#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wx7 s SER 2 N 0.00 6.54 -1.00 1.61 1.04 -1.26 -4.94 113.70 115.69 1wx7 s SER 2 Ca 0.00 2.63 -0.10 0.00 0.48 0.00 0.00 55.95 58.96 1wx7 s SER 2 Cb 0.00 -2.58 0.25 0.00 0.10 0.00 0.00 66.02 63.79 1wx7 s SER 2 CO 0.00 -0.88 0.97 -0.55 0.98 0.00 0.00 173.24 173.76 1wx7 s SER 3 N 1.72 7.04 0.00 7.02 0.15 -1.26 -4.56 113.70 123.82 1wx7 s SER 3 Ca 0.73 -3.31 0.00 0.00 0.70 0.00 0.00 55.95 54.07 1wx7 s SER 3 Cb -0.44 -2.19 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 1wx7 s SER 3 CO 0.32 -0.37 0.00 0.61 1.20 0.00 0.00 173.24 175.00 1wx7 n GLY 4 N 3.09 0.80 0.44 9.45 0.00 -1.26 -5.04 105.19 112.67 1wx7 n GLY 4 Ca 0.20 -0.63 -0.17 0.00 0.00 0.00 0.00 46.02 45.42 1wx7 n GLY 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1wx7 h SER 5 N 0.00 -0.95 0.00 1.61 0.87 -2.01 -3.40 113.55 109.67 1wx7 h SER 5 Ca 0.00 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 1wx7 h SER 5 Cb 0.32 0.25 0.00 0.00 -0.44 0.00 0.00 62.40 62.53 1wx7 h SER 5 CO 0.00 -0.67 0.00 -1.20 -0.53 0.00 0.00 176.83 174.43 1wx7 n SER 6 N -4.99 0.00 -2.49 6.23 7.64 -1.26 -5.03 113.62 113.72 1wx7 n SER 6 Ca -0.14 0.17 -0.07 0.00 1.01 0.00 0.00 58.87 59.85 1wx7 n SER 6 Cb 0.44 -0.25 0.03 0.00 -1.01 0.00 0.00 64.21 63.41 1wx7 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wx7 n GLY 7 N 2.16 -0.44 3.96 0.23 0.00 -1.26 -3.80 105.19 106.04 1wx7 n GLY 7 Ca 0.00 0.22 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 1wx7 n GLY 7 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1wx7 n SER 8 N -2.24 -2.27 -2.52 1.61 7.64 -1.26 -4.95 113.62 109.63 1wx7 n SER 8 Ca -0.03 -1.11 -0.00 0.00 1.01 0.00 0.00 58.87 58.73 1wx7 n SER 8 Cb 0.55 -2.63 0.00 0.00 -1.01 0.00 0.00 64.21 61.12 1wx7 n SER 8 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1wx7 n PRO 9 N -4.51 -1.04 -4.41 1.43 -0.04 -1.25 -5.09 135.00 120.09 1wx7 n PRO 9 Ca -0.21 -0.01 -0.24 0.00 -0.04 0.00 0.00 63.50 63.00 1wx7 n PRO 9 Cb 0.64 -0.01 -0.11 0.00 -0.04 0.00 0.00 33.50 33.98 1wx7 n PRO 9 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1wx7 s ALA 10 N -2.97 2.42 0.90 0.55 0.00 -1.26 -5.14 121.76 116.26 1wx7 s ALA 10 Ca 0.01 -1.69 -0.12 0.00 0.00 0.00 0.00 51.96 50.16 1wx7 s ALA 10 Cb -0.00 -0.24 0.13 0.00 0.00 0.00 0.00 23.12 23.01 1wx7 s ALA 10 CO 0.00 0.29 1.09 -1.25 0.00 0.00 0.00 175.76 175.90 1wx7 s PRO 11 N -3.09 1.19 -0.01 0.00 0.04 -1.26 -5.08 135.00 126.79 1wx7 s PRO 11 Ca 0.23 0.79 0.00 0.00 0.04 0.00 0.00 61.00 62.06 1wx7 s PRO 11 Cb -0.06 -1.80 0.02 0.00 0.04 0.00 0.00 34.50 32.70 1wx7 s PRO 11 CO 0.10 -2.28 0.02 0.08 0.04 0.00 0.00 177.00 174.96 1wx7 s VAL 12 N -2.94 -0.03 0.21 -0.36 1.01 -1.26 -5.16 120.40 111.88 1wx7 s VAL 12 Ca 0.64 0.11 0.10 0.00 0.00 0.00 0.00 61.98 62.82 1wx7 s VAL 12 Cb -0.18 -0.05 -0.05 0.00 0.00 0.00 0.00 36.38 36.10 1wx7 s VAL 12 CO 0.57 0.05 -0.18 -1.10 0.00 0.00 0.00 175.10 174.43 1wx7 s GLN 13 N 0.56 1.44 -0.17 2.72 -1.52 -1.26 -5.15 119.66 116.28 1wx7 s GLN 13 Ca -0.05 -1.58 -0.35 0.00 -1.95 0.00 0.00 55.36 51.43 1wx7 s GLN 13 Cb -0.07 -1.46 0.14 0.00 -0.22 0.00 0.00 33.01 31.40 1wx7 s GLN 13 CO -0.02 0.28 1.21 -0.51 -0.25 0.00 0.00 175.29 176.00 1wx7 s ASP 14 N -3.11 -0.14 0.00 5.90 1.01 -1.26 -5.09 116.67 113.98 1wx7 s ASP 14 Ca 0.23 -0.01 0.00 0.00 0.71 0.00 0.00 52.55 53.47 1wx7 s ASP 14 Cb -0.04 0.15 0.00 0.00 1.01 0.00 0.00 42.92 44.04 1wx7 s ASP 14 CO 0.10 -0.25 0.00 -0.81 0.21 0.00 0.00 175.17 174.42 1wx7 n PRO 15 N -0.13 0.00 -0.69 8.23 -0.04 -1.26 -4.68 135.00 136.43 1wx7 n PRO 15 Ca -0.00 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.47 1wx7 n PRO 15 Cb 0.59 -0.23 0.20 0.00 -0.04 0.00 0.00 33.50 34.02 1wx7 n PRO 15 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1wx7 n HIS 16 N 0.00 0.51 -1.85 0.54 8.25 -1.26 -5.01 115.22 116.41 1wx7 n HIS 16 Ca 0.00 -1.54 -0.40 0.00 -0.26 0.00 0.00 57.72 55.52 1wx7 n HIS 16 Cb 0.00 -0.36 -0.03 0.00 1.12 0.00 0.00 29.99 30.72 1wx7 n HIS 16 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1wx7 s LEU 17 N -3.24 3.42 0.46 2.41 1.98 -1.26 -1.93 118.68 120.51 1wx7 s LEU 17 Ca 0.41 1.10 0.08 0.00 -2.89 0.00 0.00 54.13 52.83 1wx7 s LEU 17 Cb 0.39 -3.03 0.01 0.00 0.66 0.00 0.00 46.19 44.22 1wx7 s LEU 17 CO -0.04 -2.19 0.50 0.27 -1.89 0.00 0.00 176.35 173.01 1wx7 s ILE 18 N 8.88 2.56 -0.00 6.68 -4.36 0.19 -4.85 121.20 130.30 1wx7 s ILE 18 Ca 0.84 -1.21 0.02 0.00 -0.26 0.00 0.00 60.65 60.04 1wx7 s ILE 18 Cb -0.20 -2.77 -0.03 0.00 1.25 0.00 0.00 42.46 40.70 1wx7 s ILE 18 CO 0.29 0.00 -0.02 -0.75 0.24 0.00 0.00 174.94 174.70 1wx7 s LYS 19 N -4.30 2.72 -0.05 0.37 2.36 -1.26 -0.12 119.74 119.46 1wx7 s LYS 19 Ca 0.51 -0.64 -0.02 0.00 -2.55 0.00 0.00 55.97 53.27 1wx7 s LYS 19 Cb -0.05 -2.62 0.03 0.00 -1.05 0.00 0.00 37.83 34.14 1wx7 s LYS 19 CO 0.30 0.62 0.04 0.08 1.55 0.00 0.00 175.35 177.95 1wx7 s VAL 20 N -1.04 0.04 -0.27 4.02 1.01 0.90 -2.89 120.40 122.17 1wx7 s VAL 20 Ca 0.18 0.33 -0.17 0.00 0.00 0.00 0.00 61.98 62.33 1wx7 s VAL 20 Cb -0.11 -0.27 -0.03 0.00 0.00 0.00 0.00 36.38 35.97 1wx7 s VAL 20 CO 0.09 0.20 0.45 -0.89 0.00 0.00 0.00 175.10 174.95 1wx7 s THR 21 N 2.11 5.11 -0.40 3.92 2.01 -0.93 0.27 115.64 127.73 1wx7 s THR 21 Ca 0.05 0.71 -0.20 0.00 0.31 0.00 0.00 61.69 62.55 1wx7 s THR 21 Cb -0.12 -3.78 0.01 0.00 0.01 0.00 0.00 72.50 68.62 1wx7 s THR 21 CO -0.04 0.10 0.62 -0.69 -0.69 0.00 0.00 174.62 173.92 1wx7 s VAL 22 N 2.21 4.87 -0.44 3.82 1.01 0.51 -0.10 120.40 132.29 1wx7 s VAL 22 Ca 0.18 0.30 -0.18 0.00 0.00 0.00 0.00 61.98 62.28 1wx7 s VAL 22 Cb -0.16 -4.13 0.03 0.00 0.00 0.00 0.00 36.38 32.12 1wx7 s VAL 22 CO 0.10 -0.45 0.48 -0.54 0.00 0.00 0.00 175.10 174.68 1wx7 s LYS 23 N 2.73 3.11 0.20 2.72 1.02 0.89 -2.16 119.74 128.25 1wx7 s LYS 23 Ca 0.23 -0.78 0.08 0.00 0.02 0.00 0.00 55.97 55.51 1wx7 s LYS 23 Cb -0.14 -3.99 -0.04 0.00 -0.52 0.00 0.00 37.83 33.13 1wx7 s LYS 23 CO 0.17 -0.93 0.00 0.95 -0.92 0.00 0.00 175.35 174.62 1wx7 s THR 24 N 2.23 3.67 -2.00 2.17 -4.23 0.11 0.19 115.64 117.80 1wx7 s THR 24 Ca 0.13 -1.54 0.09 0.00 -1.18 0.00 0.00 61.69 59.19 1wx7 s THR 24 Cb -0.18 -2.88 0.27 0.00 1.34 0.00 0.00 72.50 71.05 1wx7 s THR 24 CO 0.13 -0.18 1.00 -0.81 -0.54 0.00 0.00 174.62 174.22 1wx7 n PRO 25 N -0.34 0.49 0.00 3.99 -0.04 -1.26 -2.49 135.00 135.35 1wx7 n PRO 25 Ca -0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 1wx7 n PRO 25 Cb 0.56 -1.30 0.00 0.00 -0.04 0.00 0.00 33.50 32.72 1wx7 n PRO 25 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1wx7 n LYS 26 N -0.80 2.29 -3.83 0.54 5.02 -1.26 -5.13 118.16 114.99 1wx7 n LYS 26 Ca 0.07 0.00 0.02 0.00 -2.02 0.00 0.00 58.31 56.38 1wx7 n LYS 26 Cb 0.03 -0.86 0.01 0.00 -0.02 0.00 0.00 35.03 34.19 1wx7 n LYS 26 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1wx7 n ASP 27 N -1.35 -1.21 -3.78 4.39 8.00 -1.04 -5.18 116.55 116.39 1wx7 n ASP 27 Ca 0.00 -1.34 -0.13 