#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 1.76 2.24 1.08 0.00 -0.90 -5.04 105.19 104.33 1wa7 n GLY 10 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 1wa7 n GLY 10 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1wa7 n ASP 11 N 0.00 -1.14 -4.53 1.61 9.92 -1.16 -4.98 116.55 116.26 1wa7 n ASP 11 Ca 0.00 -2.10 -0.34 0.00 -0.53 0.00 0.00 54.79 51.83 1wa7 n ASP 11 Cb 0.00 1.99 -0.12 0.00 -0.64 0.00 0.00 41.12 42.35 1wa7 n ASP 11 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 1wa7 s ILE 12 N -2.56 3.57 0.16 0.53 1.10 -1.26 0.37 121.20 123.11 1wa7 s ILE 12 Ca 0.14 -0.52 0.04 0.00 -0.51 0.00 0.00 60.65 59.81 1wa7 s ILE 12 Cb -0.02 -2.47 -0.05 0.00 0.15 0.00 0.00 42.46 40.08 1wa7 s ILE 12 CO 0.10 0.58 -0.08 0.68 -2.11 0.00 0.00 174.94 174.11 1wa7 s VAL 13 N -0.52 1.11 -0.02 4.00 -7.23 0.36 -4.19 120.40 113.91 1wa7 s VAL 13 Ca 0.07 -2.05 0.08 0.00 -1.81 0.00 0.00 61.98 58.28 1wa7 s VAL 13 Cb -0.12 -1.95 -0.02 0.00 0.56 0.00 0.00 36.38 34.85 1wa7 s VAL 13 CO 0.02 -0.66 -0.26 0.54 -0.31 0.00 0.00 175.10 174.44 1wa7 s VAL 14 N -3.37 2.04 0.14 1.32 0.11 0.12 0.07 120.40 120.82 1wa7 s VAL 14 Ca 0.19 -1.10 -0.30 0.00 -2.93 0.00 0.00 61.98 57.84 1wa7 s VAL 14 Cb 0.03 -1.69 -0.07 0.00 -1.53 0.00 0.00 36.38 33.12 1wa7 s VAL 14 CO 0.02 0.58 1.21 0.00 -3.33 0.00 0.00 175.10 173.57 1wa7 s ALA 15 N -0.60 3.43 -0.61 1.54 0.00 0.45 0.65 121.76 126.61 1wa7 s ALA 15 Ca 0.10 0.92 0.21 0.00 0.00 0.00 0.00 51.96 53.19 1wa7 s ALA 15 Cb -0.10 -3.43 -0.27 0.00 0.00 0.00 0.00 23.12 19.32 1wa7 s ALA 15 CO -0.01 -0.40 0.73 1.28 0.00 0.00 0.00 175.76 177.36 1wa7 n LEU 16 N 3.07 0.60 -3.61 0.00 4.77 -0.08 0.25 117.00 122.00 1wa7 n LEU 16 Ca 0.06 -0.30 -0.16 0.00 -0.03 0.00 0.00 56.01 55.58 1wa7 n LEU 16 Cb 0.45 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.47 1wa7 n LEU 16 CO 0.56 0.15 0.27 -0.31 -1.33 0.00 0.00 177.39 176.73 1wa7 s TYR 17 N -3.20 -0.46 0.61 -1.77 2.02 -1.25 -4.62 117.35 108.68 1wa7 s TYR 17 Ca 0.02 0.75 -0.19 0.00 -0.37 0.00 0.00 57.07 57.27 1wa7 s TYR 17 Cb 0.15 0.29 -0.02 0.00 -0.40 0.00 0.00 41.96 41.98 1wa7 s TYR 17 CO 0.88 -0.53 1.30 -1.25 -1.57 0.00 0.00 175.55 174.38 1wa7 s PRO 18 N -1.37 2.77 0.61 -1.71 0.04 -1.25 -4.11 135.00 129.97 1wa7 s PRO 18 Ca -0.11 2.08 0.07 0.00 0.04 0.00 0.00 61.00 63.07 1wa7 s PRO 18 Cb -0.02 -1.97 0.10 0.00 0.04 0.00 0.00 34.50 32.65 1wa7 s PRO 18 CO 0.07 -1.43 0.84 -0.47 0.04 0.00 0.00 177.00 176.04 1wa7 s TYR 19 N -1.39 1.47 -0.91 0.56 5.04 0.89 -4.93 117.35 