#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbd s ILE 4 N 0.00 0.11 0.52 3.15 -5.25 -1.26 -5.15 121.20 113.32 2qbd s ILE 4 Ca 0.00 -0.88 -0.22 0.00 -0.99 0.00 0.00 60.65 58.56 2qbd s ILE 4 Cb 0.00 -1.06 -0.06 0.00 2.95 0.00 0.00 42.46 44.29 2qbd s ILE 4 CO 0.00 -0.49 1.30 -0.13 -1.79 0.00 0.00 174.94 173.83 2qbd s ARG 5 N -3.03 3.34 -0.27 0.37 0.52 -1.26 -5.04 118.95 113.59 2qbd s ARG 5 Ca -0.02 2.10 -0.21 0.00 -0.52 0.00 0.00 55.73 57.08 2qbd s ARG 5 Cb 0.01 -2.31 0.07 0.00 0.52 0.00 0.00 34.95 33.24 2qbd s ARG 5 CO -0.06 -0.99 0.69 0.95 0.02 0.00 0.00 175.30 175.91 2qbd s THR 6 N -1.37 -0.00 0.32 0.02 -4.23 -1.26 -4.55 115.64 104.57 2qbd s THR 6 Ca 0.69 0.00 0.09 0.00 -1.18 0.00 0.00 61.69 61.29 2qbd s THR 6 Cb -0.37 -0.98 -0.04 0.00 1.34 0.00 0.00 72.50 72.45 2qbd s THR 6 CO 0.44 0.00 0.07 -0.76 -0.54 0.00 0.00 174.62 173.83 2qbd s LEU 7 N 0.85 3.19 0.06 4.79 1.43 0.62 -4.90 118.68 124.72 2qbd s LEU 7 Ca -0.04 -0.77 0.01 0.00 -1.03 0.00 0.00 54.13 52.30 2qbd s LEU 7 Cb -0.05 -1.66 -0.03 0.00 0.03 0.00 0.00 46.19 44.47 2qbd s LEU 7 CO -0.07 -0.19 -0.06 0.00 0.23 0.00 0.00 176.35 176.26 2qbd s GLN 8 N -3.77 0.62 0.05 1.70 -2.07 -1.26 0.13 119.66 115.07 2qbd s GLN 8 Ca 0.35 -1.04 -0.27 0.00 -1.82 0.00 0.00 55.36 52.58 2qbd s GLN 8 Cb -0.03 -0.10 0.10 0.00 -1.09 0.00 0.00 33.01 31.89 2qbd s GLN 8 CO 0.21 -0.02 1.18 0.20 -1.32 0.00 0.00 175.29 175.54 2qbd s GLY 9 N -2.37 -0.22 -0.00 2.60 0.00 -0.28 -4.78 107.32 102.27 2qbd s GLY 9 Ca 0.01 0.26 -0.29 0.00 0.00 0.00 0.00 44.72 44.70 2qbd s GLY 9 CO -0.04 1.64 0.93 1.09 0.00 0.00 0.00 173.10 176.72 2qbd s ARG 10 N -2.46 4.55 -1.18 2.90 1.70 -1.12 -2.38 118.95 120.96 2qbd s ARG 10 Ca 0.18 1.32 -0.22 0.00 -0.47 0.00 0.00 55.73 56.55 2qbd s ARG 10 Cb 0.01 -3.45 -0.04 0.00 -0.57 0.00 0.00 34.95 30.91 2qbd s ARG 10 CO -0.00 -0.00 1.86 0.08 -1.08 0.00 0.00 175.30 176.16 2qbd s VAL 11 N 0.88 3.70 0.36 4.99 1.01 -0.01 -1.44 120.40 129.89 2qbd s VAL 11 Ca 0.49 -1.11 0.09 0.00 0.00 0.00 0.00 61.98 61.44 2qbd s VAL 11 Cb -0.21 -4.70 0.32 0.00 0.00 0.00 0.00 36.38 31.79 2qbd s VAL 11 CO 0.26 -1.29 1.90 1.62 0.00 0.00 0.00 175.10 177.59 2qbd h VAL 12 N 6.16 0.89 -4.24 2.92 3.04 -1.81 0.19 116.25 123.41 2qbd h VAL 12 Ca 0.26 -0.24 -0.57 0.00 -1.01 0.00 0.00 66.70 65.14 2qbd h VAL 12 Cb 0.93 0.14 -0.27 0.00 -2.01 0.00 0.00 31.29 30.08 2qbd h VAL 12 CO 1.29 0.13 -0.84 -0.55 -1.01 0.00 0.00 177.57 176.59 2qbd s SER 13 N -5.92 2.37 -0.46 3.17 0.15 -0.74 -4.76 113.70 107.51 2qbd s SER 13 Ca -0.10 -0.46 0.05 0.00 0.70 0.00 0.00 55.95 56.15 2qbd s SER 13 Cb 0.21 -0.22 0.18 0.00 -1.71 0.00 0.00 66.02 64.48 2qbd s SER 13 CO 0.78 0.18 0.53 -0.62 1.20 0.00 0.00 173.24 175.31 2qbd s ASP 14 N -0.92 0.04 0.09 5.45 3.68 -1.26 -2.83 116.67 120.91 2qbd s ASP 14 Ca 0.07 -2.37 0.00 0.00 2.13 0.00 0.00 52.55 52.39 2qbd s ASP 14 Cb -0.08 0.72 0.00 0.00 -1.45 0.00 0.00 42.92 42.10 2qbd s ASP 14 CO 0.01 -0.12 0.00 0.29 0.13 0.00 0.00 175.17 175.48 2qbd n LYS 15 N 2.96 0.00 -1.30 4.34 4.01 -1.26 -4.84 118.16 122.06 2qbd n LYS 15 Ca 0.23 0.00 -0.41 0.00 -0.51 0.00 0.00 58.31 57.62 2qbd n LYS 15 Cb 0.52 -0.04 -0.00 0.00 -0.51 0.00 0.00 35.03 34.99 2qbd n LYS 15 CO 0.00 0.00 0.00 -1.33 -1.11 0.00 0.00 177.40 174.96 2qbd n MET 16 N -2.85 0.04 -2.34 1.97 2.81 -1.25 -4.83 117.12 110.66 2qbd n MET 16 Ca 0.00 0.01 -0.43 0.00 -1.81 0.00 0.00 57.70 55.48 2qbd n MET 16 Cb 0.00 -1.04 -0.02 0.00 -0.71 0.00 0.00 33.22 31.45 2qbd n MET 16 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 2qbd s GLU 17 N -1.05 4.24 0.00 0.03 2.02 -1.26 -3.25 118.70 119.44 2qbd s GLU 17 Ca 0.59 1.78 0.00 0.00 0.02 0.00 0.00 54.97 57.36 2qbd s GLU 17 Cb -0.62 -3.75 0.00 0.00 0.10 0.00 0.00 34.13 29.86 2qbd s GLU 17 CO 0.63 -0.68 0.00 1.63 0.02 0.00 0.00 175.26 176.86 2qbd n LYS 18 N 6.39 0.00 -3.56 1.61 5.02 -1.26 -4.91 118.16 121.45 2qbd n LYS 18 Ca 0.14 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 56.06 2qbd n LYS 18 Cb 0.45 -2.40 -0.06 0.00 -0.02 0.00 0.00 35.03 32.99 2qbd n LYS 18 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2qbd s SER 19 N -0.86 6.56 0.09 4.39 0.01 -1.20 0.23 113.70 122.92 2qbd s SER 19 Ca 0.00 0.67 0.04 0.00 1.31 0.00 0.00 55.95 57.96 2qbd s SER 19 Cb 0.00 -2.19 -0.03 0.00 0.21 0.00 0.00 66.02 64.00 2qbd s SER 19 CO 0.00 0.21 -0.10 -0.51 0.41 0.00 0.00 173.24 173.25 2qbd s ILE 20 N -0.25 0.90 -0.15 1.44 1.10 -0.45 -3.79 121.20 120.01 2qbd s ILE 20 Ca 0.19 -1.52 0.01 0.00 -0.51 0.00 0.00 60.65 58.83 2qbd s ILE 20 Cb -0.14 -1.21 0.00 0.00 0.15 0.00 0.00 42.46 41.25 2qbd s ILE 20 CO 0.07 -0.49 -0.17 -0.69 -2.11 0.00 0.00 174.94 171.55 2qbd s VAL 21 N -2.14 2.50 0.06 4.00 1.01 -1.13 0.56 120.40 125.27 2qbd s VAL 21 Ca 0.02 -0.83 0.08 0.00 0.00 0.00 0.00 61.98 61.25 2qbd s VAL 21 Cb -0.05 -2.04 -0.03 0.00 0.00 0.00 0.00 36.38 34.26 2qbd s VAL 21 CO 0.00 0.53 -0.22 -0.69 0.00 0.00 0.00 175.10 174.72 2qbd s VAL 22 N 0.79 1.78 -0.13 2.92 1.01 -0.48 -1.80 120.40 124.50 2qbd s VAL 22 Ca -0.06 -1.33 -0.06 0.00 0.00 0.00 0.00 61.98 60.53 2qbd s VAL 22 Cb -0.15 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.63 2qbd s VAL 22 CO -0.00 0.17 0.08 0.00 0.00 0.00 0.00 175.10 175.34 