#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbb s ILE 4 N 0.00 -0.01 -0.14 3.15 -5.25 -1.26 -5.13 121.20 112.57 2qbb s ILE 4 Ca 0.00 0.02 -0.29 0.00 -0.99 0.00 0.00 60.65 59.38 2qbb s ILE 4 Cb 0.00 -0.24 -0.02 0.00 2.95 0.00 0.00 42.46 45.15 2qbb s ILE 4 CO 0.00 0.01 1.21 -0.13 -1.79 0.00 0.00 174.94 174.23 2qbb s ARG 5 N 0.21 4.28 0.29 0.37 1.81 -1.26 -5.02 118.95 119.63 2qbb s ARG 5 Ca -0.01 1.61 0.03 0.00 -1.72 0.00 0.00 55.73 55.64 2qbb s ARG 5 Cb -0.02 -3.68 -0.06 0.00 -0.45 0.00 0.00 34.95 30.74 2qbb s ARG 5 CO -0.01 -0.61 0.07 0.95 -0.68 0.00 0.00 175.30 175.03 2qbb s THR 6 N 3.04 0.93 -0.17 0.02 -4.23 -1.26 -4.39 115.64 109.57 2qbb s THR 6 Ca 0.53 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 58.98 2qbb s THR 6 Cb -0.21 -2.70 0.08 0.00 1.34 0.00 0.00 72.50 71.00 2qbb s THR 6 CO 0.16 -0.02 0.36 -0.76 -0.54 0.00 0.00 174.62 173.81 2qbb s LEU 7 N -3.41 -0.52 -0.18 4.79 1.43 0.55 -4.94 118.68 116.41 2qbb s LEU 7 Ca 0.37 0.85 -0.12 0.00 -1.03 0.00 0.00 54.13 54.19 2qbb s LEU 7 Cb 0.08 1.11 -0.05 0.00 0.03 0.00 0.00 46.19 47.36 2qbb s LEU 7 CO 0.14 -0.23 0.22 0.00 0.23 0.00 0.00 176.35 176.71 2qbb s GLN 8 N 2.54 4.23 0.19 1.70 -2.07 -1.26 -0.49 119.66 124.49 2qbb s GLN 8 Ca -0.01 -0.04 -0.11 0.00 -1.82 0.00 0.00 55.36 53.39 2qbb s GLN 8 Cb -0.12 -3.42 -0.00 0.00 -1.09 0.00 0.00 33.01 28.37 2qbb s GLN 8 CO -0.11 0.26 0.35 0.20 -1.32 0.00 0.00 175.29 174.67 2qbb s GLY 9 N 0.42 0.47 0.30 2.60 0.00 0.11 -4.93 107.32 106.28 2qbb s GLY 9 Ca 0.13 -0.84 -0.28 0.00 0.00 0.00 0.00 44.72 43.73 2qbb s GLY 9 CO 0.01 -0.74 1.01 1.09 0.00 0.00 0.00 173.10 174.48 2qbb s ARG 10 N -3.98 4.61 -0.60 2.90 1.70 -1.05 -2.06 118.95 120.47 2qbb s ARG 10 Ca 0.18 1.57 -0.26 0.00 -0.47 0.00 0.00 55.73 56.75 2qbb s ARG 10 Cb 0.02 -3.03 0.04 0.00 -0.57 0.00 0.00 34.95 31.40 2qbb s ARG 10 CO 0.02 0.26 1.11 0.08 -1.08 0.00 0.00 175.30 175.69 2qbb s VAL 11 N -1.34 4.11 0.19 4.99 1.01 -0.88 -0.68 120.40 127.80 2qbb s VAL 11 Ca 0.47 0.56 0.09 0.00 0.00 0.00 0.00 61.98 63.10 2qbb s VAL 11 Cb -0.26 -4.69 -0.12 0.00 0.00 0.00 0.00 36.38 31.30 2qbb s VAL 11 CO 0.33 -1.35 1.43 1.62 0.00 0.00 0.00 175.10 177.13 2qbb h VAL 12 N 6.09 1.59 -3.62 2.92 3.04 -1.72 -2.13 116.25 122.42 2qbb h VAL 12 Ca -0.26 -2.82 -0.13 0.00 -1.01 0.00 0.00 66.70 62.48 2qbb h VAL 12 Cb 1.06 2.52 -0.19 0.00 -2.01 0.00 0.00 31.29 32.68 2qbb h VAL 12 CO 1.17 0.81 -0.48 -0.55 -1.01 0.00 0.00 177.57 177.51 2qbb s SER 13 N -6.77 0.08 -0.48 3.17 0.15 -1.14 -4.95 113.70 103.76 2qbb s SER 13 Ca -0.00 -0.35 0.06 0.00 0.70 0.00 0.00 55.95 56.36 2qbb s SER 13 Cb 0.11 0.23 0.24 0.00 -1.71 0.00 