GLN 8 Cb -0.11 -3.91 -0.06 0.00 -1.09 0.00 0.00 33.01 27.84 2qou s GLN 8 CO -0.11 -0.72 0.07 0.20 -1.32 0.00 0.00 175.29 173.42 2qou s GLY 9 N 1.76 1.92 0.18 2.60 0.00 0.87 -4.93 107.32 109.72 2qou s GLY 9 Ca 0.10 -1.98 -0.15 0.00 0.00 0.00 0.00 44.72 42.70 2qou s GLY 9 CO 0.12 -1.73 0.60 1.09 0.00 0.00 0.00 173.10 173.18 2qou s ARG 10 N -3.94 4.03 -0.93 2.90 1.70 -0.47 -1.26 118.95 120.98 2qou s ARG 10 Ca 0.36 0.57 -0.24 0.00 -0.47 0.00 0.00 55.73 55.95 2qou s ARG 10 Cb 0.08 -2.88 0.01 0.00 -0.57 0.00 0.00 34.95 31.59 2qou s ARG 10 CO 0.14 0.44 1.64 0.08 -1.08 0.00 0.00 175.30 176.52 2qou s VAL 11 N -1.52 3.70 0.50 4.99 1.01 0.18 -0.26 120.40 129.00 2qou s VAL 11 Ca 0.40 -0.48 0.19 0.00 0.00 0.00 0.00 61.98 62.10 2qou s VAL 11 Cb -0.15 -4.60 0.26 0.00 0.00 0.00 0.00 36.38 31.88 2qou s VAL 11 CO 0.20 -1.52 2.11 1.62 0.00 0.00 0.00 175.10 177.51 2qou h VAL 12 N 6.91 0.92 -2.29 2.92 3.04 -1.63 -0.42 116.25 125.70 2qou h VAL 12 Ca 0.10 -0.27 -0.07 0.00 -1.01 0.00 0.00 66.70 65.45 2qou h VAL 12 Cb 1.02 1.15 -0.19 0.00 -2.01 0.00 0.00 31.29 31.26 2qou h VAL 12 CO 1.33 0.07 0.09 -0.55 -1.01 0.00 0.00 177.57 177.50 2qou s SER 13 N -6.80 -0.55 -0.22 3.17 0.15 0.23 -4.89 113.70 104.79 2qou s SER 13 Ca -0.04 0.53 -0.03 0.00 0.70 0.00 0.00 55.95 57.10 2qou s SER 13 Cb 0.16 0.50 0.10 0.00 -1.71 0.00 0.00 66.02 65.06 2qou s SER 13 CO 0.65 -0.60 0.23 -0.62 1.20 0.00 0.00 173.24 174.10 2qou s ASP 14 N -1.34 1.51 0.00 5.45 3.68 -1.26 -0.71 116.67 124.01 2qou s ASP 14 Ca -0.11 -0.35 0.00 0.00 2.13 0.00 0.00 52.55 54.23 2qou s ASP 14 Cb -0.01 0.37 0.00 0.00 -1.45 0.00 0.00 42.92 41.83 2qou s ASP 14 CO 0.07 -0.34 0.00 0.29 0.13 0.00 0.00 175.17 175.32 2qou n LYS 15 N 5.31 0.00 -0.59 4.34 4.01 -1.26 -5.00 118.16 124.98 2qou n LYS 15 Ca -0.05 0.00 -0.21 0.00 -0.51 0.00 0.00 58.31 57.54 2qou n LYS 15 Cb 0.49 0.00 -0.02 0.00 -0.51 0.00 0.00 35.03 34.99 2qou n LYS 15 CO 0.00 0.00 0.00 -1.33 -1.11 0.00 0.00 177.40 174.96 2qou n MET 16 N -1.09 0.00 -1.53 1.97 2.81 -1.21 -4.58 117.12 113.50 2qou n MET 16 Ca 0.00 0.00 -0.50 0.00 -1.81 0.00 0.00 57.70 55.39 2qou n MET 16 Cb 0.00 -0.49 -0.06 0.00 -0.71 0.00 0.00 33.22 31.96 2qou n MET 16 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 2qou n GLU 17 N 0.49 1.37 0.00 0.03 1.02 -1.26 -1.44 120.64 120.84 2qou n GLU 17 Ca 0.08 0.42 0.00 0.00 -0.02 0.00 0.00 57.16 57.63 2qou n GLU 17 Cb 0.08 -2.55 0.00 0.00 -0.02 