#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wx7 n SER 2 N 0.00 2.69 -3.95 1.61 2.88 -1.26 -5.00 113.62 110.59 1wx7 n SER 2 Ca 0.00 1.20 -0.24 0.00 -1.33 0.00 0.00 58.87 58.50 1wx7 n SER 2 Cb 0.00 -1.47 -0.17 0.00 -0.75 0.00 0.00 64.21 61.82 1wx7 n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1wx7 s SER 3 N -0.28 1.72 0.01 -3.46 1.04 -1.26 -5.04 113.70 106.43 1wx7 s SER 3 Ca 0.56 -0.25 -0.20 0.00 0.48 0.00 0.00 55.95 56.54 1wx7 s SER 3 Cb -0.58 -0.73 -0.20 0.00 0.10 0.00 0.00 66.02 64.61 1wx7 s SER 3 CO 0.61 -0.04 1.18 1.23 0.98 0.00 0.00 173.24 177.20 1wx7 h GLY 4 N 7.46 0.42 -7.07 7.32 0.00 -1.94 -3.47 103.07 105.78 1wx7 h GLY 4 Ca -0.31 -0.61 -0.61 0.00 0.00 0.00 0.00 47.33 45.80 1wx7 h GLY 4 CO 0.44 0.54 -0.91 -1.26 0.00 0.00 0.00 176.54 175.35 1wx7 n SER 5 N -4.36 -1.30 -4.53 0.19 2.88 -1.26 -4.72 113.62 100.52 1wx7 n SER 5 Ca -0.09 -1.21 -0.45 0.00 -1.33 0.00 0.00 58.87 55.80 1wx7 n SER 5 Cb 0.54 -1.86 -0.05 0.00 -0.75 0.00 0.00 64.21 62.09 1wx7 n SER 5 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1wx7 n SER 6 N -2.63 2.64 0.00 -3.46 3.41 -1.26 -4.92 113.62 107.40 1wx7 n SER 6 Ca -0.02 0.20 0.00 0.00 -0.26 0.00 0.00 58.87 58.79 1wx7 n SER 6 Cb 0.53 -1.43 0.00 0.00 -0.26 0.00 0.00 64.21 63.05 1wx7 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wx7 n GLY 7 N 6.13 0.46 3.78 5.00 0.00 -1.26 -5.00 105.19 114.29 1wx7 n GLY 7 Ca 0.36 -0.04 -0.34 0.00 0.00 0.00 0.00 46.02 46.01 1wx7 n GLY 7 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wx7 s SER 8 N -1.21 5.69 0.60 1.61 0.15 -1.26 -5.10 113.70 114.19 1wx7 s SER 8 Ca 0.00 0.18 -0.17 0.00 0.70 0.00 0.00 55.95 56.66 1wx7 s SER 8 Cb 0.00 -1.66 -0.03 0.00 -1.71 0.00 0.00 66.02 62.62 1wx7 s SER 8 CO 0.00 0.30 1.12 -2.16 1.20 0.00 0.00 173.24 173.70 1wx7 s PRO 9 N -1.52 3.07 -0.06 5.44 0.04 -1.26 -5.06 135.00 135.64 1wx7 s PRO 9 Ca 0.21 1.49 -0.29 0.00 0.04 0.00 0.00 61.00 62.44 1wx7 s PRO 9 Cb -0.12 -1.98 0.11 0.00 0.04 0.00 0.00 34.50 32.55 1wx7 s PRO 9 CO 0.11 -1.06 0.90 0.00 0.04 0.00 0.00 177.00 176.99 1wx7 s ALA 10 N -2.08 -1.85 1.08 8.56 0.00 -1.26 -5.18 121.76 121.03 1wx7 s ALA 10 Ca 0.70 1.25 -0.15 0.00 0.00 0.00 0.00 51.96 53.76 1wx7 s ALA 10 Cb -0.22 -0.05 0.23 0.00 0.00 0.00 0.00 23.12 23.08 1wx7 s ALA 10 CO 0.35 -0.51 1.10 -1.25 0.00 0.00 0.00 175.76 175.45 1wx7 s PRO 11 N -2.14 -0.23 0.01 0.00 0.04 -1.26 -5.08 135.00 126.35 1wx7 s PRO 11 Ca 0.00 0.30 0.02 0.00 0.04 0.00 0.00 61.00 61.35 1wx7 s PRO 11 Cb -0.01 -1.68 -0.01 0.00 0.04 0.00 0.00 34.50 32.84 1wx7 s PRO 11 CO -0.03 -3.12 -0.05 0.08 0.04 0.00 0.00 177.00 173.91 1wx7 s VAL 12 N -2.98 0.39 0.28 -0.36 1.01 -1.26 -5.16 120.40 112.33 1wx7 s VAL 12 Ca 0.67 -0.53 0.11 0.00 0.00 0.00 0.00 61.98 62.23 1wx7 s VAL 12 Cb -0.16 -0.40 -0.05 0.00 0.00 0.00 0.00 36.38 35.78 1wx7 s VAL 12 CO 0.57 -0.10 -0.11 0.00 0.00 0.00 0.00 175.10 175.46 1wx7 s GLN 13 N -0.68 1.92 -0.24 2.72 -2.07 -1.26 -5.13 119.66 114.91 1wx7 s GLN 13 Ca -0.03 -1.66 -0.03 0.00 -1.82 0.00 0.00 55.36 51.81 1wx7 s GLN 13 Cb -0.05 -1.91 0.13 0.00 -1.09 0.00 0.00 33.01 30.10 1wx7 s GLN 13 CO -0.00 0.31 0.39 0.16 -1.32 0.00 0.00 175.29 174.83 1wx7 s ASP 14 N -3.59 0.14 -0.02 12.60 1.47 -1.26 -5.02 116.67 120.99 1wx7 s ASP 14 Ca 0.31 0.31 -0.23 0.00 1.18 0.00 0.00 52.55 54.12 1wx7 s ASP 14 Cb -0.05 1.17 -0.16 0.00 -0.34 0.00 0.00 42.92 43.54 1wx7 s ASP 14 