2qbd s ALA 23 N -0.89 3.59 -0.22 5.51 0.00 -0.52 -1.32 121.76 127.90 2qbd s ALA 23 Ca 0.08 -0.72 0.01 0.00 0.00 0.00 0.00 51.96 51.34 2qbd s ALA 23 Cb -0.09 -1.81 0.05 0.00 0.00 0.00 0.00 23.12 21.27 2qbd s ALA 23 CO 0.03 0.50 -0.09 0.42 0.00 0.00 0.00 175.76 176.62 2qbd s ILE 24 N -0.64 1.67 0.89 0.00 1.09 0.10 -2.79 121.20 121.53 2qbd s ILE 24 Ca 0.12 -1.17 -0.13 0.00 -1.10 0.00 0.00 60.65 58.37 2qbd s ILE 24 Cb -0.12 -1.82 0.13 0.00 -1.06 0.00 0.00 42.46 39.59 2qbd s ILE 24 CO 0.02 0.05 1.19 -1.61 -0.10 0.00 0.00 174.94 174.50 2qbd s GLU 25 N 1.36 1.29 -0.30 2.79 2.02 -1.26 -0.30 118.70 124.31 2qbd s GLU 25 Ca -0.04 0.04 -0.26 0.00 0.02 0.00 0.00 54.97 54.73 2qbd s GLU 25 Cb -0.18 -1.88 0.19 0.00 0.10 0.00 0.00 34.13 32.37 2qbd s GLU 25 CO -0.07 -2.05 1.43 -0.98 0.02 0.00 0.00 175.26 173.62 2qbd s ARG 26 N -5.55 0.05 0.93 1.61 1.70 0.38 -4.89 118.95 113.18 2qbd s ARG 26 Ca 0.65 0.05 -0.14 0.00 -0.47 0.00 0.00 55.73 55.82 2qbd s ARG 26 Cb -0.10 0.03 0.16 0.00 -0.57 0.00 0.00 34.95 34.46 2qbd s ARG 26 CO 0.51 -0.01 1.22 -0.06 -1.08 0.00 0.00 175.30 175.89 2qbd s PHE 27 N -0.20 2.11 0.00 5.89 0.08 -1.26 -1.01 117.98 123.58 2qbd s PHE 27 Ca 0.08 0.58 0.00 0.00 0.12 0.00 0.00 56.93 57.70 2qbd s PHE 27 Cb -0.04 -3.72 0.00 0.00 -0.57 0.00 0.00 43.02 38.69 2qbd s PHE 27 CO -0.14 -2.43 0.00 1.55 -0.10 0.00 0.00 175.22 174.10 2qbd n VAL 28 N -3.71 0.00 -2.78 -0.44 3.14 -1.03 -4.80 118.33 108.70 2qbd n VAL 28 Ca 0.11 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 61.07 2qbd n VAL 28 Cb 0.60 0.00 -0.03 0.00 -1.06 0.00 0.00 33.84 33.35 2qbd n VAL 28 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 2qbd s LYS 29 N 0.00 4.33 0.03 1.45 2.20 -1.26 -0.95 119.74 125.53 2qbd s LYS 29 Ca 0.00 1.20 -0.30 0.00 -0.36 0.00 0.00 55.97 56.51 2qbd s LYS 29 Cb 0.00 -3.58 -0.09 0.00 -1.51 0.00 0.00 37.83 32.66 2qbd s LYS 29 CO 0.00 -0.39 1.95 -1.58 -0.36 0.00 0.00 175.35 174.97 2qbd s HIS 30 N 2.33 1.32 -0.27 4.03 5.65 -0.99 -4.80 115.29 122.56 2qbd s HIS 30 Ca 0.42 -0.41 0.00 0.00 0.25 0.00 0.00 55.06 55.33 2qbd s HIS 30 Cb -0.17 -4.22 0.00 0.00 -1.18 0.00 0.00 32.58 27.01 2qbd s HIS 30 CO 0.13 -5.45 0.00 -0.35 -0.65 0.00 0.00 174.74 168.42 2qbd n PRO 31 N 7.54 0.00 0.00 2.88 -0.04 -1.26 -1.63 135.00 142.49 2qbd n PRO 31 Ca 0.20 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.66 2qbd n PRO 31 Cb 0.41 -1.36 0.00 0.00 -0.04 0.00 0.00 33.50 32.51 2qbd n PRO 31 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 2qbd n ILE 32 N 0.86 0.00 -0.01 0.52 3.06 -1.26 -4.99 119.36 117.54 2qbd n ILE 32 Ca 0.00 0.00 -0.02 0.00 -2.50 0.00 0.00 62.75 60.23 2qbd n ILE 32 Cb 0.00 0.00 -0.02 0.00 0.54 0.00 0.00 39.64 40.16 2qbd n ILE 32 CO 0.00 0.00 0.00 -1.22 -2.50 0.00 0.00 176.55 172.83 2qbd n TYR 33 N 0.00 0.00 0.00 9.51 0.53 -0.82 -5.05 117.16 121.33 2qbd n TYR 33 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.88 2qbd n TYR 33 Cb 0.00 -0.12 0.00 0.00 -1.03 0.00 0.00 39.34 38.19 2qbd n TYR 33 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2qbd n GLY 34 N 3.07 2.79 3.04 2.72 0.00 -0.64 -4.93 105.19 111.24 2qbd n GLY 34 Ca -0.05 -0.69 -0.52 0.00 0.00 0.00 0.00 46.02 44.76 2qbd n GLY 34 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2qbd n LYS 35 N 0.00 0.00 -2.73 1.61 3.00 -1.26 -3.48 118.16 115.29 2qbd n LYS 35 Ca 0.00 0.00 -0.43 0.00 -0.00 0.00 0.00 58.31 57.88 2qbd n LYS 35 Cb 0.00 -1.28 -0.03 0.00 0.00 0.00 0.00 35.03 33.72 2qbd n LYS 35 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.40 177.34 2qbd s PHE 36 N 0.69 2.77 0.40 5.64 0.40 -1.26 -2.34 117.98 124.27 2qbd s PHE 36 Ca 0.81 0.27 -0.07 0.00 -0.60 0.00 0.00 56.93 57.34 2qbd s PHE 36 Cb -1.13 -4.22 -0.05 0.00 0.51 0.00 0.00 43.02 38.13 2qbd s PHE 36 CO 0.54 -1.36 0.71 0.42 0.70 0.00 0.00 175.22 176.23 2qbd s ILE 37 N 4.25 4.90 -0.43 0.64 1.01 -0.12 -4.76 121.20 126.69 2qbd s ILE 37 Ca 0.37 0.29 -0.12 0.00 0.00 0.00 0.00 60.65 61.19 2qbd s ILE 37 Cb -0.10 -3.78 0.06 0.00 0.01 0.00 0.00 42.46 38.65 2qbd s ILE 37 CO 0.24 -0.58 0.30 -0.75 0.00 0.00 0.00 174.94 174.15 2qbd s LYS 38 N -4.08 2.80 0.16 2.79 2.20 -1.26 -2.46 119.74 119.89 2qbd s LYS 38 Ca 0.48 -1.32 -0.01 0.00 -0.36 0.00 0.00 55.97 54.75 2qbd s LYS 38 Cb -0.10 -3.91 -0.04 0.00 -1.51 0.00 0.00 37.83 32.26 2qbd s LYS 38 CO 0.35 -0.92 0.34 1.03 -0.36 0.00 0.00 175.35 175.80 2qbd s ARG 39 N 1.54 3.52 -0.03 4.03 3.00 -0.18 -4.87 118.95 125.96 2qbd s ARG 39 Ca 0.03 -0.32 0.03 0.00 0.00 0.00 0.00 55.73 55.47 2qbd s ARG 39 Cb -0.22 -2.89 0.00 0.00 0.00 0.00 0.00 34.95 31.84 2qbd s ARG 39 CO 0.05 0.47 -0.11 0.99 0.00 0.00 0.00 175.30 176.70 2qbd s THR 40 N -1.74 0.91 -0.11 0.02 2.01 -1.26 -0.47 115.64 115.00 2qbd s THR 40 Ca 0.38 -0.43 0.03 0.00 0.31 0.00 0.00 61.69 61.98 2qbd s THR 40 Cb -0.12 -0.81 -0.00 0.00 0.01 0.00 0.00 72.50 71.58 2qbd s THR 40 CO 0.28 0.28 -0.21 -0.89 -0.69 0.00 0.00 174.62 173.39 2qbd s THR 41 N 0.18 2.31 -0.33 -0.82 2.01 0.59 -4.86 115.64 114.72 2qbd s THR 41 Ca -0.04 -0.93 -0.11 0.00 0.31 0.00 0.00 61.69 60.93 2qbd s THR 41 Cb -0.09 -1.91 -0.00 0.00 0.01 0.00 0.00 72.50 70.51 2qbd s THR 41 CO 0.01 0.55 0.18 -0.54 -0.69 0.00 0.00 174.62 174.13 2qbd s LYS 