#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 2.51 3.17 2.61 0.00 -1.26 -5.00 105.19 107.21 1wa7 n GLY 10 Ca 0.00 -1.25 -0.08 0.00 0.00 0.00 0.00 46.02 44.69 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 0.00 0.28 -0.09 1.61 1.11 -1.25 -5.01 116.67 113.32 1wa7 s ASP 11 Ca 0.00 -0.92 0.01 0.00 0.18 0.00 0.00 52.55 51.82 1wa7 s ASP 11 Cb 0.00 0.29 -0.03 0.00 1.07 0.00 0.00 42.92 44.26 1wa7 s ASP 11 CO 0.00 -0.70 -0.09 -0.63 1.18 0.00 0.00 175.17 174.92 1wa7 s ILE 12 N -3.93 3.46 0.17 0.77 -1.09 -1.26 -0.85 121.20 118.46 1wa7 s ILE 12 Ca 0.11 -0.55 0.03 0.00 -2.23 0.00 0.00 60.65 58.01 1wa7 s ILE 12 Cb 0.06 -2.42 -0.05 0.00 -1.58 0.00 0.00 42.46 38.48 1wa7 s ILE 12 CO -0.07 0.57 -0.04 0.68 -1.23 0.00 0.00 174.94 174.85 1wa7 s VAL 13 N -0.42 0.91 -0.03 2.92 -7.23 -0.77 -3.65 120.40 112.12 1wa7 s VAL 13 Ca 0.06 -2.01 0.07 0.00 -1.81 0.00 0.00 61.98 58.28 1wa7 s VAL 13 Cb -0.12 -2.05 -0.02 0.00 0.56 0.00 0.00 36.38 34.75 1wa7 s VAL 13 CO 0.02 -0.56 -0.23 -0.69 -0.31 0.00 0.00 175.10 173.33 1wa7 s VAL 14 N -3.50 2.28 -0.77 1.32 1.01 0.41 -1.12 120.40 120.03 1wa7 s VAL 14 Ca 0.22 -1.01 -0.25 0.00 0.00 0.00 0.00 61.98 60.93 1wa7 s VAL 14 Cb 0.05 -1.82 -0.02 0.00 0.00 0.00 0.00 36.38 34.59 1wa7 s VAL 14 CO 0.03 0.58 1.78 0.00 0.00 0.00 0.00 175.10 177.49 1wa7 s ALA 15 N -0.56 2.12 0.39 5.51 0.00 0.51 0.74 121.76 130.47 1wa7 s ALA 15 Ca 0.08 -1.21 0.07 0.00 0.00 0.00 0.00 51.96 50.90 1wa7 s ALA 15 Cb -0.11 -4.41 0.80 0.00 0.00 0.00 0.00 23.12 19.40 1wa7 s ALA 15 CO 0.00 -4.12 2.02 -0.07 0.00 0.00 0.00 175.76 173.58 1wa7 h LEU 16 N 16.15 0.47 -8.33 0.00 3.38 -1.26 1.77 115.31 127.48 1wa7 h LEU 16 Ca -0.09 -0.03 -0.31 0.00 0.09 0.00 0.00 57.88 57.55 1wa7 h LEU 16 Cb 1.08 -0.12 -0.19 0.00 0.09 0.00 0.00 40.66 41.52 1wa7 h LEU 16 CO 1.25 0.39 -0.74 -0.31 0.09 0.00 0.00 178.44 179.12 1wa7 s TYR 17 N -5.36 0.92 0.56 1.13 2.02 -1.12 -4.25 117.35 111.24 1wa7 s TYR 17 Ca -0.08 -0.59 -0.19 0.00 -0.37 0.00 0.00 57.07 55.84 1wa7 s TYR 17 Cb 0.17 -0.52 -0.05 0.00 -0.40 0.00 0.00 41.96 41.16 1wa7 s TYR 17 CO 0.74 -0.04 1.12 -1.25 -1.57 0.00 0.00 175.55 174.55 1wa7 s PRO 18 N -2.27 3.30 -0.34 -1.71 0.04 -1.26 -4.25 135.00 128.51 1wa7 s PRO 18 Ca -0.01 1.55 -0.02 0.00 0.04 0.00 0.00 61.00 62.56 1wa7 s PRO 18 Cb -0.06 -2.00 0.07 0.00 0.04 0.00 0.00 34.50 32.55 1wa7 s PRO 18 CO -0.00 -0.88 0.08 -0.47 0.04 0.00 0.00 177.00 175.77 1wa7 s TYR 19 N -1.89 3.42 0.15 0.56 5.04 0.13 -4.92 117.35 119.84 1wa7 s TYR 19 Ca 0.71 -2.15 0.10 0.00 -2.44 0.00 0.00 57.07 53.30 1wa7 s TYR 19 Cb -0.23 -2.58 0.54 0.00 0.35 0.00 0.00 41.96 40.05 1wa7 s TYR 19 CO 0.29 -0.87 0.59 -0.25 -1.34 0.00 0.00 175.55 173.97 1wa7 n ASP 20 N 4.59 0.10 -2.26 4.32 8.00 -1.26 -3.90 116.55 126.14 1wa7 n ASP 20 Ca -0.08 0.57 -0.03 0.00 0.71 0.00 0.00 54.79 55.96 1wa7 n ASP 20 Cb 0.43 -0.28 -0.02 0.00 -0.02 0.00 0.00 41.12 41.23 1wa7 n ASP 20 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1wa7 n GLY 21 N -1.15 -4.28 0.03 0.44 0.00 -1.26 -4.96 105.19 94.00 1wa7 n GLY 21 Ca 0.15 0.79 -0.04 0.00 0.00 0.00 0.00 46.02 46.91 1wa7 n GLY 21 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1wa7 n ILE 22 N 0.90 0.37 -2.51 -0.61 5.41 -1.26 -5.01 119.36 116.64 1wa7 n ILE 22 Ca -0.18 -0.15 -0.33 0.00 1.00 0.00 0.00 62.75 63.08 1wa7 n ILE 22 Cb 0.28 -0.75 -0.04 0.00 -0.71 0.00 0.00 39.64 38.42 1wa7 n ILE 22 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 176.55 175.55 1wa7 s HIS 23 N -2.13 3.19 -0.98 1.39 3.76 -1.26 -4.90 115.29 114.36 1wa7 s HIS 23 Ca -0.08 1.55 0.10 0.00 -0.15 0.00 0.00 55.06 56.48 1wa7 s HIS 23 Cb 0.02 -2.93 0.42 0.00 1.11 0.00 0.00 32.58 31.19 1wa7 s HIS 23 CO 0.16 -0.57 1.31 -0.35 -0.85 0.00 0.00 174.74 174.44 1wa7 n PRO 24 N -1.18 0.01 -0.00 8.40 -0.04 -1.26 -2.27 135.00 138.65 1wa7 n PRO 24 Ca 0.08 0.35 0.03 0.00 -0.04 0.00 0.00 63.50 63.91 1wa7 n PRO 24 Cb 0.53 -1.51 -0.04 0.00 -0.04 0.00 0.00 33.50 32.44 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 -1.53 2.76 -4.73 3.54 8.00 -1.26 -5.02 116.55 118.31 1wa7 n ASP 25 Ca 0.02 -0.17 -0.42 0.00 0.71 0.00 0.00 54.79 54.93 1wa7 n ASP 25 Cb 0.11 1.18 -0.01 0.00 -0.02 0.00 0.00 41.12 42.39 1wa7 n ASP 25 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1wa7 n ASP 26 N -1.54 3.25 -4.59 -2.24 8.00 -0.96 -4.10 116.55 114.37 1wa7 n ASP 26 Ca -0.00 1.21 -0.42 0.00 0.71 0.00 0.00 