0.00 66.02 64.89 2qbb s SER 13 CO 0.79 -0.46 0.84 -0.67 1.20 0.00 0.00 173.24 174.95 2qbb n ASP 14 N 1.05 -2.63 -0.11 5.45 4.64 -1.26 -2.25 116.55 121.45 2qbb n ASP 14 Ca -0.21 -3.22 0.01 0.00 -1.38 0.00 0.00 54.79 49.99 2qbb n ASP 14 Cb 0.57 1.58 0.01 0.00 -1.04 0.00 0.00 41.12 42.24 2qbb n ASP 14 CO 0.00 0.00 0.00 0.29 -0.82 0.00 0.00 177.20 176.67 2qbb n LYS 15 N 1.71 0.61 -4.57 -0.67 5.02 -1.26 -4.94 118.16 114.05 2qbb n LYS 15 Ca 0.11 -0.91 -0.32 0.00 -2.02 0.00 0.00 58.31 55.16 2qbb n LYS 15 Cb 0.62 -0.65 -0.11 0.00 -0.02 0.00 0.00 35.03 34.86 2qbb n LYS 15 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 2qbb s MET 16 N -0.36 2.49 -0.28 1.97 -1.94 -1.25 -5.05 119.30 114.88 2qbb s MET 16 Ca 0.02 -0.74 -0.31 0.00 -1.71 0.00 0.00 55.69 52.95 2qbb s MET 16 Cb 0.02 -2.44 -0.08 0.00 2.01 0.00 0.00 34.83 34.34 2qbb s MET 16 CO 0.00 0.60 2.22 0.39 -0.01 0.00 0.00 175.02 178.22 2qbb n GLU 17 N 1.74 1.58 0.00 2.03 1.02 -1.26 -2.23 120.64 123.52 2qbb n GLU 17 Ca -0.16 0.42 0.00 0.00 -0.02 0.00 0.00 57.16 57.40 2qbb n GLU 17 Cb 0.52 -2.93 0.00 0.00 -0.02 0.00 0.00 31.44 29.01 2qbb n GLU 17 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2qbb n LYS 18 N 8.55 0.00 -2.41 3.49 5.02 -1.26 -4.92 118.16 126.63 2qbb n LYS 18 Ca 0.35 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 56.28 2qbb n LYS 18 Cb 0.36 -0.89 -0.02 0.00 -0.02 0.00 0.00 35.03 34.46 2qbb n LYS 18 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2qbb s SER 19 N 0.00 6.28 0.00 4.39 0.01 -0.95 0.19 113.70 123.63 2qbb s SER 19 Ca 0.00 2.11 -0.08 0.00 1.31 0.00 0.00 55.95 59.29 2qbb s SER 19 Cb 0.00 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.65 2qbb s SER 19 CO 0.00 -0.83 0.15 -0.63 0.41 0.00 0.00 173.24 172.35 2qbb s ILE 20 N -1.74 0.08 -0.09 1.44 1.09 -0.74 -3.81 121.20 117.43 2qbb s ILE 20 Ca 0.65 -0.70 0.01 0.00 -1.10 0.00 0.00 60.65 59.51 2qbb s ILE 20 Cb -0.23 -0.49 -0.02 0.00 -1.06 0.00 0.00 42.46 40.66 2qbb s ILE 20 CO 0.27 -0.38 -0.12 -0.69 -0.10 0.00 0.00 174.94 173.92 2qbb s VAL 21 N -1.50 3.22 0.03 2.92 1.01 -0.95 0.14 120.40 125.26 2qbb s VAL 21 Ca -0.14 -0.63 0.04 0.00 0.00 0.00 0.00 61.98 61.25 2qbb s VAL 21 Cb -0.07 -2.32 -0.02 0.00 0.00 0.00 0.00 36.38 33.98 2qbb s VAL 21 CO 0.01 0.56 -0.11 -0.69 0.00 0.00 0.00 175.10 174.87 2qbb s VAL 22 N -0.19 0.87 -0.02 2.92 1.01 0.76 -1.90 120.40 123.85 2qbb s VAL 22 Ca 0.01 -0.84 0.01 0.00 0.00 0.00 0.00 61.98 61.16 2qbb s VAL 22 Cb -0.13 -0.80 -0.04 0.00 0.00 0.00 0.00 36.38 35.41 2qbb s VAL 22 CO 0.03 -0.03 0.00 0.00 0.00 0.00 0.00 175.10 175.11 2qbb s ALA 23 N -0.77 3.29 -0.15 5.51 0.00 0.14 -0.24 121.76 129.53 2qbb s ALA 23 Ca -0.00 -0.92 -0.03 0.00 0.00 0.00 0.00 51.96 51.01 2qbb s ALA 23 Cb -0.07 -1.37 0.05 0.00 0.00 0.00 0.00 23.12 21.73 2qbb s ALA 23 CO 0.01 0.64 0.03 0.42 0.00 0.00 0.00 175.76 176.85 2qbb s ILE 24 N -1.05 0.42 0.85 0.00 1.09 -0.41 -2.52 121.20 119.57 2qbb s ILE 24 Ca 0.18 -0.30 -0.12 0.00 -1.10 0.00 0.00 60.65 59.31 2qbb s ILE 24 Cb -0.11 -0.83 0.10 0.00 -1.06 0.00 0.00 42.46 40.56 2qbb s ILE 24 CO 0.09 -0.06 1.16 -1.61 -0.10 0.00 0.00 174.94 174.41 2qbb s GLU 25 N 1.92 1.66 0.00 2.79 2.02 -1.25 -0.72 118.70 125.12 2qbb s GLU 25 Ca 0.01 0.22 0.00 0.00 0.02 0.00 0.00 54.97 55.22 2qbb s GLU 25 Cb -0.15 -1.91 0.00 0.00 0.10 0.00 0.00 34.13 32.17 2qbb s GLU 25 CO -0.07 -1.83 0.00 2.89 0.02 0.00 0.00 175.26 176.27 2qbb n ARG 26 N -3.50 0.00 -0.68 1.61 1.85 0.11 -4.89 116.66 111.16 2qbb n ARG 26 Ca 0.07 0.00 -0.28 0.00 -1.00 0.00 0.00 57.85 56.64 2qbb n ARG 26 Cb 0.60 0.00 0.23 0.00 -1.05 0.00 0.00 32.46 32.24 2qbb n ARG 26 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 2qbb s PHE 27 N 0.00 1.51 -0.30 2.89 0.08 -1.26 -1.47 117.98 119.44 2qbb s PHE 27 Ca 0.00 1.17 -0.13 0.00 0.12 0.00 0.00 56.93 58.09 2qbb s PHE 27 Cb 0.00 -3.14 0.17 0.00 -0.57 0.00 0.00 43.02 39.48 2qbb s PHE 27 CO 0.00 -3.64 1.00 0.54 -0.10 0.00 0.00 175.22 173.02 2qbb s VAL 28 N -2.57 -0.45 -0.06 -0.44 0.11 -0.82 -4.83 120.40 111.33 2qbb s VAL 28 Ca 0.68 0.00 -0.34 0.00 -2.93 0.00 0.00 61.98 59.38 2qbb s VAL 28 Cb -0.24 -1.00 -0.12 0.00 -1.53 0.00 0.00 36.38 33.49 2qbb s VAL 28 CO 0.63 0.00 1.83 1.17 -3.33 0.00 0.00 175.10 175.40 2qbb n LYS 29 N 5.17 2.11 -1.80 1.54 4.81 -1.26 -2.38 118.16 126.35 2qbb n LYS 29 Ca -0.07 0.77 -0.42 0.00 -0.87 0.00 0.00 58.31 57.72 2qbb n LYS 29 Cb 0.53 -2.60 -0.03 0.00 0.02 0.00 0.00 35.03 32.95 2qbb n LYS 29 CO 0.00 0.00 0.00 -1.58 1.17 0.00 0.00 177.40 176.99 2qbb s HIS 30 N 3.57 2.57 0.00 5.64 5.65 -0.33 -4.82 115.29 127.57 2qbb s HIS 30 Ca 0.91 0.26 0.00 0.00 0.25 0.00 0.00 55.06 56.48 2qbb s HIS 30 Cb -0.71 -4.08 0.00 0.00 -1.18 0.00 0.00 32.58 26.60 2qbb s HIS 30 CO 0.50 -4.27 0.33 -0.35 -0.65 0.00 0.00 174.74 170.30 2qbb n PRO 31 N 4.89 0.17 0.00 2.88 -0.04 -1.26 -1.45 135.00 140.19 2qbb n PRO 31 Ca 0.16 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 2qbb n PRO 31 Cb 0.38 -1.42 0.00 0.00 -0.04 0.00 0.00 33.50 32.42 2qbb n PRO 31 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 2qbb n ILE 32 N 1.86 0.00 0.27 0.52 3.06 -1.26 -4.98 119.36 118.83 2qbb n ILE 32 Ca 0.00 0.00 0.03 0.00 -2.50 0.00 0.00 62.75 60.28 2qbb n ILE 32 Cb 0.08 0.00 -0.03 0.00 0.54 0.00 0.00 39.64 40.23 2qbb n