#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wa7 n GLY 10 N 0.00 -0.50 3.64 2.61 0.00 -1.26 -5.04 105.19 104.63 1wa7 n GLY 10 Ca 0.00 -0.85 -0.40 0.00 0.00 0.00 0.00 46.02 44.77 1wa7 n GLY 10 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1wa7 s ASP 11 N -4.00 6.62 -0.02 1.61 1.01 -1.25 -5.00 116.67 115.64 1wa7 s ASP 11 Ca 0.00 0.75 -0.16 0.00 0.71 0.00 0.00 52.55 53.85 1wa7 s ASP 11 Cb 0.00 -2.34 -0.05 0.00 1.01 0.00 0.00 42.92 41.53 1wa7 s ASP 11 CO 0.00 -0.33 0.45 -0.63 0.21 0.00 0.00 175.17 174.86 1wa7 s ILE 12 N 2.29 5.03 0.15 0.77 -1.09 -1.26 -1.57 121.20 125.52 1wa7 s ILE 12 Ca 0.27 0.92 0.05 0.00 -2.23 0.00 0.00 60.65 59.65 1wa7 s ILE 12 Cb -0.16 -3.76 -0.04 0.00 -1.58 0.00 0.00 42.46 36.92 1wa7 s ILE 12 CO 0.09 0.51 -0.10 0.68 -1.23 0.00 0.00 174.94 174.89 1wa7 s VAL 13 N -0.62 1.18 -0.03 2.92 -7.23 0.20 -4.36 120.40 112.46 1wa7 s VAL 13 Ca 0.25 -2.07 0.07 0.00 -1.81 0.00 0.00 61.98 58.42 1wa7 s VAL 13 Cb -0.17 -1.87 -0.02 0.00 0.56 0.00 0.00 36.38 34.89 1wa7 s VAL 13 CO 0.13 -0.73 -0.24 0.54 -0.31 0.00 0.00 175.10 174.50 1wa7 s VAL 14 N -3.32 1.88 0.15 1.32 0.11 0.70 0.10 120.40 121.34 1wa7 s VAL 14 Ca 0.17 -1.00 -0.31 0.00 -2.93 0.00 0.00 61.98 57.91 1wa7 s VAL 14 Cb 0.03 -1.57 -0.08 0.00 -1.53 0.00 0.00 36.38 33.22 1wa7 s VAL 14 CO 0.01 0.53 1.33 0.00 -3.33 0.00 0.00 175.10 173.64 1wa7 s ALA 15 N -0.41 3.53 -0.66 1.54 0.00 0.70 0.34 121.76 126.80 1wa7 s ALA 15 Ca 0.05 1.08 0.22 0.00 0.00 0.00 0.00 51.96 53.30 1wa7 s ALA 15 Cb -0.10 -3.50 -0.15 0.00 0.00 0.00 0.00 23.12 19.36 1wa7 s ALA 15 CO 0.00 -0.55 0.85 1.28 0.00 0.00 0.00 175.76 177.35 1wa7 n LEU 16 N 3.34 0.64 -3.61 0.00 4.77 0.29 0.31 117.00 122.74 1wa7 n LEU 16 Ca 0.09 -0.23 -0.15 0.00 -0.03 0.00 0.00 56.01 55.69 1wa7 n LEU 16 Cb 0.43 -0.04 -0.06 0.00 -2.33 0.00 0.00 43.42 41.42 1wa7 n LEU 16 CO 0.58 0.13 0.25 -0.31 -1.33 0.00 0.00 177.39 176.71 1wa7 s TYR 17 N -3.18 -0.41 0.57 -1.77 2.02 -1.20 -4.54 117.35 108.85 1wa7 s TYR 17 Ca 0.03 0.55 -0.19 0.00 -0.37 0.00 0.00 57.07 57.09 1wa7 s TYR 17 Cb 0.15 0.29 -0.04 0.00 -0.40 0.00 0.00 41.96 41.96 1wa7 s TYR 17 CO 0.85 -0.58 1.20 -1.25 -1.57 0.00 0.00 175.55 174.21 1wa7 s PRO 18 N -1.94 3.12 0.35 -1.71 0.04 -1.26 -3.98 135.00 