#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wuo s LEU 4 N 0.00 4.39 0.54 1.04 1.02 -1.26 -5.03 118.68 119.38 1wuo s LEU 4 Ca 0.00 1.61 -0.20 0.00 0.02 0.00 0.00 54.13 55.55 1wuo s LEU 4 Cb 0.00 -3.68 -0.07 0.00 0.02 0.00 0.00 46.19 42.46 1wuo s LEU 4 CO 0.00 0.03 0.92 -2.65 0.02 0.00 0.00 176.35 174.67 1wuo n PRO 5 N 0.83 1.00 -2.09 1.29 -0.02 -1.26 -4.93 135.00 129.82 1wuo n PRO 5 Ca -0.01 0.38 -0.34 0.00 -2.02 0.00 0.00 63.50 61.50 1wuo n PRO 5 Cb 0.50 -2.07 0.01 0.00 -0.02 0.00 0.00 33.50 31.93 1wuo n PRO 5 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1wuo s ASP 6 N -1.07 5.61 0.38 2.55 -0.00 -1.26 -4.61 116.67 118.28 1wuo s ASP 6 Ca 0.71 2.01 -0.28 0.00 -0.00 0.00 0.00 52.55 54.99 1wuo s ASP 6 Cb -0.46 -2.56 -0.11 0.00 -0.00 0.00 0.00 42.92 39.79 1wuo s ASP 6 CO 0.51 -1.29 1.43 -0.11 -0.00 0.00 0.00 175.17 175.72 1wuo n LEU 7 N -1.78 4.56 -4.20 1.23 7.94 -1.26 -4.89 117.00 118.61 1wuo n LEU 7 Ca 0.10 1.20 -0.25 0.00 -1.11 0.00 0.00 56.01 55.96 1wuo n LEU 7 Cb 0.52 -1.59 -0.15 0.00 0.53 0.00 0.00 43.42 42.73 1wuo n LEU 7 CO 0.45 -0.04 -0.51 -0.54 -1.11 0.00 0.00 177.39 175.64 1wuo s LYS 8 N -2.11 1.39 -0.23 1.96 1.02 -0.52 -4.98 119.74 116.27 1wuo s LYS 8 Ca 0.55 -0.77 -0.01 0.00 0.02 0.00 0.00 55.97 55.76 1wuo s LYS 8 Cb -0.49 -1.41 0.07 0.00 -0.52 0.00 0.00 37.83 35.48 1wuo s LYS 8 CO 0.62 0.37 0.02 0.42 -0.92 0.00 0.00 175.35 175.87 1wuo s ILE 9 N -0.61 0.88 -0.08 2.17 1.01 -1.26 -0.33 121.20 122.99 1wuo s ILE 9 Ca 0.07 -0.90 0.03 0.00 0.00 0.00 0.00 60.65 59.85 1wuo s ILE 9 Cb -0.08 -1.37 0.01 0.00 0.01 0.00 0.00 42.46 41.03 1wuo s ILE 9 CO 0.00 -0.26 -0.17 -1.61 0.00 0.00 0.00 174.94 172.90 1wuo s GLU 10 N 1.68 2.21 0.19 2.79 2.02 -0.32 -4.95 118.70 122.32 1wuo s GLU 10 Ca -0.01 -0.60 -0.32 0.00 0.02 0.00 0.00 54.97 54.06 1wuo s GLU 10 Cb -0.18 -1.75 -0.11 0.00 0.10 0.00 0.00 34.13 32.19 1wuo s GLU 10 CO -0.10 0.10 1.69 0.21 0.02 0.00 0.00 175.26 177.18 1wuo s LYS 11 N 0.49 4.15 -0.22 1.61 2.20 -1.26 -0.65 119.74 126.07 1wuo s LYS 11 Ca -0.15 2.54 0.09 0.00 -0.36 0.00 0.00 55.97 58.08 1wuo s LYS 11 Cb -0.16 -3.15 -0.19 0.00 -1.51 0.00 0.00 37.83 32.81 1wuo s LYS 11 CO 0.06 -0.72 -0.09 -0.11 -0.36 0.00 0.00 175.35 174.13 1wuo n LEU 12 N 4.18 1.62 -3.86 5.43 7.94 0.11 -4.87 117.00 127.54 1wuo n LEU 12 Ca 0.16 -0.07 -0.04 0.00 -1.11 0.00 0.00 56.01 54.95 1wuo n LEU 12 Cb 0.36 -0.25 0.02 0.00 0.53 0.00 0.00 43.42 44.09 1wuo n LEU 12 CO 0.63 0.70 0.77 -0.62 -1.11 0.00 0.00 177.39 177.76 1wuo s ASP 13 N -5.86 -0.01 0.04 1.96 3.68 -0.74 -5.04 116.67 110.70 1wuo s ASP 13 Ca -0.22 -0.72 -0.35 0.00 2.13 0.00 0.00 52.55 53.39 1wuo s ASP 13 Cb 0.07 0.55 -0.13 0.00 -1.45 0.00 0.00 42.92 41.96 1wuo s ASP 13 CO 0.65 -1.09 1.68 1.21 0.13 0.00 0.00 175.17 177.75 1wuo n GLU 14 N -0.66 2.02 -1.42 4.34 2.13 -1.26 -1.71 120.64 124.07 1wuo n GLU 14 Ca -0.04 0.73 -0.15 0.00 0.66 0.00 0.00 57.16 58.37 1wuo n GLU 14 Cb 0.60 -2.51 -0.06 0.00 0.27 0.00 0.00 31.44 29.73 1wuo n GLU 14 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1wuo n GLY 15 N 3.75 1.39 2.78 8.31 0.00 -1.26 -4.98 105.19 115.17 1wuo n GLY 15 Ca 0.20 -0.01 -0.15 0.00 0.00 0.00 0.00 46.02 46.05 1wuo n GLY 15 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wuo s VAL 16 N -2.24 -0.07 0.15 1.61 1.01 -0.69 -1.21 120.40 118.95 1wuo s VAL 16 Ca 0.00 0.24 0.09 0.00 0.00 0.00 0.00 61.98 62.31 1wuo s VAL 16 Cb 0.00 -0.11 -0.04 0.00 0.00 0.00 0.00 36.38 36.23 1wuo s VAL 16 CO 0.00 0.10 -0.20 -0.31 0.00 0.00 0.00 175.10 174.69 1wuo s TYR 17 N 1.25 1.91 -0.20 5.22 1.51 -0.01 0.06 117.35 127.09 1wuo s TYR 17 Ca -0.07 -0.43 -0.03 0.00 -1.01 0.00 0.00 57.07 55.53 1wuo s TYR 17 Cb -0.13 -0.99 -0.01 0.00 -0.11 0.00 0.00 41.96 40.73 1wuo s TYR 17 CO -0.03 0.31 -0.05 0.08 -1.11 0.00 0.00 175.55 174.75 1wuo s VAL 18 N -1.64 3.37 -0.12 0.71 1.01 0.18 -0.77 120.40 123.14 1wuo s VAL 18 Ca 0.13 -0.50 -0.06 0.00 0.00 0.00 0.00 61.98 61.55 1wuo s VAL 18 Cb -0.08 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.75 1wuo s VAL 18 CO 0.06 0.44 0.12 -1.38 0.00 0.00 0.00 175.10 174.34 1wuo s HIS 19 N 1.23 3.52 -0.09 5.22 -3.43 -0.69 -1.17 115.29 119.88 1wuo s HIS 19 Ca 0.03 0.46 -0.00 0.00 -0.80 0.00 0.00 55.06 54.74 1wuo s HIS 19 Cb -0.14 -1.92 0.02 0.00 -1.43 0.00 0.00 32.58 29.11 1wuo s HIS 19 CO -0.02 0.67 -0.05 0.99 -2.00 0.00 0.00 174.74 174.33 1wuo s THR 20 N -0.94 0.79 0.44 -5.38 2.01 0.55 -1.14 115.64 111.98 1wuo s THR 20 Ca 0.14 -0.16 0.05 0.00 0.31 0.00 0.00 61.69 62.03 1wuo s THR 20 Cb -0.12 -0.85 -0.05 0.00 0.01 0.00 0.00 72.50 71.49 1wuo s THR 20 CO 0.03 0.32 0.01 -0.94 -0.69 0.00 0.00 174.62 173.36 1wuo s SER 21 N 1.68 3.89 0.01 3.53 1.04 -0.69 -1.44 113.70 121.72 1wuo s SER 21 Ca 0.03 -1.48 0.01 0.00 0.48 0.00 0.00 55.95 54.98 1wuo s SER 21 Cb -0.13 -0.02 -0.01 0.00 0.10 0.00 0.00 66.02 65.96 1wuo s SER 21 CO -0.06 -0.62 -0.03 -0.36 0.98 0.00 0.00 173.24 173.15 1wuo s PHE 22 N -2.81 0.31 0.14 5.02 0.40 -1.26 0.10 117.98 119.87 1wuo s PHE 22 Ca 0.24 -0.21 0.06 0.00 -0.60 0.00 0.00 56.93 56.42 1wuo s PHE 22 Cb 0.07 -0.20 -0.04 0.00 0.51 0.00 0.00 43.02 43.36 1wuo s PHE 22 CO 0.12 -0.05 -0.14 -1.83 0.70 0.00 0.00 175.22 174.02 1wuo s GLU 23 N -0.58 1.09 0.07 0.44 -1.05 -0.84 -4.93 118.70 112.91 1wuo s GLU 23 Ca -0.04 -1.32 -0.19 0.00 -0.15 0.00 0.00 54.97 53.27 1wuo s GLU 23 Cb -0.04 -0.96 -0.07 0.00 -0.44 0.00 0.00 34.13 32.62 1wuo s GLU 23 CO -0.00 0.18 0.56 -2.00 0.95 0.00 0.00 175.26 174.95 1wuo s GLU 24 N -2.89 4.17 0.08 -4.83 2.56 -1.26 -1.20 118.70 115.33 1wuo s GLU 24 Ca 0.12 0.71 -0.01 0.00 0.00 0.00 0.00 54.97 55.79 1wuo s GLU 24 Cb -0.04 -3.22 -0.04 0.00 2.00 0.00 0.00 34.13 32.83 1wuo s GLU 24 CO 0.04 0.63 -0.01 0.14 -0.56 0.00 0.00 175.26 175.50 1wuo s VAL 25 N -1.13 0.27 -0.44 3.70 -7.23 0.25 -4.96 120.40 110.85 1wuo s VAL 25 Ca 0.29 -1.86 0.02 0.00 -1.81 0.00 0.00 61.98 58.62 1wuo s VAL 25 Cb -0.19 -1.69 0.50 0.00 0.56 0.00 0.00 36.38 35.56 1wuo s VAL 25 CO 0.19 -0.84 1.87 0.59 -0.31 0.00 0.00 175.10 176.59 1wuo n ASN 26 N 0.03 4.95 0.00 4.85 4.13 -1.26 -3.37 115.26 124.59 1wuo n ASN 26 Ca -0.11 -3.43 0.00 0.00 1.68 0.00 0.00 54.58 52.71 1wuo n ASN 26 Cb 0.62 -0.86 0.00 0.00 -1.54 0.00 0.00 39.78 37.99 1wuo n ASN 26 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1wuo n GLY 27 N -0.76 0.81 0.70 7.41 0.00 -1.26 -4.81 105.19 107.28 1wuo n GLY 27 Ca 0.51 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.49 1wuo n GLY 27 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1wuo n TRP 28 N 0.00 0.00 0.00 1.61 -0.00 -1.26 -4.90 117.44 112.89 1wuo n TRP 28 Ca 0.00 -0.17 0.00 0.00 -0.00 0.00 0.00 57.50 57.33 1wuo n TRP 28 Cb 0.00 -0.14 0.00 0.00 -0.00 0.00 0.00 31.31 31.17 1wuo n TRP 28 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1wuo n GLY 29 N 0.29 0.58 3.76 5.87 0.00 -1.22 -4.36 105.19 110.11 1wuo n GLY 29 Ca 0.00 0.61 -0.37 0.00 0.00 0.00 0.00 46.02 46.26 1wuo n GLY 29 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wuo s VAL 30 N 0.00 5.22 -0.15 1.61 1.01 -1.26 0.84 120.40 127.66 1wuo s VAL 30 Ca 0.00 0.72 0.01 0.00 0.00 0.00 0.00 61.98 62.70 1wuo s VAL 30 Cb 0.00 -3.69 0.02 0.00 0.00 0.00 0.00 36.38 32.71 1wuo s VAL 30 CO 0.00 0.43 -0.16 -0.69 0.00 0.00 0.00 175.10 174.68 1wuo s VAL 31 N 0.06 1.69 0.53 2.92 1.01 -0.34 -4.97 120.40 121.31 1wuo s VAL 31 Ca 0.21 -0.71 -0.20 0.00 0.00 0.00 0.00 61.98 61.28 1wuo s VAL 31 Cb -0.14 -1.56 -0.06 