#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 1.07 -0.22 1.61 0.15 -1.26 -5.02 113.70 110.02 1wx7 s SER 2 Ca 0.00 0.07 -0.14 0.00 0.70 0.00 0.00 55.95 56.58 1wx7 s SER 2 Cb 0.00 -0.15 0.07 0.00 -1.71 0.00 0.00 66.02 64.22 1wx7 s SER 2 CO 0.00 -0.24 0.55 -0.55 1.20 0.00 0.00 173.24 174.21 1wx7 s SER 3 N 2.06 -0.72 0.00 5.45 0.15 -1.26 -5.18 113.70 114.20 1wx7 s SER 3 Ca 0.04 1.20 0.00 0.00 0.70 0.00 0.00 55.95 57.89 1wx7 s SER 3 Cb -0.12 1.09 0.00 0.00 -1.71 0.00 0.00 66.02 65.28 1wx7 s SER 3 CO -0.03 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 174.80 1wx7 n GLY 4 N 4.09 4.63 2.93 9.45 0.00 -1.26 -4.96 105.19 120.07 1wx7 n GLY 4 Ca -0.21 -2.18 -0.29 0.00 0.00 0.00 0.00 46.02 43.34 1wx7 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wx7 s SER 5 N -0.74 2.93 -0.57 1.61 1.04 -1.26 -5.07 113.70 111.64 1wx7 s SER 5 Ca 0.00 -0.68 0.04 0.00 0.48 0.00 0.00 55.95 55.79 1wx7 s SER 5 Cb 0.00 -1.02 0.16 0.00 0.10 0.00 0.00 66.02 65.27 1wx7 s SER 5 CO 0.00 -0.16 0.40 -0.44 0.98 0.00 0.00 173.24 174.02 1wx7 s SER 6 N 1.56 3.69 0.00 7.02 0.01 -1.26 -5.03 113.70 119.69 1wx7 s SER 6 Ca 0.01 -3.41 0.00 0.00 1.31 0.00 0.00 55.95 53.86 1wx7 s SER 6 Cb -0.15 -1.22 0.00 0.00 0.21 0.00 0.00 66.02 64.86 1wx7 s SER 6 CO -0.08 -0.14 0.00 0.61 0.41 0.00 0.00 173.24 174.04 1wx7 n GLY 7 N 2.50 0.89 2.44 3.44 0.00 -1.26 -4.98 105.19 108.22 1wx7 n GLY 7 Ca 0.20 -1.06 -0.09 0.00 0.00 0.00 0.00 46.02 45.07 1wx7 n GLY 7 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1wx7 n SER 8 N 0.00 -3.30 -4.77 1.61 2.88 -1.26 -5.00 113.62 103.78 1wx7 n SER 8 Ca 0.00 -0.38 -0.35 0.00 -1.33 0.00 0.00 58.87 56.81 1wx7 n SER 8 Cb 0.00 -3.17 -0.00 0.00 -0.75 0.00 0.00 64.21 60.29 1wx7 n SER 8 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1wx7 s PRO 9 N -4.30 3.45 -0.02 -1.46 0.04 -1.26 -5.06 135.00 126.38 1wx7 s PRO 9 Ca 0.13 1.64 -0.23 0.00 0.04 0.00 0.00 61.00 62.58 1wx7 s PRO 9 Cb -0.02 -2.09 0.05 0.00 0.04 0.00 0.00 34.50 32.48 1wx7 s PRO 9 CO 0.42 -0.78 0.49 0.00 0.04 0.00 0.00 177.00 177.17 1wx7 s ALA 10 N -1.73 -1.26 1.17 8.56 0.00 -1.26 -5.18 121.76 122.07 1wx7 s ALA 10 Ca 0.71 0.78 -0.18 0.00 0.00 0.00 0.00 51.96 53.27 1wx7 s ALA 10 Cb -0.25 0.07 0.27 0.00 0.00 0.00 0.00 23.12 