0.00 0.00 31.44 28.95 2qou n GLU 17 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2qou n LYS 18 N 7.74 0.00 -2.72 3.49 5.02 -1.26 -4.92 118.16 125.52 2qou n LYS 18 Ca 0.35 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 56.22 2qou n LYS 18 Cb 0.26 -0.73 -0.03 0.00 -0.02 0.00 0.00 35.03 34.51 2qou n LYS 18 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2qou s SER 19 N 0.00 7.08 -0.02 4.39 0.01 -0.52 -0.27 113.70 124.36 2qou s SER 19 Ca 0.00 1.35 0.06 0.00 1.31 0.00 0.00 55.95 58.67 2qou s SER 19 Cb 0.00 -2.52 -0.02 0.00 0.21 0.00 0.00 66.02 63.68 2qou s SER 19 CO 0.00 -0.57 -0.21 -0.63 0.41 0.00 0.00 173.24 172.23 2qou s ILE 20 N 2.78 2.47 -0.20 1.44 1.09 -0.26 -3.36 121.20 125.16 2qou s ILE 20 Ca 0.43 -1.00 -0.14 0.00 -1.10 0.00 0.00 60.65 58.84 2qou s ILE 20 Cb -0.16 -1.92 -0.04 0.00 -1.06 0.00 0.00 42.46 39.28 2qou s ILE 20 CO 0.09 0.55 0.31 -0.69 -0.10 0.00 0.00 174.94 175.10 2qou s VAL 21 N -0.69 5.27 0.00 2.92 1.01 0.12 0.72 120.40 129.75 2qou s VAL 21 Ca 0.11 0.53 0.06 0.00 0.00 0.00 0.00 61.98 62.68 2qou s VAL 21 Cb -0.10 -3.64 -0.02 0.00 0.00 0.00 0.00 36.38 32.62 2qou s VAL 21 CO 0.00 0.31 -0.19 -0.69 0.00 0.00 0.00 175.10 174.53 2qou s VAL 22 N 1.07 1.49 -0.01 2.92 1.01 0.44 -0.60 120.40 126.72 2qou s VAL 22 Ca 0.15 -0.91 0.04 0.00 0.00 0.00 0.00 61.98 61.26 2qou s VAL 22 Cb -0.14 -1.26 -0.03 0.00 0.00 0.00 0.00 36.38 34.95 2qou s VAL 22 CO 0.06 0.33 -0.10 0.00 0.00 0.00 0.00 175.10 175.39 2qou s ALA 23 N -0.56 2.86 -0.20 5.51 0.00 0.64 -0.26 121.76 129.75 2qou s ALA 23 Ca 0.07 -1.02 -0.05 0.00 0.00 0.00 0.00 51.96 50.96 2qou s ALA 23 Cb -0.08 -1.04 0.07 0.00 0.00 0.00 0.00 23.12 22.08 2qou s ALA 23 CO 0.00 0.59 0.10 0.42 0.00 0.00 0.00 175.76 176.86 2qou s ILE 24 N -0.89 -0.04 0.82 0.00 1.09 0.06 -1.37 121.20 120.87 2qou s ILE 24 Ca 0.15 -0.34 -0.12 0.00 -1.10 0.00 0.00 60.65 59.23 2qou s ILE 24 Cb -0.11 -0.71 0.08 0.00 -1.06 0.00 0.00 42.46 40.67 2qou s ILE 24 CO 0.05 -0.39 1.15 -1.83 -0.10 0.00 0.00 174.94 173.81 2qou s GLU 25 N 2.11 1.90 -0.17 2.79 -1.05 -1.26 -1.10 118.70 121.91 2qou s GLU 25 Ca 0.04 0.28 -0.28 0.00 -0.15 0.00 0.00 54.97 54.85 2qou s GLU 25 Cb -0.16 -1.93 0.08 0.00 -0.44 0.00 0.00 34.13 31.68 2qou s GLU 25 CO -0.16 -1.67 0.77 -0.98 0.95 0.00 0.00 175.26 174.17 2qou s ARG 26 N -5.41 0.86 0.57 -4.83 1.70 0.54 -4.87 118.95 107.50 2qou s ARG 26 Ca 0.62 0.56 -0.16 0.00 -0.47 0.00 0.00 