54.79 56.28 1wa7 n ASP 26 Cb 0.13 -1.54 -0.05 0.00 -0.02 0.00 0.00 41.12 39.63 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 -1.29 4.15 0.29 0.64 1.98 -1.23 -4.77 118.68 118.45 1wa7 s LEU 27 Ca 0.56 0.36 -0.29 0.00 -2.89 0.00 0.00 54.13 51.88 1wa7 s LEU 27 Cb -0.53 -2.97 -0.09 0.00 0.66 0.00 0.00 46.19 43.25 1wa7 s LEU 27 CO 0.61 -0.67 1.04 -0.94 -1.89 0.00 0.00 176.35 174.50 1wa7 s SER 28 N 1.78 7.29 0.06 3.68 1.04 -1.26 -4.78 113.70 121.51 1wa7 s SER 28 Ca 0.30 2.12 -0.08 0.00 0.48 0.00 0.00 55.95 58.77 1wa7 s SER 28 Cb -0.14 -2.61 -0.00 0.00 0.10 0.00 0.00 66.02 63.37 1wa7 s SER 28 CO 0.15 -0.11 0.16 0.72 0.98 0.00 0.00 173.24 175.14 1wa7 s PHE 29 N -1.27 0.14 0.48 5.02 -0.12 -1.25 -4.95 117.98 116.02 1wa7 s PHE 29 Ca 0.46 -0.46 0.06 0.00 -0.05 0.00 0.00 56.93 56.94 1wa7 s PHE 29 Cb -0.28 -0.08 0.00 0.00 -0.63 0.00 0.00 43.02 42.03 1wa7 s PHE 29 CO 0.35 -0.45 0.34 0.15 -0.05 0.00 0.00 175.22 175.56 1wa7 s LYS 30 N -3.06 2.32 0.59 1.99 1.02 -1.26 0.22 119.74 121.56 1wa7 s LYS 30 Ca -0.01 -1.87 -0.18 0.00 0.02 0.00 0.00 55.97 53.93 1wa7 s LYS 30 Cb 0.01 -2.13 -0.03 0.00 -0.52 0.00 0.00 37.83 35.16 1wa7 s LYS 30 CO -0.07 -0.40 1.16 -1.59 -0.92 0.00 0.00 175.35 173.54 1wa7 s LYS 31 N -4.15 3.03 0.00 1.68 -2.85 -1.24 -2.23 119.74 113.98 1wa7 s LYS 31 Ca 0.38 1.67 0.00 0.00 -1.00 0.00 0.00 55.97 57.03 1wa7 s LYS 31 Cb -0.01 -1.95 0.00 0.00 -2.06 0.00 0.00 37.83 33.81 1wa7 s LYS 31 CO 0.23 -1.13 0.00 0.41 0.10 0.00 0.00 175.35 174.96 1wa7 n GLY 32 N 0.21 1.41 3.77 0.59 0.00 0.60 -4.92 105.19 106.86 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 -0.11 4.36 -0.08 1.61 2.12 -0.94 -4.69 118.70 120.97 1wa7 s GLU 33 Ca 0.00 1.64 -0.10 0.00 0.36 0.00 0.00 54.97 56.87 1wa7 s GLU 33 Cb 0.00 -2.82 -0.05 0.00 0.26 0.00 0.00 34.13 31.53 1wa7 s GLU 33 CO 0.00 0.00 0.24 0.15 -0.54 0.00 0.00 175.26 175.11 1wa7 s LYS 34 N -2.04 3.65 0.06 4.30 1.02 -1.26 0.19 119.74 125.65 1wa7 s LYS 34 Ca 0.52 0.07 0.02 0.00 0.02 0.00 0.00 55.97 56.60 1wa7 s LYS 34 Cb -0.26 -3.21 -0.03 0.00 -0.52 0.00 0.00 37.83 33.80 1wa7 s LYS 34 CO 0.33 0.72 -0.08 -1.64 -0.92 0.00 0.00 175.35 173.77 1wa7 s MET 35 N -0.97 0.61 -0.21 1.68 -1.94 -0.27 -3.57 119.30 114.62 1wa7 s MET 35 Ca 0.18 -0.90 -0.07 0.00 -1.71 0.00 0.00 55.69 53.19 1wa7 s MET 35 Cb -0.14 -0.28 -0.04 0.00 2.01 0.00 0.00 34.83 36.39 1wa7 s MET 35 CO 0.07 0.04 0.06 0.21 -0.01 0.00 0.00 175.02 175.39 1wa7 s LYS 36 N -2.13 3.83 0.09 2.03 2.20 -0.59 -1.84 119.74 123.33 1wa7 s LYS 36 Ca -0.05 -0.41 -0.30 0.00 -0.36 0.00 0.00 55.97 54.86 1wa7 s LYS 36 Cb -0.06 -3.26 -0.06 0.00 -1.51 0.00 0.00 37.83 32.94 1wa7 s LYS 36 CO -0.01 0.08 1.12 0.08 -0.36 0.00 0.00 175.35 176.26 1wa7 s VAL 37 N 0.90 4.12 -0.13 4.02 1.01 -0.03 0.63 120.40 130.93 1wa7 s VAL 37 Ca 0.04 1.62 -0.05 0.00 0.00 0.00 0.00 61.98 63.59 1wa7 s VAL 37 Cb -0.14 -4.04 -0.06 0.00 0.00 0.00 0.00 36.38 32.15 1wa7 s VAL 37 CO 0.03 0.18 -0.15 0.18 0.00 0.00 0.00 175.10 175.34 1wa7 n LEU 38 N 3.34 1.20 -3.43 3.92 4.77 0.14 -3.89 117.00 123.05 1wa7 n LEU 38 Ca 0.06 0.12 -0.24 0.00 -0.03 0.00 0.00 56.01 55.92 1wa7 n LEU 38 Cb 0.47 -0.38 -0.11 0.00 -2.33 0.00 0.00 43.42 41.08 1wa7 n LEU 38 CO 0.54 0.33 -0.25 -1.83 -1.33 0.00 0.00 177.39 174.84 1wa7 s GLU 39 N -2.23 0.52 -0.34 3.23 -1.05 -1.18 -4.95 118.70 112.70 1wa7 s GLU 39 Ca -0.17 -0.99 -0.29 0.00 -0.15 0.00 0.00 54.97 53.36 1wa7 s GLU 39 Cb 0.06 -1.04 0.01 0.00 -0.44 0.00 0.00 34.13 32.73 1wa7 s GLU 39 CO 0.23 -1.17 1.16 -2.00 0.95 0.00 0.00 175.26 174.43 1wa7 s GLU 40 N 1.40 3.96 0.00 -4.83 2.12 -1.26 -2.82 118.70 117.27 1wa7 s GLU 40 Ca 0.16 1.04 0.00 0.00 0.36 0.00 0.00 54.97 56.53 1wa7 s GLU 40 Cb -0.19 -3.81 0.00 0.00 0.26 0.00 0.00 34.13 30.39 1wa7 s GLU 40 CO -0.07 -1.05 0.00 0.72 -0.54 0.00 0.00 175.26 174.32 1wa7 n HIS 41 N 7.28 0.00 0.00 5.30 8.25 -1.26 -4.97 115.22 129.82 1wa7 n HIS 41 Ca 0.13 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.59 1wa7 n HIS 41 Cb 0.47 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.58 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 4.17 0.71 0.00 -1.41 0.00 -1.26 -4.93 105.19 102.48 1wa7 n GLY 42 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.21 2.01 -3.60 1.61 4.71 -1.26 -5.01 120.64 118.88 1wa7 n GLU 43 Ca 0.00 0.00 -0.29 0.00 -0.01 0.00 0.00 57.16 56.86 1wa7 n GLU 43 Cb 0.00 -0.17 -0.15 0.00 -1.01 