23.22 1wx7 s ALA 10 CO 0.28 -0.33 1.11 -1.25 0.00 0.00 0.00 175.76 175.57 1wx7 s PRO 11 N -1.39 -0.96 -0.46 0.00 0.04 -1.26 -4.93 135.00 126.05 1wx7 s PRO 11 Ca -0.12 0.03 -0.02 0.00 0.04 0.00 0.00 61.00 60.94 1wx7 s PRO 11 Cb -0.02 -1.62 0.28 0.00 0.04 0.00 0.00 34.50 33.18 1wx7 s PRO 11 CO 0.06 -3.56 2.08 0.28 0.04 0.00 0.00 177.00 175.91 1wx7 n VAL 12 N -4.67 3.12 -4.00 -0.36 0.31 -1.26 -4.90 118.33 106.57 1wx7 n VAL 12 Ca 0.12 -2.24 -0.10 0.00 -0.01 0.00 0.00 64.34 62.11 1wx7 n VAL 12 Cb 0.59 -1.30 -0.04 0.00 -0.91 0.00 0.00 33.84 32.18 1wx7 n VAL 12 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1wx7 s GLN 13 N -2.51 1.72 -0.03 5.55 -2.07 -1.26 -5.18 119.66 115.88 1wx7 s GLN 13 Ca 0.44 -1.41 -0.06 0.00 -1.82 0.00 0.00 55.36 52.52 1wx7 s GLN 13 Cb 0.34 0.48 0.01 0.00 -1.09 0.00 0.00 33.01 32.75 1wx7 s GLN 13 CO -0.03 -0.73 0.14 -0.51 -1.32 0.00 0.00 175.29 172.84 1wx7 s ASP 14 N -3.08 -0.06 0.00 12.60 1.01 -1.26 -5.12 116.67 120.76 1wx7 s ASP 14 Ca 0.24 0.04 0.00 0.00 0.71 0.00 0.00 52.55 53.54 1wx7 s ASP 14 Cb -0.01 0.26 0.00 0.00 1.01 0.00 0.00 42.92 44.18 1wx7 s ASP 14 CO 0.12 -0.21 0.00 -0.81 0.21 0.00 0.00 175.17 174.48 1wx7 n PRO 15 N 2.23 0.00 -0.73 8.23 -0.04 -1.26 -4.65 135.00 138.78 1wx7 n PRO 15 Ca -0.18 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.27 1wx7 n PRO 15 Cb 0.57 -0.23 0.20 0.00 -0.04 0.00 0.00 33.50 34.00 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 0.93 -1.57 0.54 8.25 -1.26 -5.01 115.22 117.10 1wx7 n HIS 16 Ca 0.00 -1.50 -0.42 0.00 -0.26 0.00 0.00 57.72 55.53 1wx7 n HIS 16 Cb 0.00 -0.44 -0.04 0.00 1.12 0.00 0.00 29.99 30.63 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 -1.08 2.84 -4.90 2.41 -0.00 -1.26 -2.51 117.00 112.50 1wx7 n LEU 17 Ca 0.30 0.05 -0.23 0.00 -0.00 0.00 0.00 56.01 56.13 1wx7 n LEU 17 Cb 0.98 -1.52 -0.01 0.00 -0.00 0.00 0.00 43.42 42.86 1wx7 n LEU 17 CO 0.16 -0.92 0.05 0.27 -0.00 0.00 0.00 177.39 176.95 1wx7 s ILE 18 N 9.20 2.21 -0.01 1.96 -4.36 0.18 -4.86 121.20 125.51 1wx7 s ILE 18 Ca 1.02 -1.38 0.02 0.00 -0.26 0.00 0.00 60.65 60.05 1wx7 s ILE 18 Cb -0.38 -2.59 -0.03 0.00 1.25 0.00 0.00 42.46 40.71 1wx7 s ILE 18 CO 0.35 0.00 -0.03 -0.75 0.24 0.00 0.00 174.94 174.75 1wx7 s LYS 19 N -4.23 2.72 -0.07 