42 N 0.38 3.27 0.35 4.92 1.02 -1.26 0.01 119.74 128.42 2qbd s LYS 42 Ca -0.16 -0.78 0.08 0.00 0.02 0.00 0.00 55.97 55.13 2qbd s LYS 42 Cb -0.17 -3.65 -0.04 0.00 -0.52 0.00 0.00 37.83 33.45 2qbd s LYS 42 CO 0.07 -0.48 0.22 -0.51 -0.92 0.00 0.00 175.35 173.73 2qbd s LEU 43 N 1.62 3.39 -0.69 3.17 1.02 -0.44 -4.93 118.68 121.83 2qbd s LEU 43 Ca 0.04 -0.68 -0.02 0.00 0.02 0.00 0.00 54.13 53.50 2qbd s LEU 43 Cb -0.18 -1.93 0.17 0.00 0.02 0.00 0.00 46.19 44.28 2qbd s LEU 43 CO 0.07 -0.35 0.51 -1.00 0.02 0.00 0.00 176.35 175.60 2qbd s HIS 44 N -2.39 3.50 1.04 0.29 3.76 -1.26 -1.38 115.29 118.85 2qbd s HIS 44 Ca 0.40 -2.85 -0.14 0.00 -0.15 0.00 0.00 55.06 52.32 2qbd s HIS 44 Cb -0.04 -3.16 0.21 0.00 1.11 0.00 0.00 32.58 30.71 2qbd s HIS 44 CO 0.24 -0.79 1.10 0.08 -0.85 0.00 0.00 174.74 174.52 2qbd s VAL 45 N -0.47 1.93 -0.19 -0.90 1.01 0.19 -4.33 120.40 117.65 2qbd s VAL 45 Ca 0.20 0.00 0.01 0.00 0.00 0.00 0.00 61.98 62.19 2qbd s VAL 45 Cb -0.17 -2.51 0.03 0.00 0.00 0.00 0.00 36.38 33.73 2qbd s VAL 45 CO -0.06 0.00 -0.17 -2.28 0.00 0.00 0.00 175.10 172.59 2qbd s HIS 46 N -3.00 2.79 -0.68 5.22 2.46 -0.75 -1.34 115.29 120.00 2qbd s HIS 46 Ca 0.66 -1.73 0.05 0.00 0.47 0.00 0.00 55.06 54.51 2qbd s HIS 46 Cb -0.17 -1.88 0.16 0.00 -0.13 0.00 0.00 32.58 30.57 2qbd s HIS 46 CO 0.57 -0.81 0.46 0.34 -2.47 0.00 0.00 174.74 172.84 2qbd s ASP 47 N 1.28 4.77 0.39 9.88 3.68 0.63 -2.29 116.67 135.01 2qbd s ASP 47 Ca 0.02 -3.72 0.19 0.00 2.13 0.00 0.00 52.55 51.17 2qbd s ASP 47 Cb -0.14 -1.64 1.13 0.00 -1.45 0.00 0.00 42.92 40.81 2qbd s ASP 47 CO -0.11 -0.11 1.72 -0.33 0.13 0.00 0.00 175.17 176.47 2qbd h GLU 48 N 5.58 0.35 -0.02 4.34 4.39 -1.97 0.30 114.58 127.54 2qbd h GLU 48 Ca 0.11 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.79 2qbd h GLU 48 Cb 0.78 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.35 2qbd h GLU 48 CO 0.72 0.23 -0.16 0.09 -1.16 0.00 0.00 179.01 178.72 2qbd n ASN 49 N -4.73 2.06 -1.49 1.42 3.02 -1.26 -4.80 115.26 109.48 2qbd n ASN 49 Ca 0.29 -1.57 -0.17 0.00 -0.03 0.00 0.00 54.58 53.10 2qbd n ASN 49 Cb 0.97 0.14 -0.07 0.00 -0.61 0.00 0.00 39.78 40.21 2qbd n ASN 49 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2qbd n ASN 50 N 0.39 -4.45 -0.07 6.41 4.13 0.11 -4.82 115.26 116.96 2qbd n ASN 50 Ca 0.14 0.42 0.11 0.00 1.68 0.00 0.00 54.58 56.93 2qbd n ASN 50 Cb 0.46 -4.02 0.49 0.00 -1.54 0.00 0.00 39.78 35.18 2qbd n ASN 50 CO 0.00 0.00 0.00 1.05 0.28 0.00 0.00 177.26 178.59 2qbd h GLU 51 N 0.00 0.41 -5.90 3.52 4.11 -1.92 -3.40 114.58 111.40 2qbd h GLU 51 Ca -0.35 -0.02 -0.57 0.00 0.07 0.00 