0.00 0.00 0.00 0.00 36.38 34.62 1wuo s VAL 31 CO 0.08 0.48 1.11 -2.16 0.00 0.00 0.00 175.10 174.61 1wuo s PRO 32 N 1.35 3.43 -0.20 2.72 0.04 -1.26 -1.98 135.00 139.10 1wuo s PRO 32 Ca 0.03 1.56 -0.01 0.00 0.04 0.00 0.00 61.00 62.62 1wuo s PRO 32 Cb -0.13 -2.02 0.05 0.00 0.04 0.00 0.00 34.50 32.44 1wuo s PRO 32 CO -0.10 -0.77 -0.02 0.21 0.04 0.00 0.00 177.00 176.36 1wuo s LYS 33 N -3.29 1.18 -0.01 4.56 2.47 0.11 -4.44 119.74 120.32 1wuo s LYS 33 Ca 0.72 -0.62 -0.18 0.00 -1.56 0.00 0.00 55.97 54.32 1wuo s LYS 33 Cb -0.22 -2.22 -0.05 0.00 -1.46 0.00 0.00 37.83 33.88 1wuo s LYS 33 CO 0.26 -0.56 0.51 -1.01 0.16 0.00 0.00 175.35 174.70 1wuo s HIS 34 N 1.65 3.69 0.28 4.03 3.76 0.62 -1.71 115.29 127.61 1wuo s HIS 34 Ca -0.02 1.09 0.06 0.00 -0.15 0.00 0.00 55.06 56.04 1wuo s HIS 34 Cb -0.17 -2.48 -0.02 0.00 1.11 0.00 0.00 32.58 31.02 1wuo s HIS 34 CO -0.07 0.45 0.21 0.41 -0.85 0.00 0.00 174.74 174.89 1wuo n GLY 35 N 2.29 3.15 3.47 -2.22 0.00 -0.29 -4.49 105.19 107.10 1wuo n GLY 35 Ca -0.10 -1.89 -0.23 0.00 0.00 0.00 0.00 46.02 43.81 1wuo n GLY 35 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wuo s LEU 36 N 0.00 2.07 -0.06 0.99 1.43 -0.02 -1.70 118.68 121.40 1wuo s LEU 36 Ca 0.30 -1.49 -0.02 0.00 -1.03 0.00 0.00 54.13 51.89 1wuo s LEU 36 Cb 0.01 -0.27 0.04 0.00 0.03 0.00 0.00 46.19 46.01 1wuo s LEU 36 CO 0.21 -0.74 0.10 -0.69 0.23 0.00 0.00 176.35 175.47 1wuo s VAL 37 N -3.29 -0.14 -0.14 -1.59 1.01 0.05 -0.21 120.40 116.09 1wuo s VAL 37 Ca 0.31 0.33 0.02 0.00 0.00 0.00 0.00 61.98 62.64 1wuo s VAL 37 Cb 0.06 -0.20 0.01 0.00 0.00 0.00 0.00 36.38 36.25 1wuo s VAL 37 CO 0.15 0.14 -0.22 -0.69 0.00 0.00 0.00 175.10 174.47 1wuo s VAL 38 N 1.84 2.07 -0.15 2.92 1.01 -0.43 -0.83 120.40 126.84 1wuo s VAL 38 Ca -0.01 -0.98 -0.16 0.00 0.00 0.00 0.00 61.98 60.83 1wuo s VAL 38 Cb -0.12 -1.82 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 1wuo s VAL 38 CO -0.04 0.55 0.40 -0.76 0.00 0.00 0.00 175.10 175.25 1wuo s LEU 39 N 0.81 4.24 -0.18 3.92 1.43 -0.35 -0.53 118.68 128.03 1wuo s LEU 39 Ca -0.07 0.66 -0.14 0.00 -1.03 0.00 0.00 54.13 53.55 1wuo s LEU 39 Cb -0.16 -2.56 -0.07 0.00 0.03 0.00 0.00 46.19 43.43 1wuo s LEU 39 CO -0.02 0.02 -0.19 0.52 0.23 0.00 0.00 176.35 176.91 1wuo n VAL 40 N 3.76 1.47 0.07 -1.59 0.31 -0.67 -4.86 118.33 116.82 1wuo n VAL 40 Ca -0.09 0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1wuo n VAL 40 Cb 0.52 -2.27 0.00 0.00 -0.91 0.00 0.00 33.84 31.18 1wuo n VAL 40 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1wuo n ASN 41 N -4.50 0.24 0.00 4.52 3.02 -1.26 -4.93 115.26 112.35 1wuo n ASN 41 Ca -0.18 0.23 0.00 0.00 -0.03 0.00 0.00 54.58 54.60 1wuo n ASN 41 Cb 0.47 0.07 0.00 0.00 -0.61 0.00 0.00 39.78 39.71 1wuo n ASN 41 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wuo n ALA 42 N -3.16 0.23 -2.70 5.41 0.00 -1.26 -5.09 120.51 113.94 1wuo n ALA 42 Ca 0.00 -0.10 -0.30 0.00 0.00 0.00 0.00 53.44 53.03 1wuo n ALA 42 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 1wuo n ALA 42 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1wuo s GLU 43 N 0.00 2.62 0.03 0.00 2.02 -1.26 -2.87 118.70 119.24 1wuo s GLU 43 Ca 0.00 -0.79 0.09 0.00 0.02 0.00 0.00 54.97 54.29 1wuo s GLU 43 Cb 0.00 -2.58 -0.03 0.00 0.10 0.00 0.00 34.13 31.62 1wuo s GLU 43 CO 0.00 0.55 -0.26 0.00 0.02 0.00 0.00 175.26 175.57 1wuo s ALA 44 N -1.30 2.21 -0.13 5.21 0.00 -0.34 -1.68 121.76 125.74 1wuo s ALA 44 Ca 0.26 -1.22 0.02 0.00 0.00 0.00 0.00 51.96 51.02 1wuo s ALA 44 Cb -0.12 -0.49 0.00 0.00 0.00 0.00 0.00 23.12 22.51 1wuo s ALA 44 CO 0.18 0.53 -0.20 0.71 0.00 0.00 0.00 175.76 176.98 1wuo s TYR 45 N -0.75 2.67 0.15 0.00 1.51 0.31 -0.10 117.35 121.14 1wuo s TYR 45 Ca 0.11 -1.08 -0.24 0.00 -1.01 0.00 0.00 57.07 54.85 1wuo s TYR 45 Cb -0.10 -1.80 -0.08 0.00 -0.11 0.00 0.00 41.96 39.88 1wuo s TYR 45 CO 0.01 -0.46 0.74 -0.51 -1.11 0.00 0.00 175.55 174.22 1wuo s LEU 46 N 0.58 4.57 -0.32 -1.29 1.43 0.31 -1.31 118.68 122.64 1wuo s LEU 46 Ca -0.12 1.56 0.02 0.00 -1.03 0.00 0.00 54.13 54.56 1wuo s LEU 46 Cb -0.16 -3.24 0.08 0.00 0.03 0.00 0.00 46.19 42.90 1wuo s LEU 46 CO 0.03 0.21 0.02 -0.63 0.23 0.00 0.00 176.35 176.21 1wuo s ILE 47 N -1.17 2.51 0.23 -0.59 -1.09 0.71 -0.97 121.20 120.84 1wuo s ILE 47 Ca 0.35 -1.94 0.00 0.00 -2.23 0.00 0.00 60.65 56.83 1wuo s ILE 47 Cb -0.22 -2.66 0.00 0.00 -1.58 0.00 0.00 42.46 38.00 1wuo s ILE 47 CO 0.25 -0.36 0.00 0.47 -1.23 0.00 0.00 174.94 174.06 1wuo n ASP 48 N 4.42 -3.23 -4.64 3.58 9.92 0.66 -0.84 116.55 126.41 1wuo n ASP 48 Ca -0.05 0.70 -0.23 0.00 -0.53 0.00 0.00 54.79 54.68 1wuo n ASP 48 Cb 0.42 -1.43 -0.07 0.00 -0.64 0.00 0.00 41.12 39.40 1wuo n ASP 48 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1wuo s THR 49 N -4.40 3.35 1.19 -3.53 -4.23 -0.87 -4.64 115.64 102.51 1wuo s THR 49 Ca 0.00 -1.93 -0.17 0.00 -1.18 0.00 0.00 61.69 58.42 1wuo s THR 49 Cb 0.00 -2.83 0.28 0.00 1.34 0.00 0.00 72.50 71.29 1wuo s THR 49 CO 0.00 -0.36 1.06 -2.84 -0.54 0.00 0.00 174.62 171.94 1wuo s PRO 50 N -3.68 -1.09 0.27 3.99 0.02 -1.26 -4.13 135.00 129.12 1wuo s PRO 50 Ca 0.32 0.27 0.05 0.00 0.02 0.00 0.00 61.00 61.66 1wuo s PRO 50 Cb -0.06 -1.58 0.38 0.00 0.02 0.00 0.00 34.50 33.26 1wuo s PRO 50 CO 0.20 -3.69 1.66 0.74 -0.33 0.00 0.00 177.00 175.57 1wuo h PHE 51 N -2.58 0.35 -2.69 6.54 -1.00 -1.82 -2.99 116.94 112.75 1wuo h PHE 51 Ca -0.51 -0.10 -0.62 0.00 2.81 0.00 0.00 57.97 59.55 1wuo h PHE 51 Cb 1.32 -0.07 -0.15 0.00 3.61 0.00 0.00 35.95 40.66 1wuo h PHE 51 CO -1.25 0.69 -0.75 0.95 -1.61 0.00 0.00 178.31 176.34 1wuo s THR 52 N -4.09 2.80 0.27 -1.55 -4.23 -1.26 -4.39 115.64 103.19 1wuo s THR 52 Ca -0.05 -2.02 -0.01 0.00 -1.18 0.00 0.00 61.69 58.43 1wuo s THR 52 Cb 0.13 -2.42 0.28 0.00 1.34 0.00 0.00 72.50 71.83 1wuo s THR 52 CO 0.78 -0.24 1.88 0.00 -0.54 0.00 0.00 174.62 176.50 1wuo h ALA 53 N 2.63 1.44 -0.15 3.99 0.00 -1.89 -0.68 119.26 124.61 1wuo h ALA 53 Ca -0.44 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1wuo h ALA 53 Cb 1.23 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1wuo h ALA 53 CO 0.55 0.39 0.04 0.87 0.00 0.00 0.00 179.25 181.09 1wuo h LYS 54 N 1.12 0.24 -0.58 0.00 1.57 -1.96 0.16 116.57 117.12 1wuo h LYS 54 Ca 0.44 -0.06 -0.11 0.00 -1.87 0.00 0.00 60.65 59.06 1wuo h LYS 54 Cb 0.24 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 1wuo h LYS 54 CO -0.19 0.39 -0.05 -0.44 -0.57 0.00 0.00 179.45 178.59 1wuo h ASP 55 N 0.04 1.05 -0.77 0.86 3.45 -1.94 0.33 116.42 119.43 1wuo h ASP 55 Ca 0.05 -0.32 0.06 0.00 0.43 0.00 0.00 57.03 57.25 1wuo h ASP 55 Cb 0.26 -0.28 -0.06 0.00 -0.56 0.00 0.00 39.33 38.68 1wuo h ASP 55 CO 0.00 1.12 0.46 0.74 -1.57 0.00 0.00 179.24 179.99 1wuo h THR 56 N 0.95 1.01 -0.49 0.35 2.02 -0.94 0.13 112.91 115.94 1wuo h THR 56 Ca 0.16 -0.29 -0.02 0.00 0.77 0.00 0.00 66.41 67.03 1wuo h THR 56 Cb 0.62 0.09 -0.02 0.00 -1.74 0.00 0.00 68.15 67.10 1wuo h THR 56 CO 0.04 0.15 0.23 -0.08 0.37 0.00 0.00 175.52 176.23 1wuo h GLU 57 N 0.84 0.71 -0.72 6.66 4.57 -0.50 0.79 114.58 126.94 1wuo h GLU 57 Ca 0.34 -0.11 -0.02 0.00 -1.18 0.00 0.00 59.36 58.39 1wuo h GLU 57 Cb 0.18 -0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 28.61 1wuo h GLU 57 CO -0.18 0.60 0.36 0.87 -1.18 0.00 0.00 179.01 179.49 1wuo h LYS 58 N 0.65 1.02 0.27 1.92 1.57 0.10 0.45 116.57 122.55 1wuo h LYS 58 Ca 0.17 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1wuo h LYS 58 Cb 0.13 