55.73 56.28 2qou s ARG 26 Cb -0.12 0.41 -0.05 0.00 -0.57 0.00 0.00 34.95 34.62 2qou s ARG 26 CO 0.51 -0.20 1.05 -0.06 -1.08 0.00 0.00 175.30 175.52 2qou s PHE 27 N -0.42 3.05 -0.29 5.89 0.08 -1.26 -0.83 117.98 124.19 2qou s PHE 27 Ca -0.04 1.51 -0.16 0.00 0.12 0.00 0.00 56.93 58.36 2qou s PHE 27 Cb -0.03 -2.99 0.12 0.00 -0.57 0.00 0.00 43.02 39.56 2qou s PHE 27 CO 0.04 -0.99 0.87 0.54 -0.10 0.00 0.00 175.22 175.58 2qou s VAL 28 N -2.41 -0.04 0.30 -0.44 0.11 -0.79 -4.89 120.40 112.23 2qou s VAL 28 Ca 0.63 0.00 -0.28 0.00 -2.93 0.00 0.00 61.98 59.41 2qou s VAL 28 Cb -0.15 -1.00 -0.09 0.00 -1.53 0.00 0.00 36.38 33.60 2qou s VAL 28 CO 0.34 0.00 0.99 -0.75 -3.33 0.00 0.00 175.10 172.35 2qou s LYS 29 N 1.52 4.63 0.22 1.54 2.20 -1.26 0.43 119.74 129.02 2qou s LYS 29 Ca -0.09 1.52 -0.30 0.00 -0.36 0.00 0.00 55.97 56.74 2qou s LYS 29 Cb -0.04 -3.01 -0.09 0.00 -1.51 0.00 0.00 37.83 33.18 2qou s LYS 29 CO -0.17 0.28 1.23 -1.58 -0.36 0.00 0.00 175.35 174.75 2qou s HIS 30 N -1.38 3.35 0.58 4.03 5.65 0.34 -4.91 115.29 122.95 2qou s HIS 30 Ca 0.47 1.41 0.28 0.00 0.25 0.00 0.00 55.06 57.46 2qou s HIS 30 Cb -0.25 -3.49 1.66 0.00 -1.18 0.00 0.00 32.58 29.33 2qou s HIS 30 CO 0.31 -1.39 2.14 -1.00 -0.65 0.00 0.00 174.74 174.15 2qou h PRO 31 N 4.82 0.00 0.00 2.88 0.13 -1.92 -2.83 132.00 135.08 2qou h PRO 31 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2qou h PRO 31 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2qou h PRO 31 CO 0.73 0.00 -0.32 1.51 -0.23 0.00 0.00 178.00 179.69 2qou n ILE 32 N -3.88 0.00 0.28 -3.56 0.13 -1.26 -4.81 119.36 106.25 2qou n ILE 32 Ca 0.00 0.00 0.15 0.00 -1.10 0.00 0.00 62.75 61.80 2qou n ILE 32 Cb 0.26 -0.17 0.46 0.00 -0.84 0.00 0.00 39.64 39.34 2qou n ILE 32 CO 0.00 0.00 0.00 1.88 2.80 0.00 0.00 176.55 181.23 2qou h TYR 33 N 0.00 0.00 0.00 9.51 0.99 -1.98 -3.47 116.97 122.02 2qou h TYR 33 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2qou h TYR 33 Cb 0.32 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.05 2qou h TYR 33 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 178.16 178.57 2qou n GLY 34 N 0.52 2.17 0.84 3.88 0.00 -1.07 -4.93 105.19 106.62 2qou n GLY 34 Ca 0.02 -0.17 -0.15 0.00 0.00 0.00 0.00 46.02 45.72 2qou n GLY 34 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2qou n LYS 35 N 0.00 0.00 -1.13 1.61 3.00 -1.26 -0.51 118.16 119.87 2qou n LYS 35 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 