0.00 0.71 0.00 0.00 54.79 54.04 1wx7 n ASP 27 Cb 0.19 1.89 -0.12 0.00 -0.02 0.00 0.00 41.12 43.06 1wx7 n ASP 27 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 1wx7 s LYS 28 N -2.02 0.27 0.01 -1.24 0.00 -1.26 0.10 119.74 115.60 1wx7 s LYS 28 Ca 0.27 0.35 -0.04 0.00 0.00 0.00 0.00 55.97 56.55 1wx7 s LYS 28 Cb -0.01 0.11 -0.01 0.00 0.00 0.00 0.00 37.83 37.92 1wx7 s LYS 28 CO 0.00 -0.05 0.07 -2.00 0.00 0.00 0.00 175.35 173.38 1wx7 s GLU 29 N 0.24 0.39 -0.07 1.78 2.56 -0.92 -4.99 118.70 117.69 1wx7 s GLU 29 Ca -0.01 -0.44 -0.11 0.00 0.00 0.00 0.00 54.97 54.41 1wx7 s GLU 29 Cb -0.03 0.15 -0.05 0.00 2.00 0.00 0.00 34.13 36.21 1wx7 s GLU 29 CO -0.01 -0.08 0.27 -0.51 -0.56 0.00 0.00 175.26 174.38 1wx7 s ASP 30 N -1.30 6.58 0.27 -1.70 1.11 -1.26 -0.36 116.67 120.02 1wx7 s ASP 30 Ca -0.14 0.69 0.08 0.00 0.18 0.00 0.00 52.55 53.37 1wx7 s ASP 30 Cb -0.08 -2.16 -0.05 0.00 1.07 0.00 0.00 42.92 41.69 1wx7 s ASP 30 CO 0.00 0.34 -0.11 -0.36 1.18 0.00 0.00 175.17 176.23 1wx7 s PHE 31 N -0.90 2.02 -0.18 4.23 0.40 0.14 -4.96 117.98 118.74 1wx7 s PHE 31 Ca 0.19 -0.57 -0.01 0.00 -0.60 0.00 0.00 56.93 55.94 1wx7 s PHE 31 Cb -0.14 -1.06 0.05 0.00 0.51 0.00 0.00 43.02 42.38 1wx7 s PHE 31 CO 0.08 0.42 -0.04 -1.54 0.70 0.00 0.00 175.22 174.85 1wx7 s SER 32 N -3.45 2.96 0.08 1.36 1.04 -1.26 -0.07 113.70 114.36 1wx7 s SER 32 Ca 0.28 -0.75 -0.13 0.00 0.48 0.00 0.00 55.95 55.84 1wx7 s SER 32 Cb 0.01 -0.89 0.02 0.00 0.10 0.00 0.00 66.02 65.26 1wx7 s SER 32 CO 0.12 -0.21 0.29 0.68 0.98 0.00 0.00 173.24 175.10 1wx7 s VAL 33 N 1.64 0.10 0.37 5.02 -7.23 0.84 -4.93 120.40 116.22 1wx7 s VAL 33 Ca -0.00 -0.83 -0.26 0.00 -1.81 0.00 0.00 61.98 59.08 1wx7 s VAL 33 Cb -0.16 -1.14 -0.09 0.00 0.56 0.00 0.00 36.38 35.55 1wx7 s VAL 33 CO -0.07 -0.46 1.16 0.42 -0.31 0.00 0.00 175.10 175.84 1wx7 s THR 34 N -3.36 3.20 0.56 5.32 -4.23 -1.26 0.55 115.64 116.42 1wx7 s THR 34 Ca 0.01 1.05 0.28 0.00 -1.18 0.00 0.00 61.69 61.84 1wx7 s THR 34 Cb 0.02 -3.61 0.40 0.00 1.34 0.00 0.00 72.50 70.65 1wx7 s THR 34 CO -0.08 0.13 1.96 -2.24 -0.54 0.00 0.00 174.62 173.85 1wx7 h ASP 35 N 2.89 0.00 0.89 3.99 3.04 -1.74 0.46 116.42 125.95 1wx7 h ASP 35 Ca -0.48 0.00 -0.03 0.00 -3.24 0.00 0.00 57.03 53.28 1wx7 h ASP 35 Cb 1.23 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 39.51 1wx7 h ASP 35 CO 0.63 0.00 -0.14 0.00 -2.04 0.00 0.00 179.24 177.69 1wx7 h THR 36 N 0.00 0.38 -2.89 1.15 1.03 -1.90 -2.49 112.91 108.18 1wx7 h THR 36 Ca 0.24 -0.86 -0.59 0.00 -0.01 0.00 0.00 66.41 65.19 1wx7 h THR 36 Cb 1.10 1.64 0.13 0.00 -1.07 0.00 0.00 68.15 69.95 1wx7 h THR 36 CO -0.00 0.14 0.07 0.00 -0.01 0.00 0.00 175.52 175.72 1wx7 s THR 38 N -1.29 5.08 0.16 0.00 -4.23 -1.26 -2.20 115.64 111.90 1wx7 s THR 38 Ca 0.63 -0.05 -0.16 0.00 -1.18 0.00 0.00 61.69 60.93 1wx7 s THR 38 Cb -0.58 -3.72 0.04 0.00 1.34 0.00 0.00 72.50 69.59 1wx7 s THR 38 CO 0.57 -0.24 1.72 0.40 -0.54 0.00 0.00 174.62 176.53 1wx7 h ILE 39 N 1.50 0.78 -0.29 2.99 1.08 -1.69 -0.60 117.51 121.29 1wx7 h ILE 39 Ca -0.48 -0.06 0.05 0.00 -0.39 0.00 0.00 64.86 63.99 1wx7 h ILE 39 Cb 1.19 0.61 -0.01 0.00 -3.07 0.00 0.00 36.82 35.53 1wx7 h ILE 39 CO 0.67 0.03 0.20 0.06 -0.69 0.00 0.00 178.15 178.42 1wx7 h GLN 40 N 0.16 0.14 0.00 2.37 -0.00 -1.84 0.78 115.11 116.72 1wx7 h GLN 40 Ca 0.18 -0.01 -0.04 0.00 -0.00 0.00 0.00 58.65 58.78 1wx7 h GLN 40 Cb 0.22 -0.03 -0.01 0.00 -0.00 0.00 0.00 27.48 27.66 1wx7 h GLN 40 CO -0.25 0.09 -0.18 