118.08 1wa7 s TYR 19 Ca 0.79 -0.61 -0.02 0.00 -2.44 0.00 0.00 57.07 54.79 1wa7 s TYR 19 Cb -0.37 -2.41 0.22 0.00 0.35 0.00 0.00 41.96 39.75 1wa7 s TYR 19 CO 0.41 -1.29 0.80 0.34 -1.34 0.00 0.00 175.55 174.48 1wa7 s ASP 20 N -4.68 6.10 -0.73 4.32 2.15 -1.26 -4.73 116.67 117.84 1wa7 s ASP 20 Ca 0.63 -3.71 -0.25 0.00 0.43 0.00 0.00 52.55 49.65 1wa7 s ASP 20 Cb -0.06 -1.93 -0.14 0.00 -0.30 0.00 0.00 42.92 40.49 1wa7 s ASP 20 CO 0.40 -0.19 2.41 0.61 -0.17 0.00 0.00 175.17 178.23 1wa7 n GLY 21 N 2.37 -0.10 0.19 2.66 0.00 -1.26 -4.57 105.19 104.48 1wa7 n GLY 21 Ca 0.21 0.42 -0.14 0.00 0.00 0.00 0.00 46.02 46.52 1wa7 n GLY 21 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1wa7 n ILE 22 N 8.27 0.96 -2.03 -0.61 -5.35 -1.26 -4.99 119.36 114.36 1wa7 n ILE 22 Ca 0.47 -0.33 -0.32 0.00 -0.27 0.00 0.00 62.75 62.30 1wa7 n ILE 22 Cb 0.43 -1.27 0.01 0.00 -1.74 0.00 0.00 39.64 37.06 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 -2.33 3.24 -0.54 4.28 3.76 -1.26 -4.93 115.29 117.51 1wa7 s HIS 23 Ca -0.23 1.45 0.22 0.00 -0.15 0.00 0.00 55.06 56.35 1wa7 s HIS 23 Cb 0.07 -2.88 0.93 0.00 1.11 0.00 0.00 32.58 31.81 1wa7 s HIS 23 CO 0.36 -0.86 1.66 -0.35 -0.85 0.00 0.00 174.74 174.70 1wa7 n PRO 24 N -2.22 0.16 -0.00 8.40 -0.04 -1.26 -2.79 135.00 137.25 1wa7 n PRO 24 Ca 0.07 0.42 0.04 0.00 -0.04 0.00 0.00 63.50 64.00 1wa7 n PRO 24 Cb 0.53 -1.82 -0.06 0.00 -0.04 0.00 0.00 33.50 32.12 1wa7 n PRO 24 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1wa7 n ASP 25 N -2.13 1.35 -4.74 3.54 -0.08 -1.26 -5.01 116.55 108.23 1wa7 n ASP 25 Ca 0.02 -0.44 -0.41 0.00 -1.51 0.00 0.00 54.79 52.44 1wa7 n ASP 25 Cb 0.20 1.15 0.00 0.00 2.34 0.00 0.00 41.12 44.82 1wa7 n ASP 25 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1wa7 n ASP 26 N -1.43 3.25 -4.63 1.67 8.00 -1.12 -3.44 116.55 118.84 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 0.17 -1.56 -0.09 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 -1.70 4.08 0.24 0.64 1.98 -1.20 -4.71 118.68 118.02 1wa7 s LEU 27 Ca 0.55 0.35 -0.29 0.00 -2.89 0.00 0.00 54.13 51.85 1wa7 s LEU 27 Cb -0.51 -2.43 -0.09 0.00 0.66 0.00 0.00 46.19 43.82 1wa7 s LEU 27 CO 0.62 -0.13 0.92 -0.94 -1.89 0.00 0.00 176.35 174.93 1wa7 s SER 28 N 1.40 7.58 0.07 3.68 1.04 -1.26 -4.79 113.70 121.42 1wa7 s SER 28 Ca 0.16 1.90 -0.09 0.00 0.48 0.00 0.00 55.95 58.39 1wa7 s SER 28 Cb -0.15 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.38 1wa7 s SER 28 CO 0.09 0.14 0.20 0.72 0.98 0.00 0.00 173.24 175.37 1wa7 