58.31 58.01 2qou n LYS 35 Cb 0.00 -0.34 0.13 0.00 0.00 0.00 0.00 35.03 34.81 2qou n LYS 35 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.40 177.34 2qou s PHE 36 N 0.46 2.28 0.04 5.64 0.40 -1.26 -2.39 117.98 123.16 2qou s PHE 36 Ca 0.23 1.44 -0.07 0.00 -0.60 0.00 0.00 56.93 57.93 2qou s PHE 36 Cb -0.33 -3.14 -0.00 0.00 0.51 0.00 0.00 43.02 40.06 2qou s PHE 36 CO 0.17 -2.28 0.15 0.42 0.70 0.00 0.00 175.22 174.37 2qou s ILE 37 N -2.86 0.12 -0.41 0.64 1.01 0.17 -4.87 121.20 115.00 2qou s ILE 37 Ca 0.63 -0.98 -0.20 0.00 0.00 0.00 0.00 60.65 60.10 2qou s ILE 37 Cb -0.19 -0.89 0.02 0.00 0.01 0.00 0.00 42.46 41.41 2qou s ILE 37 CO 0.57 -0.54 0.58 -0.75 0.00 0.00 0.00 174.94 174.80 2qou s LYS 38 N -2.54 3.35 -0.12 2.79 2.20 -1.26 -1.89 119.74 122.26 2qou s LYS 38 Ca -0.05 -0.36 0.02 0.00 -0.36 0.00 0.00 55.97 55.21 2qou s LYS 38 Cb -0.01 -3.91 -0.01 0.00 -1.51 0.00 0.00 37.83 32.39 2qou s LYS 38 CO -0.04 -0.88 -0.18 0.50 -0.36 0.00 0.00 175.35 174.39 2qou s ARG 39 N 2.60 3.22 0.31 4.03 6.06 -0.01 -4.89 118.95 130.26 2qou s ARG 39 Ca 0.20 -0.77 0.08 0.00 -2.50 0.00 0.00 55.73 52.74 2qou s ARG 39 Cb -0.15 -2.50 -0.04 0.00 0.06 0.00 0.00 34.95 32.32 2qou s ARG 39 CO 0.16 0.16 0.19 0.99 -2.50 0.00 0.00 175.30 174.31 2qou s THR 40 N 0.44 3.62 -0.03 4.11 2.01 -1.26 0.20 115.64 124.74 2qou s THR 40 Ca -0.13 -1.54 0.00 0.00 0.31 0.00 0.00 61.69 60.34 2qou s THR 40 Cb -0.17 -3.14 0.03 0.00 0.01 0.00 0.00 72.50 69.23 2qou s THR 40 CO 0.06 -0.25 0.01 -0.89 -0.69 0.00 0.00 174.62 172.86 2qou s THR 41 N -2.30 0.12 -0.33 -0.82 2.01 -0.26 -4.89 115.64 109.17 2qou s THR 41 Ca 0.37 0.11 -0.13 0.00 0.31 0.00 0.00 61.69 62.34 2qou s THR 41 Cb -0.06 -0.21 -0.02 0.00 0.01 0.00 0.00 72.50 72.22 2qou s THR 41 CO 0.24 0.12 0.27 -0.54 -0.69 0.00 0.00 174.62 174.03 2qou s LYS 42 N 0.96 3.61 0.33 4.92 1.02 -1.26 -0.76 119.74 128.55 2qou s LYS 42 Ca -0.09 -0.50 0.10 0.00 0.02 0.00 0.00 55.97 55.50 2qou s LYS 42 Cb -0.13 -3.78 -0.06 0.00 -0.52 0.00 0.00 37.83 33.35 2qou s LYS 42 CO -0.02 -0.42 -0.11 -0.51 -0.92 0.00 0.00 175.35 173.37 2qou s LEU 43 N 1.82 2.73 -0.49 3.17 1.02 0.64 -4.99 118.68 122.59 2qou s LEU 43 Ca 0.08 -1.13 -0.06 0.00 0.02 0.00 0.00 54.13 53.04 2qou s LEU 43 Cb -0.17 -1.07 0.13 0.00 0.02 0.00 0.00 46.19 45.10 2qou s LEU 43 CO 0.11 -0.14 0.33 -1.00 0.02 0.00 0.00 176.35 175.67 2qou s HIS 44 N -2.57 3.49 0.59 0.29 3.76 -1.26 -0.42 115.29 119.18 2qou s HIS 44 Ca 0.32 -2.18 -0.14 0.00 -0.15 0.00 0.00 55.06 52.91 2qou s HIS 44 Cb 0.00 -3.38 -0.04 0.00 1.11 0.00 0.00 32.58 30.27 2qou s HIS 44 CO 0.16 -0.97 1.02 0.08 -0.85 0.00 0.00 174.74 174.19 2qou s VAL 45 N 1.03 4.37 -0.22 -0.90 1.01 0.22 -4.22 120.40 121.70 2qou s VAL 45 Ca 0.09 0.96 -0.05 0.00 0.00 0.00 0.00 61.98 62.98 2qou s VAL 45 Cb -0.24 -3.65 -0.02 0.00 0.00 0.00 0.00 36.38 32.48 2qou s VAL 45 CO -0.03 -0.83 -0.01 -2.28 0.00 0.00 0.00 175.10 171.96 2qou s HIS 46 N -2.83 3.00 -0.40 5.22 2.46 0.11 -1.10 115.29 121.74 2qou s HIS 46 Ca 0.58 -0.66 0.01 0.00 0.47 0.00 0.00 55.06 55.46 2qou s HIS 46 Cb -0.12 -2.11 0.14 0.00 -0.13 0.00 0.00 32.58 30.35 2qou s HIS 46 CO 0.43 -0.39 0.22 0.34 -2.47 0.00 0.00 174.74 172.87 2qou s ASP 47 N 1.29 3.41 0.00 9.88 3.68 0.62 -3.03 116.67 132.53 2qou s ASP 47 Ca 0.04 -2.43 0.00 0.00 2.13 0.00 0.00 52.55 52.29 2qou s ASP 47 Cb -0.15 -0.80 0.00 0.00 -1.45 0.00 0.00 42.92 40.53 2qou s ASP 47 CO 0.00 -0.29 0.87 1.21 0.13 0.00 0.00 175.17 177.09 2qou n GLU 48 N 3.77 0.53 0.00 4.34 2.13 -1.26 -2.07 120.64 128.08 2qou n GLU 48 Ca 0.09 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.91 2qou n GLU 48 Cb 0.36 -1.24 0.00 0.00 0.27 0.00 0.00 31.44 30.83 2qou n GLU 48 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2qou n ASN 49 N 1.37 0.00 -1.30 4.31 3.02 -1.26 -5.00 115.26 116.40 2qou n ASN 49 Ca 0.00 0.00 -0.15 0.00 -0.03 0.00 0.00 54.58 54.40 2qou n ASN 49 Cb 0.26 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.37 2qou n ASN 49 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2qou n ASN 50 N 0.00 -4.58 0.00 6.41 4.13 -0.88 -4.79 115.26 115.55 2qou n ASN 50 Ca 0.00 0.37 0.08 0.00 1.68 0.00 0.00 54.58 56.71 2qou n ASN 50 Cb 0.00 -3.94 0.47 0.00 -1.54 0.00 0.00 39.78 34.77 2qou n ASN 50 CO 0.00 0.00 0.00 -1.84 0.28 0.00 0.00 177.26 175.70 2qou n GLU 51 N -1.75 0.40 -4.03 3.52 0.28 -1.26 -4.74 120.64 113.07 2qou n GLU 51 Ca -0.15 0.06 -0.30 0.00 -0.16 0.00 0.00 57.16 56.61 2qou n GLU 51 Cb 0.54 -1.50 -0.06 0.00 1.43 0.00 0.00 31.44 31.86 2qou n GLU 51 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2qou s GLY 53 N -2.56 2.13 0.27 0.00 0.00 -1.26 -5.08 107.32 100.82 2qou s GLY 53 Ca 0.31 -1.82 -0.19 0.00 0.00 0.00 0.00 44.72 43.02 2qou s GLY 53 CO 0.24 -1.72 0.76 -1.50 0.00 0.00 0.00 173.10 170.88 2qou s ILE 54 N -2.51 4.56 0.00 0.90 2.07 -1.26 -3.62 