CO 0.17 -0.29 1.06 1.55 0.68 0.00 0.00 175.17 178.33 1wx7 h PRO 15 N 8.18 -0.31 0.00 2.11 0.13 -2.03 -3.40 132.00 136.68 1wx7 h PRO 15 Ca -0.19 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1wx7 h PRO 15 Cb 1.15 0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1wx7 h PRO 15 CO 0.26 0.06 -0.14 0.72 -0.23 0.00 0.00 178.00 178.67 1wx7 n HIS 16 N -5.03 0.00 -1.50 1.56 8.25 -1.26 -5.05 115.22 112.18 1wx7 n HIS 16 Ca -0.09 -0.17 -0.41 0.00 -0.26 0.00 0.00 57.72 56.80 1wx7 n HIS 16 Cb 0.26 -0.04 -0.12 0.00 1.12 0.00 0.00 29.99 31.21 1wx7 n HIS 16 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1wx7 n LEU 17 N -0.21 0.75 -4.99 2.41 -0.00 -1.26 -3.01 117.00 110.68 1wx7 n LEU 17 Ca 0.01 0.06 -0.22 0.00 -0.00 0.00 0.00 56.01 55.86 1wx7 n LEU 17 Cb 0.53 -1.06 0.04 0.00 -0.00 0.00 0.00 43.42 42.93 1wx7 n LEU 17 CO 0.00 -0.90 0.24 0.27 -0.00 0.00 0.00 177.39 177.01 1wx7 s ILE 18 N 9.53 1.89 0.01 1.96 -4.36 0.23 -4.81 121.20 125.64 1wx7 s ILE 18 Ca 1.27 -1.19 0.04 0.00 -0.26 0.00 0.00 60.65 60.51 1wx7 s ILE 18 Cb -1.04 -2.08 -0.03 0.00 1.25 0.00 0.00 42.46 40.55 1wx7 s ILE 18 CO 0.45 0.00 -0.08 -0.75 0.24 0.00 0.00 174.94 174.80 1wx7 s LYS 19 N -4.54 2.50 -0.13 0.37 2.20 -1.26 0.45 119.74 119.33 1wx7 s LYS 19 Ca 0.51 -0.75 -0.04 0.00 -0.36 0.00 0.00 55.97 55.33 1wx7 s LYS 19 Cb -0.04 -2.47 0.05 0.00 -1.51 0.00 0.00 37.83 33.86 1wx7 s LYS 19 CO 0.32 0.60 0.08 0.08 -0.36 0.00 0.00 175.35 176.06 1wx7 s VAL 20 N -0.98 -0.04 -0.24 4.02 1.01 0.96 -2.84 120.40 122.29 1wx7 s VAL 20 Ca 0.17 -0.01 -0.25 0.00 0.00 0.00 0.00 61.98 61.89 1wx7 s VAL 20 Cb -0.11 -0.48 -0.00 0.00 0.00 0.00 0.00 36.38 35.78 1wx7 s VAL 20 CO 0.07 -0.13 0.83 -0.89 0.00 0.00 0.00 175.10 174.98 1wx7 s THR 21 N 2.13 4.83 -0.43 3.92 2.01 -0.67 -0.28 115.64 127.15 1wx7 s THR 21 Ca 0.03 1.58 -0.21 0.00 0.31 0.00 0.00 61.69 63.40 1wx7 s THR 21 Cb -0.15 -4.12 0.02 0.00 0.01 0.00 0.00 72.50 68.26 1wx7 s THR 21 CO -0.07 -0.07 0.64 -0.69 -0.69 0.00 0.00 174.62 173.73 1wx7 s VAL 22 N 2.84 4.84 -0.46 3.82 1.01 0.13 0.10 120.40 132.68 1wx7 s VAL 22 Ca 0.35 0.13 -0.18 0.00 0.00 0.00 0.00 61.98 62.28 1wx7 s VAL 22 Cb -0.15 -4.19 0.04 0.00 0.00 0.00 0.00 36.38 32.08 1wx7 s VAL 22 CO 0.07 -0.57 0.52 -0.54 0.00 0.00 0.00 175.10 174.58 1wx7 s LYS 23 N 2.79 3.11 0.20 2.72 1.02 0.62 -2.35 119.74 127.85 1wx7 s LYS 23 Ca 0.22 -0.83 0.08 0.00 0.02 0.00 0.00 55.97 55.46 1wx7 s LYS 23 Cb -0.14 -4.03 -0.04 0.00 -0.52 0.00 0.00 37.83 33.10 1wx7 s LYS 23 CO 0.19 -1.02 -0.03 0.95 -0.92 0.00 0.00 175.35 174.52 1wx7 s THR 24 N 2.32 3.50 -2.00 2.17 -4.23 0.70 0.15 115.64 118.25 1wx7 s THR 24 Ca 0.13 -1.62 0.08 0.00 -1.18 0.00 0.00 61.69 59.10 1wx7 s THR 24 Cb -0.18 -2.78 0.23 0.00 1.34 0.00 0.00 72.50 71.10 1wx7 s THR 24 CO 0.13 -0.18 0.92 -0.81 -0.54 0.00 0.00 174.62 174.14 1wx7 n PRO 25 N -0.28 0.49 0.00 3.99 -0.04 -1.26 -2.48 135.00 135.42 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 -1.26 0.00 0.00 -0.04 0.00 0.00 33.50 32.77 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 -0.76 2.46 -3.98 0.54 4.76 -1.26 -5.13 118.16 114.79 1wx7 n LYS 26 Ca 0.06 0.00 0.02 0.00 -2.87 0.00 0.00 58.31 55.52 1wx7 n LYS 26 Cb 0.03 -0.88 0.01 0.00 -1.84 0.00 0.00 35.03 32.35 1wx7 n LYS 26 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1wx7 s ASP 27 N -2.14 0.01 -0.08 4.39 1.01 -1.03 -5.18 116.67 113.64 1wx7 s ASP 27 Ca 