1.96 -0.00 0.00 0.00 178.83 180.45 1wx7 h GLN 41 N 0.15 0.00 0.07 0.06 4.20 -1.48 -3.23 115.11 114.87 1wx7 h GLN 41 Ca 0.13 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.84 1wx7 h GLN 41 Cb 0.33 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.11 1wx7 h GLN 41 CO -0.02 0.18 -0.03 1.25 -0.67 0.00 0.00 178.83 179.54 1wx7 h LEU 42 N 0.00 -0.07 -0.92 1.46 5.85 -0.37 -3.33 115.31 117.92 1wx7 h LEU 42 Ca -0.00 -0.55 0.12 0.00 0.84 0.00 0.00 57.88 58.29 1wx7 h LEU 42 Cb 0.75 0.02 -0.14 0.00 0.37 0.00 0.00 40.66 41.66 1wx7 h LEU 42 CO 0.02 0.57 -0.46 0.11 -0.34 0.00 0.00 178.44 178.35 1wx7 h LYS 43 N -0.79 -0.04 -1.30 1.25 6.56 -1.53 1.02 116.57 121.75 1wx7 h LYS 43 Ca -0.01 0.00 0.40 0.00 -1.06 0.00 0.00 60.65 59.98 1wx7 h LYS 43 Cb 0.62 0.01 -0.10 0.00 -0.57 0.00 0.00 32.23 32.18 1wx7 h LYS 43 CO 0.01 -0.03 0.86 0.93 -2.06 0.00 0.00 179.45 179.17 1wx7 h GLU 44 N -0.04 0.14 0.10 3.15 5.08 -1.67 0.64 114.58 121.97 1wx7 h GLU 44 Ca 0.26 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.61 1wx7 h GLU 44 Cb 0.53 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.75 1wx7 h GLU 44 CO -0.92 0.09 -0.05 0.93 -1.00 0.00 0.00 179.01 178.06 1wx7 h GLU 45 N 0.14 -0.13 0.00 2.33 4.39 0.94 -3.27 114.58 118.97 1wx7 h GLU 45 Ca 0.74 0.01 0.00 0.00 0.34 0.00 0.00 59.36 60.45 1wx7 h GLU 45 Cb 2.39 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 31.07 1wx7 h GLU 45 CO -0.30 -0.09 0.09 0.44 -1.16 0.00 0.00 179.01 177.99 1wx7 n ILE 46 N -3.76 1.31 -0.30 3.13 -5.35 -0.63 -1.66 119.36 112.10 1wx7 n ILE 46 Ca -0.02 0.62 -0.04 0.00 -0.27 0.00 0.00 62.75 63.04 1wx7 n ILE 46 Cb 0.06 -1.62 0.07 0.00 -1.74 0.00 0.00 39.64 36.41 1wx7 n ILE 46 CO 0.00 0.00 0.00 -1.28 -1.76 0.00 0.00 176.55 173.51 1wx7 h SER 47 N 0.00 0.97 0.39 7.28 0.87 0.19 0.23 113.55 123.48 1wx7 h SER 47 Ca 0.00 -0.05 -0.32 0.00 -1.23 0.00 0.00 61.79 60.19 1wx7 h SER 47 Cb 0.18 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.89 1wx7 h SER 47 CO 0.00 0.73 -1.62 0.06 -0.53 0.00 0.00 176.83 175.48 1wx7 h GLN 48 N 1.12 0.25 -0.33 2.24 3.07 -1.48 0.60 115.11 120.58 1wx7 h GLN 48 Ca 0.30 -0.44 -0.07 0.00 0.09 0.00 0.00 58.65 58.53 1wx7 h GLN 48 Cb -0.07 0.16 -0.02 0.00 0.08 0.00 0.00 27.48 27.63 1wx7 h GLN 48 CO -0.06 1.11 -0.10 0.00 0.09 0.00 0.00 178.83 179.88 1wx7 h ARG 49 N 0.07 0.56 0.00 0.06 2.47 -1.47 -3.09 114.38 112.98 1wx7 h ARG 49 Ca -0.28 -0.16 0.00 0.00 -1.26 0.00 0.00 59.98 58.29 1wx7 h ARG 49 Cb 2.03 -0.06 0.00 0.00 -1.65 0.00 0.00 29.97 30.29 1wx7 h ARG 49 CO 0.15 0.65 -0.72 1.19 0.56 0.00 0.00 179.97 181.80 1wx7 n PHE 50 N -4.21 0.00 -3.06 3.04 3.72 0.78 -5.02 117.46 112.71 1wx7 n PHE 50 Ca 0.01 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.28 1wx7 n PHE 50 Cb 0.32 -0.04 0.07 0.00 -0.94 0.00 0.00 39.48 38.88 1wx7 n PHE 50 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1wx7 n LYS 51 N -1.38 -4.88 -3.92 -1.08 4.76 0.17 -5.03 118.16 106.81 1wx7 n LYS 51 Ca 0.02 0.63 -0.12 0.00 -2.87 0.00 0.00 58.31 55.97 1wx7 n LYS 51 Cb 0.21 -5.01 -0.14 0.00 -1.84 0.00 0.00 35.03 28.26 1wx7 n LYS 51 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1wx7 s ALA 52 N -3.27 0.07 0.40 7.82 0.00 0.11 -4.99 121.76 121.90 1wx7 s ALA 52 Ca 0.01 -0.05 -0.27 0.00 0.00 0.00 0.00 51.96 51.64 1wx7 s ALA 52 Cb -0.00 -0.01 -0.10 0.00 0.00 0.00 0.00 23.12 23.01 1wx7 s ALA 52 CO 0.54 0.01 1.45 -1.58 0.00 0.00 0.00 175.76 176.19 1wx7 s HIS 53 N -0.07 2.58 -1.60 