ILE 32 CO 0.00 0.00 0.00 -1.22 -2.50 0.00 0.00 176.55 172.83 2qbb n TYR 33 N 0.00 0.00 0.00 9.51 0.53 -1.01 -5.02 117.16 121.18 2qbb n TYR 33 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.88 2qbb n TYR 33 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.31 2qbb n TYR 33 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2qbb n GLY 34 N 1.12 1.25 1.79 2.72 0.00 -0.53 -4.85 105.19 106.69 2qbb n GLY 34 Ca 0.01 -0.02 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2qbb n GLY 34 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2qbb n LYS 35 N 0.00 0.00 -2.76 1.61 3.00 -1.26 -2.47 118.16 116.28 2qbb n LYS 35 Ca 0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 58.31 57.89 2qbb n LYS 35 Cb 0.00 -0.73 -0.03 0.00 0.00 0.00 0.00 35.03 34.26 2qbb n LYS 35 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.40 177.34 2qbb s PHE 36 N 0.93 2.68 0.01 5.64 0.40 -1.26 -1.18 117.98 125.18 2qbb s PHE 36 Ca 0.49 -0.70 -0.27 0.00 -0.60 0.00 0.00 56.93 55.84 2qbb s PHE 36 Cb -0.69 -4.43 -0.04 0.00 0.51 0.00 0.00 43.02 38.37 2qbb s PHE 36 CO 0.36 -1.75 0.86 0.42 0.70 0.00 0.00 175.22 175.80 2qbb s ILE 37 N 4.23 4.84 -0.28 0.64 1.01 -1.00 -4.48 121.20 126.16 2qbb s ILE 37 Ca 0.31 1.80 -0.27 0.00 0.00 0.00 0.00 60.65 62.50 2qbb s ILE 37 Cb -0.09 -4.20 0.01 0.00 0.01 0.00 0.00 42.46 38.18 2qbb s ILE 37 CO 0.03 0.25 0.94 -0.75 0.00 0.00 0.00 174.94 175.40 2qbb s LYS 38 N 0.59 4.12 0.11 2.79 2.36 -1.26 -1.95 119.74 126.49 2qbb s LYS 38 Ca 0.45 0.99 0.06 0.00 -2.55 0.00 0.00 55.97 54.92 2qbb s LYS 38 Cb -0.20 -3.69 -0.04 0.00 -1.05 0.00 0.00 37.83 32.85 2qbb s LYS 38 CO 0.25 -0.69 -0.04 0.50 1.55 0.00 0.00 175.35 176.92 2qbb s ARG 39 N 3.17 2.35 0.00 4.03 6.06 -0.54 -4.83 118.95 129.19 2qbb s ARG 39 Ca 0.39 -0.95 0.07 0.00 -2.50 0.00 0.00 55.73 52.75 2qbb s ARG 39 Cb -0.14 -2.42 -0.03 0.00 0.06 0.00 0.00 34.95 32.42 2qbb s ARG 39 CO 0.10 0.52 -0.22 0.99 -2.50 0.00 0.00 175.30 174.19 2qbb s THR 40 N -1.31 2.45 -0.10 4.11 2.01 -1.26 0.09 115.64 121.62 2qbb s THR 40 Ca 0.24 -1.12 0.01 0.00 0.31 0.00 0.00 61.69 61.14 2qbb s THR 40 Cb -0.11 -1.94 0.02 0.00 0.01 0.00 0.00 72.50 70.48 2qbb s THR 40 CO 0.16 0.48 -0.13 -0.89 -0.69 0.00 0.00 174.62 173.55 2qbb s THR 41 N -0.75 1.34 -0.05 -0.82 2.01 0.10 -4.87 115.64 112.59 2qbb s THR 41 Ca 0.12 -0.54 -0.18 0.00 0.31 0.00 0.00 61.69 61.40 2qbb s THR 41 Cb -0.10 -1.25 -0.05 0.00 0.01 0.00 0.00 72.50 71.11 2qbb s THR 41 CO 0.01 0.41 0.50 -0.54 -0.69 0.00 0.00 174.62 174.31 2qbb s LYS 42 N 1.11 4.24 0.07 4.92 1.02 -1.26 -1.29 119.74 128.54 2qbb s LYS 42 Ca -0.05 0.53 0.06 0.00 0.02 0.00 0.00 55.97 