0.00 -0.26 -0.09 0.00 0.71 0.00 0.00 52.55 52.91 1wx7 s ASP 27 Cb 0.00 0.19 0.02 0.00 1.01 0.00 0.00 42.92 44.14 1wx7 s ASP 27 CO 0.00 -0.38 0.24 -1.59 0.21 0.00 0.00 175.17 173.65 1wx7 s LYS 28 N -2.03 0.33 -0.05 8.23 0.00 -1.26 -0.21 119.74 124.75 1wx7 s LYS 28 Ca 0.29 0.24 -0.12 0.00 0.00 0.00 0.00 55.97 56.38 1wx7 s LYS 28 Cb -0.01 0.16 0.02 0.00 0.00 0.00 0.00 37.83 38.00 1wx7 s LYS 28 CO 0.00 -0.05 0.27 -2.00 0.00 0.00 0.00 175.35 173.57 1wx7 s GLU 29 N -0.11 0.51 0.01 1.78 2.56 -0.99 -4.99 118.70 117.47 1wx7 s GLU 29 Ca -0.02 -0.01 -0.20 0.00 0.00 0.00 0.00 54.97 54.73 1wx7 s GLU 29 Cb -0.03 0.23 -0.06 0.00 2.00 0.00 0.00 34.13 36.28 1wx7 s GLU 29 CO 0.01 -0.12 0.60 -0.51 -0.56 0.00 0.00 175.26 174.68 1wx7 s ASP 30 N -0.79 6.99 0.35 -1.70 1.11 -1.26 -0.69 116.67 120.68 1wx7 s ASP 30 Ca -0.09 1.18 0.09 0.00 0.18 0.00 0.00 52.55 53.92 1wx7 s ASP 30 Cb -0.04 -2.37 -0.06 0.00 1.07 0.00 0.00 42.92 41.52 1wx7 s ASP 30 CO 0.02 0.12 -0.05 -0.36 1.18 0.00 0.00 175.17 176.09 1wx7 s PHE 31 N -0.31 2.46 -0.14 4.23 0.40 0.62 -4.94 117.98 120.30 1wx7 s PHE 31 Ca 0.31 -0.50 -0.02 0.00 -0.60 0.00 0.00 56.93 56.13 1wx7 s PHE 31 Cb -0.18 -1.46 0.04 0.00 0.51 0.00 0.00 43.02 41.93 1wx7 s PHE 31 CO 0.18 0.53 -0.01 -1.54 0.70 0.00 0.00 175.22 175.08 1wx7 s SER 32 N -3.66 2.36 0.03 1.36 1.04 -1.26 -0.03 113.70 113.56 1wx7 s SER 32 Ca 0.34 -0.48 -0.19 0.00 0.48 0.00 0.00 55.95 56.10 1wx7 s SER 32 Cb 0.02 -0.64 0.04 0.00 0.10 0.00 0.00 66.02 65.54 1wx7 s SER 32 CO 0.18 -0.22 0.42 0.68 0.98 0.00 0.00 173.24 175.27 1wx7 s VAL 33 N 1.83 0.05 0.36 5.02 -7.23 0.17 -4.91 120.40 115.69 1wx7 s VAL 33 Ca 0.02 -0.43 -0.27 0.00 -1.81 0.00 0.00 61.98 59.49 1wx7 s VAL 33 Cb -0.15 -0.92 -0.09 0.00 0.56 0.00 0.00 36.38 35.78 1wx7 s VAL 33 CO -0.07 -0.24 1.26 0.42 -0.31 0.00 0.00 175.10 176.16 1wx7 s THR 34 N -2.30 2.84 0.47 5.32 -4.23 -1.26 0.76 115.64 117.24 1wx7 s THR 34 Ca -0.06 0.80 0.23 0.00 -1.18 0.00 0.00 61.69 61.48 1wx7 s THR 34 Cb -0.01 -3.49 0.42 0.00 1.34 0.00 0.00 72.50 70.76 1wx7 s THR 34 CO -0.01 0.15 1.88 -2.24 -0.54 0.00 0.00 174.62 173.87 1wx7 h ASP 35 N 3.11 0.22 0.52 3.99 2.03 -1.90 0.54 116.42 124.93 1wx7 h ASP 35 Ca -0.49 0.02 -0.02 0.00 -0.73 0.00 0.00 57.03 55.81 1wx7 h ASP 35 Cb 1.23 -0.02 -0.00 0.00 -0.83 0.00 0.00 39.33 39.71 1wx7 h ASP 35 CO 0.64 0.09 -0.10 0.00 -1.03 0.00 0.00 179.24 178.83 1wx7 h THR 36 N 0.22 0.41 -2.71 1.15 1.03 -1.90 -2.26 112.91 108.85 1wx7 h THR 36 Ca 0.43 -0.57 -0.59 0.00 -0.01 0.00 0.00 66.41 65.67 1wx7 h THR 36 Cb 1.34 1.40 0.14 0.00 -1.07 0.00 0.00 68.15 69.96 1wx7 h THR 36 CO -0.10 0.10 -0.13 0.00 -0.01 0.00 0.00 175.52 175.39 1wx7 s THR 38 N -1.38 5.16 0.16 0.00 -4.23 -1.26 -2.07 115.64 112.03 1wx7 s THR 38 Ca 0.64 -0.61 -0.15 0.00 -1.18 0.00 0.00 61.69 60.39 1wx7 s THR 38 Cb -0.58 -3.84 0.04 0.00 1.34 0.00 0.00 72.50 69.46 1wx7 s THR 38 CO 0.57 -0.44 1.81 0.40 -0.54 0.00 0.00 174.62 176.42 1wx7 h ILE 39 N 0.99 1.07 0.00 2.99 1.08 -1.65 -1.30 117.51 120.69 1wx7 h ILE 39 Ca -0.50 -0.19 -0.00 0.00 -0.39 0.00 0.00 64.86 63.78 1wx7 h ILE 39 Cb 1.22 0.47 -0.00 0.00 -3.07 0.00 0.00 36.82 35.43 1wx7 h ILE 39 CO 0.62 0.10 -0.01 0.06 -0.69 0.00 0.00 178.15 178.23 1wx7 h GLN 40 N 0.55 0.00 -0.09 2.37 3.07 -1.84 -1.90 115.11 117.26 1wx7 h GLN 40 Ca 0.17 0.00 -0.17 0.00 0.09 0.00 0.00 58.65 58.74 1wx7 h GLN 40 Cb -0.01 0.00 0.01 0.00 0.08 