129.62 1wa7 s PRO 18 Ca -0.08 1.82 0.05 0.00 0.04 0.00 0.00 61.00 62.83 1wa7 s PRO 18 Cb -0.01 -2.01 0.05 0.00 0.04 0.00 0.00 34.50 32.57 1wa7 s PRO 18 CO 0.02 -1.09 0.43 0.98 0.04 0.00 0.00 177.00 177.38 1wa7 n TYR 19 N -1.40 -2.19 -3.72 0.56 9.36 0.03 -4.91 117.16 114.89 1wa7 n TYR 19 Ca 0.13 -1.31 -0.35 0.00 3.32 0.00 0.00 57.90 59.68 1wa7 n TYR 19 Cb 0.49 -0.32 -0.09 0.00 -0.63 0.00 0.00 39.34 38.80 1wa7 n TYR 19 CO 0.00 0.00 0.00 -0.51 0.22 0.00 0.00 176.86 176.57 1wa7 s ASP 20 N -3.12 5.40 -0.73 2.98 1.01 -1.26 -4.76 116.67 116.19 1wa7 s ASP 20 Ca 0.33 -3.27 -0.26 0.00 0.71 0.00 0.00 52.55 50.06 1wa7 s ASP 20 Cb -0.03 -1.84 -0.12 0.00 1.01 0.00 0.00 42.92 41.94 1wa7 s ASP 20 CO 0.21 -0.27 2.41 -0.83 0.21 0.00 0.00 175.17 176.90 1wa7 s GLY 21 N 0.12 -0.75 -0.16 0.21 0.00 -1.26 -4.54 107.32 100.93 1wa7 s GLY 21 Ca 0.21 -0.64 -0.02 0.00 0.00 0.00 0.00 44.72 44.28 1wa7 s GLY 21 CO -0.08 4.22 -0.16 0.29 0.00 0.00 0.00 173.10 177.37 1wa7 n ILE 22 N 8.64 0.92 -1.93 0.90 -5.35 -1.26 -4.99 119.36 116.28 1wa7 n ILE 22 Ca 0.45 -0.32 -0.32 0.00 -0.27 0.00 0.00 62.75 62.29 1wa7 n ILE 22 Cb 0.45 -1.26 0.02 0.00 -1.74 0.00 0.00 39.64 37.11 1wa7 n ILE 22 CO 0.00 0.00 0.00 -1.00 -1.76 0.00 0.00 176.55 173.79 1wa7 s HIS 23 N -2.32 3.18 -0.63 4.28 3.76 -1.26 -4.92 115.29 117.38 1wa7 s HIS 23 Ca -0.22 1.45 0.20 0.00 -0.15 0.00 0.00 55.06 56.34 1wa7 s HIS 23 Cb 0.07 -2.90 0.87 0.00 1.11 0.00 0.00 32.58 31.72 1wa7 s HIS 23 CO 0.35 -0.98 1.62 -0.35 -0.85 0.00 0.00 174.74 174.53 1wa7 n PRO 24 N -2.38 0.13 -0.00 8.40 -0.04 -1.26 -2.82 135.00 137.03 1wa7 n PRO 24 Ca 0.08 0.38 0.04 0.00 -0.04 0.00 0.00 63.50 63.96 1wa7 n PRO 24 Cb 0.53 -1.76 -0.05 0.00 -0.04 0.00 0.00 33.50 32.18 1wa7 n PRO 24 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1wa7 n ASP 25 N -2.01 1.42 -4.73 3.54 9.92 -1.26 -5.01 116.55 118.42 1wa7 n ASP 25 Ca 0.02 -0.43 -0.42 0.00 -0.53 0.00 0.00 54.79 53.44 1wa7 n ASP 25 Cb 0.20 1.14 -0.01 0.00 -0.64 0.00 0.00 41.12 41.81 1wa7 n ASP 25 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1wa7 n ASP 26 N -1.41 3.23 -4.63 -2.24 8.00 -1.13 -2.99 116.55 115.38 1wa7 n ASP 26 Ca 0.00 1.20 -0.39 0.00 0.71 0.00 0.00 54.79 56.32 1wa7 n ASP 26 Cb 0.15 -1.54 -0.08 