0.37 2.36 -1.26 -0.30 119.74 119.33 1wx7 s LYS 19 Ca 0.44 -0.62 -0.02 0.00 -2.55 0.00 0.00 55.97 53.22 1wx7 s LYS 19 Cb -0.03 -2.61 0.03 0.00 -1.05 0.00 0.00 37.83 34.17 1wx7 s LYS 19 CO 0.26 0.63 0.03 0.08 1.55 0.00 0.00 175.35 177.90 1wx7 s VAL 20 N -1.01 0.15 -0.25 4.02 1.01 0.79 -2.71 120.40 122.40 1wx7 s VAL 20 Ca 0.17 0.22 -0.18 0.00 0.00 0.00 0.00 61.98 62.19 1wx7 s VAL 20 Cb -0.11 -0.39 -0.03 0.00 0.00 0.00 0.00 36.38 35.85 1wx7 s VAL 20 CO 0.08 0.18 0.51 -0.89 0.00 0.00 0.00 175.10 174.97 1wx7 s THR 21 N 2.06 5.08 -0.43 3.92 2.01 -0.83 0.39 115.64 127.85 1wx7 s THR 21 Ca 0.05 0.88 -0.20 0.00 0.31 0.00 0.00 61.69 62.72 1wx7 s THR 21 Cb -0.12 -3.82 0.02 0.00 0.01 0.00 0.00 72.50 68.58 1wx7 s THR 21 CO -0.05 0.10 0.62 -0.69 -0.69 0.00 0.00 174.62 173.92 1wx7 s VAL 22 N 2.19 4.86 -0.45 3.82 1.01 0.28 -0.10 120.40 132.00 1wx7 s VAL 22 Ca 0.21 0.11 -0.18 0.00 0.00 0.00 0.00 61.98 62.12 1wx7 s VAL 22 Cb -0.16 -4.18 0.04 0.00 0.00 0.00 0.00 36.38 32.09 1wx7 s VAL 22 CO 0.09 -0.56 0.50 -0.54 0.00 0.00 0.00 175.10 174.60 1wx7 s LYS 23 N 2.74 3.10 0.20 2.72 1.02 0.76 -2.14 119.74 128.14 1wx7 s LYS 23 Ca 0.22 -0.86 0.08 0.00 0.02 0.00 0.00 55.97 55.43 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 0.18 -1.00 -0.02 0.95 -0.92 0.00 0.00 175.35 174.55 1wx7 s THR 24 N 2.25 3.54 -2.00 2.17 -4.23 0.80 0.17 115.64 118.34 1wx7 s THR 24 Ca 0.12 -1.61 0.09 0.00 -1.18 0.00 0.00 61.69 59.11 1wx7 s THR 24 Cb -0.19 -2.81 0.25 0.00 1.34 0.00 0.00 72.50 71.09 1wx7 s THR 24 CO 0.12 -0.19 0.97 -0.81 -0.54 0.00 0.00 174.62 174.17 1wx7 n PRO 25 N -0.32 0.49 0.00 3.99 -0.04 -1.26 -2.51 135.00 135.35 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 -1.28 0.00 0.00 -0.04 0.00 0.00 33.50 32.75 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 -0.78 2.48 -3.94 0.54 4.76 -1.26 -5.13 118.16 114.84 1wx7 n LYS 26 Ca 0.07 0.00 0.02 0.00 -2.87 0.00 0.00 58.31 55.52 1wx7 n LYS 26 Cb 0.03 -0.87 0.01 0.00 -1.84 0.00 0.00 35.03 32.36 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 -0.00 -0.06 4.39 1.01 -1.04 -5.17 116.67 113.65 1wx7 s ASP 27 Ca 0.00 -0.27 -0.05 0.00 0.71 0.00 0.00 52.55 52.94 1wx7 s ASP 27 Cb 0.00 0.20 0.02 0.00 1.01 0.00 0.00 42.92 44.16 1wx7 s ASP 27 CO 0.00 -0.41 0.16 -1.59 