0.00 0.00 27.48 27.55 1wx7 h GLN 40 CO -0.07 0.01 -0.62 1.96 0.09 0.00 0.00 178.83 180.20 1wx7 h GLN 41 N 0.00 0.59 -0.44 0.06 4.20 -1.60 -3.28 115.11 114.63 1wx7 h GLN 41 Ca -0.00 -0.51 -0.05 0.00 0.06 0.00 0.00 58.65 58.15 1wx7 h GLN 41 Cb 0.03 0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.91 1wx7 h GLN 41 CO 0.00 1.13 0.08 1.25 -0.67 0.00 0.00 178.83 180.62 1wx7 h LEU 42 N 0.21 0.69 -0.81 1.46 5.85 -0.93 -3.05 115.31 118.74 1wx7 h LEU 42 Ca -0.05 -0.26 0.18 0.00 0.84 0.00 0.00 57.88 58.59 1wx7 h LEU 42 Cb 1.27 -0.18 -0.15 0.00 0.37 0.00 0.00 40.66 41.97 1wx7 h LEU 42 CO 0.13 0.77 -0.11 0.11 -0.34 0.00 0.00 178.44 179.00 1wx7 h LYS 43 N 0.59 0.03 0.00 1.25 1.79 -1.46 1.20 116.57 119.97 1wx7 h LYS 43 Ca 0.13 -0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.59 1wx7 h LYS 43 Cb 0.37 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 31.01 1wx7 h LYS 43 CO 0.01 0.02 -0.05 0.93 -1.08 0.00 0.00 179.45 179.27 1wx7 h GLU 44 N 0.03 0.00 0.12 3.15 5.08 -1.60 0.99 114.58 122.35 1wx7 h GLU 44 Ca 0.42 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.77 1wx7 h GLU 44 Cb 0.70 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.95 1wx7 h GLU 44 CO -0.79 0.05 -0.06 0.93 -1.00 0.00 0.00 179.01 178.15 1wx7 h GLU 45 N 0.00 -0.16 0.00 2.33 4.39 0.14 -3.26 114.58 118.02 1wx7 h GLU 45 Ca -0.00 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.71 1wx7 h GLU 45 Cb 0.11 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 1wx7 h GLU 45 CO 0.01 0.22 0.00 0.44 -1.16 0.00 0.00 179.01 178.52 1wx7 n ILE 46 N -4.86 1.08 -0.27 3.13 -5.35 0.09 -2.73 119.36 110.46 1wx7 n ILE 46 Ca -0.06 0.33 -0.05 0.00 -0.27 0.00 0.00 62.75 62.70 1wx7 n ILE 46 Cb 0.22 -1.20 0.06 0.00 -1.74 0.00 0.00 39.64 36.98 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 0.89 0.22 7.28 0.87 -0.84 0.61 113.55 122.59 1wx7 h SER 47 Ca 0.00 -0.06 -0.35 0.00 -1.23 0.00 0.00 61.79 60.15 1wx7 h SER 47 Cb 0.23 -0.22 0.01 0.00 -0.44 0.00 0.00 62.40 61.97 1wx7 h SER 47 CO 0.00 0.69 -1.74 0.06 -0.53 0.00 0.00 176.83 175.31 1wx7 h GLN 48 N 1.01 0.37 -0.65 2.24 3.07 -1.66 0.64 115.11 120.13 1wx7 h GLN 48 Ca 0.26 -0.63 -0.00 0.00 0.09 0.00 0.00 58.65 58.37 1wx7 h GLN 48 Cb -0.03 0.24 -0.03 0.00 0.08 0.00 0.00 27.48 27.73 1wx7 h GLN 48 CO -0.05 1.28 0.40 -0.09 0.09 0.00 0.00 178.83 180.47 1wx7 h ARG 49 N 0.10 0.87 0.00 0.06 9.65 -1.46 -2.76 114.38 120.84 1wx7 h ARG 49 Ca -0.34 -0.07 0.00 0.00 -1.10 0.00 0.00 59.98 58.48 1wx7 h ARG 49 Cb 2.09 -0.19 0.00 0.00 -1.39 0.00 0.00 29.97 30.48 1wx7 h ARG 49 CO 0.17 0.60 -0.90 1.19 2.80 0.00 0.00 179.97 183.84 1wx7 n PHE 50 N -4.41 0.00 -2.99 2.20 3.72 0.20 -5.01 117.46 111.16 1wx7 n PHE 50 Ca 0.07 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.35 1wx7 n PHE 50 Cb 0.06 -0.07 0.06 0.00 -0.94 0.00 0.00 39.48 38.60 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 -1.48 -4.57 -3.71 -1.08 4.76 0.95 -5.04 118.16 107.99 1wx7 n LYS 51 Ca 0.02 0.58 -0.16 0.00 -2.87 0.00 0.00 58.31 55.88 1wx7 n LYS 51 Cb 0.27 -4.79 -0.16 0.00 -1.84 0.00 0.00 35.03 28.51 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 -3.24 -0.09 0.30 7.82 0.00 0.19 -4.98 121.76 121.75 1wx7 s ALA 52 Ca 0.03 0.50 -0.27 0.00 0.00 0.00 0.00 51.96 52.22 1wx7 s ALA 52 Cb -0.01 -0.57 -0.14 0.00 0.00 0.00 0.00 23.12 22.40 1wx7 s ALA 52 CO 0.50 -0.34 0.87 1.58 0.00 0.00 0.00 175.76 178.37 