0.00 -0.02 0.00 0.00 41.12 39.64 1wa7 n ASP 26 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1wa7 s LEU 27 N -1.18 4.08 0.23 0.64 1.98 -1.20 -4.68 118.68 118.56 1wa7 s LEU 27 Ca 0.57 0.39 -0.30 0.00 -2.89 0.00 0.00 54.13 51.90 1wa7 s LEU 27 Cb -0.54 -2.48 -0.09 0.00 0.66 0.00 0.00 46.19 43.75 1wa7 s LEU 27 CO 0.60 -0.15 0.98 -0.44 -1.89 0.00 0.00 176.35 175.45 1wa7 s SER 28 N 1.40 7.55 0.07 3.68 0.01 -1.26 -4.80 113.70 120.35 1wa7 s SER 28 Ca 0.17 2.00 -0.09 0.00 1.31 0.00 0.00 55.95 59.34 1wa7 s SER 28 Cb -0.15 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.47 1wa7 s SER 28 CO 0.09 0.07 0.19 0.72 0.41 0.00 0.00 173.24 174.72 1wa7 s PHE 29 N -1.01 0.12 0.48 2.43 -0.12 -1.26 -4.98 117.98 113.63 1wa7 s PHE 29 Ca 0.43 -0.47 0.06 0.00 -0.05 0.00 0.00 56.93 56.90 1wa7 s PHE 29 Cb -0.27 -0.05 -0.01 0.00 -0.63 0.00 0.00 43.02 42.07 1wa7 s PHE 29 CO 0.34 -0.50 0.28 0.15 -0.05 0.00 0.00 175.22 175.44 1wa7 s LYS 30 N -3.39 2.28 0.65 1.99 1.02 -1.26 -0.79 119.74 120.24 1wa7 s LYS 30 Ca 0.01 -1.93 -0.16 0.00 0.02 0.00 0.00 55.97 53.91 1wa7 s LYS 30 Cb 0.03 -2.04 -0.00 0.00 -0.52 0.00 0.00 37.83 35.29 1wa7 s LYS 30 CO -0.08 -0.36 1.16 -1.59 -0.92 0.00 0.00 175.35 173.56 1wa7 s LYS 31 N -4.09 2.72 0.00 1.68 0.00 -1.26 -2.23 119.74 116.57 1wa7 s LYS 31 Ca 0.36 1.62 0.00 0.00 0.00 0.00 0.00 55.97 57.94 1wa7 s LYS 31 Cb 0.00 -1.92 0.00 0.00 0.00 0.00 0.00 37.83 35.91 1wa7 s LYS 31 CO 0.21 -1.35 0.00 0.41 0.00 0.00 0.00 175.35 174.62 1wa7 n GLY 32 N 0.05 1.33 3.77 0.59 0.00 0.91 -4.88 105.19 106.97 1wa7 n GLY 32 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 1wa7 n GLY 32 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1wa7 s GLU 33 N -0.10 4.29 -0.10 1.61 2.12 -0.95 -4.69 118.70 120.89 1wa7 s GLU 33 Ca 0.00 1.63 -0.12 0.00 0.36 0.00 0.00 54.97 56.84 1wa7 s GLU 33 Cb 0.00 -2.75 -0.05 0.00 0.26 0.00 0.00 34.13 31.60 1wa7 s GLU 33 CO 0.00 -0.05 0.27 -1.59 -0.54 0.00 0.00 175.26 173.35 1wa7 s LYS 34 N -2.16 3.90 0.05 4.30 -2.85 -1.26 0.25 119.74 121.97 1wa7 s LYS 34 Ca 0.54 0.11 0.01 0.00 -1.00 0.00 0.00 55.97 55.62 1wa7 s LYS 34 Cb -0.26 -3.29 -0.03 0.00 -2.06 0.00 0.00 37.83 32.19 1wa7 s LYS 34 CO 0.33 0.54 -0.05 -1.64 0.10 0.00 0.00 175.35 174.63 1wa7 