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.25 1wuo h LYS 58 CO -0.02 0.79 -0.13 1.25 -0.57 0.00 0.00 179.45 180.77 1wuo h LEU 59 N 1.00 -0.30 -0.70 2.94 5.85 -0.56 -1.09 115.31 122.45 1wuo h LEU 59 Ca 0.25 -0.10 0.02 0.00 0.84 0.00 0.00 57.88 58.89 1wuo h LEU 59 Cb 0.10 0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.17 1wuo h LEU 59 CO -0.03 -0.09 0.45 0.58 -0.34 0.00 0.00 178.44 179.01 1wuo h VAL 60 N -0.51 1.14 0.00 1.05 2.07 -0.67 -2.41 116.25 116.92 1wuo h VAL 60 Ca -0.04 -0.31 -0.10 0.00 0.82 0.00 0.00 66.70 67.07 1wuo h VAL 60 Cb 0.38 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 1wuo h VAL 60 CO 0.06 0.16 -0.49 0.71 0.02 0.00 0.00 177.57 178.04 1wuo h THR 61 N 0.90 1.33 -0.18 2.57 1.35 -0.75 0.11 112.91 118.24 1wuo h THR 61 Ca 0.27 -1.69 0.00 0.00 -0.55 0.00 0.00 66.41 64.44 1wuo h THR 61 Cb -0.05 1.91 -0.01 0.00 -1.73 0.00 0.00 68.15 68.28 1wuo h THR 61 CO -0.08 0.48 0.12 -0.25 -0.25 0.00 0.00 175.52 175.53 1wuo h TRP 62 N 0.00 0.22 -0.08 4.73 7.01 -0.69 -0.28 115.95 126.86 1wuo h TRP 62 Ca -0.00 0.01 -0.23 0.00 2.11 0.00 0.00 58.89 60.77 1wuo h TRP 62 Cb 0.88 -0.07 0.01 0.00 -2.10 0.00 0.00 29.16 27.88 1wuo h TRP 62 CO 0.00 0.14 -0.83 0.74 -2.79 0.00 0.00 178.44 175.70 1wuo h PHE 63 N 0.24 1.00 -0.62 2.65 -1.00 -1.34 -3.20 116.94 114.67 1wuo h PHE 63 Ca 0.07 -0.48 0.06 0.00 2.81 0.00 0.00 57.97 60.42 1wuo h PHE 63 Cb -0.03 -0.14 -0.05 0.00 3.61 0.00 0.00 35.95 39.34 1wuo h PHE 63 CO -0.07 1.31 0.33 0.28 -1.61 0.00 0.00 178.31 178.56 1wuo h VAL 64 N 0.40 0.96 0.00 -0.55 2.07 -0.69 0.71 116.25 119.15 1wuo h VAL 64 Ca -0.08 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1wuo h VAL 64 Cb 1.48 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.52 1wuo h VAL 64 CO 0.17 0.11 0.00 -0.62 0.02 0.00 0.00 177.57 177.25 1wuo n GLU 65 N -4.82 0.14 -0.66 1.57 1.02 -0.14 -2.34 120.64 115.41 1wuo n GLU 65 Ca 0.07 0.19 0.02 0.00 -0.02 0.00 0.00 57.16 57.43 1wuo n GLU 65 Cb 0.17 -1.50 0.20 0.00 -0.02 0.00 0.00 31.44 30.29 1wuo n GLU 65 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1wuo n ARG 66 N -1.29 1.69 0.00 3.49 1.74 0.16 -4.96 116.66 117.50 1wuo n ARG 66 Ca 0.05 -3.23 0.00 0.00 -0.77 0.00 0.00 57.85 53.90 1wuo n ARG 66 Cb 0.08 -1.69 0.00 0.00 -1.02 0.00 0.00 32.46 29.83 1wuo n ARG 66 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wuo n GLY 67 N -1.13 2.58 3.80 -0.13 0.00 -0.99 -5.04 105.19 104.28 1wuo n GLY 67 Ca 0.24 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.89 1wuo n GLY 67 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1wuo s TYR 68 N -2.63 3.76 -0.22 1.61 2.02 -0.70 -4.94 117.35 116.25 1wuo s TYR 68 Ca 0.00 1.51 -0.07 0.00 -0.37 0.00 0.00 57.07 58.14 1wuo s TYR 68 Cb 0.00 -2.70 -0.03 0.00 -0.40 0.00 0.00 41.96 38.83 1wuo s TYR 68 CO 0.00 0.40 0.06 0.21 -1.57 0.00 0.00 175.55 174.65 1wuo s LYS 69 N -1.63 3.77 -0.24 -0.62 2.20 -1.14 -3.49 119.74 118.59 1wuo s LYS 69 Ca 0.40 -0.43 -0.29 0.00 -0.36 0.00 0.00 55.97 55.29 1wuo s LYS 69 Cb -0.19 -3.25 -0.03 0.00 -1.51 0.00 0.00 37.83 32.85 1wuo s LYS 69 CO 0.23 0.01 1.70 0.42 -0.36 0.00 0.00 175.35 177.35 1wuo s ILE 70 N 1.08 3.58 -0.24 5.43 -1.09 -1.26 -1.19 121.20 127.51 1wuo s ILE 70 Ca 0.04 0.64 0.22 0.00 -2.23 0.00 0.00 60.65 59.31 1wuo s ILE 70 Cb -0.14 -3.63 0.01 0.00 -1.58 0.00 0.00 42.46 37.12 1wuo s ILE 70 CO 0.03 -0.31 1.07 0.50 -1.23 0.00 0.00 174.94 175.01 1wuo h LYS 71 N 11.48 0.00 0.00 2.79 1.63 -0.86 -3.47 116.57 128.14 1wuo h LYS 71 Ca -0.35 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.45 1wuo h LYS 71 Cb 1.16 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.79 1wuo h LYS 71 CO 1.01 0.05 0.00 0.41 -3.45 0.00 0.00 179.45 177.47 1wuo n GLY 72 N 1.20 -0.56 3.00 5.01 0.00 -1.23 -4.43 105.19 108.18 1wuo n GLY 72 Ca -0.01 -1.22 -0.10 0.00 0.00 0.00 0.00 46.02 44.69 1wuo n GLY 72 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wuo s SER 73 N 0.00 0.35 -0.07 1.61 1.04 -0.62 -0.53 113.70 115.47 1wuo s SER 73 Ca 0.00 -0.52 0.02 0.00 0.48 0.00 0.00 55.95 55.92 1wuo s SER 73 Cb 0.00 0.09 0.02 0.00 0.10 0.00 0.00 66.02 66.23 1wuo s SER 73 CO 0.00 -0.29 -0.11 -0.51 0.98 0.00 0.00 173.24 173.30 1wuo s ILE 74 N -1.52 1.12 -0.20 -1.02 1.10 -0.14 -0.35 121.20 120.19 1wuo s ILE 74 Ca -0.14 -0.45 -0.10 0.00 -0.51 0.00 0.00 60.65 59.45 1wuo s ILE 74 Cb -0.09 -1.04 -0.05 0.00 0.15 0.00 0.00 42.46 41.43 1wuo s ILE 74 CO -0.01 0.36 0.13 -0.44 -2.11 0.00 0.00 174.94 172.87 1wuo s SER 75 N 0.85 6.21 0.42 4.50 0.01 -0.87 -0.25 113.70 124.58 1wuo s SER 75 Ca -0.11 0.23 0.29 0.00 1.31 0.00 0.00 55.95 57.67 1wuo s SER 75 Cb -0.15 -2.09 1.15 0.00 0.21 0.00 0.00 66.02 65.14 1wuo s SER 75 CO 0.01 0.18 1.85 0.77 0.41 0.00 0.00 173.24 176.47 1wuo h SER 76 N 6.66 0.00 -4.97 2.44 4.64 -1.86 -3.42 113.55 117.04 1wuo h SER 76 Ca -0.41 0.00 0.19 0.00 -0.47 0.00 0.00 61.79 61.10 1wuo h SER 76 Cb 1.15 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 63.11 1wuo h SER 76 CO 0.76 0.00 0.59 -1.38 -0.87 0.00 0.00 176.83 175.93 1wuo s HIS 77 N -3.49 -0.20 0.22 4.77 -3.43 -1.26 -0.63 115.29 111.28 1wuo s HIS 77 Ca 0.03 0.03 0.36 0.00 -0.80 0.00 0.00 55.06 54.68 1wuo s HIS 77 Cb 0.09 0.57 1.61 0.00 -1.43 0.00 0.00 32.58 33.41 1wuo s HIS 77 CO 0.49 -0.54 2.07 0.27 -2.00 0.00 0.00 174.74 175.03 1wuo h PHE 78 N 2.00 0.00 -3.63 0.38 -0.00 -1.90 -3.40 116.94 110.39 1wuo h PHE 78 Ca -0.22 0.00 -0.57 0.00 -0.00 0.00 0.00 57.97 57.18 1wuo h PHE 78 Cb 1.22 0.00 0.15 0.00 -0.00 0.00 0.00 35.95 37.32 1wuo h PHE 78 CO 0.31 0.00 0.29 0.72 -0.00 0.00 0.00 178.31 179.63 1wuo n HIS 79 N -3.08 1.37 -0.32 6.09 8.25 -1.26 -4.50 115.22 121.77 1wuo n HIS 79 Ca -0.00 0.46 0.22 0.00 -0.26 0.00 0.00 57.72 58.14 1wuo n HIS 79 Cb 0.25 -2.23 0.44 0.00 1.12 0.00 0.00 29.99 29.58 1wuo n HIS 79 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 1wuo h SER 80 N 0.97 0.24 -0.12 0.41 0.02 -1.91 0.23 113.55 113.39 1wuo h SER 80 Ca -0.49 0.22 0.04 0.00 -0.84 0.00 0.00 61.79 60.72 1wuo h SER 80 Cb 1.34 0.24 -0.00 0.00 0.14 0.00 0.00 62.40 64.11 1wuo h SER 80 CO 0.54 -0.24 0.45 0.00 -1.14 0.00 0.00 176.83 176.44 1wuo h ALA 81 N 1.89 1.62 0.00 3.77 0.00 -1.88 0.15 119.26 124.80 1wuo h ALA 81 Ca 0.71 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.61 1wuo h ALA 81 Cb 1.65 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.45 1wuo h ALA 81 CO -0.70 -0.51 -0.95 0.43 0.00 0.00 0.00 179.25 177.52 1wuo n SER 82 N -3.04 4.77 0.00 0.00 7.64 0.65 -4.53 113.62 119.12 1wuo n SER 82 Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.89 1wuo n SER 82 Cb 0.53 0.80 0.00 0.00 -1.01 0.00 0.00 64.21 64.53 1wuo n SER 82 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1wuo n THR 83 N -1.59 0.87 -0.19 0.44 -2.24 -0.30 -2.05 114.28 109.21 1wuo n THR 83 Ca 0.00 -0.93 0.17 0.00 -2.27 0.00 0.00 64.05 61.02 1wuo n THR 83 Cb 0.15 0.57 0.52 0.00 -2.10 0.00 0.00 70.33 69.46 1wuo n THR 83 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1wuo h GLY 84 N 0.00 0.74 -0.01 3.38 0.00 -0.76 -2.47 103.07 103.95 1wuo h GLY 84 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.16 1wuo h GLY 84 CO 0.00 0.03 -0.16 0.61 0.00 0.00 0.00 176.54 177.02 1wuo n GLY 85 N -1.53 -0.39 0.17 4.60 0.00 -1.13 -4.18 105.19 102.73 1wuo n GLY 85 Ca 0.16 -0.42 -0.07 0.00 0.00 0.00 0.00 46.02 45.69 1wuo n GLY 85 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1wuo h ILE 86 N 1.62 1.02 -0.23 -0.61 2.04 -1.79 0.40 117.51 