1wx7 n HIS 53 N 4.75 0.75 0.89 0.00 -0.00 -1.26 -4.14 115.22 116.21 1wx7 n HIS 53 Ca -0.16 0.73 0.08 0.00 0.46 0.00 0.00 57.72 58.83 1wx7 n HIS 53 Cb 0.50 -2.17 0.44 0.00 -0.12 0.00 0.00 29.99 28.65 1wx7 n HIS 53 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 1wx7 n PRO 54 N 0.71 0.40 0.00 1.57 -0.04 -1.26 -2.10 135.00 134.28 1wx7 n PRO 54 Ca 0.11 0.05 0.14 0.00 -0.04 0.00 0.00 63.50 63.75 1wx7 n PRO 54 Cb 0.32 -1.50 0.48 0.00 -0.04 0.00 0.00 33.50 32.76 1wx7 n PRO 54 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1wx7 n ASP 55 N -1.09 1.46 0.00 3.54 9.92 -1.26 -4.14 116.55 124.98 1wx7 n ASP 55 Ca 0.10 -1.39 0.00 0.00 -0.53 0.00 0.00 54.79 52.97 1wx7 n ASP 55 Cb 0.07 0.03 0.00 0.00 -0.64 0.00 0.00 41.12 40.58 1wx7 n ASP 55 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1wx7 n GLN 56 N 0.05 2.66 -1.63 -1.24 10.64 -0.89 -4.93 117.38 122.04 1wx7 n GLN 56 Ca 0.17 0.00 -0.46 0.00 -1.83 0.00 0.00 57.00 54.88 1wx7 n GLN 56 Cb 0.36 -0.92 -0.03 0.00 -0.86 0.00 0.00 30.24 28.79 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 -1.87 2.39 -3.92 2.61 4.77 -1.15 -3.11 117.00 116.72 1wx7 n LEU 57 Ca 0.00 1.14 -0.28 0.00 -0.03 0.00 0.00 56.01 56.84 1wx7 n LEU 57 Cb 0.42 -1.33 -0.17 0.00 -2.33 0.00 0.00 43.42 40.01 1wx7 n LEU 57 CO 0.00 -0.87 -0.44 -0.69 -1.33 0.00 0.00 177.39 174.06 1wx7 s VAL 58 N -0.16 1.17 -0.14 4.08 1.01 0.24 -4.96 120.40 121.65 1wx7 s VAL 58 Ca 0.70 -0.51 -0.14 0.00 0.00 0.00 0.00 61.98 62.03 1wx7 s VAL 58 Cb -0.74 -1.24 -0.05 0.00 0.00 0.00 0.00 36.38 34.36 1wx7 s VAL 58 CO 0.51 0.27 0.31 -0.76 0.00 0.00 0.00 175.10 175.44 1wx7 s LEU 59 N 1.63 4.28 -0.16 3.92 1.43 -1.26 0.29 118.68 128.80 1wx7 s LEU 59 Ca 0.03 0.58 -0.00 0.00 -1.03 0.00 0.00 54.13 53.71 1wx7 s LEU 59 Cb -0.14 -2.41 0.04 0.00 0.03 0.00 0.00 46.19 43.71 1wx7 s LEU 59 CO -0.08 0.13 -0.06 -0.63 0.23 0.00 0.00 176.35 175.94 1wx7 s ILE 60 N 0.24 1.13 -0.02 -0.59 1.01 -0.90 -2.68 121.20 119.38 1wx7 s ILE 60 Ca 0.18 -0.61 0.00 0.00 0.00 0.00 0.00 60.65 60.22 1wx7 s ILE 60 Cb -0.13 -1.28 0.02 0.00 0.01 0.00 0.00 42.46 41.07 1wx7 s ILE 60 CO 0.05 0.15 -0.00 0.12 0.00 0.00 0.00 174.94 175.27 1wx7 s PHE 61 N 1.63 0.24 -1.19 3.97 2.19 -0.52 -2.70 117.98 121.61 1wx7 s PHE 61 Ca 0.01 0.01 0.00 0.00 0.33 0.00 0.00 56.93 57.28 1wx7 s PHE 61 Cb -0.15 -0.31 0.00 0.00 -1.31 0.00 0.00 43.02 41.25 1wx7 s PHE 61 CO -0.08 -0.09 0.00 0.00 1.83 0.00 0.00 175.22 176.88 1wx7 n ALA 62 N 3.85 -0.34 -1.70 11.12 0.00 -1.26 -2.27 120.51 129.92 1wx7 n ALA 62 Ca -0.23 0.13 -0.11 0.00 0.00 0.00 0.00 53.44 53.23 1wx7 n ALA 62 Cb 0.53 -1.54 -0.03 0.00 0.00 0.00 0.00 19.45 18.40 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 -1.10 0.65 3.09 0.00 0.00 -1.26 -5.01 105.19 101.56 1wx7 n GLY 63 Ca -0.15 -0.50 -0.12 0.00 0.00 0.00 0.00 46.02 45.25 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 -3.61 0.35 -0.33 1.61 -2.85 -0.96 -5.12 119.74 108.83 1wx7 s LYS 64 Ca 0.00 -0.03 -0.29 0.00 -1.00 0.00 0.00 55.97 54.65 1wx7 s LYS 64 Cb 0.00 0.15 0.01 0.00 -2.06 0.00 0.00 37.83 35.93 1wx7 s LYS 64 CO 0.00 -0.07 1.22 0.42 0.10 0.00 0.00 175.35 177.02 1wx7 s ILE 65 N -0.58 4.25 0.46 3.79 -1.09 -1.26 -1.43 121.20 125.34 1wx7 s ILE 65 Ca -0.07 1.40 -0.23 0.00 -2.23 0.00 0.00 60.65 59.53 1wx7 s ILE 65 Cb -0.04 -4.28 -0.09 0.00 -1.58 0.00 0.00 42.46 36.47 1wx7 s ILE 65 CO 0.01 -0.54 0.97 0.18 -1.23 0.00 