s MET 35 N -0.46 0.54 -0.18 1.78 -1.94 0.28 -3.55 119.30 115.76 1wa7 s MET 35 Ca 0.18 -0.91 -0.03 0.00 -1.71 0.00 0.00 55.69 53.22 1wa7 s MET 35 Cb -0.14 -0.07 -0.02 0.00 2.01 0.00 0.00 34.83 36.62 1wa7 s MET 35 CO 0.06 -0.02 -0.05 0.21 -0.01 0.00 0.00 175.02 175.22 1wa7 s LYS 36 N -2.39 3.51 -0.10 2.03 2.20 -1.02 0.59 119.74 124.56 1wa7 s LYS 36 Ca -0.05 -0.59 -0.22 0.00 -0.36 0.00 0.00 55.97 54.75 1wa7 s LYS 36 Cb -0.04 -2.93 -0.03 0.00 -1.51 0.00 0.00 37.83 33.32 1wa7 s LYS 36 CO -0.03 0.04 0.66 0.54 -0.36 0.00 0.00 175.35 176.20 1wa7 s VAL 37 N 0.88 5.05 -0.02 4.02 0.11 -0.61 -0.16 120.40 129.67 1wa7 s VAL 37 Ca -0.01 1.34 0.12 0.00 -2.93 0.00 0.00 61.98 60.50 1wa7 s VAL 37 Cb -0.15 -4.00 -0.22 0.00 -1.53 0.00 0.00 36.38 30.49 1wa7 s VAL 37 CO 0.01 0.22 0.77 -0.07 -3.33 0.00 0.00 175.10 172.71 1wa7 h LEU 38 N 7.11 0.00 -7.00 2.54 3.38 -1.69 -3.33 115.31 116.32 1wa7 h LEU 38 Ca -0.39 0.00 0.19 0.00 0.09 0.00 0.00 57.88 57.77 1wa7 h LEU 38 Cb 1.18 0.00 -0.32 0.00 0.09 0.00 0.00 40.66 41.61 1wa7 h LEU 38 CO 0.76 0.97 0.70 -1.61 0.09 0.00 0.00 178.44 179.35 1wa7 s GLU 39 N -2.64 0.11 0.07 1.13 2.02 -1.26 -4.99 118.70 113.14 1wa7 s GLU 39 Ca -0.04 0.18 -0.30 0.00 0.02 0.00 0.00 54.97 54.83 1wa7 s GLU 39 Cb 0.08 0.03 -0.05 0.00 0.10 0.00 0.00 34.13 34.29 1wa7 s GLU 39 CO 0.82 -0.02 1.02 -2.00 0.02 0.00 0.00 175.26 175.10 1wa7 s GLU 40 N 0.99 4.59 -0.32 1.61 -6.30 -1.26 -3.78 118.70 114.24 1wa7 s GLU 40 Ca -0.07 1.52 0.08 0.00 -2.50 0.00 0.00 54.97 54.00 1wa7 s GLU 40 Cb -0.03 -3.39 0.52 0.00 0.00 0.00 0.00 34.13 31.23 1wa7 s GLU 40 CO -0.11 0.03 1.52 0.72 0.02 0.00 0.00 175.26 177.44 1wa7 n HIS 41 N 3.30 1.43 0.00 5.30 8.25 -1.25 -4.93 115.22 127.31 1wa7 n HIS 41 Ca 0.05 -1.72 0.00 0.00 -0.26 0.00 0.00 57.72 55.79 1wa7 n HIS 41 Cb 0.49 -0.57 0.00 0.00 1.12 0.00 0.00 29.99 31.03 1wa7 n HIS 41 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1wa7 n GLY 42 N -1.11 3.14 0.00 -1.41 0.00 -1.26 -4.52 105.19 100.03 1wa7 n GLY 42 Ca 0.38 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.50 1wa7 n GLY 42 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1wa7 n GLU 43 N 0.00 0.00 -3.51 1.61 1.02 -1.26 -5.06 120.64 113.44 1wa7 n GLU 43 Ca 0.00 