0.00 59.36 58.49 2qbd h GLU 51 Cb 1.10 -0.09 -0.07 0.00 0.50 0.00 0.00 28.75 30.20 2qbd h GLU 51 CO 0.51 0.27 -0.01 0.00 0.07 0.00 0.00 179.01 179.85 2qbd n GLY 53 N 3.19 1.38 3.78 0.00 0.00 -1.26 -5.04 105.19 107.24 2qbd n GLY 53 Ca -0.04 -2.06 -0.36 0.00 0.00 0.00 0.00 46.02 43.56 2qbd n GLY 53 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2qbd s ILE 54 N 0.11 3.73 -1.09 -0.61 2.07 -1.26 -3.53 121.20 120.62 2qbd s ILE 54 Ca 0.10 1.31 -0.02 0.00 -1.41 0.00 0.00 60.65 60.63 2qbd s ILE 54 Cb -0.01 -3.67 0.00 0.00 0.13 0.00 0.00 42.46 38.92 2qbd s ILE 54 CO 0.06 -0.01 0.23 0.61 -1.91 0.00 0.00 174.94 173.92 2qbd n GLY 55 N 0.30 -0.15 3.77 1.50 0.00 0.68 -4.76 105.19 106.53 2qbd n GLY 55 Ca 0.05 -0.24 -0.32 0.00 0.00 0.00 0.00 46.02 45.51 2qbd n GLY 55 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qbd s ASP 56 N -2.62 5.58 -1.17 1.61 1.11 -1.23 -4.20 116.67 115.75 2qbd s ASP 56 Ca 0.11 0.10 -0.14 0.00 0.18 0.00 0.00 52.55 52.80 2qbd s ASP 56 Cb -0.05 -1.57 0.18 0.00 1.07 0.00 0.00 42.92 42.55 2qbd s ASP 56 CO 0.14 0.26 1.37 -0.69 1.18 0.00 0.00 175.17 177.42 2qbd s VAL 57 N -1.21 5.10 0.27 -1.27 1.01 -0.79 -0.83 120.40 122.67 2qbd s VAL 57 Ca 0.23 -2.60 0.02 0.00 0.00 0.00 0.00 61.98 59.63 2qbd s VAL 57 Cb -0.12 -4.87 -0.03 0.00 0.00 0.00 0.00 36.38 31.36 2qbd s VAL 57 CO 0.15 -1.57 0.43 0.68 0.00 0.00 0.00 175.10 174.79 2qbd s VAL 58 N 1.42 5.20 -0.01 2.92 -7.23 -1.00 0.10 120.40 121.80 2qbd s VAL 58 Ca 0.40 -0.69 0.08 0.00 -1.81 0.00 0.00 61.98 59.97 2qbd s VAL 58 Cb -0.04 -3.84 -0.02 0.00 0.56 0.00 0.00 36.38 33.05 2qbd s VAL 58 CO -0.02 -0.38 -0.25 -0.70 -0.31 0.00 0.00 175.10 173.44 2qbd s GLU 59 N -3.97 2.01 0.22 4.82 2.12 0.04 -1.13 118.70 122.81 2qbd s GLU 59 Ca 0.37 -0.93 0.00 0.00 0.36 0.00 0.00 54.97 54.77 2qbd s GLU 59 Cb -0.10 -1.98 -0.04 0.00 0.26 0.00 0.00 34.13 32.28 2qbd s GLU 59 CO 0.32 0.54 0.16 0.96 -0.54 0.00 0.00 175.26 176.69 2qbd s ILE 60 N -0.63 0.00 0.06 -3.70 -0.00 0.34 -0.52 121.20 116.76 2qbd s ILE 60 Ca 0.10 -1.99 0.01 0.00 -0.00 0.00 0.00 60.65 58.77 2qbd s ILE 60 Cb -0.10 -2.50 -0.03 0.00 -0.00 0.00 0.00 42.46 39.83 2qbd s ILE 60 CO -0.01 0.00 -0.06 0.00 -0.00 0.00 0.00 174.94 174.88 2qbd s ARG 61 N -4.02 0.64 0.25 0.37 1.70 -0.78 -0.28 118.95 116.83 2qbd s ARG 61 Ca 0.39 -1.07 -0.30 0.00 -0.47 0.00 0.00 55.73 54.29 2qbd s ARG 61 Cb 0.06 -0.11 -0.09 0.00 -0.57 0.00 0.00 34.95 34.24 2qbd s ARG 61 CO 0.15 -0.02 1.15 -2.00 -1.08 0.00 0.00 175.30 173.50 2qbd s GLU 62 N -2.94 4.56 0.10 3.89 2.12 -1.26 -1.78 118.70 123.39 2qbd s GLU 62 Ca 0.01 1.87 0.01 0.00 0.36 