56.53 2qbb s LYS 42 Cb -0.14 -3.36 -0.03 0.00 -0.52 0.00 0.00 37.83 33.78 2qbb s LYS 42 CO -0.03 0.35 -0.16 -0.51 -0.92 0.00 0.00 175.35 174.08 2qbb s LEU 43 N -0.04 2.25 -0.89 3.17 1.02 0.66 -4.94 118.68 119.91 2qbb s LEU 43 Ca 0.27 -0.59 -0.11 0.00 0.02 0.00 0.00 54.13 53.72 2qbb s LEU 43 Cb -0.16 -0.66 0.23 0.00 0.02 0.00 0.00 46.19 45.61 2qbb s LEU 43 CO 0.13 -0.00 0.83 -1.00 0.02 0.00 0.00 176.35 176.33 2qbb s HIS 44 N -1.11 3.87 1.01 0.29 3.76 -1.24 -0.17 115.29 121.70 2qbb s HIS 44 Ca 0.02 -2.30 -0.15 0.00 -0.15 0.00 0.00 55.06 52.48 2qbb s HIS 44 Cb -0.09 -3.74 0.19 0.00 1.11 0.00 0.00 32.58 30.05 2qbb s HIS 44 CO 0.02 -0.95 1.16 0.08 -0.85 0.00 0.00 174.74 174.20 2qbb s VAL 45 N -0.31 1.90 -0.28 -0.90 1.01 0.12 -3.99 120.40 117.95 2qbb s VAL 45 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 61.98 62.20 2qbb s VAL 45 Cb -0.11 -2.69 0.05 0.00 0.00 0.00 0.00 36.38 33.63 2qbb s VAL 45 CO -0.08 0.00 -0.06 -2.28 0.00 0.00 0.00 175.10 172.68 2qbb s HIS 46 N -3.28 3.24 -0.82 5.22 2.46 0.37 -1.80 115.29 120.69 2qbb s HIS 46 Ca 0.68 -2.05 -0.03 0.00 0.47 0.00 0.00 55.06 54.13 2qbb s HIS 46 Cb -0.12 -2.02 0.21 0.00 -0.13 0.00 0.00 32.58 30.51 2qbb s HIS 46 CO 0.54 -0.83 0.69 0.34 -2.47 0.00 0.00 174.74 173.02 2qbb s ASP 47 N 1.19 5.87 0.00 9.88 3.68 0.50 -2.75 116.67 135.04 2qbb s ASP 47 Ca -0.06 -3.42 -0.00 0.00 2.13 0.00 0.00 52.55 51.20 2qbb s ASP 47 Cb -0.20 -1.92 -0.00 0.00 -1.45 0.00 0.00 42.92 39.35 2qbb s ASP 47 CO -0.03 -0.26 1.00 -0.08 0.13 0.00 0.00 175.17 175.93 2qbb h GLU 48 N 6.42 -0.00 0.00 4.34 4.22 -1.96 -1.67 114.58 125.94 2qbb h GLU 48 Ca 0.11 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.55 2qbb h GLU 48 Cb 0.87 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.12 2qbb h GLU 48 CO 0.81 -0.00 0.00 0.09 -2.18 0.00 0.00 179.01 177.73 2qbb n ASN 49 N -2.64 0.00 -1.53 1.04 3.02 -1.26 -4.63 115.26 109.26 2qbb n ASN 49 Ca -0.00 -1.54 -0.15 0.00 -0.03 0.00 0.00 54.58 52.86 2qbb n ASN 49 Cb 0.00 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.11 2qbb n ASN 49 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2qbb n ASN 50 N -0.55 -4.00 0.19 6.41 4.13 -0.63 -4.78 115.26 116.04 2qbb n ASN 50 Ca 0.02 0.35 0.10 0.00 1.68 0.00 0.00 54.58 56.72 2qbb n ASN 50 Cb 0.01 -3.64 0.52 0.00 -1.54 0.00 0.00 39.78 35.13 2qbb n ASN 50 CO 0.00 0.00 0.00 1.05 0.28 0.00 0.00 177.26 178.59 2qbb h GLU 51 N 0.00 0.00 -6.39 3.52 4.11 -1.87 -3.41 114.58 110.54 2qbb h GLU 51 Ca -0.31 0.00 -0.63 0.00 0.07 0.00 0.00 59.36 58.49 2qbb h GLU 51 Cb 1.00 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 30.13 2qbb h GLU 51 CO 