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 56.88 1wa7 n GLU 43 Cb 0.00 -0.01 -0.14 0.00 -0.02 0.00 0.00 31.44 31.27 1wa7 n GLU 43 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1wa7 s TRP 44 N 0.00 0.14 0.13 -0.32 0.52 -1.26 -2.69 118.94 115.47 1wa7 s TRP 44 Ca 0.00 -0.72 -0.07 0.00 0.02 0.00 0.00 56.10 55.33 1wa7 s TRP 44 Cb 0.00 -0.80 -0.06 0.00 -1.15 0.00 0.00 33.47 31.46 1wa7 s TRP 44 CO 0.00 -0.85 0.40 -1.58 0.02 0.00 0.00 176.95 174.94 1wa7 s TRP 45 N 2.15 3.50 -0.47 -1.98 0.51 -0.45 -3.92 118.94 118.27 1wa7 s TRP 45 Ca 0.09 0.65 -0.23 0.00 -2.12 0.00 0.00 56.10 54.49 1wa7 s TRP 45 Cb -0.16 -2.07 0.03 0.00 -0.81 0.00 0.00 33.47 30.46 1wa7 s TRP 45 CO -0.36 0.44 0.80 0.21 -0.51 0.00 0.00 176.95 177.53 1wa7 s LYS 46 N -2.47 3.37 0.57 4.98 2.20 -1.25 0.19 119.74 127.33 1wa7 s LYS 46 Ca 0.39 -0.18 0.09 0.00 -0.36 0.00 0.00 55.97 55.91 1wa7 s LYS 46 Cb -0.12 -3.97 0.08 0.00 -1.51 0.00 0.00 37.83 32.31 1wa7 s LYS 46 CO 0.22 -1.18 0.76 0.00 -0.36 0.00 0.00 175.35 174.79 1wa7 s ALA 47 N 3.34 4.69 -0.10 3.13 0.00 -0.17 -1.90 121.76 130.75 1wa7 s ALA 47 Ca 0.29 -2.06 0.04 0.00 0.00 0.00 0.00 51.96 50.22 1wa7 s ALA 47 Cb -0.13 -1.39 0.00 0.00 0.00 0.00 0.00 23.12 21.61 1wa7 s ALA 47 CO 0.21 -0.82 -0.22 0.15 0.00 0.00 0.00 175.76 175.08 1wa7 s LYS 48 N -4.63 2.88 -0.01 0.00 1.02 0.77 -2.11 119.74 117.66 1wa7 s LYS 48 Ca 0.59 -0.82 -0.30 0.00 0.02 0.00 0.00 55.97 55.46 1wa7 s LYS 48 Cb -0.05 -2.19 -0.03 0.00 -0.52 0.00 0.00 37.83 35.03 1wa7 s LYS 48 CO 0.37 0.15 1.08 0.45 -0.92 0.00 0.00 175.35 176.49 1wa7 s SER 49 N 0.40 7.21 0.00 2.83 0.15 0.77 -2.42 113.70 122.65 1wa7 s SER 49 Ca -0.18 1.76 0.19 0.00 0.70 0.00 0.00 55.95 58.42 1wa7 s SER 49 Cb -0.18 -2.57 0.83 0.00 -1.71 0.00 0.00 66.02 62.40 1wa7 s SER 49 CO 0.08 -0.41 1.60 -0.11 1.20 0.00 0.00 173.24 175.61 1wa7 n LEU 50 N 4.32 0.00 0.03 3.45 7.94 -1.23 -1.58 117.00 129.92 1wa7 n LEU 50 Ca 0.08 0.46 -0.11 0.00 -1.11 0.00 0.00 56.01 55.33 1wa7 n LEU 50 Cb 0.48 -0.46 -0.04 0.00 0.53 0.00 0.00 43.42 43.93 1wa7 n LEU 50 CO 0.54 -0.16 0.66 0.25 -1.11 0.00 0.00 177.39 177.56 1wa7 h LEU 51 N 0.00 -0.94 -1.86 -1.96 5.85 -1.90 -3.39 115.31 111.11 1wa7 h LEU 51 Ca 0.00 0.13 -0.11 0.00 0.84 0.00 0.00 57.88 58.74 1wa7 