s PHE 29 N -1.22 0.11 0.48 5.02 -0.12 -1.26 -4.95 117.98 116.04 1wa7 s PHE 29 Ca 0.41 -0.47 0.06 0.00 -0.05 0.00 0.00 56.93 56.88 1wa7 s PHE 29 Cb -0.25 -0.04 -0.00 0.00 -0.63 0.00 0.00 43.02 42.09 1wa7 s PHE 29 CO 0.30 -0.51 0.29 0.15 -0.05 0.00 0.00 175.22 175.41 1wa7 s LYS 30 N -3.43 2.28 0.72 1.99 1.02 -1.26 -0.07 119.74 120.99 1wa7 s LYS 30 Ca 0.02 -1.93 -0.14 0.00 0.02 0.00 0.00 55.97 53.93 1wa7 s LYS 30 Cb 0.03 -2.05 0.03 0.00 -0.52 0.00 0.00 37.83 35.33 1wa7 s LYS 30 CO -0.09 -0.37 1.14 0.15 -0.92 0.00 0.00 175.35 175.26 1wa7 s LYS 31 N -4.10 2.34 0.00 1.68 3.01 -1.26 -2.28 119.74 119.14 1wa7 s LYS 31 Ca 0.35 1.49 0.00 0.00 -1.01 0.00 0.00 55.97 56.81 1wa7 s LYS 31 Cb -0.00 -1.88 0.00 0.00 -1.01 0.00 0.00 37.83 34.94 1wa7 s LYS 31 CO 0.21 -1.62 0.00 0.41 0.51 0.00 0.00 175.35 174.85 1wa7 n GLY 32 N -0.25 0.91 3.76 -3.33 0.00 0.71 -4.90 105.19 102.08 1wa7 n GLY 32 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.20 4.63 -0.06 1.61 2.56 -0.96 -4.70 118.70 121.59 1wa7 s GLU 33 Ca 0.00 1.73 -0.12 0.00 0.00 0.00 0.00 54.97 56.58 1wa7 s GLU 33 Cb 0.00 -3.15 -0.05 0.00 2.00 0.00 0.00 34.13 32.93 1wa7 s GLU 33 CO 0.00 0.23 0.30 0.15 -0.56 0.00 0.00 175.26 175.38 1wa7 s LYS 34 N -1.50 3.79 0.05 4.30 1.02 -1.26 0.17 119.74 126.31 1wa7 s LYS 34 Ca 0.45 0.19 0.02 0.00 0.02 0.00 0.00 55.97 56.66 1wa7 s LYS 34 Cb -0.30 -3.23 -0.03 0.00 -0.52 0.00 0.00 37.83 33.75 1wa7 s LYS 34 CO 0.39 0.68 -0.08 -1.64 -0.92 0.00 0.00 175.35 173.78 1wa7 s MET 35 N -0.90 0.60 -0.19 1.68 -1.94 0.11 -3.18 119.30 115.48 1wa7 s MET 35 Ca 0.20 -0.89 -0.05 0.00 -1.71 0.00 0.00 55.69 53.25 1wa7 s MET 35 Cb -0.15 -0.29 -0.03 0.00 2.01 0.00 0.00 34.83 36.38 1wa7 s MET 35 CO 0.09 0.04 -0.01 0.21 -0.01 0.00 0.00 175.02 175.34 1wa7 s LYS 36 N -2.07 3.64 -0.10 2.03 2.20 -1.00 -0.48 119.74 123.96 1wa7 s LYS 36 Ca -0.05 -0.52 -0.28 0.00 -0.36 0.00 0.00 55.97 54.77 1wa7 s LYS 36 Cb -0.07 -3.04 -0.02 0.00 -1.51 0.00 0.00 37.83 33.20 1wa7 s LYS 36 CO -0.01 0.08 0.91 0.08 -0.36 0.00 0.00 175.35 176.05 1wa7 s VAL 37 N 0.82 4.86 -0.27 4.02 1.01 0.16 -0.35 120.40 130.65 1wa7 s VAL 37 Ca 0.00 1.85 -0.09 0.00 0.00 0.00 0.00 61.98 63.74 1wa7 s VAL 37 Cb -0.14 -4.23 -0.14 0.00 0.00 0.00 0.00 36.38 31.87 1wa7 s VAL 37 CO 0.02 0.07 -0.28 0.18 0.00 0.00 0.00 175.10 175.09 1wa7 n LEU 38 N 4.72 2.30 -3.55 3.92 4.77 -0.76 -2.12 117.00 126.28 1wa7 n LEU 38 Ca 0.06 0.19 -0.29 0.00 -0.03 0.00 0.00 56.01 55.93 1wa7 n LEU 38 Cb 0.49 -0.86 -0.13 0.00 -2.33 0.00 0.00 43.42 