0.00 174.94 174.33 1wx7 n LEU 66 N 7.46 2.71 -4.94 2.97 4.77 -1.09 -4.99 117.00 123.89 1wx7 n LEU 66 Ca 0.14 0.97 -0.26 0.00 -0.03 0.00 0.00 56.01 56.83 1wx7 n LEU 66 Cb 0.47 -1.35 -0.03 0.00 -2.33 0.00 0.00 43.42 40.18 1wx7 n LEU 66 CO 0.63 -1.64 -0.10 -0.54 -1.33 0.00 0.00 177.39 174.41 1wx7 s LYS 67 N -2.16 3.44 0.06 3.23 -0.14 -1.26 -4.90 119.74 118.01 1wx7 s LYS 67 Ca 0.66 -0.59 -0.30 0.00 -1.36 0.00 0.00 55.97 54.37 1wx7 s LYS 67 Cb -0.52 -2.97 -0.18 0.00 -1.68 0.00 0.00 37.83 32.48 1wx7 s LYS 67 CO 0.55 0.52 1.56 0.22 -0.76 0.00 0.00 175.35 177.44 1wx7 h ASP 68 N 2.18 -0.61 0.00 2.83 3.58 -1.94 -2.36 116.42 120.09 1wx7 h ASP 68 Ca -0.48 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 56.96 1wx7 h ASP 68 Cb 1.19 0.16 0.00 0.00 1.72 0.00 0.00 39.33 42.40 1wx7 h ASP 68 CO 0.69 -0.39 0.00 -0.81 -2.88 0.00 0.00 179.24 175.85 1wx7 n PRO 69 N -5.38 0.49 -3.63 0.28 -0.04 -1.26 -3.38 135.00 122.08 1wx7 n PRO 69 Ca -0.12 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 62.94 1wx7 n PRO 69 Cb 0.31 -1.27 -0.11 0.00 -0.04 0.00 0.00 33.50 32.38 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 -1.78 5.63 0.83 3.54 1.11 -0.89 -5.04 116.67 120.07 1wx7 s ASP 70 Ca 0.13 -1.11 -0.10 0.00 0.18 0.00 0.00 52.55 51.64 1wx7 s ASP 70 Cb 0.06 -1.98 0.09 0.00 1.07 0.00 0.00 42.92 42.16 1wx7 s ASP 70 CO 0.10 -0.40 1.11 -0.94 1.18 0.00 0.00 175.17 176.22 1wx7 s SER 71 N 1.60 3.85 0.34 0.27 1.04 -1.26 -3.82 113.70 115.71 1wx7 s SER 71 Ca 0.01 1.96 0.10 0.00 0.48 0.00 0.00 55.95 58.50 1wx7 s SER 71 Cb -0.20 -2.53 0.87 0.00 0.10 0.00 0.00 66.02 64.26 1wx7 s SER 71 CO 0.05 -2.48 1.77 -0.07 0.98 0.00 0.00 173.24 173.50 1wx7 h LEU 72 N -1.44 0.66 -0.90 2.42 3.38 -0.83 0.43 115.31 119.04 1wx7 h LEU 72 Ca -0.44 0.10 -0.12 0.00 0.09 0.00 0.00 57.88 57.52 1wx7 h LEU 72 Cb 1.25 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.97 1wx7 h LEU 72 CO 0.48 0.19 -0.50 0.00 0.09 0.00 0.00 178.44 178.70 1wx7 h ALA 73 N 1.66 1.07 0.00 1.53 0.00 -1.66 0.48 119.26 122.34 1wx7 h ALA 73 Ca 0.58 -0.46 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 1wx7 h ALA 73 Cb 1.11 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1wx7 h ALA 73 CO -0.36 0.64 -0.23 1.96 0.00 0.00 0.00 179.25 181.26 1wx7 h GLN 74 N 0.11 0.00 0.00 0.00 4.20 -0.59 -3.20 115.11 115.63 1wx7 h GLN 74 Ca 0.00 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.62 1wx7 h GLN 74 Cb 0.92 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.68 1wx7 h GLN 74 CO 0.07 0.23 -0.93 0.00 -0.67 0.00 0.00 178.83 177.53 1wx7 n GLY 76 N 1.27 1.33 3.83 0.00 0.00 -0.75 -4.89 105.19 105.97 1wx7 n GLY 76 Ca -0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 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 4.58 0.17 1.61 1.01 0.16 -5.00 120.40 120.94 1wx7 s VAL 77 Ca 0.00 1.20 0.03 0.00 0.00 0.00 0.00 61.98 63.21 1wx7 s VAL 77 Cb 0.00 -3.75 -0.01 0.00 0.00 0.00 0.00 36.38 32.61 1wx7 s VAL 77 CO 0.00 0.02 0.16 0.54 0.00 0.00 0.00 175.10 175.82 1wx7 n ARG 78 N 0.20 0.23 -2.37 2.72 5.12 -1.26 -4.09 116.66 117.21 1wx7 n ARG 78 Ca 0.01 -1.70 -0.41 0.00 -1.93 0.00 0.00 57.85 53.82 1wx7 n ARG 78 Cb 0.52 1.42 -0.03 0.00 -1.16 0.00 0.00 32.46 33.21 1wx7 n ARG 78 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1wx7 s ASP 79 N -2.20 5.99 0.00 0.55 -1.08 -1.26 -2.69 116.67 115.98 1wx7 s ASP 79 Ca 0.20 0.12 0.00 0.00 -0.52 