0.45 0.00 -0.68 0.00 0.07 0.00 0.00 179.01 178.85 2qbb n GLY 53 N 0.19 7.55 3.82 0.00 0.00 -1.26 -5.08 105.19 110.40 2qbb n GLY 53 Ca -0.11 -1.97 -0.35 0.00 0.00 0.00 0.00 46.02 43.60 2qbb n GLY 53 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2qbb s ILE 54 N 0.86 4.56 0.00 -0.61 2.07 -1.26 -3.59 121.20 123.22 2qbb s ILE 54 Ca 0.00 1.23 0.00 0.00 -1.41 0.00 0.00 60.65 60.47 2qbb s ILE 54 Cb 0.00 -3.76 0.00 0.00 0.13 0.00 0.00 42.46 38.83 2qbb s ILE 54 CO 0.00 0.01 0.00 0.61 -1.91 0.00 0.00 174.94 173.65 2qbb n GLY 55 N 0.17 2.94 3.70 1.50 0.00 -0.80 -4.94 105.19 107.76 2qbb n GLY 55 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 2qbb n GLY 55 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qbb s ASP 56 N -2.14 6.54 -1.44 1.61 1.11 -1.24 -4.51 116.67 116.60 2qbb s ASP 56 Ca 0.00 2.61 -0.11 0.00 0.18 0.00 0.00 52.55 55.22 2qbb s ASP 56 Cb 0.00 -2.57 0.05 0.00 1.07 0.00 0.00 42.92 41.46 2qbb s ASP 56 CO 0.00 -0.90 2.32 0.52 1.18 0.00 0.00 175.17 178.29 2qbb n VAL 57 N 4.47 4.00 -2.74 -1.27 0.31 -0.75 -2.06 118.33 120.29 2qbb n VAL 57 Ca 0.16 -3.35 -0.33 0.00 -0.01 0.00 0.00 64.34 60.81 2qbb n VAL 57 Cb 0.39 -2.51 -0.06 0.00 -0.91 0.00 0.00 33.84 30.76 2qbb n VAL 57 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 2qbb s VAL 58 N 1.96 4.49 0.08 2.52 -7.23 -0.88 -0.96 120.40 120.38 2qbb s VAL 58 Ca 0.51 1.29 0.07 0.00 -1.81 0.00 0.00 61.98 62.04 2qbb s VAL 58 Cb 0.14 -3.64 -0.04 0.00 0.56 0.00 0.00 36.38 33.40 2qbb s VAL 58 CO -0.06 -0.42 -0.15 -0.70 -0.31 0.00 0.00 175.10 173.46 2qbb s GLU 59 N -3.46 2.06 0.18 4.82 2.12 -0.09 0.05 118.70 124.37 2qbb s GLU 59 Ca 0.59 -1.02 0.03 0.00 0.36 0.00 0.00 54.97 54.93 2qbb s GLU 59 Cb -0.09 -2.23 -0.01 0.00 0.26 0.00 0.00 34.13 32.05 2qbb s GLU 59 CO 0.20 0.52 0.18 0.44 -0.54 0.00 0.00 175.26 176.07 2qbb n ILE 60 N 1.11 0.00 -3.76 -3.70 -0.00 0.35 -1.45 119.36 111.91 2qbb n ILE 60 Ca -0.15 -1.24 -0.13 0.00 -0.00 0.00 0.00 62.75 61.23 2qbb n ILE 60 Cb 0.52 0.65 -0.08 0.00 -0.00 0.00 0.00 39.64 40.73 2qbb n ILE 60 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2qbb s ARG 61 N -2.66 0.72 0.62 6.28 1.04 -0.96 -0.33 118.95 123.65 2qbb s ARG 61 Ca 0.20 -0.29 -0.17 0.00 -1.04 0.00 0.00 55.73 54.43 2qbb s ARG 61 Cb 0.01 0.32 -0.02 0.00 -2.04 0.00 0.00 34.95 33.21 2qbb s ARG 61 CO 0.14 -0.21 1.15 -2.00 -0.04 0.00 0.00 175.30 174.35 2qbb s GLU 62 N -1.73 2.93 0.00 3.89 2.12 -1.26 -1.70 118.70 122.95 2qbb s GLU 62 Ca -0.11 1.61 0.00 0.00 0.36 0.00 0.00 54.97 56.84 2qbb s GLU 62 Cb -0.04 -1.95 0.00 0.00 0.26 0.00 0.00 34.13 32.41 2qbb s GLU 62 CO 0.02 -1.19 0.00 0.00 -0.54 0.00 