119.96 1wuo h ILE 86 Ca 0.00 -0.15 0.05 0.00 1.00 0.00 0.00 64.86 65.76 1wuo h ILE 86 Cb 0.51 0.54 -0.05 0.00 -0.74 0.00 0.00 36.82 37.08 1wuo h ILE 86 CO 0.00 0.08 -0.07 -0.33 0.00 0.00 0.00 178.15 177.83 1wuo h GLU 87 N 0.44 -0.02 -0.43 2.37 5.08 -1.80 0.38 114.58 120.60 1wuo h GLU 87 Ca 0.16 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.51 1wuo h GLU 87 Cb 0.03 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 1wuo h GLU 87 CO -0.08 -0.01 0.23 2.35 -1.00 0.00 0.00 179.01 180.49 1wuo h TRP 88 N -0.02 0.60 0.31 4.33 7.01 -1.64 -0.62 115.95 125.92 1wuo h TRP 88 Ca 0.11 -0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.09 1wuo h TRP 88 Cb 0.19 -0.19 -0.02 0.00 -2.10 0.00 0.00 29.16 27.04 1wuo h TRP 88 CO -0.25 0.47 -0.26 -0.07 -2.79 0.00 0.00 178.44 175.54 1wuo h LEU 89 N 0.56 -0.69 -0.81 0.65 3.38 -0.49 -1.55 115.31 116.36 1wuo h LEU 89 Ca 0.15 0.06 0.19 0.00 0.09 0.00 0.00 57.88 58.37 1wuo h LEU 89 Cb 0.08 0.23 -0.12 0.00 0.09 0.00 0.00 40.66 40.93 1wuo h LEU 89 CO -0.02 -0.39 0.24 0.78 0.09 0.00 0.00 178.44 179.13 1wuo h ASN 90 N -0.59 0.07 0.75 -0.43 -0.26 -0.70 0.54 115.58 114.95 1wuo h ASN 90 Ca -0.02 0.16 -0.01 0.00 -0.56 0.00 0.00 56.30 55.87 1wuo h ASN 90 Cb 0.52 0.20 -0.00 0.00 -1.06 0.00 0.00 38.32 37.99 1wuo h ASN 90 CO -0.03 -0.06 -0.04 0.77 -1.06 0.00 0.00 177.43 177.02 1wuo h SER 91 N 0.28 0.00 -0.62 5.81 4.64 -0.19 -1.10 113.55 122.38 1wuo h SER 91 Ca 0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.80 1wuo h SER 91 Cb 0.88 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 1wuo h SER 91 CO -0.55 0.04 0.00 0.54 -0.87 0.00 0.00 176.83 175.98 1wuo n ARG 92 N -3.19 3.65 -2.87 4.77 3.00 0.18 -4.93 116.66 117.27 1wuo n ARG 92 Ca -0.00 -2.75 -0.22 0.00 -0.01 0.00 0.00 57.85 54.87 1wuo n ARG 92 Cb 0.27 -1.88 0.02 0.00 0.00 0.00 0.00 32.46 30.87 1wuo n ARG 92 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 1wuo n SER 93 N 1.07 -5.93 -4.44 0.55 7.64 -0.42 -4.96 113.62 107.14 1wuo n SER 93 Ca 0.25 -0.22 -0.40 0.00 1.01 0.00 0.00 58.87 59.52 1wuo n SER 93 Cb 0.87 -4.83 -0.11 0.00 -1.01 0.00 0.00 64.21 59.12 1wuo n SER 93 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1wuo s ILE 94 N -3.12 4.74 0.03 0.44 1.01 -0.82 -5.02 121.20 118.44 1wuo s ILE 94 Ca 0.23 -0.51 -0.37 0.00 0.00 0.00 0.00 60.65 59.99 1wuo s ILE 94 Cb -0.10 -3.49 -0.17 0.00 0.01 0.00 0.00 42.46 38.71 1wuo s ILE 94 CO 0.28 -0.04 1.40 -2.65 0.00 0.00 0.00 174.94 173.93 1wuo n PRO 95 N 5.01 1.11 -4.92 2.79 -0.02 -1.26 -4.12 135.00 133.60 1wuo n PRO 95 Ca -0.13 0.40 -0.30 0.00 -2.02 0.00 0.00 63.50 61.45 1wuo n PRO 95 Cb 0.48 -2.05 -0.15 0.00 -0.02 0.00 0.00 33.50 31.77 1wuo n PRO 95 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1wuo s THR 96 N 0.94 2.19 0.08 3.45 -4.23 -1.26 -1.59 115.64 115.22 1wuo s THR 96 Ca 0.87 -1.35 0.08 0.00 -1.18 0.00 0.00 61.69 60.10 1wuo s THR 96 Cb -0.98 -1.85 -0.03 0.00 1.34 0.00 0.00 72.50 70.98 1wuo s THR 96 CO 0.50 0.38 -0.20 -0.31 -0.54 0.00 0.00 174.62 174.45 1wuo s TYR 97 N -0.80 1.71 -0.15 3.99 1.51 0.53 -1.27 117.35 122.87 1wuo s TYR 97 Ca 0.12 -0.41 -0.29 0.00 -1.01 0.00 0.00 57.07 55.48 1wuo s TYR 97 Cb -0.10 -0.97 0.09 0.00 -0.11 0.00 0.00 41.96 40.88 1wuo s TYR 97 CO 0.02 0.15 0.82 0.00 -1.11 0.00 0.00 175.55 175.44 1wuo s ALA 98 N -1.06 -1.84 1.13 3.71 0.00 -0.60 -2.05 121.76 121.04 1wuo s ALA 98 Ca 0.06 1.61 -0.13 0.00 0.00 0.00 0.00 51.96 53.50 1wuo s ALA 98 Cb -0.10 -0.62 0.24 0.00 0.00 0.00 0.00 23.12 22.65 1wuo s ALA 98 CO 0.03 -0.33 0.93 -1.13 0.00 0.00 0.00 175.76 175.26 1wuo n SER 99 N 1.39 -1.46 -0.10 0.00 3.41 -1.26 -2.99 113.62 112.60 1wuo n SER 99 Ca -0.15 -0.05 -0.09 0.00 -0.26 0.00 0.00 58.87 58.32 1wuo n SER 99 Cb 0.57 -1.27 -0.01 0.00 -0.26 0.00 0.00 64.21 63.24 1wuo n SER 99 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1wuo h GLU 100 N -2.48 0.46 -0.45 4.33 5.08 -0.46 -1.68 114.58 119.38 1wuo h GLU 100 Ca -0.57 -0.05 0.04 0.00 -1.00 0.00 0.00 59.36 57.78 1wuo h GLU 100 Cb 1.32 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 30.44 1wuo h GLU 100 CO 0.46 0.37 0.20 -0.07 -1.00 0.00 0.00 179.01 178.97 1wuo h LEU 101 N 0.43 0.26 -0.54 1.33 3.38 -1.90 -0.89 115.31 117.39 1wuo h LEU 101 Ca 0.12 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.13 1wuo h LEU 101 Cb 0.03 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 1wuo h LEU 101 CO -0.02 0.19 0.35 0.74 0.09 0.00 0.00 178.44 179.79 1wuo h THR 102 N 0.40 1.12 -0.48 0.22 2.02 -1.75 -1.38 112.91 113.06 1wuo h THR 102 Ca 0.20 -0.24 -0.04 0.00 0.77 0.00 0.00 66.41 67.10 1wuo h THR 102 Cb 0.14 0.35 -0.02 0.00 -1.74 0.00 0.00 68.15 66.88 1wuo h THR 102 CO -0.17 0.13 0.15 0.78 0.37 0.00 0.00 175.52 176.78 1wuo h ASN 103 N 0.71 0.65 -0.23 4.18 -0.26 -0.98 0.83 115.58 120.48 1wuo h ASN 103 Ca 0.20 -0.09 -0.02 0.00 -0.56 0.00 0.00 56.30 55.83 1wuo h ASN 103 Cb -0.06 -0.17 -0.01 0.00 -1.06 0.00 0.00 38.32 37.02 1wuo h ASN 103 CO -0.05 0.62 0.06 -0.08 -1.06 0.00 0.00 177.43 176.92 1wuo h GLU 104 N 0.69 0.37 -0.14 0.81 4.57 -0.86 0.38 114.58 120.40 1wuo h GLU 104 Ca 0.16 -0.09 -0.09 0.00 -1.18 0.00 0.00 59.36 58.17 1wuo h GLU 104 Cb 0.21 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.74 1wuo h GLU 104 CO -0.01 0.47 -0.31 -0.07 -1.18 0.00 0.00 179.01 177.91 1wuo h LEU 105 N 0.20 0.28 -0.21 1.64 3.38 -0.97 -0.23 115.31 119.40 1wuo h LEU 105 Ca 0.07 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 1wuo h LEU 105 Cb 0.26 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1wuo h LEU 105 CO -0.00 0.58 -0.11 -0.07 0.09 0.00 0.00 178.44 178.93 1wuo h LEU 106 N 0.24 0.46 0.55 1.67 3.38 -0.29 -1.95 115.31 119.37 1wuo h LEU 106 Ca 0.03 -0.42 -0.02 0.00 0.09 0.00 0.00 57.88 57.57 1wuo h LEU 106 Cb 0.67 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1wuo h LEU 106 CO 0.05 0.78 -0.43 0.50 0.09 0.00 0.00 178.44 179.43 1wuo h LYS 107 N 0.15 -0.93 -0.75 1.13 3.64 0.01 0.24 116.57 120.06 1wuo h LYS 107 Ca 0.05 0.06 0.22 0.00 -1.27 0.00 0.00 60.65 59.71 1wuo h LYS 107 Cb 0.61 0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.61 1wuo h LYS 107 CO 0.03 -0.62 0.58 -0.22 -2.27 0.00 0.00 179.45 176.96 1wuo h LYS 108 N -0.96 0.00 -0.12 1.90 3.64 -1.07 0.30 116.57 120.25 1wuo h LYS 108 Ca -0.06 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1wuo h LYS 108 Cb 0.81 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.63 1wuo h LYS 108 CO 0.00 0.00 0.00 -3.47 -2.27 0.00 0.00 179.45 173.71 1wuo n ASP 109 N -4.15 1.55 -1.35 4.20 4.64 -0.35 -4.92 116.55 116.16 1wuo n ASP 109 Ca 0.15 -1.64 -0.10 0.00 -1.38 0.00 0.00 54.79 51.82 1wuo n ASP 109 Cb 0.86 -0.08 0.01 0.00 -1.04 0.00 0.00 41.12 40.87 1wuo n ASP 109 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1wuo n GLY 110 N 1.13 0.09 3.57 0.27 0.00 0.10 -5.04 105.19 105.32 1wuo n GLY 110 Ca 0.17 -0.41 -0.27 0.00 0.00 0.00 0.00 46.02 45.50 1wuo n GLY 110 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wuo s LYS 111 N -4.87 2.08 0.26 1.61 -0.14 -0.07 -5.03 119.74 113.59 1wuo s LYS 111 Ca 0.09 -1.20 -0.30 0.00 -1.36 0.00 0.00 55.97 53.21 1wuo s LYS 111 Cb -0.04 -2.20 -0.10 0.00 -1.68 0.00 0.00 37.83 33.81 1wuo s LYS 111 CO 0.12 0.45 1.36 0.08 -0.76 0.00 0.00 175.35 176.59 1wuo s VAL 112 N -1.58 2.84 0.49 3.17 1.01 -1.26 -4.08 120.40 120.99 1wuo s VAL 112 Ca 0.24 0.74 -0.02 0.00 0.00 0.00 0.00 61.98 62.94 1wuo s VAL 112 Cb -0.09 -3.47 -0.00 0.00 0.00 0.00 0.00 