0.00 0.00 31.44 30.11 1wa7 n GLU 43 CO 0.00 0.00 0.00 -1.58 0.09 0.00 0.00 177.13 175.64 1wa7 s TRP 44 N 0.00 0.77 0.22 -0.32 0.52 -1.26 -1.36 118.94 117.51 1wa7 s TRP 44 Ca 0.00 -1.16 -0.15 0.00 0.02 0.00 0.00 56.10 54.81 1wa7 s TRP 44 Cb 0.00 -1.16 -0.08 0.00 -1.15 0.00 0.00 33.47 31.08 1wa7 s TRP 44 CO 0.00 -0.85 0.64 -1.58 0.02 0.00 0.00 176.95 175.18 1wa7 s TRP 45 N 1.94 3.53 -0.51 -1.98 0.51 0.29 -4.09 118.94 118.62 1wa7 s TRP 45 Ca 0.09 1.14 -0.19 0.00 -2.12 0.00 0.00 56.10 55.02 1wa7 s TRP 45 Cb -0.16 -2.45 0.06 0.00 -0.81 0.00 0.00 33.47 30.10 1wa7 s TRP 45 CO -0.33 0.30 0.64 0.21 -0.51 0.00 0.00 176.95 177.26 1wa7 s LYS 46 N -2.36 3.14 0.47 4.98 2.20 -1.13 0.27 119.74 127.30 1wa7 s LYS 46 Ca 0.45 -0.84 0.06 0.00 -0.36 0.00 0.00 55.97 55.28 1wa7 s LYS 46 Cb -0.14 -4.09 0.06 0.00 -1.51 0.00 0.00 37.83 32.16 1wa7 s LYS 46 CO 0.20 -1.22 0.54 0.00 -0.36 0.00 0.00 175.35 174.50 1wa7 n ALA 47 N 6.23 0.89 -3.46 3.13 0.00 -0.45 -0.68 120.51 126.17 1wa7 n ALA 47 Ca -0.06 -1.76 -0.29 0.00 0.00 0.00 0.00 53.44 51.33 1wa7 n ALA 47 Cb 0.46 0.58 -0.17 0.00 0.00 0.00 0.00 19.45 20.31 1wa7 n ALA 47 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1wa7 s LYS 48 N -4.04 2.46 -0.01 0.00 2.20 0.21 -2.06 119.74 118.50 1wa7 s LYS 48 Ca 0.41 -0.67 -0.30 0.00 -0.36 0.00 0.00 55.97 55.05 1wa7 s LYS 48 Cb -0.03 -1.97 -0.04 0.00 -1.51 0.00 0.00 37.83 34.27 1wa7 s LYS 48 CO 0.26 0.05 1.22 0.45 -0.36 0.00 0.00 175.35 176.97 1wa7 s SER 49 N 0.67 7.04 0.00 1.43 0.15 0.72 -1.55 113.70 122.16 1wa7 s SER 49 Ca -0.13 1.92 0.18 0.00 0.70 0.00 0.00 55.95 58.62 1wa7 s SER 49 Cb -0.16 -2.57 0.86 0.00 -1.71 0.00 0.00 66.02 62.45 1wa7 s SER 49 CO 0.03 -0.56 1.57 0.18 1.20 0.00 0.00 173.24 175.66 1wa7 n LEU 50 N 4.76 0.00 0.07 3.45 4.77 -1.23 -1.58 117.00 127.23 1wa7 n LEU 50 Ca 0.10 0.37 -0.12 0.00 -0.03 0.00 0.00 56.01 56.34 1wa7 n LEU 50 Cb 0.46 -0.37 -0.05 0.00 -2.33 0.00 0.00 43.42 41.13 1wa7 n LEU 50 CO 0.56 -0.14 0.66 0.25 -1.33 0.00 0.00 177.39 177.39 1wa7 h LEU 51 N 0.00 -0.88 -1.85 2.23 5.85 -1.89 -3.40 115.31 115.37 1wa7 h LEU 51 Ca 0.00 0.11 -0.11 0.00 0.84 0.00 0.00 57.88 58.72 1wa7 h LEU 51 Cb 0.23 0.35 -0.11 0.00 