40.60 1wa7 n LEU 38 CO 0.50 0.69 -0.30 -0.70 -1.33 0.00 0.00 177.39 176.25 1wa7 s GLU 39 N -2.51 0.77 -0.24 3.23 2.12 -1.25 -3.80 118.70 117.02 1wa7 s GLU 39 Ca -0.37 -1.50 -0.29 0.00 0.36 0.00 0.00 54.97 53.17 1wa7 s GLU 39 Cb 0.12 -1.64 -0.00 0.00 0.26 0.00 0.00 34.13 32.88 1wa7 s GLU 39 CO 0.54 -1.18 1.23 -2.00 -0.54 0.00 0.00 175.26 173.31 1wa7 s GLU 40 N 0.90 4.09 0.00 4.30 2.12 -1.26 -3.63 118.70 125.23 1wa7 s GLU 40 Ca 0.17 1.40 0.00 0.00 0.36 0.00 0.00 54.97 56.90 1wa7 s GLU 40 Cb -0.23 -3.79 0.00 0.00 0.26 0.00 0.00 34.13 30.37 1wa7 s GLU 40 CO -0.01 -0.88 0.00 0.72 -0.54 0.00 0.00 175.26 174.55 1wa7 n HIS 41 N 7.00 0.00 -0.85 5.30 8.25 -1.26 -5.01 115.22 128.64 1wa7 n HIS 41 Ca 0.14 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.60 1wa7 n HIS 41 Cb 0.46 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.57 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 3.88 1.00 0.00 -1.41 0.00 -1.26 -4.96 105.19 102.44 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 0.00 0.15 -3.57 1.61 4.71 -1.26 -5.00 120.64 117.28 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 0.06 -0.26 -0.14 0.00 -1.01 0.00 0.00 31.44 30.09 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 -0.95 0.79 0.21 -0.32 0.52 -1.26 -2.40 118.94 115.52 1wa7 s TRP 44 Ca 0.00 -1.30 -0.15 0.00 0.02 0.00 0.00 56.10 54.67 1wa7 s TRP 44 Cb 0.00 -1.13 -0.08 0.00 -1.15 0.00 0.00 33.47 31.11 1wa7 s TRP 44 CO 0.00 -0.84 0.63 -1.58 0.02 0.00 0.00 176.95 175.18 1wa7 s TRP 45 N 1.68 3.54 -0.49 -1.98 0.51 0.17 -4.43 118.94 117.95 1wa7 s TRP 45 Ca 0.12 1.14 -0.20 0.00 -2.12 0.00 0.00 56.10 55.04 1wa7 s TRP 45 Cb -0.18 -2.44 0.04 0.00 -0.81 0.00 0.00 33.47 30.08 1wa7 s TRP 45 CO -0.24 0.32 0.64 0.21 -0.51 0.00 0.00 176.95 177.36 1wa7 s LYS 46 N -2.30 3.18 0.20 4.98 2.20 -1.24 0.30 119.74 127.05 1wa7 s LYS 46 Ca 0.44 -0.69 0.03 0.00 -0.36 0.00 0.00 55.97 55.38 1wa7 s LYS 46 Cb -0.14 -4.04 0.03 0.00 -1.51 0.00 0.00 37.83 32.16 1wa7 s LYS 46 CO 0.20 -1.16 0.21 0.00 -0.36 0.00 0.00 175.35 174.24 1wa7 n ALA 47 N 6.26 0.37 -3.42 3.13 0.00 -0.44 -1.82 120.51 124.58 1wa7 n ALA 47 Ca -0.05 -0.75 -0.27 0.00 0.00 0.00 0.00 53.44 52.37 1wa7 n ALA 47 Cb 0.46 0.26 -0.17 0.00 0.00 0.00 0.00 19.45 20.00 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 -2.86 2.16 0.02 0.00 2.36 0.53 -2.24 119.74 119.71 1wa7 s LYS 48 Ca 0.16 -0.57 -0.30 0.00 -2.55 0.00 0.00 55.97 52.71 1wa7 s LYS 48 Cb -0.01 -1.73 -0.05 0.00 -1.05 0.00 0.00 37.83 34.99 1wa7 s LYS 48 CO 