0.21 0.00 0.00 175.17 173.55 1wx7 s LYS 28 N -2.09 0.17 -0.01 8.23 0.00 -1.26 -0.14 119.74 124.64 1wx7 s LYS 28 Ca 0.27 0.27 -0.03 0.00 0.00 0.00 0.00 55.97 56.49 1wx7 s LYS 28 Cb -0.00 0.02 -0.00 0.00 0.00 0.00 0.00 37.83 37.84 1wx7 s LYS 28 CO -0.00 -0.06 0.06 -2.00 0.00 0.00 0.00 175.35 173.34 1wx7 s GLU 29 N 0.41 0.19 0.06 1.78 2.12 -0.91 -4.98 118.70 117.37 1wx7 s GLU 29 Ca -0.03 -0.14 -0.17 0.00 0.36 0.00 0.00 54.97 55.00 1wx7 s GLU 29 Cb -0.04 0.08 -0.06 0.00 0.26 0.00 0.00 34.13 34.37 1wx7 s GLU 29 CO -0.02 -0.03 0.51 0.16 -0.54 0.00 0.00 175.26 175.34 1wx7 s ASP 30 N -0.52 6.94 0.28 -1.70 1.47 -1.26 -0.56 116.67 121.32 1wx7 s ASP 30 Ca -0.06 1.13 0.07 0.00 1.18 0.00 0.00 52.55 54.87 1wx7 s ASP 30 Cb -0.04 -2.31 -0.06 0.00 -0.34 0.00 0.00 42.92 40.18 1wx7 s ASP 30 CO 0.00 0.26 -0.07 -0.36 0.68 0.00 0.00 175.17 175.68 1wx7 s PHE 31 N -1.17 1.98 -0.17 2.11 0.40 0.16 -4.96 117.98 116.33 1wx7 s PHE 31 Ca 0.29 -0.67 -0.02 0.00 -0.60 0.00 0.00 56.93 55.94 1wx7 s PHE 31 Cb -0.18 -1.11 0.05 0.00 0.51 0.00 0.00 43.02 42.29 1wx7 s PHE 31 CO 0.17 0.32 -0.00 -1.54 0.70 0.00 0.00 175.22 174.87 1wx7 s SER 32 N -3.45 2.76 0.11 1.36 1.04 -1.26 -0.15 113.70 114.11 1wx7 s SER 32 Ca 0.29 -0.69 -0.13 0.00 0.48 0.00 0.00 55.95 55.91 1wx7 s SER 32 Cb 0.03 -0.72 0.02 0.00 0.10 0.00 0.00 66.02 65.45 1wx7 s SER 32 CO 0.12 -0.25 0.30 0.68 0.98 0.00 0.00 173.24 175.08 1wx7 s VAL 33 N 1.77 0.10 0.31 5.02 -7.23 0.59 -4.93 120.40 116.04 1wx7 s VAL 33 Ca 0.00 -0.86 -0.29 0.00 -1.81 0.00 0.00 61.98 59.02 1wx7 s VAL 33 Cb -0.16 -1.25 -0.10 0.00 0.56 0.00 0.00 36.38 35.43 1wx7 s VAL 33 CO -0.07 -0.47 1.18 0.42 -0.31 0.00 0.00 175.10 175.84 1wx7 s THR 34 N -3.83 3.19 0.52 5.32 -4.23 -1.26 0.50 115.64 115.85 1wx7 s THR 34 Ca 0.04 1.18 0.27 0.00 -1.18 0.00 0.00 61.69 62.00 1wx7 s THR 34 Cb 0.03 -3.74 0.43 0.00 1.34 0.00 0.00 72.50 70.56 1wx7 s THR 34 CO -0.12 0.27 1.94 -2.24 -0.54 0.00 0.00 174.62 173.93 1wx7 h ASP 35 N 3.56 0.04 0.62 3.99 2.03 -1.84 0.46 116.42 125.29 1wx7 h ASP 35 Ca -0.48 0.00 -0.03 0.00 -0.73 0.00 0.00 57.03 55.80 1wx7 h ASP 35 Cb 1.22 -0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.71 1wx7 h ASP 35 CO 0.66 0.02 -0.13 0.00 -1.03 0.00 0.00 179.24 178.76 1wx7 h THR 36 N 0.04 