0.00 175.26 173.55 2qbb s ARG 64 N 1.05 4.46 -0.23 0.00 3.52 -1.26 -4.76 118.95 121.73 2qbb s ARG 64 Ca 0.00 2.04 -0.28 0.00 -0.13 0.00 0.00 55.73 57.36 2qbb s ARG 64 Cb 0.00 -3.14 -0.04 0.00 -1.56 0.00 0.00 34.95 30.20 2qbb s ARG 64 CO 0.00 -0.08 2.11 -1.25 -0.81 0.00 0.00 175.30 175.27 2qbb s PRO 65 N -1.21 3.24 0.16 5.12 0.04 -1.26 -4.65 135.00 136.43 2qbb s PRO 65 Ca 0.50 1.93 0.25 0.00 0.04 0.00 0.00 61.00 63.72 2qbb s PRO 65 Cb -0.36 -4.32 0.59 0.00 0.04 0.00 0.00 34.50 30.44 2qbb s PRO 65 CO 0.45 -1.98 1.55 1.28 0.04 0.00 0.00 177.00 178.34 2qbb n LEU 66 N 11.14 0.73 0.00 -3.56 4.32 -0.28 -4.97 117.00 124.38 2qbb n LEU 66 Ca 0.28 0.39 0.00 0.00 -0.02 0.00 0.00 56.01 56.66 2qbb n LEU 66 Cb 0.45 -0.26 0.00 0.00 -1.62 0.00 0.00 43.42 42.00 2qbb n LEU 66 CO 0.67 -0.11 0.00 -0.24 -1.22 0.00 0.00 177.39 176.49 2qbb n SER 67 N -2.15 0.00 -4.75 -1.43 2.88 -0.93 -5.01 113.62 102.23 2qbb n SER 67 Ca 0.04 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.17 2qbb n SER 67 Cb 0.43 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.89 2qbb n SER 67 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2qbb n LYS 68 N -0.30 2.45 0.00 -1.46 5.02 -1.26 -1.43 118.16 121.17 2qbb n LYS 68 Ca 0.00 0.86 0.00 0.00 -2.02 0.00 0.00 58.31 57.15 2qbb n LYS 68 Cb 0.00 -2.57 0.00 0.00 -0.02 0.00 0.00 35.03 32.44 2qbb n LYS 68 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2qbb n THR 69 N 0.28 0.00 -3.59 -0.18 -2.24 -1.26 -4.85 114.28 102.44 2qbb n THR 69 Ca 0.03 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.40 2qbb n THR 69 Cb 0.39 0.00 -0.11 0.00 -2.10 0.00 0.00 70.33 68.50 2qbb n THR 69 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2qbb s LYS 70 N 0.00 2.81 0.00 -0.78 2.20 -0.51 -3.64 119.74 119.81 2qbb s LYS 70 Ca 0.00 -1.09 0.00 0.00 -0.36 0.00 0.00 55.97 54.52 2qbb s LYS 70 Cb 0.00 -3.74 0.00 0.00 -1.51 0.00 0.00 37.83 32.58 2qbb s LYS 70 CO 0.00 -0.71 0.23 0.43 -0.36 0.00 0.00 175.35 174.94 2qbb n SER 71 N 5.00 0.00 -4.21 1.43 7.64 -1.26 -1.13 113.62 121.10 2qbb n SER 71 Ca -0.12 -1.00 -0.26 0.00 1.01 0.00 0.00 58.87 58.50 2qbb n SER 71 Cb 0.46 0.00 -0.15 0.00 -1.01 0.00 0.00 64.21 63.51 2qbb n SER 71 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 2qbb s TRP 72 N 0.00 1.77 -0.09 1.43 0.52 -1.26 -0.11 118.94 121.20 2qbb s TRP 72 Ca 0.00 -0.34 0.02 0.00 0.02 0.00 0.00 56.10 55.80 2qbb s TRP 72 Cb 0.00 -1.13 -0.02 0.00 -1.15 0.00 0.00 33.47 31.17 2qbb s TRP 72 CO 0.00 -0.01 -0.13 0.99 0.02 0.00 0.00 176.95 177.82 2qbb s THR 73 N -0.52 3.11 -0.05 2.01 2.01 -0.69 -0.48 115.64 121.04 2qbb s THR 73 Ca 0.08 -0.68 -0.30 0.00 