0.10 0.06 1.22 0.45 1.55 0.00 0.00 175.35 178.73 1wa7 s SER 49 N 0.62 7.04 0.00 1.43 0.15 0.82 -2.36 113.70 121.41 1wa7 s SER 49 Ca -0.15 1.97 0.19 0.00 0.70 0.00 0.00 55.95 58.66 1wa7 s SER 49 Cb -0.16 -2.57 0.83 0.00 -1.71 0.00 0.00 66.02 62.41 1wa7 s SER 49 CO 0.04 -0.53 1.59 -0.11 1.20 0.00 0.00 173.24 175.43 1wa7 n LEU 50 N 4.46 0.00 0.06 3.45 7.94 -1.19 -1.55 117.00 130.16 1wa7 n LEU 50 Ca 0.10 0.44 -0.12 0.00 -1.11 0.00 0.00 56.01 55.33 1wa7 n LEU 50 Cb 0.46 -0.44 -0.05 0.00 0.53 0.00 0.00 43.42 43.92 1wa7 n LEU 50 CO 0.56 -0.16 0.66 0.25 -1.11 0.00 0.00 177.39 177.58 1wa7 h LEU 51 N 0.00 -0.93 -1.90 -1.96 5.85 -1.89 -3.40 115.31 111.08 1wa7 h LEU 51 Ca 0.00 0.12 -0.12 0.00 0.84 0.00 0.00 57.88 58.73 1wa7 h LEU 51 Cb 0.28 0.37 -0.12 0.00 0.37 0.00 0.00 40.66 41.57 1wa7 h LEU 51 CO 0.00 -0.37 -0.26 1.07 -0.34 0.00 0.00 178.44 178.53 1wa7 n THR 52 N -5.41 0.00 -1.50 1.05 5.66 -1.22 -5.00 114.28 107.86 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 0.32 0.45 0.00 0.00 -1.55 0.00 0.00 70.33 69.55 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 -3.02 1.09 5.02 -0.60 -5.05 118.16 115.60 1wa7 n LYS 53 Ca -0.25 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 55.64 1wa7 n LYS 53 Cb 0.66 -1.68 -0.05 0.00 -0.02 0.00 0.00 35.03 33.95 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 -2.83 4.45 -0.19 1.97 2.20 -1.02 -4.78 119.74 119.55 1wa7 s LYS 54 Ca 0.00 0.97 0.01 0.00 -0.36 0.00 0.00 55.97 56.59 1wa7 s LYS 54 Cb 0.00 -3.40 0.03 0.00 -1.51 0.00 0.00 37.83 32.96 1wa7 s LYS 54 CO 0.00 0.20 -0.14 -2.00 -0.36 0.00 0.00 175.35 173.05 1wa7 s GLU 55 N 0.30 2.39 0.26 4.03 2.56 -1.26 0.29 118.70 127.27 1wa7 s GLU 55 Ca 0.38 -0.85 -0.19 0.00 0.00 0.00 0.00 54.97 54.31 1wa7 s GLU 55 Cb -0.19 -2.46 0.02 0.00 2.00 0.00 0.00 34.13 33.50 1wa7 s GLU 55 CO 0.21 -0.34 0.64 0.20 -0.56 0.00 0.00 175.26 175.40 1wa7 s GLY 56 N 1.35 0.04 0.16 -1.50 0.00 -0.95 -4.64 107.32 101.77 1wa7 s GLY 56 Ca 0.01 -0.41 -0.30 0.00 0.00 0.00 0.00 44.72 44.02 1wa7 s GLY 56 CO -0.10 -0.23 1.21 -1.36 0.00 0.00 0.00 173.10 172.63 1wa7 s PHE 57 N -3.93 3.41 0.03 1.90 0.40 -1.22 -1.32 117.98 117.24 1wa7 s PHE 57 Ca 0.13 1.36 0.08 0.00 -0.60 0.00 0.00 56.93 57.91 1wa7 s PHE 57 Cb -0.04 -3.45 -0.03 0.00 0.51 0.00 0.00 43.02 40.01 1wa7 s PHE 57 CO 0.06 -1.32 -0.24 0.96 0.70 0.00 0.00 175.22 175.38 1wa7 s ILE 58 N 0.23 1.92 0.57 0.64 -4.36 0.86 -3.22 121.20 117.85 1wa7 s ILE 58 Ca 0.55 -1.24 -0.18 0.00 -0.26 0.00 0.00 60.65 59.52 1wa7 s ILE 58 