0.43 -3.07 1.15 1.03 -1.90 -2.18 112.91 108.41 1wx7 h THR 36 Ca 0.35 -0.68 -0.58 0.00 -0.01 0.00 0.00 66.41 65.49 1wx7 h THR 36 Cb 1.33 1.48 0.17 0.00 -1.07 0.00 0.00 68.15 70.07 1wx7 h THR 36 CO -0.02 0.12 -0.34 0.00 -0.01 0.00 0.00 175.52 175.28 1wx7 s THR 38 N -1.72 5.20 0.15 0.00 -4.23 -1.26 -1.97 115.64 111.81 1wx7 s THR 38 Ca 0.69 -0.80 -0.17 0.00 -1.18 0.00 0.00 61.69 60.23 1wx7 s THR 38 Cb -0.43 -3.70 0.02 0.00 1.34 0.00 0.00 72.50 69.73 1wx7 s THR 38 CO 0.54 -0.14 1.73 0.40 -0.54 0.00 0.00 174.62 176.61 1wx7 h ILE 39 N 1.59 0.85 -0.28 2.99 1.08 -1.66 -0.72 117.51 121.35 1wx7 h ILE 39 Ca -0.49 -0.07 0.08 0.00 -0.39 0.00 0.00 64.86 63.99 1wx7 h ILE 39 Cb 1.20 0.63 -0.01 0.00 -3.07 0.00 0.00 36.82 35.57 1wx7 h ILE 39 CO 0.66 0.04 0.21 0.06 -0.69 0.00 0.00 178.15 178.43 1wx7 h GLN 40 N 0.20 0.00 -0.18 2.37 3.07 -1.85 -0.54 115.11 118.19 1wx7 h GLN 40 Ca 0.16 0.00 -0.18 0.00 0.09 0.00 0.00 58.65 58.71 1wx7 h GLN 40 Cb 0.17 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.73 1wx7 h GLN 40 CO -0.20 0.00 -0.63 1.96 0.09 0.00 0.00 178.83 180.05 1wx7 h GLN 41 N 0.00 0.64 -0.43 0.06 4.20 -1.50 -3.22 115.11 114.86 1wx7 h GLN 41 Ca 0.13 -0.45 -0.11 0.00 0.06 0.00 0.00 58.65 58.28 1wx7 h GLN 41 Cb 0.56 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.40 1wx7 h GLN 41 CO -0.00 1.07 -0.16 1.25 -0.67 0.00 0.00 178.83 180.32 1wx7 h LEU 42 N 0.47 0.89 -0.85 1.46 5.85 -0.61 -3.11 115.31 119.42 1wx7 h LEU 42 Ca -0.01 -0.38 0.22 0.00 0.84 0.00 0.00 57.88 58.54 1wx7 h LEU 42 Cb 1.21 -0.24 -0.14 0.00 0.37 0.00 0.00 40.66 41.86 1wx7 h LEU 42 CO 0.12 1.07 0.15 0.11 -0.34 0.00 0.00 178.44 179.56 1wx7 h LYS 43 N 0.70 0.16 -0.67 1.25 1.79 -1.39 0.67 116.57 119.08 1wx7 h LYS 43 Ca 0.10 -0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.59 1wx7 h LYS 43 Cb 0.71 -0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 31.29 1wx7 h LYS 43 CO 0.05 0.10 0.44 0.93 -1.08 0.00 0.00 179.45 179.90 1wx7 h GLU 44 N 0.16 0.83 0.36 3.15 5.08 -1.62 0.21 114.58 122.75 1wx7 h GLU 44 Ca 0.51 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.80 1wx7 h GLU 44 Cb 1.00 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 30.06 1wx7 h GLU 44 CO -0.68 0.55 -0.17 0.93 -1.00 0.00 0.00 179.01 178.64 