h LEU 51 Cb 0.30 0.39 -0.11 0.00 0.37 0.00 0.00 40.66 41.61 1wa7 h LEU 51 CO 0.00 -0.36 -0.25 1.07 -0.34 0.00 0.00 178.44 178.56 1wa7 n THR 52 N -5.40 0.00 -1.52 1.05 5.66 -1.22 -5.00 114.28 107.84 1wa7 n THR 52 Ca -0.04 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.96 1wa7 n THR 52 Cb 0.32 0.43 0.00 0.00 -1.55 0.00 0.00 70.33 69.53 1wa7 n THR 52 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1wa7 n LYS 53 N 0.00 0.00 -2.99 1.09 4.76 -0.62 -5.05 118.16 115.36 1wa7 n LYS 53 Ca -0.24 0.00 -0.40 0.00 -2.87 0.00 0.00 58.31 54.80 1wa7 n LYS 53 Cb 0.65 -1.67 -0.05 0.00 -1.84 0.00 0.00 35.03 32.13 1wa7 n LYS 53 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1wa7 s LYS 54 N -2.90 4.48 -0.21 1.97 2.20 -1.01 -4.78 119.74 119.50 1wa7 s LYS 54 Ca 0.00 1.03 0.01 0.00 -0.36 0.00 0.00 55.97 56.66 1wa7 s LYS 54 Cb 0.00 -3.39 0.04 0.00 -1.51 0.00 0.00 37.83 32.98 1wa7 s LYS 54 CO 0.00 0.22 -0.12 -1.83 -0.36 0.00 0.00 175.35 173.26 1wa7 s GLU 55 N 0.20 2.19 0.24 4.03 -1.05 -1.26 0.27 118.70 123.32 1wa7 s GLU 55 Ca 0.39 -0.94 -0.14 0.00 -0.15 0.00 0.00 54.97 54.13 1wa7 s GLU 55 Cb -0.20 -2.53 0.00 0.00 -0.44 0.00 0.00 34.13 30.96 1wa7 s GLU 55 CO 0.22 -0.43 0.49 0.20 0.95 0.00 0.00 175.26 176.69 1wa7 s GLY 56 N 1.32 0.42 0.11 -3.83 0.00 -0.90 -4.67 107.32 99.79 1wa7 s GLY 56 Ca -0.02 -0.77 -0.30 0.00 0.00 0.00 0.00 44.72 43.62 1wa7 s GLY 56 CO -0.08 -0.56 1.21 -1.36 0.00 0.00 0.00 173.10 172.30 1wa7 s PHE 57 N -3.99 3.43 -0.00 1.90 0.08 -1.16 -1.00 117.98 117.23 1wa7 s PHE 57 Ca 0.20 1.33 0.07 0.00 0.12 0.00 0.00 56.93 58.66 1wa7 s PHE 57 Cb -0.01 -3.43 -0.02 0.00 -0.57 0.00 0.00 43.02 38.99 1wa7 s PHE 57 CO 0.07 -1.30 -0.24 0.96 -0.10 0.00 0.00 175.22 174.62 1wa7 s ILE 58 N 0.62 1.87 0.53 0.64 -4.36 0.50 -3.22 121.20 117.78 1wa7 s ILE 58 Ca 0.57 -1.07 -0.20 0.00 -0.26 0.00 0.00 60.65 59.69 1wa7 s ILE 58 Cb -0.31 -1.56 -0.06 0.00 1.25 0.00 0.00 42.46 41.78 1wa7 s ILE 58 CO 0.32 0.47 1.14 -2.16 0.24 0.00 0.00 174.94 174.95 1wa7 s PRO 59 N -0.69 3.41 0.00 0.37 0.04 -1.26 -1.35 135.00 135.51 1wa7 s PRO 59 Ca 0.09 1.65 0.06 0.00 0.04 0.00 0.00 61.00 62.84 1wa7 s PRO 59 Cb -0.09 -2.07 0.37 0.00 0.04 0.00 0.00 34.50 32.75 1wa7 s PRO 59 CO -0.00 -0.81 1.13 0.45 