121.20 121.33 2qou s ILE 54 Ca 0.48 1.25 0.00 0.00 -1.41 0.00 0.00 60.65 60.97 2qou s ILE 54 Cb -0.04 -3.78 0.00 0.00 0.13 0.00 0.00 42.46 38.77 2qou s ILE 54 CO 0.28 0.05 0.00 0.61 -1.91 0.00 0.00 174.94 173.97 2qou n GLY 55 N 0.30 0.59 3.91 1.50 0.00 -0.17 -4.89 105.19 106.43 2qou n GLY 55 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 2qou n GLY 55 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qou s ASP 56 N -2.29 5.67 -0.67 1.61 1.11 -1.24 -4.30 116.67 116.56 2qou s ASP 56 Ca 0.00 0.83 -0.07 0.00 0.18 0.00 0.00 52.55 53.49 2qou s ASP 56 Cb 0.00 -1.83 0.17 0.00 1.07 0.00 0.00 42.92 42.33 2qou s ASP 56 CO 0.00 -1.05 0.52 -0.69 1.18 0.00 0.00 175.17 175.14 2qou s VAL 57 N -3.03 4.30 0.44 -1.27 1.01 0.14 -0.64 120.40 121.35 2qou s VAL 57 Ca 0.54 -2.70 0.08 0.00 0.00 0.00 0.00 61.98 59.90 2qou s VAL 57 Cb -0.11 -3.76 0.01 0.00 0.00 0.00 0.00 36.38 32.53 2qou s VAL 57 CO 0.46 -0.91 0.53 0.68 0.00 0.00 0.00 175.10 175.87 2qou s VAL 58 N 0.14 2.77 0.03 2.92 -7.23 -0.39 -0.65 120.40 118.00 2qou s VAL 58 Ca 0.16 -1.12 0.08 0.00 -1.81 0.00 0.00 61.98 59.30 2qou s VAL 58 Cb -0.18 -2.88 -0.03 0.00 0.56 0.00 0.00 36.38 33.85 2qou s VAL 58 CO -0.05 0.00 -0.24 -0.70 -0.31 0.00 0.00 175.10 173.81 2qou s GLU 59 N -4.32 1.66 0.33 4.82 2.12 -0.36 -0.09 118.70 122.86 2qou s GLU 59 Ca 0.53 -1.00 0.04 0.00 0.36 0.00 0.00 54.97 54.91 2qou s GLU 59 Cb -0.07 -1.77 -0.03 0.00 0.26 0.00 0.00 34.13 32.51 2qou s GLU 59 CO 0.32 0.46 0.19 0.96 -0.54 0.00 0.00 175.26 176.65 2qou s ILE 60 N -0.76 0.27 -0.15 -3.70 -0.00 0.15 0.12 121.20 117.14 2qou s ILE 60 Ca 0.10 -2.00 -0.16 0.00 -0.00 0.00 0.00 60.65 58.59 2qou s ILE 60 Cb -0.09 -2.47 0.04 0.00 -0.00 0.00 0.00 42.46 39.94 2qou s ILE 60 CO 0.01 0.00 0.44 0.00 -0.00 0.00 0.00 174.94 175.40 2qou s ARG 61 N -3.70 0.55 0.59 0.37 1.70 -1.12 -1.00 118.95 116.34 2qou s ARG 61 Ca 0.35 0.53 -0.20 0.00 -0.47 0.00 0.00 55.73 55.94 2qou s ARG 61 Cb 0.04 0.27 -0.03 0.00 -0.57 0.00 0.00 34.95 34.65 2qou s ARG 61 CO 0.20 -0.08 1.27 -2.00 -1.08 0.00 0.00 175.30 173.60 2qou s GLU 62 N 0.03 2.96 0.25 3.89 2.12 -1.26 -2.61 118.70 124.07 2qou s GLU 62 Ca -0.02 2.00 -0.17 0.00 0.36 0.00 0.00 54.97 57.15 2qou s GLU 62 Cb -0.03 -2.03 0.06 0.00 0.26 0.00 0.00 34.13 32.39 2qou s GLU 62 CO 0.01 -1.26 0.83 0.00 -0.54 0.00 0.00 175.26 174.30 2qou n ARG 64 N -0.58 0.97 -1.69 0.00 0.63 -1.26 -4.59 116.66 110.14 2qou n ARG 64 Ca -0.04 0.34 -0.17 0.00 -0.92 0.00 0.00 57.85 57.05 2qou n ARG 64 Cb 0.53 -1.70 -0.06 0.00 0.45 0.00 0.00 32.46 31.67 2qou n ARG 64 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 2qou s PRO 65 N -0.93 1.85 0.42 -0.14 0.04 -1.26 -4.59 135.00 130.38 2qou s PRO 65 Ca 0.67 0.33 0.11 0.00 0.04 0.00 0.00 61.00 62.14 2qou s PRO 65 Cb -0.83 -4.84 0.94 0.00 0.04 0.00 0.00 34.50 29.82 2qou s PRO 65 CO 0.56 -4.16 2.00 -0.07 0.04 0.00 0.00 177.00 175.38 2qou h LEU 66 N 21.32 0.43 -7.06 -3.56 3.38 -1.29 -3.45 115.31 125.09 2qou h LEU 66 Ca 0.02 0.00 0.17 0.00 0.09 0.00 0.00 57.88 58.16 2qou h LEU 66 Cb 1.01 -0.09 -0.16 0.00 0.09 0.00 0.00 40.66 41.51 2qou h LEU 66 CO 1.06 0.28 0.61 -0.55 0.09 0.00 0.00 178.44 179.94 2qou s SER 67 N -6.38 -0.26 0.13 -0.43 0.15 -0.74 -5.05 113.70 101.12 2qou s SER 67 Ca -0.08 -0.04 -0.33 0.00 0.70 0.00 0.00 55.95 56.20 2qou s SER 67 Cb 0.19 0.30 -0.17 0.00 -1.71 0.00 0.00 66.02 64.63 2qou s SER 67 CO 0.75 -0.50 0.91 1.17 1.20 0.00 0.00 173.24 176.77 2qou n LYS 68 N -0.22 0.40 -3.98 5.44 4.81 -1.26 -0.03 118.16 123.32 2qou n LYS 68 Ca -0.05 0.14 -0.27 0.00 -0.87 0.00 0.00 58.31 57.25 2qou n LYS 68 Cb 0.61 -1.47 -0.02 0.00 0.02 0.00 0.00 35.03 34.17 2qou n LYS 68 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 2qou n THR 69 N 0.95 -2.73 -3.08 3.15 -2.24 -1.26 -4.93 114.28 104.16 2qou n THR 69 Ca 0.17 -0.38 0.03 0.00 -2.27 0.00 0.00 64.05 61.61 2qou n THR 69 Cb 0.20 -2.57 -0.00 0.00 -2.10 0.00 0.00 70.33 65.85 2qou n THR 69 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2qou s LYS 70 N -6.59 0.47 -0.01 -0.78 2.20 0.95 -4.32 119.74 111.67 2qou s LYS 70 Ca 0.18 0.06 0.11 0.00 -0.36 0.00 0.00 55.97 55.96 2qou s LYS 70 Cb -0.10 0.11 0.19 0.00 -1.51 0.00 0.00 37.83 36.52 2qou s LYS 70 CO 0.89 -0.75 1.08 0.43 -0.36 0.00 0.00 175.35 176.63 2qou n SER 71 N 4.61 0.52 -3.98 1.43 7.64 -1.26 -0.85 113.62 121.72 2qou n SER 71 Ca 0.08 -2.09 -0.20 0.00 1.01 0.00 0.00 58.87 57.67 2qou n SER 71 Cb 0.58 -0.26 -0.16 0.00 -1.01 0.00 0.00 64.21 63.37 2qou n SER 71 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 2qou s TRP 72 N -0.19 0.90 -0.07 1.43 0.52 -1.26 0.66 118.94 120.93 2qou s TRP 72 Ca 0.15 -0.24 0.04 0.00 0.02 0.00 0.00 56.10 56.07 2qou s TRP 72 Cb 0.17 -0.67 -0.02 0.00 -1.15 0.00 0.00 33.47 31.80 2qou s TRP 72 CO -0.07 -0.12 -0.18 0.99 0.02 0.00 0.00 176.95 177.59 2qou s THR 73 N 0.34 2.69 0.18 2.01 2.01 -1.07 0.06 115.64 121.85 2qou s THR 73 Ca -0.05 -0.84 -0.31 0.00 0.31 0.00 0.00 61.69 60.80 2qou s THR 73 Cb -0.10 -2.04 -0.09 0.00 0.01 0.00 0.00 72.50 70.28 2qou s THR 73 CO 0.01 0.57 1.38 -0.22 -0.69 0.00 0.00 174.62 175.67 2qou s LEU 74 N -0.31 4.39 -0.09 4.42 1.98 -1.17 -2.78 118.68 125.12 2qou s LEU 74 Ca 0.02 2.45 -0.08 0.00 -2.89 0.00 0.00 54.13 53.62 2qou s LEU 74 Cb -0.13 -3.60 -0.03 0.00 0.66 0.00 0.00 46.19 43.09 2qou s LEU 74 CO 0.02 -0.63 -0.15 1.33 -1.89 0.00 0.00 176.35 175.03 2qou n VAL 75 N 3.14 0.80 -4.06 1.68 0.24 0.12 -4.97 118.33 115.28 2qou n VAL 75 Ca 0.09 0.32 -0.13 0.00 -2.04 0.00 0.00 64.34 62.58 2qou n VAL 75 Cb 0.42 -1.97 -0.13 0.00 -1.47 0.00 0.00 33.84 30.69 2qou n VAL 75 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2qou s ARG 76 N -1.90 0.40 -0.91 7.34 1.70 -1.25 -4.99 118.95 119.34 2qou s ARG 76 Ca -0.13 -0.44 -0.18 0.00 -0.47 0.00 0.00 55.73 54.51 2qou s ARG 76 Cb 0.02 -0.24 0.14 0.00 -0.57 0.00 0.00 34.95 34.29 2qou s ARG 76 CO 0.19 0.05 1.08 0.08 -1.08 0.00 0.00 175.30 175.62 2qou s VAL 77 N -0.77 4.83 0.05 4.99 1.01 -1.26 -1.23 120.40 128.02 2qou s VAL 77 Ca -0.05 -1.66 -0.16 0.00 0.00 0.00 0.00 61.98 60.11 2qou s VAL 77 Cb -0.06 -4.74 -0.06 0.00 0.00 0.00 0.00 36.38 31.52 2qou s VAL 77 CO -0.00 -1.45 1.25 0.58 0.00 0.00 0.00 175.10 175.48 2qou h VAL 78 N 5.71 0.00 -4.38 2.92 2.07 -1.20 -3.42 116.25 117.94 2qou h VAL 78 Ca 0.14 0.00 -0.66 0.00 0.82 0.00 0.00 66.70 67.00 2qou h VAL 78 Cb 1.03 0.00 -0.28 0.00 -1.52 0.00 0.00 31.29 30.52 2qou h VAL 78 CO 1.07 0.00 -0.87 -0.70 0.02 0.00 0.00 177.57 177.09 2qou s GLU 79 N -4.24 1.78 -0.36 1.57 2.56 -0.44 -4.98 118.70 114.59 2qou s GLU 79 Ca -0.07 -0.96 0.08 0.00 0.00 0.00 0.00 54.97 54.02 2qou s GLU 79 Cb 0.03 -1.83 0.73 0.00 2.00 0.00 0.00 34.13 35.06 2qou s GLU 79 CO 0.28 0.49 1.84 0.36 -0.56 0.00 0.00 175.26 177.67 2qou n LYS 80 N 2.12 3.34 -1.42 4.30 -0.00 -1.26 0.28 118.16 125.51 2qou n LYS 80 Ca -0.16 -3.05 0.18 0.00 -0.00 0.00 0.00 58.31 55.28 2qou n LYS 80 Cb 0.52 -2.21 -0.07 0.00 -0.00 0.00 0.00 35.03 33.27 2qou n LYS 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2qou n ALA 81 N -0.41 -3.70 0.35 0.58 0.00 -1.26 -4.75 120.51 111.31 2qou n ALA 81 Ca 0.46 0.72 0.03 0.00 0.00 0.00 0.00 53.44 54.65 2qou n ALA 81 Cb 1.48 -1.44 0.17 0.00 0.00 0.00 0.00 19.45 19.66 2qou n ALA 81 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05