Cb -0.32 -1.64 -0.05 0.00 1.25 0.00 0.00 42.46 41.70 1wa7 s ILE 58 CO 0.35 0.35 1.10 -2.16 0.24 0.00 0.00 174.94 174.81 1wa7 s PRO 59 N -1.07 3.29 0.00 0.37 0.04 -1.26 -0.66 135.00 135.71 1wa7 s PRO 59 Ca 0.10 1.45 0.12 0.00 0.04 0.00 0.00 61.00 62.70 1wa7 s PRO 59 Cb -0.09 -2.01 0.71 0.00 0.04 0.00 0.00 34.50 33.14 1wa7 s PRO 59 CO 0.01 -0.87 1.46 0.45 0.04 0.00 0.00 177.00 178.10 1wa7 n SER 60 N -1.63 0.06 -0.06 6.66 2.88 -1.01 -4.00 113.62 116.51 1wa7 n SER 60 Ca 0.10 -1.63 -0.14 0.00 -1.33 0.00 0.00 58.87 55.88 1wa7 n SER 60 Cb 0.52 -0.00 -0.05 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 -0.65 1.20 0.05 -3.46 5.15 -1.26 -4.76 115.26 111.53 1wa7 n ASN 61 Ca 0.09 0.20 -0.12 0.00 -0.60 0.00 0.00 54.58 54.15 1wa7 n ASN 61 Cb 0.05 -0.48 -0.07 0.00 -0.53 0.00 0.00 39.78 38.75 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 -0.55 -1.17 -4.22 1.20 0.05 -1.92 -3.42 116.97 106.94 1wa7 h TYR 62 Ca -0.29 0.04 -0.48 0.00 0.05 0.00 0.00 58.73 58.04 1wa7 h TYR 62 Cb 1.14 0.51 0.03 0.00 1.01 0.00 0.00 36.73 39.42 1wa7 h TYR 62 CO -0.10 -0.43 0.38 0.14 -1.05 0.00 0.00 178.16 177.10 1wa7 s VAL 63 N -5.04 4.45 0.15 -2.88 -7.23 -1.26 -0.91 120.40 107.69 1wa7 s VAL 63 Ca -0.12 1.12 0.05 0.00 -1.81 0.00 0.00 61.98 61.22 1wa7 s VAL 63 Cb 0.05 -3.69 -0.04 0.00 0.56 0.00 0.00 36.38 33.26 1wa7 s VAL 63 CO 0.45 -0.73 -0.11 0.00 -0.31 0.00 0.00 175.10 174.40 1wa7 s ALA 64 N -2.68 1.53 -0.85 1.32 0.00 0.21 -4.82 121.76 116.47 1wa7 s ALA 64 Ca 0.59 -1.50 -0.25 0.00 0.00 0.00 0.00 51.96 50.80 1wa7 s ALA 64 Cb -0.11 0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.04 1wa7 s ALA 64 CO 0.35 -0.06 1.59 0.15 0.00 0.00 0.00 175.76 177.79 1wa7 s LYS 65 N -3.64 3.09 0.03 0.00 1.02 -1.26 0.14 119.74 119.12 1wa7 s LYS 65 Ca 0.17 -0.41 0.01 0.00 0.02 0.00 0.00 55.97 55.76 1wa7 s LYS 65 Cb 0.01 -4.82 -0.02 0.00 -0.52 0.00 0.00 37.83 32.48 1wa7 s LYS 65 CO 0.02 -2.55 -0.04 -0.51 -0.92 0.00 0.00 175.35 171.35 1wa7 s LEU 66 N 7.03 2.28 -0.15 3.17 1.02 -1.26 -4.92 118.68 125.84 1wa7 s LEU 66 Ca 0.52 -0.58 -0.32 0.00 0.02 0.00 0.00 54.13 53.77 1wa7 s LEU 66 Cb -0.06 0.03 0.13 0.00 0.02 0.00 0.00 46.19 46.32 1wa7 s LEU 66 CO 0.04 -0.31 1.11 0.21 0.02 0.00 0.00 176.35 177.42 1wa7 s ASN 67 N -1.69 -0.22 0.00 2.29 2.47 -1.26 -4.17 114.94 112.36 1wa7 s ASN 67 Ca -0.11 0.06 0.27 0.00 0.42 0.00 0.00 52.86 53.50 1wa7 s ASN 67 Cb -0.08 0.22 0.76 0.00 -1.45 0.00 0.00 41.25 40.70 1wa7 s ASN 67 CO -0.02 -0.33 1.58 1.07 -3.72 0.00 0.00 177.10 175.69