0.04 0.00 0.00 177.00 177.81 1wa7 n SER 60 N -1.18 0.00 -0.05 6.66 2.88 -1.09 -3.87 113.62 116.97 1wa7 n SER 60 Ca 0.11 -1.56 -0.11 0.00 -1.33 0.00 0.00 58.87 55.98 1wa7 n SER 60 Cb 0.50 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.93 1wa7 n SER 60 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1wa7 n ASN 61 N -0.61 0.93 -0.14 -3.46 5.15 -1.26 -4.72 115.26 111.14 1wa7 n ASN 61 Ca 0.05 0.15 -0.05 0.00 -0.60 0.00 0.00 54.58 54.13 1wa7 n ASN 61 Cb 0.02 -0.37 0.01 0.00 -0.53 0.00 0.00 39.78 38.92 1wa7 n ASN 61 CO 0.00 0.00 0.00 1.88 1.40 0.00 0.00 177.26 180.54 1wa7 h TYR 62 N -0.41 -0.58 -3.46 1.20 0.05 -1.91 -3.42 116.97 108.44 1wa7 h TYR 62 Ca -0.24 0.05 -0.50 0.00 0.05 0.00 0.00 58.73 58.09 1wa7 h TYR 62 Cb 1.10 0.32 0.00 0.00 1.01 0.00 0.00 36.73 39.17 1wa7 h TYR 62 CO -0.06 -0.31 0.01 0.14 -1.05 0.00 0.00 178.16 176.89 1wa7 s VAL 63 N -6.12 4.90 0.15 -2.88 -7.23 -1.26 0.11 120.40 108.07 1wa7 s VAL 63 Ca -0.14 0.32 0.02 0.00 -1.81 0.00 0.00 61.98 60.37 1wa7 s VAL 63 Cb 0.15 -3.75 -0.05 0.00 0.56 0.00 0.00 36.38 33.30 1wa7 s VAL 63 CO 0.70 -0.48 -0.04 0.00 -0.31 0.00 0.00 175.10 174.97 1wa7 s ALA 64 N -2.30 1.31 -0.86 1.32 0.00 0.15 -4.80 121.76 116.58 1wa7 s ALA 64 Ca 0.48 -1.52 -0.25 0.00 0.00 0.00 0.00 51.96 50.67 1wa7 s ALA 64 Cb -0.10 0.33 0.02 0.00 0.00 0.00 0.00 23.12 23.37 1wa7 s ALA 64 CO 0.32 -0.24 1.52 -1.59 0.00 0.00 0.00 175.76 175.77 1wa7 s LYS 65 N -3.85 3.18 -1.36 0.00 -2.85 -1.26 -0.21 119.74 113.38 1wa7 s LYS 65 Ca 0.20 -0.48 -0.19 0.00 -1.00 0.00 0.00 55.97 54.49 1wa7 s LYS 65 Cb 0.05 -4.80 0.03 0.00 -2.06 0.00 0.00 37.83 31.05 1wa7 s LYS 65 CO 0.01 -2.44 0.36 -0.11 0.10 0.00 0.00 175.35 173.28 1wa7 n LEU 66 N 10.32 -0.49 -4.59 2.77 -0.00 -1.26 -4.78 117.00 118.98 1wa7 n LEU 66 Ca 0.23 -1.29 -0.42 0.00 -0.00 0.00 0.00 56.01 54.52 1wa7 n LEU 66 Cb 0.50 -1.58 -0.02 0.00 -0.00 0.00 0.00 43.42 42.32 1wa7 n LEU 66 CO 0.67 0.67 1.28 0.21 -0.00 0.00 0.00 177.39 180.22 1wa7 s ASN 67 N -3.93 6.21 0.00 1.96 2.47 -1.26 -5.05 114.94 115.34 1wa7 s ASN 67 Ca 0.27 0.71 0.09 0.00 0.42 0.00 0.00 52.86 54.35 1wa7 s ASN 67 Cb -0.15 -2.54 0.07 0.00 -1.45 0.00 0.00 41.25 37.18 1wa7 s ASN 67 CO 0.98 -1.56 0.79 0.35 -3.72 0.00 0.00 177.10 173.95