0.00 0.00 54.97 57.22 2qbd s GLU 62 Cb -0.00 -3.20 -0.00 0.00 0.26 0.00 0.00 34.13 31.19 2qbd s GLU 62 CO -0.04 0.07 0.12 0.00 -0.54 0.00 0.00 175.26 174.87 2qbd s ARG 64 N -2.31 2.86 -0.48 0.00 1.70 -1.26 -4.61 118.95 114.86 2qbd s ARG 64 Ca 0.10 1.91 -0.26 0.00 -0.47 0.00 0.00 55.73 57.00 2qbd s ARG 64 Cb 0.00 -1.92 -0.06 0.00 -0.57 0.00 0.00 34.95 32.41 2qbd s ARG 64 CO 0.07 -1.31 2.28 -1.25 -1.08 0.00 0.00 175.30 174.01 2qbd s PRO 65 N -3.33 2.33 0.32 3.89 0.04 -1.26 -4.63 135.00 132.37 2qbd s PRO 65 Ca 0.79 1.34 0.26 0.00 0.04 0.00 0.00 61.00 63.43 2qbd s PRO 65 Cb -0.33 -4.52 0.88 0.00 0.04 0.00 0.00 34.50 30.58 2qbd s PRO 65 CO 0.35 -3.02 1.76 -0.07 0.04 0.00 0.00 177.00 176.07 2qbd h LEU 66 N 18.42 0.00 0.00 -3.56 4.07 -1.52 -3.47 115.31 129.24 2qbd h LEU 66 Ca -0.27 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.69 2qbd h LEU 66 Cb 1.24 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.98 2qbd h LEU 66 CO 1.14 0.00 0.00 -0.24 -1.08 0.00 0.00 178.44 178.26 2qbd n SER 67 N -2.54 0.00 -4.53 -0.43 2.88 -0.88 -5.04 113.62 103.07 2qbd n SER 67 Ca 0.03 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 57.14 2qbd n SER 67 Cb 0.36 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.82 2qbd n SER 67 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2qbd n LYS 68 N -0.23 0.96 -4.25 -1.46 4.81 -1.26 -0.62 118.16 116.11 2qbd n LYS 68 Ca 0.00 0.34 -0.37 0.00 -0.87 0.00 0.00 58.31 57.41 2qbd n LYS 68 Cb 0.00 -1.70 -0.04 0.00 0.02 0.00 0.00 35.03 33.31 2qbd n LYS 68 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 2qbd n THR 69 N -0.34 -0.66 -3.17 3.15 -2.24 -1.26 -4.89 114.28 104.87 2qbd n THR 69 Ca 0.11 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.91 2qbd n THR 69 Cb 0.36 -1.26 -0.01 0.00 -2.10 0.00 0.00 70.33 67.31 2qbd n THR 69 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2qbd s LYS 70 N -6.95 0.54 -0.00 -0.78 2.20 0.21 -4.42 119.74 110.54 2qbd s LYS 70 Ca 0.75 0.62 0.00 0.00 -0.36 0.00 0.00 55.97 56.99 2qbd s LYS 70 Cb -0.42 0.26 0.00 0.00 -1.51 0.00 0.00 37.83 36.16 2qbd s LYS 70 CO 0.92 -0.93 0.62 0.43 -0.36 0.00 0.00 175.35 176.03 2qbd n SER 71 N 5.41 0.25 -4.33 1.43 7.64 -1.26 -1.31 113.62 121.45 2qbd n SER 71 Ca 0.03 -1.26 -0.30 0.00 1.01 0.00 0.00 58.87 58.35 2qbd n SER 71 Cb 0.53 -0.03 -0.15 0.00 -1.01 0.00 0.00 64.21 63.55 2qbd n SER 71 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 2qbd s TRP 72 N -0.15 2.27 0.02 1.43 0.52 -1.26 -0.33 118.94 121.44 2qbd s TRP 72 Ca 0.01 -0.41 0.08 0.00 0.02 0.00 0.00 56.10 55.79 2qbd s TRP 72 Cb 0.00 -1.37 -0.02 