36.38 32.81 1wuo s VAL 112 CO 0.15 0.14 0.74 -1.10 0.00 0.00 0.00 175.10 175.03 1wuo s GLN 113 N -0.78 3.07 0.59 2.72 -0.21 -1.26 -4.84 119.66 118.95 1wuo s GLN 113 Ca 0.55 -0.29 -0.17 0.00 0.02 0.00 0.00 55.36 55.47 1wuo s GLN 113 Cb -0.40 -2.46 -0.03 0.00 1.00 0.00 0.00 33.01 31.12 1wuo s GLN 113 CO 0.45 -0.38 1.10 0.00 -2.12 0.00 0.00 175.29 174.34 1wuo s ALA 114 N -2.69 2.63 -0.45 6.09 0.00 -1.26 -4.94 121.76 121.15 1wuo s ALA 114 Ca 0.50 0.61 0.23 0.00 0.00 0.00 0.00 51.96 53.29 1wuo s ALA 114 Cb -0.10 -3.31 0.35 0.00 0.00 0.00 0.00 23.12 20.06 1wuo s ALA 114 CO 0.40 -0.93 1.57 1.79 0.00 0.00 0.00 175.76 178.59 1wuo h THR 115 N 0.61 0.00 -3.99 0.00 1.35 -1.83 -3.44 112.91 105.60 1wuo h THR 115 Ca -0.48 -0.95 -0.51 0.00 -0.55 0.00 0.00 66.41 63.91 1wuo h THR 115 Cb 1.24 1.91 -0.30 0.00 -1.73 0.00 0.00 68.15 69.26 1wuo h THR 115 CO 0.56 0.00 -0.82 0.20 -0.25 0.00 0.00 175.52 175.21 1wuo s ASN 116 N -5.98 1.81 0.28 5.36 0.01 -0.40 -5.00 114.94 111.02 1wuo s ASN 116 Ca 0.07 -0.29 0.06 0.00 -0.71 0.00 0.00 52.86 51.98 1wuo s ASN 116 Cb 0.06 -0.40 -0.06 0.00 0.41 0.00 0.00 41.25 41.26 1wuo s ASN 116 CO 0.68 0.14 -0.03 -0.94 -1.51 0.00 0.00 177.10 175.43 1wuo s SER 117 N -0.05 2.55 0.24 -1.22 1.04 -1.26 -1.56 113.70 113.44 1wuo s SER 117 Ca -0.00 -1.22 -0.14 0.00 0.48 0.00 0.00 55.95 55.07 1wuo s SER 117 Cb -0.09 -0.13 0.00 0.00 0.10 0.00 0.00 66.02 65.90 1wuo s SER 117 CO 0.01 -0.41 0.51 0.72 0.98 0.00 0.00 173.24 175.05 1wuo s PHE 118 N -3.12 0.25 0.31 5.02 -0.12 -1.16 -4.91 117.98 114.24 1wuo s PHE 118 Ca 0.30 -0.62 0.02 0.00 -0.05 0.00 0.00 56.93 56.58 1wuo s PHE 118 Cb 0.05 0.27 -0.01 0.00 -0.63 0.00 0.00 43.02 42.70 1wuo s PHE 118 CO 0.12 -1.01 0.37 -1.13 -0.05 0.00 0.00 175.22 173.51 1wuo n SER 119 N -0.38 -1.00 0.00 1.98 3.41 -1.26 0.34 113.62 116.71 1wuo n SER 119 Ca -0.03 -2.79 0.00 0.00 -0.26 0.00 0.00 58.87 55.79 1wuo n SER 119 Cb 0.62 1.98 0.00 0.00 -0.26 0.00 0.00 64.21 66.55 1wuo n SER 119 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wuo n GLY 120 N -0.53 0.63 0.11 5.00 0.00 -1.26 -4.73 105.19 104.40 1wuo n GLY 120 Ca 0.03 -2.10 -0.14 0.00 0.00 0.00 0.00 46.02 43.81 1wuo n GLY 120 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1wuo h VAL 121 N 0.00 1.46 -3.98 1.61 2.07 -1.93 -3.42 116.25 112.06 1wuo h VAL 121 Ca 0.00 -1.67 -0.44 0.00 0.82 0.00 0.00 66.70 65.41 1wuo h VAL 121 Cb 0.00 2.42 -0.23 0.00 -1.52 0.00 0.00 31.29 31.96 1wuo h VAL 121 CO 0.00 0.46 -0.79 0.54 0.02 0.00 0.00 177.57 177.80 1wuo s ASN 122 N -6.21 1.77 -0.07 0.57 4.22 -1.26 -0.54 114.94 113.42 1wuo s ASN 122 Ca -0.15 -0.57 -0.03 0.00 -2.14 0.00 0.00 52.86 49.97 1wuo s ASN 122 Cb 0.02 -0.08 0.04 0.00 1.28 0.00 0.00 41.25 42.51 1wuo s ASN 122 CO 0.74 -0.02 0.14 -0.47 -2.04 0.00 0.00 177.10 175.45 1wuo s TYR 123 N -1.12 -0.16 -0.59 1.54 6.14 0.75 -4.96 117.35 118.95 1wuo s TYR 123 Ca 0.00 0.49 -0.22 0.00 0.64 0.00 0.00 57.07 57.98 1wuo s TYR 123 Cb -0.09 -0.11 0.06 0.00 0.42 0.00 0.00 41.96 42.24 1wuo s TYR 123 CO 0.02 -0.18 0.87 -1.58 0.64 0.00 0.00 175.55 175.32 1wuo s TRP 124 N 1.32 2.81 0.08 4.97 0.52 -1.26 0.41 118.94 127.78 1wuo s TRP 124 Ca -0.08 -0.45 -0.20 0.00 0.02 0.00 0.00 56.10 55.39 1wuo s TRP 124 Cb -0.12 -4.07 -0.10 0.00 -1.15 0.00 0.00 33.47 28.04 1wuo s TRP 124 CO -0.06 -1.42 1.57 1.25 0.02 0.00 0.00 176.95 178.31 1wuo h LEU 125 N 10.80 0.27 -7.48 2.99 5.85 -1.42 -3.40 115.31 122.93 1wuo h LEU 125 Ca -0.28 -0.23 -0.51 0.00 0.84 0.00 0.00 57.88 57.70 1wuo h LEU 125 Cb 1.08 -0.07 -0.39 0.00 0.37 0.00 0.00 40.66 41.65 1wuo h LEU 125 CO 1.11 0.43 -0.78 -0.69 -0.34 0.00 0.00 178.44 178.17 1wuo s VAL 126 N -5.30 0.75 0.15 1.05 1.01 -0.75 -4.98 120.40 112.33 1wuo s VAL 126 Ca -0.14 -0.43 -0.32 0.00 0.00 0.00 0.00 61.98 61.09 1wuo s VAL 126 Cb 0.07 -1.03 -0.17 0.00 0.00 0.00 0.00 36.38 35.25 1wuo s VAL 126 CO 0.71 0.06 0.92 1.17 0.00 0.00 0.00 175.10 177.95 1wuo n LYS 127 N 4.99 0.53 -0.60 2.72 3.00 -1.26 -1.01 118.16 126.53 1wuo n LYS 127 Ca -0.10 0.19 0.00 0.00 -0.00 0.00 0.00 58.31 58.40 1wuo n LYS 127 Cb 0.48 -1.51 0.00 0.00 0.00 0.00 0.00 35.03 34.00 1wuo n LYS 127 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1wuo n ASN 128 N 1.82 -2.82 0.00 3.14 3.02 -1.26 -4.60 115.26 114.56 1wuo n ASN 128 Ca 0.17 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.72 1wuo n ASN 128 Cb 0.22 -2.39 0.00 0.00 -0.61 0.00 0.00 39.78 37.00 1wuo n ASN 128 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1wuo n LYS 129 N 0.04 0.00 -3.81 3.52 5.02 -0.18 -4.55 118.16 118.19 1wuo n LYS 129 Ca 0.00 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.01 1wuo n LYS 129 Cb 0.24 -0.57 -0.16 0.00 -0.02 0.00 0.00 35.03 34.51 1wuo n LYS 129 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1wuo s ILE 130 N -1.70 0.85 -0.07 -0.18 1.01 -0.20 -4.11 121.20 116.81 1wuo s ILE 130 Ca 0.00 -0.69 0.02 0.00 0.00 0.00 0.00 60.65 59.99 1wuo s ILE 130 Cb 0.00 -1.22 -0.02 0.00 0.01 0.00 0.00 42.46 41.22 1wuo s ILE 130 CO 0.00 -0.10 -0.13 -0.70 0.00 0.00 0.00 174.94 174.02 1wuo s GLU 131 N 1.72 2.75 -0.16 2.79 2.12 -0.33 -0.97 118.70 126.61 1wuo s GLU 131 Ca -0.01 -0.66 -0.05 0.00 0.36 0.00 0.00 54.97 54.60 1wuo s GLU 131 Cb -0.17 -2.48 -0.03 0.00 0.26 0.00 0.00 34.13 31.71 1wuo s GLU 131 CO -0.07 0.54 0.01 0.08 -0.54 0.00 0.00 175.26 175.28 1wuo s VAL 132 N -0.51 4.34 -0.02 3.70 1.01 0.17 0.02 120.40 129.11 1wuo s VAL 132 Ca 0.07 -0.20 0.04 0.00 0.00 0.00 0.00 61.98 61.89 1wuo s VAL 132 Cb -0.12 -2.92 -0.01 0.00 0.00 0.00 0.00 36.38 33.34 1wuo s VAL 132 CO 0.02 0.49 -0.14 0.12 0.00 0.00 0.00 175.10 175.59 1wuo s PHE 133 N 0.20 1.34 -0.31 5.22 5.36 -0.09 -0.18 117.98 129.52 1wuo s PHE 133 Ca 0.01 -0.31 -0.03 0.00 -0.96 0.00 0.00 56.93 55.65 1wuo s PHE 133 Cb -0.13 -0.89 0.05 0.00 -0.34 0.00 0.00 43.02 41.71 1wuo s PHE 133 CO 0.02 -0.07 0.02 -0.47 -1.46 0.00 0.00 175.22 173.26 1wuo s TYR 134 N -0.14 3.25 -0.88 10.12 5.04 0.29 -0.32 117.35 134.71 1wuo s TYR 134 Ca 0.02 -1.74 0.27 0.00 -2.44 0.00 0.00 57.07 53.18 1wuo s TYR 134 Cb -0.08 -2.15 0.94 0.00 0.35 0.00 0.00 41.96 41.03 1wuo s TYR 134 CO 0.00 -0.78 1.77 -0.35 -1.34 0.00 0.00 175.55 174.85 1wuo n PRO 135 N 4.67 0.11 0.00 4.97 -0.04 -1.26 -4.85 135.00 138.60 1wuo n PRO 135 Ca -0.13 0.07 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 1wuo n PRO 135 Cb 0.44 -1.61 0.00 0.00 -0.04 0.00 0.00 33.50 32.29 1wuo n PRO 135 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1wuo n GLY 136 N 1.43 -1.09 3.77 0.55 0.00 -1.26 -4.28 105.19 104.31 1wuo n GLY 136 Ca 0.06 -2.21 -0.40 0.00 0.00 0.00 0.00 46.02 43.47 1wuo n GLY 136 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1wuo s PRO 137 N -0.43 3.86 0.00 1.61 0.02 -1.25 -4.66 135.00 134.15 1wuo s PRO 137 Ca 0.00 2.49 0.00 0.00 0.02 0.00 0.00 61.00 63.51 1wuo s PRO 137 Cb 0.00 -2.78 0.00 0.00 0.02 0.00 0.00 34.50 31.74 1wuo s PRO 137 CO 0.00 -0.70 0.00 0.41 -0.33 0.00 0.00 177.00 176.38 1wuo n GLY 138 N 0.53 0.48 0.31 0.52 0.00 -1.26 -3.53 105.19 102.25 1wuo n GLY 138 Ca 0.03 0.30 -0.03 0.00 0.00 0.00 0.00 46.02 46.33 1wuo n GLY 138 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1wuo h HIS 139 N 0.00 1.00 -4.48 1.61 -0.00 -1.90 -1.07 115.15 110.31 1wuo h HIS 139 Ca 0.00 0.03 -0.22 0.00 -0.00 0.00 0.00 60.37 60.18 1wuo h HIS 139 Cb 0.00 -0.33 -0.15 0.00 -0.00 0.00 0.00 27.41 26.93 1wuo h HIS 139 CO 0.00 0.60 -0.58 0.95 -0.00 0.00 0.00 177.93 178.89 