0.00 2.46 -1.26 -4.12 115.29 113.28 1wx7 s HIS 53 Ca -0.00 1.22 0.15 0.00 0.47 0.00 0.00 55.06 56.89 1wx7 s HIS 53 Cb -0.01 -3.97 0.80 0.00 -0.13 0.00 0.00 32.58 29.28 1wx7 s HIS 53 CO -0.00 -2.89 1.39 -0.35 -2.47 0.00 0.00 174.74 170.42 1wx7 n PRO 54 N 0.28 0.29 0.00 2.88 -0.04 -1.26 -2.01 135.00 135.14 1wx7 n PRO 54 Ca 0.02 0.10 0.13 0.00 -0.04 0.00 0.00 63.50 63.71 1wx7 n PRO 54 Cb 0.40 -1.50 0.35 0.00 -0.04 0.00 0.00 33.50 32.71 1wx7 n PRO 54 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1wx7 n ASP 55 N -1.20 0.82 -0.03 3.54 5.75 -1.26 -4.24 116.55 119.93 1wx7 n ASP 55 Ca 0.08 -0.66 -0.04 0.00 -0.01 0.00 0.00 54.79 54.17 1wx7 n ASP 55 Cb 0.10 0.16 -0.03 0.00 -1.03 0.00 0.00 41.12 40.32 1wx7 n ASP 55 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1wx7 n GLN 56 N -0.94 0.14 -1.51 0.11 10.64 -0.85 -4.96 117.38 120.01 1wx7 n GLN 56 Ca 0.10 0.03 -0.57 0.00 -1.83 0.00 0.00 57.00 54.73 1wx7 n GLN 56 Cb 0.34 -1.11 -0.07 0.00 -0.86 0.00 0.00 30.24 28.54 1wx7 n GLN 56 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 1wx7 n LEU 57 N -2.68 0.20 -3.88 2.61 4.77 -1.08 -3.77 117.00 113.18 1wx7 n LEU 57 Ca -0.10 1.15 -0.28 0.00 -0.03 0.00 0.00 56.01 56.75 1wx7 n LEU 57 Cb 0.61 -0.96 -0.16 0.00 -2.33 0.00 0.00 43.42 40.57 1wx7 n LEU 57 CO 0.06 -1.82 -0.42 -0.69 -1.33 0.00 0.00 177.39 173.19 1wx7 s VAL 58 N 0.03 1.10 -0.01 4.08 1.01 -0.55 -4.97 120.40 121.08 1wx7 s VAL 58 Ca 0.89 -0.67 -0.15 0.00 0.00 0.00 0.00 61.98 62.04 1wx7 s VAL 58 Cb -1.20 -1.31 -0.06 0.00 0.00 0.00 0.00 36.38 33.81 1wx7 s VAL 58 CO 0.55 0.08 0.43 -0.76 0.00 0.00 0.00 175.10 175.40 1wx7 s LEU 59 N 1.63 4.45 -0.09 3.92 1.43 -1.26 0.32 118.68 129.08 1wx7 s LEU 59 Ca 0.00 0.96 -0.00 0.00 -1.03 0.00 0.00 54.13 54.06 1wx7 s LEU 59 Cb -0.16 -2.62 0.02 0.00 0.03 0.00 0.00 46.19 43.47 1wx7 s LEU 59 CO -0.08 0.28 -0.05 -0.63 0.23 0.00 0.00 176.35 176.10 1wx7 s ILE 60 N -0.85 0.80 -0.01 -0.59 1.01 -0.94 -2.63 121.20 118.00 1wx7 s ILE 60 Ca 0.24 -0.16 -0.01 0.00 0.00 0.00 0.00 60.65 60.72 1wx7 s ILE 60 Cb -0.17 -0.86 -0.00 0.00 0.01 0.00 0.00 42.46 41.44 1wx7 s ILE 60 CO 0.13 0.33 0.03 0.12 0.00 0.00 0.00 174.94 175.55 1wx7 s PHE 61 N 1.69 0.04 -1.49 3.97 2.19 -0.87 -2.71 117.98 120.80 1wx7 s PHE 61 Ca 0.03 -0.07 0.00 0.00 0.33 0.00 0.00 56.93 57.23 1wx7 s PHE 61 Cb -0.13 -0.04 0.00 0.00 -1.31 0.00 0.00 43.02 41.54 1wx7 s PHE 61 CO -0.06 -0.08 0.00 0.00 1.83 0.00 0.00 175.22 176.91 1wx7 n ALA 62 N 2.58 -0.64 -1.61 11.12 0.00 -1.26 -0.50 120.51 130.21 1wx7 n ALA 62 Ca -0.16 0.15 -0.12 0.00 0.00 0.00 0.00 53.44 53.31 1wx7 n ALA 62 Cb 0.58 -1.86 -0.04 0.00 0.00 0.00 0.00 19.45 18.14 1wx7 n ALA 62 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wx7 n GLY 63 N -0.84 0.92 2.89 0.00 0.00 -1.26 -4.99 105.19 101.91 1wx7 n GLY 63 Ca -0.20 -0.42 -0.14 0.00 0.00 0.00 0.00 46.02 45.26 1wx7 n GLY 63 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wx7 s LYS 64 N -3.49 0.06 -0.12 1.61 -2.85 0.35 -5.11 119.74 110.18 1wx7 s LYS 64 Ca 0.00 0.26 -0.29 0.00 -1.00 0.00 0.00 55.97 54.94 1wx7 s LYS 64 Cb 0.00 -0.14 -0.05 0.00 -2.06 0.00 0.00 37.83 35.58 1wx7 s LYS 64 CO 0.00 -0.13 1.83 0.42 0.10 0.00 0.00 175.35 177.58 1wx7 s ILE 65 N 0.87 3.36 0.48 3.79 -1.09 -1.26 -2.05 121.20 125.29 1wx7 s ILE 65 Ca -0.07 0.41 -0.23 0.00 -2.23 0.00 0.00 60.65 58.54 1wx7 s ILE 65 Cb -0.09 -3.34 -0.09 0.00 -1.58 0.00 0.00 42.46 37.36 1wx7 s ILE 65 CO -0.04 -0.12 1.03 0.18 -1.23 0.00 0.00 174.94 174.77 1wx7 n LEU 66 N 8.59 3.13 -4.91 2.97 4.77 -1.08 -4.97 117.00 125.50 1wx7 n LEU 66 Ca 0.21 0.97 -0.26 0.00 -0.03 0.00 0.00 56.01 56.90 1wx7 n LEU 66 Cb 0.44 -1.39 -0.04 0.00 -2.33 0.00 0.00 43.42 40.11 1wx7 n LEU 66 CO 0.65 -1.48 -0.12 -0.54 -1.33 0.00 0.00 177.39 174.57 1wx7 s LYS 67 N -2.27 3.31 0.04 3.23 -0.14 -1.26 -4.88 119.74 117.77 1wx7 s LYS 67 Ca 0.67 -0.67 -0.28 0.00 -1.36 0.00 0.00 55.97 54.33 1wx7 s LYS 67 Cb -0.50 -2.89 -0.17 0.00 -1.68 0.00 0.00 37.83 32.59 1wx7 s LYS 67 CO 0.54 0.51 1.41 0.22 -0.76 0.00 0.00 175.35 177.27 1wx7 h ASP 68 N 2.17 -0.50 0.00 2.83 3.58 -1.95 -2.66 116.42 119.88 1wx7 h ASP 68 Ca -0.48 -0.07 0.00 0.00 0.42 0.00 0.00 57.03 56.90 1wx7 h ASP 68 Cb 1.20 0.13 0.00 0.00 1.72 0.00 0.00 39.33 42.38 1wx7 h ASP 68 CO 0.67 -0.22 0.00 -0.81 -2.88 0.00 0.00 179.24 176.00 1wx7 n PRO 69 N -5.27 0.49 -3.52 0.28 -0.04 -1.26 -3.48 135.00 122.20 1wx7 n PRO 69 Ca -0.11 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 62.93 1wx7 n PRO 69 Cb 0.29 -1.30 -0.09 0.00 -0.04 0.00 0.00 33.50 32.36 1wx7 n PRO 69 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1wx7 s ASP 70 N -1.80 5.83 0.84 3.54 1.11 -1.00 -5.05 116.67 120.14 1wx7 s ASP 70 Ca 0.14 -1.49 -0.12 0.00 0.18 0.00 0.00 52.55 51.26 1wx7 s ASP 70 Cb 0.06 -2.06 0.10 0.00 1.07 0.00 0.00 42.92 42.09 1wx7 s ASP 70 CO 0.11 -0.60 1.18 -1.54 1.18 0.00 0.00 175.17 175.50 1wx7 n SER 71 N 5.02 0.79 -0.29 0.27 3.41 -1.26 -4.00 113.62 117.56 1wx7 n SER 71 Ca -0.11 0.53 0.22 0.00 -0.26 0.00 0.00 58.87 59.26 1wx7 n SER 71 Cb 0.43 -1.50 0.53 0.00 -0.26 0.00 0.00 64.21 63.41 1wx7 n SER 71 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1wx7 h LEU 72 N -1.21 0.40 -0.36 1.04 3.38 -0.99 0.64 115.31 118.21 1wx7 h LEU 72 Ca -0.45 0.06 -0.13 0.00 0.09 0.00 0.00 57.88 57.45 1wx7 h LEU 72 Cb 1.29 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 42.02 1wx7 h LEU 72 CO 0.44 0.11 -0.61 0.00 0.09 0.00 0.00 178.44 178.47 1wx7 h ALA 73 N 1.60 0.72 0.00 1.53 0.00 -1.66 0.76 119.26 122.21 1wx7 h ALA 73 Ca 0.54 -0.56 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1wx7 h ALA 73 Cb 1.44 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 1wx7 h ALA 73 CO -0.23 0.76 -0.31 1.96 0.00 0.00 0.00 179.25 181.43 1wx7 h GLN 74 N 0.00 0.00 0.00 0.00 4.20 -0.15 -3.25 115.11 115.91 1wx7 h GLN 74 Ca -0.01 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.62 1wx7 h GLN 74 Cb 1.31 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.08 1wx7 h GLN 74 CO 0.08 0.13 -1.10 0.00 -0.67 0.00 0.00 178.83 177.27 1wx7 n GLY 76 N 1.28 1.30 3.77 0.00 0.00 -0.98 -4.91 105.19 105.64 1wx7 n GLY 76 Ca -0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 1wx7 n GLY 76 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wx7 s VAL 77 N -2.00 4.22 0.35 1.61 1.01 0.26 -4.99 120.40 120.86 1wx7 s VAL 77 Ca 0.00 1.86 0.06 0.00 0.00 0.00 0.00 61.98 63.90 1wx7 s VAL 77 Cb 0.00 -4.15 -0.03 0.00 0.00 0.00 0.00 36.38 32.20 1wx7 s VAL 77 CO 0.00 0.38 0.24 -0.13 0.00 0.00 0.00 175.10 175.59 1wx7 s ARG 78 N -1.50 1.81 -0.79 2.72 1.81 -1.26 -4.08 118.95 117.67 1wx7 s ARG 78 Ca 0.43 -2.07 -0.25 0.00 -1.72 0.00 0.00 55.73 52.11 1wx7 s ARG 78 Cb -0.22 0.09 -0.01 0.00 -0.45 0.00 0.00 34.95 34.36 1wx7 s ARG 78 CO 0.27 -0.62 1.73 0.34 -0.68 0.00 0.00 175.30 176.34 1wx7 s ASP 79 N -3.44 5.57 0.00 0.23 2.15 -1.26 -2.37 116.67 117.54 1wx7 s ASP 79 Ca 0.36 -0.39 0.00 0.00 