1wx7 h GLU 45 N 0.85 -0.46 -0.02 2.33 5.08 0.23 -3.18 114.58 119.41 1wx7 h GLU 45 Ca 0.26 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 1wx7 h GLU 45 Cb -0.01 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 1wx7 h GLU 45 CO -0.07 -0.31 0.08 -0.84 -1.00 0.00 0.00 179.01 176.88 1wx7 h ILE 46 N -0.81 0.09 -0.83 3.13 3.07 -1.14 -1.74 117.51 119.30 1wx7 h ILE 46 Ca -0.05 0.00 0.04 0.00 1.55 0.00 0.00 64.86 66.40 1wx7 h ILE 46 Cb 0.37 0.92 -0.05 0.00 -0.27 0.00 0.00 36.82 37.78 1wx7 h ILE 46 CO 0.08 0.00 0.52 -1.28 -1.05 0.00 0.00 178.15 176.42 1wx7 h SER 47 N 0.00 0.85 0.43 2.16 0.87 -0.55 0.46 113.55 117.77 1wx7 h SER 47 Ca 0.01 0.00 -0.31 0.00 -1.23 0.00 0.00 61.79 60.26 1wx7 h SER 47 Cb 0.18 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 61.94 1wx7 h SER 47 CO -0.00 0.57 -1.62 0.06 -0.53 0.00 0.00 176.83 175.31 1wx7 h GLN 48 N 0.99 0.19 -0.14 2.24 3.07 -1.39 0.47 115.11 120.54 1wx7 h GLN 48 Ca 0.34 -0.32 -0.09 0.00 0.09 0.00 0.00 58.65 58.67 1wx7 h GLN 48 Cb 0.07 0.12 -0.01 0.00 0.08 0.00 0.00 27.48 27.73 1wx7 h GLN 48 CO -0.13 1.00 -0.30 -0.09 0.09 0.00 0.00 178.83 179.39 1wx7 h ARG 49 N 0.05 0.28 0.00 0.06 9.65 -1.20 -3.07 114.38 120.14 1wx7 h ARG 49 Ca -0.27 -0.11 0.00 0.00 -1.10 0.00 0.00 59.98 58.50 1wx7 h ARG 49 Cb 2.01 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 30.57 1wx7 h ARG 49 CO 0.13 0.56 -0.80 1.19 2.80 0.00 0.00 179.97 183.85 1wx7 n PHE 50 N -4.11 0.00 -3.01 2.20 3.72 0.16 -5.01 117.46 111.40 1wx7 n PHE 50 Ca -0.01 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.27 1wx7 n PHE 50 Cb 0.41 -0.05 0.06 0.00 -0.94 0.00 0.00 39.48 38.96 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 -1.43 -4.68 -3.73 -1.08 4.76 0.61 -5.03 118.16 107.58 1wx7 n LYS 51 Ca 0.02 0.59 -0.13 0.00 -2.87 0.00 0.00 58.31 55.92 1wx7 n LYS 51 Cb 0.24 -4.86 -0.14 0.00 -1.84 0.00 0.00 35.03 28.44 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 -3.25 -0.37 0.28 7.82 0.00 0.13 -4.99 121.76 121.37 1wx7 s ALA 52 Ca 0.02 0.80 -0.29 0.00 0.00 0.00 0.00 51.96 52.49 1wx7 s ALA 52 Cb -0.01 -0.56 -0.14 0.00 0.00 0.00 0.00 23.12 22.41 1wx7 s ALA 52 CO 0.51 -0.21 1.04 1.58 0.00 0.00 0.00 175.76 178.67 1wx7 n HIS 53 N 4.33 1.31 0.92 0.00 -0.00 -1.26 -4.14 115.22 