0.00 -1.15 0.00 0.00 33.47 30.93 2qbd s TRP 72 CO 0.00 0.10 -0.23 0.99 0.02 0.00 0.00 176.95 177.84 2qbd s THR 73 N -0.78 1.83 0.30 2.01 2.01 -0.74 -1.81 115.64 118.46 2qbd s THR 73 Ca 0.11 -1.16 -0.29 0.00 0.31 0.00 0.00 61.69 60.67 2qbd s THR 73 Cb -0.10 -1.55 -0.10 0.00 0.01 0.00 0.00 72.50 70.76 2qbd s THR 73 CO 0.02 0.36 1.26 -0.22 -0.69 0.00 0.00 174.62 175.35 2qbd s LEU 74 N -0.94 4.45 -0.20 4.42 1.98 -0.97 -1.87 118.68 125.55 2qbd s LEU 74 Ca 0.09 2.55 -0.02 0.00 -2.89 0.00 0.00 54.13 53.86 2qbd s LEU 74 Cb -0.09 -3.64 -0.12 0.00 0.66 0.00 0.00 46.19 43.01 2qbd s LEU 74 CO 0.01 -0.45 -0.20 1.33 -1.89 0.00 0.00 176.35 175.15 2qbd n VAL 75 N 1.17 1.13 -3.81 1.68 0.24 0.32 -4.91 118.33 114.15 2qbd n VAL 75 Ca 0.01 -0.39 0.01 0.00 -2.04 0.00 0.00 64.34 61.93 2qbd n VAL 75 Cb 0.43 -1.38 0.01 0.00 -1.47 0.00 0.00 33.84 31.42 2qbd n VAL 75 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2qbd s ARG 76 N -2.39 0.58 -0.03 7.34 1.70 -1.14 -5.02 118.95 119.98 2qbd s ARG 76 Ca -0.27 -0.35 0.01 0.00 -0.47 0.00 0.00 55.73 54.65 2qbd s ARG 76 Cb 0.08 0.17 -0.03 0.00 -0.57 0.00 0.00 34.95 34.60 2qbd s ARG 76 CO 0.43 -0.27 -0.03 0.08 -1.08 0.00 0.00 175.30 174.43 2qbd s VAL 77 N -2.28 3.96 -0.02 4.99 1.01 -1.26 -0.78 120.40 126.02 2qbd s VAL 77 Ca 0.21 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 61.67 2qbd s VAL 77 Cb 0.01 -2.70 0.04 0.00 0.00 0.00 0.00 36.38 33.73 2qbd s VAL 77 CO -0.01 0.47 1.02 0.52 0.00 0.00 0.00 175.10 177.10 2qbd n VAL 78 N 1.76 1.11 0.00 2.92 0.31 0.12 -4.94 118.33 119.61 2qbd n VAL 78 Ca -0.16 -1.16 0.00 0.00 -0.01 0.00 0.00 64.34 63.01 2qbd n VAL 78 Cb 0.53 0.41 0.00 0.00 -0.91 0.00 0.00 33.84 33.86 2qbd n VAL 78 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2qbd n GLU 79 N -0.62 0.00 -2.44 5.55 2.13 -1.19 -4.91 120.64 119.17 2qbd n GLU 79 Ca 0.02 0.00 -0.40 0.00 0.66 0.00 0.00 57.16 57.44 2qbd n GLU 79 Cb 0.30 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 31.98 2qbd n GLU 79 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2qbd s LYS 80 N 0.00 3.14 0.39 5.31 3.01 -1.26 -1.89 119.74 128.44 2qbd s LYS 80 Ca 0.00 -0.28 0.00 0.00 -1.01 0.00 0.00 55.97 54.68 2qbd s LYS 80 Cb 0.00 -4.51 0.00 0.00 -1.01 0.00 0.00 37.83 32.31 2qbd s LYS 80 CO 0.00 -2.33 0.00 0.00 0.51 0.00 0.00 175.35 173.53 2qbd n ALA 81 N 10.10 -3.60 0.67 5.17 0.00 -1.26 -5.05 120.51 126.54 2qbd n ALA 81 Ca 0.14 0.55 0.08 0.00 0.00 0.00 0.00 53.44 54.21 2qbd n ALA 81 Cb 0.50 -1.31 0.07 0.00 0.00 0.00 0.00 19.45 18.71 2qbd n ALA 81 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05