1wuo s THR 140 N -6.12 0.02 0.36 6.26 -4.23 -1.26 -2.37 115.64 108.30 1wuo s THR 140 Ca -0.13 -1.93 0.03 0.00 -1.18 0.00 0.00 61.69 58.48 1wuo s THR 140 Cb 0.16 -2.39 0.27 0.00 1.34 0.00 0.00 72.50 71.88 1wuo s THR 140 CO 0.79 -0.09 2.01 -0.65 -0.54 0.00 0.00 174.62 176.14 1wuo h PRO 141 N 2.64 0.80 -0.02 3.99 0.11 -1.86 -3.22 132.00 134.42 1wuo h PRO 141 Ca -0.35 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1wuo h PRO 141 Cb 1.24 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1wuo h PRO 141 CO 0.53 0.53 -0.13 -0.40 -0.21 0.00 0.00 178.00 178.32 1wuo n ASP 142 N -4.45 2.33 -4.69 -2.05 3.85 -1.26 -3.96 116.55 106.32 1wuo n ASP 142 Ca 0.07 -1.70 -0.44 0.00 -0.71 0.00 0.00 54.79 52.01 1wuo n ASP 142 Cb 0.07 0.12 -0.02 0.00 -1.35 0.00 0.00 41.12 39.93 1wuo n ASP 142 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.20 175.73 1wuo n ASN 143 N 0.65 2.94 -4.33 -1.12 2.04 -1.22 -4.76 115.26 109.45 1wuo n ASN 143 Ca 0.14 1.15 -0.17 0.00 -0.44 0.00 0.00 54.58 55.25 1wuo n ASN 143 Cb 0.50 -1.46 -0.10 0.00 -2.53 0.00 0.00 39.78 36.19 1wuo n ASN 143 CO 0.00 0.00 0.00 0.68 -0.44 0.00 0.00 177.26 177.50 1wuo s VAL 144 N -0.17 1.29 0.41 3.53 -7.23 0.19 -4.41 120.40 114.02 1wuo s VAL 144 Ca 0.66 -2.08 0.07 0.00 -1.81 0.00 0.00 61.98 58.81 1wuo s VAL 144 Cb -0.61 -2.21 -0.08 0.00 0.56 0.00 0.00 36.38 34.04 1wuo s VAL 144 CO 0.51 -0.46 0.01 0.68 -0.31 0.00 0.00 175.10 175.54 1wuo s VAL 145 N -3.25 1.93 -0.06 1.32 -7.23 0.57 -4.75 120.40 108.92 1wuo s VAL 145 Ca 0.25 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.42 1wuo s VAL 145 Cb 0.04 -2.97 0.02 0.00 0.56 0.00 0.00 36.38 34.03 1wuo s VAL 145 CO 0.07 0.00 -0.04 -0.69 -0.31 0.00 0.00 175.10 174.13 1wuo s VAL 146 N -2.75 0.57 -0.14 1.32 1.01 -0.92 -0.91 120.40 118.57 1wuo s VAL 146 Ca 0.34 -0.08 -0.04 0.00 0.00 0.00 0.00 61.98 62.21 1wuo s VAL 146 Cb 0.10 -0.63 -0.03 0.00 0.00 0.00 0.00 36.38 35.82 1wuo s VAL 146 CO 0.17 0.26 -0.01 0.86 0.00 0.00 0.00 175.10 176.38 1wuo s TRP 147 N 1.33 3.09 -0.59 5.22 -0.11 0.10 -0.40 118.94 127.58 1wuo s TRP 147 Ca -0.04 -0.10 0.02 0.00 1.22 0.00 0.00 56.10 57.20 1wuo s TRP 147 Cb -0.14 -1.92 0.15 0.00 -1.50 0.00 0.00 33.47 30.06 1wuo s TRP 147 CO -0.02 0.14 0.37 -0.51 -4.62 0.00 0.00 176.95 172.30 1wuo s LEU 148 N -0.02 4.67 0.30 5.86 1.43 0.35 -1.18 118.68 130.10 1wuo s LEU 148 Ca 0.02 -3.14 0.02 0.00 -1.03 0.00 0.00 54.13 50.00 1wuo s LEU 148 Cb -0.13 -1.71 0.76 0.00 0.03 0.00 0.00 46.19 45.15 1wuo s LEU 148 CO 0.02 -0.24 1.59 -0.65 0.23 0.00 0.00 176.35 177.31 1wuo h PRO 149 N 6.43 0.06 -0.54 1.29 0.11 -1.84 0.16 132.00 137.67 1wuo h PRO 149 Ca -0.02 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.09 1wuo h PRO 149 Cb 0.88 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 31.95 1wuo h PRO 149 CO 0.71 0.04 0.34 0.93 -0.21 0.00 0.00 178.00 179.80 1wuo h GLU 150 N 0.06 0.72 -0.00 1.05 5.08 -1.85 -2.56 114.58 117.08 1wuo h GLU 150 Ca 0.59 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.90 1wuo h GLU 150 Cb 1.24 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1wuo h GLU 150 CO -0.83 0.50 -0.56 0.54 -1.00 0.00 0.00 179.01 177.66 1wuo n ARG 151 N -4.44 2.94 -3.34 2.33 5.12 -0.90 -4.97 116.66 113.39 1wuo n ARG 151 Ca 0.05 -0.04 -0.18 0.00 -1.93 0.00 0.00 57.85 55.75 1wuo n ARG 151 Cb 0.06 -1.08 0.07 0.00 -1.16 0.00 0.00 32.46 30.35 1wuo n ARG 151 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1wuo n LYS 152 N -1.23 -6.24 -3.99 5.56 4.01 -0.01 -4.65 118.16 111.61 1wuo n LYS 152 Ca 0.02 0.67 -0.36 0.00 -0.51 0.00 0.00 58.31 58.14 1wuo n LYS 152 Cb 0.19 -5.22 -0.08 0.00 -0.51 0.00 0.00 35.03 29.41 1wuo n LYS 152 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 1wuo s ILE 153 N -3.26 5.10 -0.20 -0.18 1.01 -1.02 -0.74 121.20 121.91 1wuo s ILE 153 Ca 0.39 0.06 0.01 0.00 0.00 0.00 0.00 60.65 61.11 1wuo s ILE 153 Cb -0.17 -3.23 0.04 0.00 0.01 0.00 0.00 42.46 39.10 1wuo s ILE 153 CO 0.59 0.56 -0.12 -0.22 0.00 0.00 0.00 174.94 175.75 1wuo s LEU 154 N -0.56 2.29 -0.39 2.97 2.96 0.57 -0.49 118.68 126.03 1wuo s LEU 154 Ca 0.11 -0.85 -0.27 0.00 -0.22 0.00 0.00 54.13 52.90 1wuo s LEU 154 Cb -0.12 -1.28 0.02 0.00 0.50 0.00 0.00 46.19 45.31 1wuo s LEU 154 CO 0.02 -0.12 0.98 0.12 -1.32 0.00 0.00 176.35 176.03 1wuo s PHE 155 N 1.37 3.03 -0.65 5.38 5.36 0.46 -0.55 117.98 132.39 1wuo s PHE 155 Ca -0.00 0.77 0.24 0.00 -0.96 0.00 0.00 56.93 56.98 1wuo s PHE 155 Cb -0.16 -3.80 0.36 0.00 -0.34 0.00 0.00 43.02 39.08 1wuo s PHE 155 CO -0.09 -0.91 1.33 0.41 -1.46 0.00 0.00 175.22 174.50 1wuo n GLY 156 N 4.44 -1.42 5.25 13.12 0.00 -0.38 -2.17 105.19 124.02 1wuo n GLY 156 Ca 0.08 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1wuo n GLY 156 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wuo n GLY 157 N 1.34 0.91 4.90 -0.02 0.00 -1.20 -3.64 105.19 107.47 1wuo n GLY 157 Ca 0.03 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.40 1wuo n GLY 157 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1wuo n PHE 159 N 0.00 0.00 -2.56 1.61 -0.00 -1.26 -0.13 117.46 115.12 1wuo n PHE 159 Ca 0.00 0.00 -0.43 0.00 -0.00 0.00 0.00 57.45 57.02 1wuo n PHE 159 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 39.48 39.46 1wuo n PHE 159 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.76 177.18 1wuo s ILE 160 N 0.00 4.14 -0.51 -2.13 -1.09 -1.24 -4.80 121.20 115.57 1wuo s ILE 160 Ca 0.00 1.15 0.06 0.00 -2.23 0.00 0.00 60.65 59.63 1wuo s ILE 160 Cb 0.00 -4.56 0.22 0.00 -1.58 0.00 0.00 42.46 36.55 1wuo s ILE 160 CO 0.00 -1.00 0.55 0.29 -1.23 0.00 0.00 174.94 173.54 1wuo n LYS 161 N 7.94 1.30 0.16 2.79 4.76 -1.26 -4.66 118.16 129.18 1wuo n LYS 161 Ca 0.12 -3.82 0.13 0.00 -2.87 0.00 0.00 58.31 51.88 1wuo n LYS 161 Cb 0.49 -1.76 0.52 0.00 -1.84 0.00 0.00 35.03 32.44 1wuo n LYS 161 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 1wuo h PRO 162 N 4.56 0.00 -0.01 1.97 0.13 -1.83 -3.28 132.00 133.54 1wuo h PRO 162 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1wuo h PRO 162 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 1wuo h PRO 162 CO 0.59 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.02 1wuo n TYR 163 N -2.39 0.01 0.00 1.56 0.53 -1.26 -4.64 117.16 110.97 1wuo n TYR 163 Ca 0.02 -0.11 0.00 0.00 -1.02 0.00 0.00 57.90 56.79 1wuo n TYR 163 Cb 0.25 -0.01 0.00 0.00 -1.03 0.00 0.00 39.34 38.55 1wuo n TYR 163 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1wuo n GLY 164 N -0.02 3.83 0.12 2.72 0.00 -1.24 -5.03 105.19 105.57 1wuo n GLY 164 Ca 0.01 -0.47 -0.01 0.00 0.00 0.00 0.00 46.02 45.54 1wuo n GLY 164 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1wuo h LEU 165 N 0.00 0.00 0.00 0.99 3.38 -1.91 -3.43 115.31 114.34 1wuo h LEU 165 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1wuo h LEU 165 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1wuo h LEU 165 CO 0.00 0.69 0.00 0.61 0.09 0.00 0.00 178.44 179.83 1wuo n GLY 166 N 0.96 0.64 3.63 0.83 0.00 -1.26 -4.80 105.19 105.19 1wuo n GLY 166 Ca 0.00 -0.87 -0.43 0.00 0.00 0.00 0.00 46.02 44.73 1wuo n GLY 166 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1wuo s ASN 167 N -4.00 5.94 0.00 1.61 2.47 -1.26 -4.83 114.94 114.88 1wuo s ASN 167 Ca 0.00 2.27 0.26 0.00 0.42 0.00 0.00 52.86 55.80 1wuo s ASN 167 Cb 0.00 -2.52 0.60 0.00 -1.45 0.00 0.00 41.25 37.88 1wuo s ASN 167 CO 0.00 -1.52 1.49 0.18 -3.72 0.00 0.00 177.10 173.53 1wuo n LEU 168 N 9.65 2.31 -0.33 