0.43 0.00 0.00 52.55 52.95 1wx7 s ASP 79 Cb 0.02 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 40.09 1wx7 s ASP 79 CO 0.24 -2.27 0.00 0.61 -0.17 0.00 0.00 175.17 173.58 1wx7 n GLY 80 N 6.19 1.63 3.97 2.66 0.00 -1.14 -4.83 105.19 113.67 1wx7 n GLY 80 Ca 0.26 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.06 1wx7 n GLY 80 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wx7 s LEU 81 N 0.00 3.44 0.17 0.99 1.43 -1.00 -4.98 118.68 118.73 1wx7 s LEU 81 Ca 0.00 0.07 0.09 0.00 -1.03 0.00 0.00 54.13 53.25 1wx7 s LEU 81 Cb 0.00 -2.96 -0.04 0.00 0.03 0.00 0.00 46.19 43.22 1wx7 s LEU 81 CO 0.00 -0.95 -0.19 -0.89 0.23 0.00 0.00 176.35 174.55 1wx7 s THR 82 N -2.65 1.87 -0.10 5.49 2.01 -1.26 -2.18 115.64 118.82 1wx7 s THR 82 Ca 0.54 -1.92 -0.03 0.00 0.31 0.00 0.00 61.69 60.58 1wx7 s THR 82 Cb -0.10 -1.87 0.05 0.00 0.01 0.00 0.00 72.50 70.59 1wx7 s THR 82 CO 0.38 -0.29 0.13 -0.69 -0.69 0.00 0.00 174.62 173.46 1wx7 s VAL 83 N -1.99 -0.20 -0.55 3.82 1.01 0.86 -4.91 120.40 118.44 1wx7 s VAL 83 Ca 0.16 0.23 -0.27 0.00 0.00 0.00 0.00 61.98 62.10 1wx7 s VAL 83 Cb -0.06 -0.35 -0.01 0.00 0.00 0.00 0.00 36.38 35.96 1wx7 s VAL 83 CO 0.07 0.04 1.69 -1.00 0.00 0.00 0.00 175.10 175.90 1wx7 s HIS 84 N 2.24 1.91 0.28 5.22 3.76 -1.10 -0.07 115.29 127.52 1wx7 s HIS 84 Ca 0.04 0.63 -0.14 0.00 -0.15 0.00 0.00 55.06 55.43 1wx7 s HIS 84 Cb -0.13 -4.21 -0.08 0.00 1.11 0.00 0.00 32.58 29.26 1wx7 s HIS 84 CO -0.06 -2.32 0.68 -1.17 -0.85 0.00 0.00 174.74 171.02 1wx7 s LEU 85 N 7.59 4.13 -0.17 0.89 2.96 0.52 -2.22 118.68 132.38 1wx7 s LEU 85 Ca 0.64 1.20 -0.04 0.00 -0.22 0.00 0.00 54.13 55.70 1wx7 s LEU 85 Cb -0.14 -3.89 0.06 0.00 0.50 0.00 0.00 46.19 42.72 1wx7 s LEU 85 CO 0.24 -0.13 0.07 -0.69 -1.32 0.00 0.00 176.35 174.52 1wx7 s VAL 86 N -1.87 0.08 0.02 1.68 1.01 0.15 -4.13 120.40 117.33 1wx7 s VAL 86 Ca 0.51 -0.24 -0.27 0.00 0.00 0.00 0.00 61.98 61.97 1wx7 s VAL 86 Cb -0.11 -0.68 -0.05 0.00 0.00 0.00 0.00 36.38 35.54 1wx7 s VAL 86 CO 0.19 -0.24 0.84 -0.63 0.00 0.00 0.00 175.10 175.26 1wx7 s ILE 87 N 2.07 4.79 -0.18 2.22 1.09 -1.26 -1.48 121.20 128.43 1wx7 s ILE 87 Ca 0.01 1.78 0.22 0.00 -1.10 0.00 0.00 60.65 61.57 1wx7 s ILE 87 Cb -0.16 -4.19 -0.08 0.00 -1.06 0.00 0.00 42.46 36.97 1wx7 s ILE 87 CO -0.08 0.28 0.90 0.29 -0.10 0.00 0.00 174.94 176.23 1wx7 n LYS 88 N 3.28 0.62 -2.80 2.79 4.76 -1.25 -4.97 118.16 120.59 1wx7 n LYS 88 Ca 0.01 0.07 -0.21 0.00 -2.87 0.00 0.00 58.31 55.30 1wx7 n LYS 88 Cb 0.50 -1.76 0.02 0.00 -1.84 0.00 0.00 35.03 31.95 1wx7 n LYS 88 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1wx7 n ARG 89 N -2.62 -3.77 -0.83 1.97 5.12 -1.26 -4.85 116.66 110.42 1wx7 n ARG 89 Ca -0.02 0.93 -0.08 0.00 -1.93 0.00 0.00 57.85 56.74 1wx7 n ARG 89 Cb 0.59 -5.69 -0.12 0.00 -1.16 0.00 0.00 32.46 26.08 1wx7 n ARG 89 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1wx7 n GLN 90 N -3.64 1.66 -4.26 5.56 6.02 -1.26 -4.85 117.38 116.61 1wx7 n GLN 90 Ca -0.16 -0.70 -0.27 0.00 -0.01 0.00 0.00 57.00 55.87 1wx7 n GLN 90 Cb 0.64 -1.72 -0.09 0.00 1.02 0.00 0.00 30.24 30.09 1wx7 n GLN 90 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1wx7 s HIS 91 N 0.80 2.71 -0.13 1.08 2.46 -1.26 -4.92 115.29 116.04 1wx7 s HIS 91 Ca 0.47 -0.19 -0.10 0.00 0.47 0.00 0.00 55.06 55.71 1wx7 s HIS 91 Cb 0.22 -1.32 -0.08 0.00 -0.13 0.00 0.00 32.58 31.27 1wx7 s HIS 91 CO 0.00 0.52 0.16 -0.09 -2.47 0.00 0.00 174.74 172.86 1wx7 h ARG 92 N 2.83 0.00 -6.62 2.88 2.43 -2.05 -3.48 114.38 110.37 1wx7 h ARG 92 Ca -0.47 0.00 -0.45 0.00 -0.81 0.00 0.00 59.98 58.26 1wx7 h ARG 92 Cb 1.20 0.00 0.03 0.00 -0.42 0.00 0.00 29.97 30.79 1wx7 h ARG 92 CO 0.56 0.31 -0.15 0.00 -1.51 0.00 0.00 179.97 179.18 1wx7 s ALA 93 N -2.49 4.40 0.11 2.80 0.00 -1.26 -5.03 121.76 120.28 1wx7 s ALA 93 Ca -0.09 -1.75 -0.34 0.00 0.00 0.00 0.00 51.96 49.78 1wx7 s ALA 93 Cb 0.00 -1.69 -0.14 0.00 0.00 0.00 0.00 23.12 21.29 1wx7 s ALA 93 CO 0.25 -0.62 1.56 1.98 0.00 0.00 0.00 175.76 178.93 1wx7 h MET 94 N 0.32 -0.72 0.00 0.00 1.85 -2.02 -3.48 114.93 110.87 1wx7 h MET 94 Ca -0.37 0.05 0.00 0.00 -0.61 0.00 0.00 59.70 58.77 1wx7 h MET 94 Cb 1.28 0.16 0.00 0.00 0.43 0.00 0.00 31.60 33.48 1wx7 h MET 94 CO 0.45 -0.48 0.00 0.41 -0.40 0.00 0.00 176.91 176.88 1wx7 n GLY 95 N -1.49 3.69 3.25 1.39 0.00 -1.26 -4.93 105.19 105.84 1wx7 n GLY 95 Ca -0.08 -1.09 -0.12 0.00 0.00 0.00 0.00 46.02 44.72 1wx7 n GLY 95 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1wx7 s ASN 96 N 0.00 -0.13 0.84 1.61 2.47 -1.26 -5.16 114.94 113.31 1wx7 s ASN 96 Ca 0.00 -0.13 -0.12 0.00 0.42 0.00 0.00 52.86 53.03 1wx7 s ASN 96 Cb 0.00 0.34 0.10 0.00 -1.45 0.00 0.00 41.25 40.25 1wx7 s ASN 96 CO 0.00 -0.57 1.18 -0.70 -3.72 0.00 0.00 177.10 173.28 1wx7 s GLU 97 N -2.26 1.47 0.17 0.43 2.56 -1.26 -5.04 118.70 114.76 1wx7 s GLU 97 Ca -0.07 1.65 0.10 0.00 0.00 0.00 0.00 54.97 56.65 1wx7 s GLU 97 Cb -0.02 -1.77 -0.04 0.00 2.00 0.00 0.00 34.13 34.30 1wx7 s GLU 97 CO -0.02 -2.32 -0.22 0.00 -0.56 0.00 0.00 175.26 172.14 1wx7 n PRO 99 N 0.41 0.49 -0.23 0.00 -0.04 -1.26 -4.05 135.00 130.32 1wx7 n PRO 99 Ca -0.14 0.00 0.17 0.00 -0.04 0.00 0.00 63.50 63.50 1wx7 n PRO 99 Cb 0.56 -1.36 0.33 0.00 -0.04 0.00 0.00 33.50 32.98 1wx7 n PRO 99 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1wx7 n ALA 100 N -0.86 0.57 -3.04 0.55 0.00 -1.26 -4.44 120.51 112.03 1wx7 n ALA 100 Ca 0.08 0.73 -0.12 0.00 0.00 0.00 0.00 53.44 54.14 1wx7 n ALA 100 Cb 0.04 -0.65 -0.08 0.00 0.00 0.00 0.00 19.45 18.76 1wx7 n ALA 100 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1wx7 s SER 101 N -4.81 -0.11 0.00 0.00 0.15 -1.26 -4.95 113.70 102.73 1wx7 s SER 101 Ca -0.07 -0.16 0.00 0.00 0.70 0.00 0.00 55.95 56.42 1wx7 s SER 101 Cb 0.23 0.33 0.00 0.00 -1.71 0.00 0.00 66.02 64.86 1wx7 s SER 101 CO 0.55 -0.55 0.00 0.61 1.20 0.00 0.00 173.24 175.04 1wx7 n GLY 102 N 0.80 1.53 0.00 9.45 0.00 -1.26 -4.70 105.19 111.01 1wx7 n GLY 102 Ca -0.20 -0.88 0.08 0.00 0.00 0.00 0.00 46.02 45.02 1wx7 n GLY 102 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wx7 n PRO 103 N 0.00 0.40 -2.24 1.61 -0.04 -1.26 -4.61 135.00 128.86 1wx7 n PRO 103 Ca 0.00 0.05 -0.35 0.00 -0.04 0.00 0.00 63.50 63.16 1wx7 n PRO 103 Cb 0.00 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 31.92 1wx7 n PRO 103 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1wx7 s SER 104 N -2.18 5.65 0.16 3.54 0.15 -1.26 -4.96 113.70 114.79 1wx7 s SER 104 Ca 0.20 -0.60 -0.30 0.00 0.70 0.00 0.00 55.95 55.96 1wx7 s SER 104 Cb 0.10 -2.56 -0.07 0.00 -1.71 0.00 0.00 66.02 61.79 1wx7 s SER 104 CO 0.19 -2.23 1.03 -0.94 1.20 0.00 0.00 173.24 172.50 1wx7 s SER 105 N 6.68 7.39 0.00 5.45 1.04 -1.26 -5.04 113.70 127.96 1wx7 s SER 105 Ca 0.58 1.96 0.00 0.00 0.48 0.00 0.00 55.95 58.98 1wx7 s SER 105 Cb -0.07 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.46 1wx7 s SER 105 CO 0.04 -0.12 0.00 0.61 0.98 0.00 0.00 173.24 174.75