0.37 0.00 0.00 40.66 41.50 1wa7 h LEU 51 CO 0.00 -0.37 -0.25 1.07 -0.34 0.00 0.00 178.44 178.55 1wa7 n THR 52 N -5.40 0.00 -1.45 1.05 5.66 -1.22 -5.00 114.28 107.92 1wa7 n THR 52 Ca -0.05 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.95 1wa7 n THR 52 Cb 0.31 0.43 0.00 0.00 -1.55 0.00 0.00 70.33 69.52 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 5.02 -0.62 -5.05 118.16 115.62 1wa7 n LYS 53 Ca -0.24 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 55.65 1wa7 n LYS 53 Cb 0.66 -1.63 -0.05 0.00 -0.02 0.00 0.00 35.03 33.99 1wa7 n LYS 53 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1wa7 s LYS 54 N -2.72 4.47 -0.18 1.97 2.20 -0.99 -4.78 119.74 119.70 1wa7 s LYS 54 Ca 0.00 1.01 0.01 0.00 -0.36 0.00 0.00 55.97 56.63 1wa7 s LYS 54 Cb 0.00 -3.41 0.03 0.00 -1.51 0.00 0.00 37.83 32.95 1wa7 s LYS 54 CO 0.00 0.17 -0.13 -1.83 -0.36 0.00 0.00 175.35 173.19 1wa7 s GLU 55 N 0.39 2.31 0.23 4.03 -1.05 -1.26 0.26 118.70 123.61 1wa7 s GLU 55 Ca 0.39 -0.79 -0.21 0.00 -0.15 0.00 0.00 54.97 54.21 1wa7 s GLU 55 Cb -0.19 -2.38 0.04 0.00 -0.44 0.00 0.00 34.13 31.15 1wa7 s GLU 55 CO 0.21 -0.34 0.65 0.20 0.95 0.00 0.00 175.26 176.94 1wa7 s GLY 56 N 1.38 -0.25 0.17 -3.83 0.00 -0.88 -4.54 107.32 99.38 1wa7 s GLY 56 Ca 0.01 -0.05 -0.30 0.00 0.00 0.00 0.00 44.72 44.38 1wa7 s GLY 56 CO -0.10 -0.04 1.23 -1.36 0.00 0.00 0.00 173.10 172.84 1wa7 s PHE 57 N -3.86 3.38 0.04 1.90 0.40 -1.26 -1.34 117.98 117.24 1wa7 s PHE 57 Ca 0.08 1.34 0.08 0.00 -0.60 0.00 0.00 56.93 57.82 1wa7 s PHE 57 Cb -0.04 -3.48 -0.03 0.00 0.51 0.00 0.00 43.02 39.99 1wa7 s PHE 57 CO -0.01 -1.43 -0.22 0.96 0.70 0.00 0.00 175.22 175.22 1wa7 s ILE 58 N 0.16 1.80 0.40 0.64 -4.36 0.76 -3.52 121.20 117.08 1wa7 s ILE 58 Ca 0.55 -1.24 -0.26 0.00 -0.26 0.00 0.00 60.65 59.44 1wa7 s ILE 58 Cb -0.33 -1.55 -0.09 0.00 1.25 0.00 0.00 42.46 41.74 1wa7 s ILE 58 CO 0.36 0.26 1.25 -2.16 0.24 0.00 0.00 174.94 174.89 1wa7 s PRO 59 N -1.17 4.03 0.00 0.37 0.04 -1.26 -0.55 135.00 136.46 1wa7 s PRO 59 Ca 0.09 2.05 0.09 0.00 0.04 0.00 0.00 61.00 63.27 1wa7 s PRO 59 Cb -0.09 -2.76 0.55 0.00 0.04 0.00 0.00 34.50 32.25 1wa7 s PRO 59 CO 0.02 -0.41 1.14 -1.13 0.04 0.00 0.00 