0.00 0.00 52.55 52.35 1wx7 s ASP 79 Cb 0.01 -2.55 0.00 0.00 -1.46 0.00 0.00 42.92 38.92 1wx7 s ASP 79 CO 0.14 -1.86 0.00 0.61 0.52 0.00 0.00 175.17 174.58 1wx7 n GLY 80 N 5.37 1.30 3.96 2.66 0.00 -1.13 -4.84 105.19 112.50 1wx7 n GLY 80 Ca 0.11 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.91 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 3.33 0.15 0.99 1.43 -1.10 -4.95 118.68 118.53 1wx7 s LEU 81 Ca 0.00 0.18 0.09 0.00 -1.03 0.00 0.00 54.13 53.37 1wx7 s LEU 81 Cb 0.00 -3.03 -0.04 0.00 0.03 0.00 0.00 46.19 43.15 1wx7 s LEU 81 CO 0.00 -1.06 -0.20 -0.89 0.23 0.00 0.00 176.35 174.43 1wx7 s THR 82 N -2.77 1.92 -0.07 5.49 2.01 -1.26 -1.68 115.64 119.29 1wx7 s THR 82 Ca 0.55 -1.85 -0.03 0.00 0.31 0.00 0.00 61.69 60.68 1wx7 s THR 82 Cb -0.10 -1.84 0.04 0.00 0.01 0.00 0.00 72.50 70.60 1wx7 s THR 82 CO 0.39 -0.19 0.07 -0.69 -0.69 0.00 0.00 174.62 173.51 1wx7 s VAL 83 N -1.71 -0.12 -0.55 3.82 1.01 0.11 -4.90 120.40 118.06 1wx7 s VAL 83 Ca 0.14 0.33 -0.27 0.00 0.00 0.00 0.00 61.98 62.18 1wx7 s VAL 83 Cb -0.07 -0.23 -0.01 0.00 0.00 0.00 0.00 36.38 36.07 1wx7 s VAL 83 CO 0.07 0.10 1.66 -1.00 0.00 0.00 0.00 175.10 175.92 1wx7 s HIS 84 N 2.17 1.95 0.25 5.22 3.76 -1.10 -0.27 115.29 127.27 1wx7 s HIS 84 Ca 0.04 0.60 -0.10 0.00 -0.15 0.00 0.00 55.06 55.45 1wx7 s HIS 84 Cb -0.13 -4.23 -0.07 0.00 1.11 0.00 0.00 32.58 29.26 1wx7 s HIS 84 CO -0.04 -2.29 0.58 -1.17 -0.85 0.00 0.00 174.74 170.97 1wx7 s LEU 85 N 7.41 4.15 -0.11 0.89 2.96 0.40 -2.13 118.68 132.25 1wx7 s LEU 85 Ca 0.62 0.98 -0.03 0.00 -0.22 0.00 0.00 54.13 55.48 1wx7 s LEU 85 Cb -0.13 -3.75 0.05 0.00 0.50 0.00 0.00 46.19 42.85 1wx7 s LEU 85 CO 0.24 -0.10 0.06 -0.69 -1.32 0.00 0.00 176.35 174.55 1wx7 s VAL 86 N -1.85 0.02 -0.24 1.68 1.01 0.14 -4.16 120.40 117.01 1wx7 s VAL 86 Ca 0.48 0.05 -0.20 0.00 0.00 0.00 0.00 61.98 62.31 1wx7 s VAL 86 Cb -0.11 -0.46 -0.02 0.00 0.00 0.00 0.00 36.38 35.79 1wx7 s VAL 86 CO 0.21 -0.04 0.60 -0.63 0.00 0.00 0.00 175.10 175.24 1wx7 s ILE 87 N 2.10 5.02 -0.03 2.22 1.09 -1.26 -0.59 121.20 129.75 1wx7 s ILE 87 Ca 0.03 1.09 0.12 0.00 -1.10 0.00 0.00 60.65 60.79 1wx7 s ILE 87 Cb -0.14 -3.91 -0.07 0.00 -1.06 0.00 0.00 42.46 37.27 1wx7 s ILE 87 CO -0.06 0.07 1.31 0.11 -0.10 0.00 0.00 174.94 176.27 1wx7 h LYS 88 N 7.76 0.00 -5.80 2.79 1.79 -1.91 -3.48 116.57 117.72 1wx7 h LYS 88 Ca -0.29 0.00 -0.36 0.00 -2.18 0.00 0.00 60.65 57.82 1wx7 h LYS 88 Cb 1.13 0.00 0.13 0.00 -1.58 0.00 0.00 32.23 31.92 1wx7 h LYS 88 CO 0.76 0.70 -0.77 0.54 -1.08 0.00 0.00 179.45 179.60 1wx7 n ARG 89 N -3.25 -6.36 -1.36 3.15 1.74 -1.26 -4.91 116.66 104.41 1wx7 n ARG 89 Ca -0.00 0.79 -0.26 0.00 -0.77 0.00 0.00 57.85 57.60 1wx7 n ARG 89 Cb 0.84 -5.70 0.11 0.00 -1.02 0.00 0.00 32.46 26.69 1wx7 n ARG 89 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1wx7 n GLN 90 N -4.29 2.64 -3.88 5.56 6.02 -1.26 -4.91 117.38 117.26 1wx7 n GLN 90 Ca -0.24 -3.38 -0.35 0.00 -0.01 0.00 0.00 57.00 53.01 1wx7 n GLN 90 Cb 0.65 -2.19 -0.13 0.00 1.02 0.00 0.00 30.24 29.59 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 -3.59 3.31 -0.19 1.08 2.46 -1.26 -4.96 115.29 112.13 1wx7 s HIS 91 Ca 0.58 -1.90 -0.20 0.00 0.47 0.00 0.00 55.06 54.00 1wx7 s HIS 91 Cb 0.47 -2.27 -0.21 0.00 -0.13 0.00 0.00 32.58 30.44 1wx7 s HIS 91 CO 0.02 -0.82 0.29 -0.09 -2.47 0.00 0.00 174.74 171.68 1wx7 h ARG 92 N 8.02 0.05 -7.26 2.88 2.43 -2.04 -3.48 