3.21 4.77 -1.26 -4.57 117.00 130.79 1wuo n LEU 168 Ca 0.25 -0.79 0.15 0.00 -0.03 0.00 0.00 56.01 55.59 1wuo n LEU 168 Cb 0.43 -0.01 0.30 0.00 -2.33 0.00 0.00 43.42 41.81 1wuo n LEU 168 CO 0.67 0.39 0.85 1.23 -1.33 0.00 0.00 177.39 179.20 1wuo h GLY 169 N 4.78 1.32 -0.56 -0.72 0.00 -1.91 0.20 103.07 106.18 1wuo h GLY 169 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.43 1wuo h GLY 169 CO 0.00 -0.50 0.00 1.22 0.00 0.00 0.00 176.54 177.26 1wuo n ASP 170 N -5.42 2.77 -4.82 0.19 8.00 -1.26 -5.05 116.55 110.95 1wuo n ASP 170 Ca 0.23 -2.77 -0.33 0.00 0.71 0.00 0.00 54.79 52.63 1wuo n ASP 170 Cb 0.77 -0.37 -0.03 0.00 -0.02 0.00 0.00 41.12 41.48 1wuo n ASP 170 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1wuo s ALA 171 N -2.35 2.95 -0.59 2.24 0.00 0.06 -3.75 121.76 120.31 1wuo s ALA 171 Ca 0.28 0.31 0.04 0.00 0.00 0.00 0.00 51.96 52.59 1wuo s ALA 171 Cb 0.23 -3.17 0.15 0.00 0.00 0.00 0.00 23.12 20.33 1wuo s ALA 171 CO 0.05 -0.37 0.36 1.21 0.00 0.00 0.00 175.76 177.01 1wuo s ASN 172 N -2.79 4.47 0.52 0.00 3.84 -0.40 -4.93 114.94 115.65 1wuo s ASN 172 Ca 0.61 -3.36 0.26 0.00 0.21 0.00 0.00 52.86 50.58 1wuo s ASN 172 Cb -0.12 -1.60 1.44 0.00 -0.55 0.00 0.00 41.25 40.42 1wuo s ASN 172 CO 0.30 -0.17 2.09 0.40 -2.79 0.00 0.00 177.10 176.93 1wuo h ILE 173 N 5.01 0.65 -0.20 -5.21 2.04 -1.94 -0.05 117.51 117.81 1wuo h ILE 173 Ca 0.02 -0.45 -0.05 0.00 1.00 0.00 0.00 64.86 65.39 1wuo h ILE 173 Cb 0.83 1.28 -0.01 0.00 -0.74 0.00 0.00 36.82 38.19 1wuo h ILE 173 CO 0.69 0.11 -0.05 -0.33 0.00 0.00 0.00 178.15 178.56 1wuo h GLU 174 N 0.00 0.39 0.00 2.37 3.07 -1.96 -3.30 114.58 115.14 1wuo h GLU 174 Ca -0.00 -0.15 0.00 0.00 -0.50 0.00 0.00 59.36 58.71 1wuo h GLU 174 Cb 0.27 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.16 1wuo h GLU 174 CO 0.01 0.64 -0.87 0.00 -1.40 0.00 0.00 179.01 177.40 1wuo n ALA 175 N -2.37 2.81 -0.21 3.43 0.00 -0.97 -4.44 120.51 118.77 1wuo n ALA 175 Ca -0.05 -0.27 0.01 0.00 0.00 0.00 0.00 53.44 53.14 1wuo n ALA 175 Cb 0.28 -1.11 0.11 0.00 0.00 0.00 0.00 19.45 18.73 1wuo n ALA 175 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 1wuo h TRP 176 N 0.00 -0.01 -0.38 0.00 2.91 -1.06 -0.82 115.95 116.60 1wuo h TRP 176 Ca 0.00 0.04 0.06 0.00 1.13 0.00 0.00 58.89 60.12 1wuo h TRP 176 Cb 0.86 0.10 -0.05 0.00 -0.51 0.00 0.00 29.16 29.56 1wuo h TRP 176 CO 0.00 -0.15 0.06 -1.35 -1.03 0.00 0.00 178.44 175.96 1wuo h PRO 177 N 0.13 0.17 -0.32 2.65 0.11 -1.77 0.11 132.00 133.07 1wuo h PRO 177 Ca 0.33 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.43 1wuo h PRO 177 Cb 0.53 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 31.59 1wuo h PRO 177 CO -0.52 0.11 0.21 -0.22 -0.21 0.00 0.00 178.00 177.37 1wuo h LYS 178 N 0.18 0.42 -0.22 1.05 3.64 -1.52 -0.63 116.57 119.49 1wuo h LYS 178 Ca 0.18 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.53 1wuo h LYS 178 Cb 0.22 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1wuo h LYS 178 CO -0.25 0.28 0.11 0.77 -2.27 0.00 0.00 179.45 178.08 1wuo h SER 179 N 0.43 0.28 -0.80 4.20 0.02 -0.45 -1.72 113.55 115.50 1wuo h SER 179 Ca 0.12 -0.12 0.03 0.00 -0.84 0.00 0.00 61.79 60.98 1wuo h SER 179 Cb -0.04 -0.07 -0.04 0.00 0.14 0.00 0.00 62.40 62.38 1wuo h SER 179 CO -0.03 0.32 0.53 0.00 -1.14 0.00 0.00 176.83 176.50 1wuo h ALA 180 N 0.97 1.49 0.03 3.77 0.00 -0.54 -0.45 119.26 124.54 1wuo h ALA 180 Ca 0.07 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1wuo h ALA 180 Cb 0.11 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1wuo h ALA 180 CO -0.01 0.44 -0.01 -0.22 0.00 0.00 0.00 179.25 179.45 1wuo h LYS 181 N 1.01 -0.04 -0.90 0.00 1.63 -0.89 0.30 116.57 117.68 1wuo h LYS 181 Ca 0.31 0.00 0.10 0.00 -0.85 0.00 0.00 60.65 60.21 1wuo h LYS 181 Cb -0.01 0.01 -0.08 0.00 -0.60 0.00 0.00 32.23 31.55 1wuo h LYS 181 CO -0.08 0.14 0.54 1.25 -3.45 0.00 0.00 179.45 177.85 1wuo h LEU 182 N -0.21 0.80 -0.19 5.20 5.85 -0.47 -1.23 115.31 125.06 1wuo h LEU 182 Ca -0.00 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 1wuo h LEU 182 Cb 0.20 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 1wuo h LEU 182 CO 0.01 0.45 -0.02 0.25 -0.34 0.00 0.00 178.44 178.79 1wuo h LEU 183 N 0.90 0.34 -0.77 2.25 5.85 -0.67 0.12 115.31 123.33 1wuo h LEU 183 Ca 0.43 -0.34 0.03 0.00 0.84 0.00 0.00 57.88 58.85 1wuo h LEU 183 Cb 0.38 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.27 1wuo h LEU 183 CO -0.24 0.60 0.49 0.50 -0.34 0.00 0.00 178.44 179.45 1wuo h LYS 184 N 0.08 0.93 -0.58 1.25 3.64 -0.53 0.28 116.57 121.64 1wuo h LYS 184 Ca 0.05 -0.06 -0.09 0.00 -1.27 0.00 0.00 60.65 59.28 1wuo h LYS 184 Cb 0.44 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 32.03 1wuo h LYS 184 CO 0.01 0.62 -0.01 1.03 -2.27 0.00 0.00 179.45 178.83 1wuo h SER 185 N 0.96 1.00 -0.04 4.20 0.87 -1.09 -1.53 113.55 117.93 1wuo h SER 185 Ca 0.31 -0.31 -0.02 0.00 -1.23 0.00 0.00 61.79 60.54 1wuo h SER 185 Cb 0.00 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 61.69 1wuo h SER 185 CO -0.11 1.07 -0.04 0.50 -0.53 0.00 0.00 176.83 177.73 1wuo h LYS 186 N 0.91 0.10 -0.33 2.24 1.63 0.21 -3.37 116.57 117.97 1wuo h LYS 186 Ca 0.16 -0.05 -0.18 0.00 -0.85 0.00 0.00 60.65 59.73 1wuo h LYS 186 Cb 0.56 0.00 -0.11 0.00 -0.60 0.00 0.00 32.23 32.08 1wuo h LYS 186 CO 0.03 0.54 -0.15 0.66 -3.45 0.00 0.00 179.45 177.08 1wuo n TYR 187 N -4.78 1.03 0.09 1.91 4.02 0.86 -4.76 117.16 115.54 1wuo n TYR 187 Ca -0.08 -1.65 0.20 0.00 -0.01 0.00 0.00 57.90 56.36 1wuo n TYR 187 Cb 0.27 -0.47 0.75 0.00 -0.02 0.00 0.00 39.34 39.87 1wuo n TYR 187 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 1wuo h GLY 188 N 1.05 0.00 0.88 2.72 0.00 -1.45 0.51 103.07 106.79 1wuo h GLY 188 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.54 1wuo h GLY 188 CO 0.37 0.00 0.00 1.17 0.00 0.00 0.00 176.54 178.08 1wuo n LYS 189 N -3.88 0.98 -1.72 4.80 3.00 -1.26 -4.84 118.16 115.24 1wuo n LYS 189 Ca 0.07 0.00 -0.43 0.00 -0.00 0.00 0.00 58.31 57.95 1wuo n LYS 189 Cb 0.55 -1.44 -0.02 0.00 0.00 0.00 0.00 35.03 34.12 1wuo n LYS 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1wuo n ALA 190 N -0.94 2.17 0.07 3.14 0.00 0.17 -4.90 120.51 120.23 1wuo n ALA 190 Ca 0.21 0.39 -0.23 0.00 0.00 0.00 0.00 53.44 53.81 1wuo n ALA 190 Cb 0.09 -2.42 -0.15 0.00 0.00 0.00 0.00 19.45 16.97 1wuo n ALA 190 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1wuo h LYS 191 N 5.14 0.39 -5.58 0.00 1.57 -1.20 -3.29 116.57 113.59 1wuo h LYS 191 Ca -0.46 -0.66 -0.51 0.00 -1.87 0.00 0.00 60.65 57.16 1wuo h LYS 191 Cb 1.23 0.25 -0.27 0.00 0.08 0.00 0.00 32.23 33.52 1wuo h LYS 191 CO 0.82 1.32 -0.82 -0.51 -0.57 0.00 0.00 179.45 179.69 1wuo s LEU 192 N -7.51 2.12 -0.10 2.94 1.43 -1.05 -4.29 118.68 112.22 1wuo s LEU 192 Ca -0.15 -0.41 0.00 0.00 -1.03 0.00 0.00 54.13 52.54 1wuo s LEU 192 Cb 0.04 -0.78 0.02 0.00 0.03 0.00 0.00 46.19 45.51 1wuo s LEU 192 CO 0.85 0.13 -0.08 -0.69 0.23 0.00 0.00 176.35 176.79 1wuo s VAL 193 N -0.66 0.98 -0.40 -1.59 1.01 -0.24 -0.31 120.40 119.19 1wuo s VAL 193 Ca 0.05 -0.28 -0.10 0.00 0.00 0.00 0.00 61.98 61.65 1wuo s VAL 193 Cb -0.07 -0.99 0.06 0.00 0.00 0.00 0.00 36.38 35.38 1wuo s VAL 193 CO 0.01 0.35 0.24 -0.69 0.00 0.00 0.00 175.10 175.01 1wuo s VAL 194 N 1.52 4.31 0.56 2.92 1.01 0.28 -0.86 120.40 130.14 1wuo s VAL 194 Ca 0.01 -1.23 -0.08 0.00 0.00 0.00 0.00 61.98 60.69 1wuo s VAL 194 Cb -0.13 -3.56 -0.03 0.00 0.00 0.00 0.00 36.38 32.67 1wuo s VAL 