177.00 176.66 1wa7 n SER 60 N 0.17 0.00 -0.07 6.66 3.41 -0.46 -3.70 113.62 119.62 1wa7 n SER 60 Ca 0.04 -1.18 -0.15 0.00 -0.26 0.00 0.00 58.87 57.32 1wa7 n SER 60 Cb 0.44 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.34 1wa7 n SER 60 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1wa7 n ASN 61 N -0.70 1.22 0.04 4.04 5.15 -1.26 -4.75 115.26 119.00 1wa7 n ASN 61 Ca 0.07 0.21 -0.14 0.00 -0.60 0.00 0.00 54.58 54.12 1wa7 n ASN 61 Cb 0.03 -0.49 -0.09 0.00 -0.53 0.00 0.00 39.78 38.70 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 -0.58 -1.39 -4.25 1.20 0.05 -1.88 -3.42 116.97 106.69 1wa7 h TYR 62 Ca -0.34 0.05 -0.49 0.00 0.05 0.00 0.00 58.73 58.00 1wa7 h TYR 62 Cb 1.23 0.61 0.04 0.00 1.01 0.00 0.00 36.73 39.62 1wa7 h TYR 62 CO -0.09 -0.50 0.39 0.14 -1.05 0.00 0.00 178.16 177.05 1wa7 s VAL 63 N -5.39 4.37 0.15 -2.88 -7.23 -1.26 -0.83 120.40 107.33 1wa7 s VAL 63 Ca -0.14 1.01 0.01 0.00 -1.81 0.00 0.00 61.98 61.06 1wa7 s VAL 63 Cb 0.06 -3.65 -0.04 0.00 0.56 0.00 0.00 36.38 33.30 1wa7 s VAL 63 CO 0.53 -0.77 -0.01 0.00 -0.31 0.00 0.00 175.10 174.54 1wa7 s ALA 64 N -2.76 1.20 0.45 1.32 0.00 0.23 -4.75 121.76 117.45 1wa7 s ALA 64 Ca 0.59 -1.52 -0.21 0.00 0.00 0.00 0.00 51.96 50.81 1wa7 s ALA 64 Cb -0.12 0.50 -0.09 0.00 0.00 0.00 0.00 23.12 23.41 1wa7 s ALA 64 CO 0.40 -0.32 1.01 -1.59 0.00 0.00 0.00 175.76 175.26 1wa7 s LYS 65 N -3.91 4.02 0.00 0.00 -2.85 -1.26 0.15 119.74 115.89 1wa7 s LYS 65 Ca 0.21 1.32 0.00 0.00 -1.00 0.00 0.00 55.97 56.50 1wa7 s LYS 65 Cb 0.06 -2.23 0.00 0.00 -2.06 0.00 0.00 37.83 33.60 1wa7 s LYS 65 CO 0.02 -0.24 0.00 -0.11 0.10 0.00 0.00 175.35 175.12 1wa7 n LEU 66 N -0.64 0.00 -4.24 2.77 0.00 -1.24 -4.74 117.00 108.92 1wa7 n LEU 66 Ca 0.08 0.00 -0.18 0.00 0.00 0.00 0.00 56.01 55.90 1wa7 n LEU 66 Cb 0.52 0.00 -0.11 0.00 0.00 0.00 0.00 43.42 43.83 1wa7 n LEU 66 CO 0.40 0.00 -0.45 0.21 0.00 0.00 0.00 177.39 177.55 1wa7 s ASN 67 N 0.00 1.99 0.00 1.96 3.04 -1.26 -4.65 114.94 116.02 1wa7 s ASN 67 Ca 0.00 -0.79 0.11 0.00 0.04 0.00 0.00 52.86 52.22 1wa7 s ASN 67 Cb 0.00 -0.07 0.08 0.00 -1.54 0.00 0.00 41.25 39.73 1wa7 s ASN 67 CO 0.00 -0.13 0.84 0.41 -3.04 0.00 0.00 177.10 175.18