114.38 114.98 1wx7 h ARG 92 Ca -0.20 -0.08 -0.49 0.00 -0.81 0.00 0.00 59.98 58.40 1wx7 h ARG 92 Cb 1.06 0.03 0.18 0.00 -0.42 0.00 0.00 29.97 30.83 1wx7 h ARG 92 CO 0.56 1.04 0.19 0.00 -1.51 0.00 0.00 179.97 180.25 1wx7 s ALA 93 N -2.38 1.12 0.41 2.80 0.00 -1.26 -5.04 121.76 117.40 1wx7 s ALA 93 Ca -0.27 0.29 0.08 0.00 0.00 0.00 0.00 51.96 52.06 1wx7 s ALA 93 Cb 0.05 -3.34 0.01 0.00 0.00 0.00 0.00 23.12 19.84 1wx7 s ALA 93 CO 0.63 -2.84 0.55 -1.64 0.00 0.00 0.00 175.76 172.47 1wx7 s MET 94 N -4.68 2.88 0.00 0.00 -1.94 -1.26 -5.06 119.30 109.24 1wx7 s MET 94 Ca 0.66 -1.20 0.00 0.00 -1.71 0.00 0.00 55.69 53.44 1wx7 s MET 94 Cb -0.22 -2.77 0.00 0.00 2.01 0.00 0.00 34.83 33.85 1wx7 s MET 94 CO 0.59 -0.21 0.00 0.41 -0.01 0.00 0.00 175.02 175.80 1wx7 n GLY 95 N -1.82 -0.53 3.10 -0.03 0.00 -1.26 -5.05 105.19 99.60 1wx7 n GLY 95 Ca 0.07 0.10 -0.18 0.00 0.00 0.00 0.00 46.02 46.01 1wx7 n GLY 95 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1wx7 n ASN 96 N -2.13 -4.75 -4.76 1.61 2.85 -1.26 -4.99 115.26 101.83 1wx7 n ASN 96 Ca 0.00 -0.44 -0.38 0.00 -0.11 0.00 0.00 54.58 53.65 1wx7 n ASN 96 Cb 0.00 -4.08 -0.06 0.00 1.24 0.00 0.00 39.78 36.88 1wx7 n ASN 96 CO 0.00 0.00 0.00 -1.83 -2.11 0.00 0.00 177.26 173.32 1wx7 s GLU 97 N -5.84 4.26 -0.57 1.20 1.03 -1.26 -5.03 118.70 112.49 1wx7 s GLU 97 Ca 0.37 0.60 0.05 0.00 0.03 0.00 0.00 54.97 56.01 1wx7 s GLU 97 Cb -0.16 -3.35 0.18 0.00 -0.80 0.00 0.00 34.13 30.00 1wx7 s GLU 97 CO 0.57 0.36 0.44 0.00 -1.33 0.00 0.00 175.26 175.31 1wx7 n PRO 99 N 2.26 0.16 -0.08 0.00 -0.04 -1.26 -3.60 135.00 132.44 1wx7 n PRO 99 Ca 0.25 0.17 -0.10 0.00 -0.04 0.00 0.00 63.50 63.78 1wx7 n PRO 99 Cb 0.41 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.34 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 -1.34 1.19 -4.09 0.55 0.00 -1.26 -5.00 120.51 110.57 1wx7 n ALA 100 Ca 0.06 -0.74 -0.33 0.00 0.00 0.00 0.00 53.44 52.44 1wx7 n ALA 100 Cb 0.13 0.07 -0.01 0.00 0.00 0.00 0.00 19.45 19.65 1wx7 n ALA 100 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1wx7 n SER 101 N -4.30 -3.29 -3.16 0.00 7.64 -1.24 -4.91 113.62 104.35 1wx7 n SER 101 Ca -0.16 -0.94 0.05 0.00 1.01 0.00 0.00 58.87 58.83 1wx7 n SER 101 Cb 0.49 -3.16 -0.02 0.00 -1.01 0.00 0.00 64.21 60.52 1wx7 n SER 101 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1wx7 s GLY 102 N -3.47 -0.29 0.17 0.23 0.00 -1.26 -4.94 107.32 97.76 1wx7 s GLY 102 Ca 0.60 2.86 -0.30 0.00 0.00 0.00 0.00 44.72 47.87 1wx7 s GLY 102 CO 0.89 3.80 1.32 2.56 0.00 0.00 0.00 173.10 181.67 1wx7 s PRO 103 N 2.92 4.37 0.31 2.90 0.04 -1.26 -4.95 135.00 139.33 1wx7 s PRO 103 Ca -0.02 2.04 -0.26 0.00 0.04 0.00 0.00 61.00 62.80 1wx7 s PRO 103 Cb -0.10 -3.22 -0.14 0.00 0.04 0.00 0.00 34.50 31.08 1wx7 s PRO 103 CO -0.11 -0.30 0.74 0.43 0.04 0.00 0.00 177.00 177.80 1wx7 n SER 104 N 3.04 -0.04 -0.21 6.66 7.64 -1.26 -4.84 113.62 124.61 1wx7 n SER 104 Ca 0.08 1.08 0.02 0.00 1.01 0.00 0.00 58.87 61.06 1wx7 n SER 104 Cb 0.43 -1.15 0.12 0.00 -1.01 0.00 0.00 64.21 62.61 1wx7 n SER 104 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 1wx7 h SER 105 N 1.36 -0.11 0.00 6.43 0.87 -2.00 -3.56 113.55 116.53 1wx7 h SER 105 Ca -0.37 0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.33 1wx7 h SER 105 Cb 1.38 0.21 0.00 0.00 -0.44 0.00 0.00 62.40 63.56 1wx7 h SER 105 CO 0.57 -0.06 0.00 0.61 -0.53 0.00 0.00 176.83 177.42