0.31 0.00 0.00 61.69 61.10 2qbb s THR 73 Cb -0.08 -2.26 -0.04 0.00 0.01 0.00 0.00 72.50 70.13 2qbb s THR 73 CO -0.00 0.56 1.39 -0.22 -0.69 0.00 0.00 174.62 175.66 2qbb s LEU 74 N -0.27 4.28 -0.00 4.42 1.98 -1.11 -2.27 118.68 125.72 2qbb s LEU 74 Ca 0.02 2.00 -0.00 0.00 -2.89 0.00 0.00 54.13 53.26 2qbb s LEU 74 Cb -0.13 -3.55 -0.00 0.00 0.66 0.00 0.00 46.19 43.17 2qbb s LEU 74 CO 0.03 -0.75 -0.00 -0.37 -1.89 0.00 0.00 176.35 173.37 2qbb h VAL 75 N 5.17 0.00 -4.46 1.68 -1.51 -1.59 -3.49 116.25 112.06 2qbb h VAL 75 Ca -0.35 -0.00 -0.20 0.00 -1.23 0.00 0.00 66.70 64.91 2qbb h VAL 75 Cb 1.16 0.00 -0.15 0.00 -2.13 0.00 0.00 31.29 30.17 2qbb h VAL 75 CO 0.92 0.00 -0.64 0.00 -1.23 0.00 0.00 177.57 176.62 2qbb s ARG 76 N -1.00 1.02 -0.47 5.19 1.70 -1.21 -5.03 118.95 119.14 2qbb s ARG 76 Ca -0.00 -1.50 -0.16 0.00 -0.47 0.00 0.00 55.73 53.59 2qbb s ARG 76 Cb 0.00 0.24 0.06 0.00 -0.57 0.00 0.00 34.95 34.68 2qbb s ARG 76 CO 0.00 -0.30 0.45 0.08 -1.08 0.00 0.00 175.30 174.45 2qbb s VAL 77 N -4.07 5.14 -0.80 4.99 1.01 -1.26 -0.92 120.40 124.49 2qbb s VAL 77 Ca 0.29 -0.84 0.15 0.00 0.00 0.00 0.00 61.98 61.57 2qbb s VAL 77 Cb 0.07 -4.15 0.14 0.00 0.00 0.00 0.00 36.38 32.44 2qbb s VAL 77 CO 0.05 -0.60 1.46 0.52 0.00 0.00 0.00 175.10 176.52 2qbb n VAL 78 N 5.32 1.15 -3.40 2.92 0.31 -0.13 -4.51 118.33 119.99 2qbb n VAL 78 Ca -0.10 0.34 0.02 0.00 -0.01 0.00 0.00 64.34 64.58 2qbb n VAL 78 Cb 0.45 -1.20 -0.03 0.00 -0.91 0.00 0.00 33.84 32.14 2qbb n VAL 78 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 2qbb s GLU 79 N -3.13 0.46 0.00 5.55 2.56 -1.11 -4.94 118.70 118.09 2qbb s GLU 79 Ca 0.04 1.03 0.01 0.00 0.00 0.00 0.00 54.97 56.05 2qbb s GLU 79 Cb 0.07 0.61 0.05 0.00 2.00 0.00 0.00 34.13 36.86 2qbb s GLU 79 CO 0.24 -0.29 0.48 0.36 -0.56 0.00 0.00 175.26 175.49 2qbb n LYS 80 N 5.33 0.03 -1.42 4.30 -0.00 -1.26 -1.81 118.16 123.33 2qbb n LYS 80 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.23 2qbb n LYS 80 Cb 0.51 -1.44 0.00 0.00 -0.00 0.00 0.00 35.03 34.10 2qbb n LYS 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2qbb n ALA 81 N -0.94 -2.35 -1.42 0.58 0.00 -1.26 -4.77 120.51 110.35 2qbb n ALA 81 Ca 0.01 0.32 -0.39 0.00 0.00 0.00 0.00 53.44 53.38 2qbb n ALA 81 Cb 0.00 -1.15 0.03 0.00 0.00 0.00 0.00 19.45 18.33 2qbb n ALA 81 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2qbb n VAL 82 N 0.78 1.73 0.76 0.00 3.14 -1.26 -4.96 118.33 118.52 2qbb n VAL 82 Ca 0.00 -0.50 0.09 0.00 -2.96 0.00 0.00 64.34 60.97 2qbb n VAL 82 Cb 0.00 -0.53 0.08 0.00 -1.06 0.00 0.00 33.84 32.33 2qbb n VAL 82 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55