194 CO -0.06 -0.41 0.90 -2.84 0.00 0.00 0.00 175.10 172.70 1wuo s PRO 195 N 1.46 3.42 0.26 2.72 0.02 -1.26 -1.25 135.00 140.36 1wuo s PRO 195 Ca 0.02 0.36 -0.02 0.00 0.02 0.00 0.00 61.00 61.39 1wuo s PRO 195 Cb -0.22 -2.24 0.34 0.00 0.02 0.00 0.00 34.50 32.40 1wuo s PRO 195 CO 0.03 -0.46 1.75 0.77 -0.33 0.00 0.00 177.00 178.77 1wuo h SER 196 N -0.07 0.74 0.00 2.53 0.02 -0.75 -3.37 113.55 112.64 1wuo h SER 196 Ca -0.46 -0.19 0.00 0.00 -0.84 0.00 0.00 61.79 60.31 1wuo h SER 196 Cb 1.21 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.56 1wuo h SER 196 CO 0.62 0.82 -0.52 1.41 -1.14 0.00 0.00 176.83 178.02 1wuo n HIS 197 N -4.21 0.00 -3.57 3.45 8.25 -1.26 -0.28 115.22 117.60 1wuo n HIS 197 Ca 0.02 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.26 1wuo n HIS 197 Cb 0.31 -0.03 -0.01 0.00 1.12 0.00 0.00 29.99 31.37 1wuo n HIS 197 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 1wuo s SER 198 N -1.79 4.97 0.59 0.41 0.01 -1.26 -4.78 113.70 111.84 1wuo s SER 198 Ca 0.01 -0.87 -0.13 0.00 1.31 0.00 0.00 55.95 56.27 1wuo s SER 198 Cb 0.04 -0.25 -0.05 0.00 0.21 0.00 0.00 66.02 65.97 1wuo s SER 198 CO 0.20 -0.83 1.02 -1.61 0.41 0.00 0.00 173.24 172.43 1wuo s GLU 199 N -4.23 3.62 0.76 12.44 2.02 -1.26 -4.43 118.70 127.63 1wuo s GLU 199 Ca 0.46 0.89 -0.15 0.00 0.02 0.00 0.00 54.97 56.20 1wuo s GLU 199 Cb -0.03 -2.09 0.04 0.00 0.10 0.00 0.00 34.13 32.15 1wuo s GLU 199 CO 0.28 -0.55 1.11 0.28 0.02 0.00 0.00 175.26 176.40 1wuo n VAL 200 N -2.30 2.66 -3.26 2.63 0.31 -1.26 -4.56 118.33 112.54 1wuo n VAL 200 Ca 0.07 -0.31 0.00 0.00 -0.01 0.00 0.00 64.34 64.09 1wuo n VAL 200 Cb 0.54 -1.19 0.00 0.00 -0.91 0.00 0.00 33.84 32.28 1wuo n VAL 200 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1wuo n GLY 201 N 0.82 3.25 0.00 2.92 0.00 -0.03 -4.98 105.19 107.17 1wuo n GLY 201 Ca 0.13 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 44.88 1wuo n GLY 201 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1wuo n ASP 202 N -1.53 0.52 0.16 1.61 5.68 -1.26 -1.07 116.55 120.66 1wuo n ASP 202 Ca 0.00 -0.94 0.18 0.00 -0.50 0.00 0.00 54.79 53.53 1wuo n ASP 202 Cb 0.00 0.00 0.71 0.00 -1.14 0.00 0.00 41.12 40.69 1wuo n ASP 202 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1wuo h ALA 203 N 0.57 1.93 -0.07 2.12 0.00 -1.74 -1.44 119.26 120.63 1wuo h ALA 203 Ca 0.00 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1wuo h ALA 203 Cb 0.00 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1wuo h ALA 203 CO 0.00 -0.66 0.21 0.66 0.00 0.00 0.00 179.25 179.46 1wuo h SER 204 N 0.00 0.00 0.92 0.00 4.64 -1.93 -0.60 113.55 116.59 1wuo h SER 204 Ca 0.15 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.45 1wuo h SER 204 Cb 1.14 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1wuo h SER 204 CO -0.00 0.00 -0.10 -0.07 -0.87 0.00 0.00 176.83 175.79 1wuo h LEU 205 N 0.00 0.00 -0.34 5.97 3.38 -1.64 -1.32 115.31 121.36 1wuo h LEU 205 Ca 0.03 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.83 1wuo h LEU 205 Cb 0.45 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 1wuo h LEU 205 CO -0.00 0.10 -0.53 -0.07 0.09 0.00 0.00 178.44 178.03 1wuo h LEU 206 N 0.00 0.93 -0.23 1.67 3.38 -1.33 -1.47 115.31 118.26 1wuo h LEU 206 Ca -0.00 -0.49 -0.06 0.00 0.09 0.00 0.00 57.88 57.42 1wuo h LEU 206 Cb 0.59 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1wuo h LEU 206 CO 0.01 1.28 -0.07 0.50 0.09 0.00 0.00 178.44 180.25 1wuo h LYS 207 N 0.65 0.46 -0.64 1.13 1.63 -1.45 -2.47 116.57 115.89 1wuo h LYS 207 Ca 0.02 -0.18 -0.02 0.00 -0.85 0.00 0.00 60.65 59.61 1wuo h LYS 207 Cb 1.13 -0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 32.70 1wuo h LYS 207 CO 0.12 0.70 0.31 -0.07 -3.45 0.00 0.00 179.45 177.06 1wuo h LEU 208 N 0.19 0.81 -0.12 5.20 3.38 -1.22 -1.52 115.31 122.04 1wuo h LEU 208 Ca 0.06 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1wuo h LEU 208 Cb 0.54 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 1wuo h LEU 208 CO 0.03 0.69 0.04 0.74 0.09 0.00 0.00 178.44 180.02 1wuo h THR 209 N 0.90 1.18 -0.47 0.22 2.02 -1.16 -0.09 112.91 115.51 1wuo h THR 209 Ca 0.22 -0.55 0.08 0.00 0.77 0.00 0.00 66.41 66.93 1wuo h THR 209 Cb 0.09 1.33 -0.07 0.00 -1.74 0.00 0.00 68.15 67.75 1wuo h THR 209 CO -0.03 0.16 0.07 0.25 0.37 0.00 0.00 175.52 176.34 1wuo h LEU 210 N 0.00 -0.05 -0.84 2.58 5.85 -1.11 0.23 115.31 121.97 1wuo h LEU 210 Ca 0.04 0.09 0.03 0.00 0.84 0.00 0.00 57.88 58.87 1wuo h LEU 210 Cb 0.22 0.14 -0.05 0.00 0.37 0.00 0.00 40.66 41.34 1wuo h LEU 210 CO -0.00 0.01 0.54 -0.33 -0.34 0.00 0.00 178.44 178.32 1wuo h GLU 211 N 0.19 1.04 -0.41 1.25 5.08 -0.98 -0.16 114.58 120.60 1wuo h GLU 211 Ca 0.23 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.47 1wuo h GLU 211 Cb 0.32 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 1wuo h GLU 211 CO -0.33 0.69 0.02 1.96 -1.00 0.00 0.00 179.01 180.35 1wuo h GLN 212 N 1.07 0.71 -0.07 2.33 1.08 0.19 -1.45 115.11 118.97 1wuo h GLN 212 Ca 0.33 -0.22 -0.00 0.00 -1.45 0.00 0.00 58.65 57.31 1wuo h GLN 212 Cb -0.03 -0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 27.33 1wuo h GLN 212 CO -0.10 0.78 0.04 0.00 -0.95 0.00 0.00 178.83 178.60 1wuo h ALA 213 N 0.90 0.09 -0.48 3.87 0.00 0.08 0.42 119.26 124.14 1wuo h ALA 213 Ca 0.12 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1wuo h ALA 213 Cb 0.45 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1wuo h ALA 213 CO 0.02 -0.39 0.27 -0.39 0.00 0.00 0.00 179.25 178.76 1wuo h VAL 214 N 0.06 1.16 -0.63 0.00 -1.51 -1.07 -0.39 116.25 113.88 1wuo h VAL 214 Ca 0.03 -0.40 -0.03 0.00 -1.23 0.00 0.00 66.70 65.06 1wuo h VAL 214 Cb 0.04 0.56 -0.03 0.00 -2.13 0.00 0.00 31.29 29.73 1wuo h VAL 214 CO -0.00 0.17 0.26 0.50 -1.23 0.00 0.00 177.57 177.27 1wuo h LYS 215 N 0.64 0.91 -0.44 5.19 3.64 -0.86 -2.14 116.57 123.51 1wuo h LYS 215 Ca 0.17 -0.14 -0.10 0.00 -1.27 0.00 0.00 60.65 59.31 1wuo h LYS 215 Cb 0.04 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.68 1wuo h LYS 215 CO -0.03 0.73 -0.13 0.78 -2.27 0.00 0.00 179.45 178.54 1wuo h GLY 216 N 1.00 0.87 0.84 5.01 0.00 0.59 -1.12 103.07 110.25 1wuo h GLY 216 Ca 0.21 -0.68 -0.03 0.00 0.00 0.00 0.00 47.33 46.84 1wuo h GLY 216 CO -0.02 0.62 0.03 -2.00 0.00 0.00 0.00 176.54 175.17 1wuo h LEU 217 N 0.73 0.34 -1.11 3.11 5.85 -0.54 -2.50 115.31 121.18 1wuo h LEU 217 Ca 0.12 -0.27 -0.09 0.00 0.84 0.00 0.00 57.88 58.48 1wuo h LEU 217 Cb 0.62 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 1wuo h LEU 217 CO 0.04 0.52 -0.41 0.78 -0.34 0.00 0.00 178.44 179.04 1wuo h ASN 218 N 0.14 0.08 -0.49 1.25 2.35 -1.29 -2.86 115.58 114.75 1wuo h ASN 218 Ca 0.06 -0.03 -0.08 0.00 -0.55 0.00 0.00 56.30 55.71 1wuo h ASN 218 Cb 0.33 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.66 1wuo h ASN 218 CO 0.01 0.48 0.03 -0.08 -1.65 0.00 0.00 177.43 176.22 1wuo h GLU 219 N 0.06 0.90 0.43 0.81 4.57 -1.11 -3.25 114.58 116.99 1wuo h GLU 219 Ca 0.00 -0.24 -0.02 0.00 -1.18 0.00 0.00 59.36 57.92 1wuo h GLU 219 Cb 0.75 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.24 1wuo h GLU 219 CO 0.06 0.87 -0.21 0.66 -1.18 0.00 0.00 179.01 179.21 1wuo h SER 220 N 0.84 -0.49 -0.00 1.04 4.64 -1.23 -3.51 113.55 114.83 1wuo h SER 220 Ca 0.16 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1wuo h SER 220 Cb 0.45 0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.67 1wuo h SER 220 CO 0.02 -0.09 0.00 2.29 -0.87 0.00 0.00 176.83 178.18