116.38 1wx7 n HIS 53 Ca -0.24 0.69 0.08 0.00 0.46 0.00 0.00 57.72 58.71 1wx7 n HIS 53 Cb 0.52 -2.26 0.45 0.00 -0.12 0.00 0.00 29.99 28.58 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 0.84 0.44 0.00 1.57 -0.04 -1.26 -2.15 135.00 134.40 1wx7 n PRO 54 Ca 0.10 0.03 0.13 0.00 -0.04 0.00 0.00 63.50 63.72 1wx7 n PRO 54 Cb 0.31 -1.50 0.47 0.00 -0.04 0.00 0.00 33.50 32.75 1wx7 n PRO 54 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1wx7 n ASP 55 N -1.05 0.93 0.00 3.54 -0.08 -1.26 -4.09 116.55 114.53 1wx7 n ASP 55 Ca 0.11 -0.90 0.00 0.00 -1.51 0.00 0.00 54.79 52.49 1wx7 n ASP 55 Cb 0.07 0.06 0.00 0.00 2.34 0.00 0.00 41.12 43.58 1wx7 n ASP 55 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1wx7 n GLN 56 N -0.61 2.96 -1.64 -0.67 10.64 -0.91 -4.97 117.38 122.18 1wx7 n GLN 56 Ca 0.14 0.00 -0.44 0.00 -1.83 0.00 0.00 57.00 54.87 1wx7 n GLN 56 Cb 0.33 -0.99 -0.02 0.00 -0.86 0.00 0.00 30.24 28.70 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 -2.11 2.62 -3.81 2.61 4.77 -1.17 -2.63 117.00 117.28 1wx7 n LEU 57 Ca 0.00 1.18 -0.20 0.00 -0.03 0.00 0.00 56.01 56.96 1wx7 n LEU 57 Cb 0.49 -1.38 -0.17 0.00 -2.33 0.00 0.00 43.42 40.04 1wx7 n LEU 57 CO 0.00 -0.91 -0.38 -0.69 -1.33 0.00 0.00 177.39 174.08 1wx7 s VAL 58 N -0.81 0.32 -0.15 4.08 1.01 -0.88 -4.93 120.40 119.04 1wx7 s VAL 58 Ca 0.60 0.07 -0.10 0.00 0.00 0.00 0.00 61.98 62.55 1wx7 s VAL 58 Cb -0.66 -0.43 -0.05 0.00 0.00 0.00 0.00 36.38 35.24 1wx7 s VAL 58 CO 0.58 0.21 0.19 -0.76 0.00 0.00 0.00 175.10 175.32 1wx7 s LEU 59 N 1.41 4.29 -0.27 3.92 1.43 -1.26 0.06 118.68 128.27 1wx7 s LEU 59 Ca -0.04 0.42 0.00 0.00 -1.03 0.00 0.00 54.13 53.48 1wx7 s LEU 59 Cb -0.13 -2.19 0.08 0.00 0.03 0.00 0.00 46.19 43.98 1wx7 s LEU 59 CO -0.03 0.24 0.03 -0.63 0.23 0.00 0.00 176.35 176.19 1wx7 s ILE 60 N -0.13 1.22 0.04 -0.59 1.01 -0.81 -2.50 121.20 119.44 1wx7 s ILE 60 Ca 0.13 -1.32 0.08 0.00 0.00 0.00 0.00 60.65 59.55 1wx7 s ILE 60 Cb -0.12 -1.73 -0.03 0.00 0.01 0.00 0.00 42.46 40.59 1wx7 s ILE 60 CO 0.02 -0.39 -0.24 0.12 0.00 0.00 0.00 174.94 174.45 1wx7 s PHE 61 N 1.49 2.11 -1.24 3.97 2.19 -0.42 -2.90 117.98 123.18 1wx7 s PHE 61 Ca 0.03 -0.40 0.00 0.00 0.33 0.00 0.00 56.93 56.89 1wx7 s PHE 61 Cb -0.18 -1.26 0.00 0.00 -1.31 0.00 0.00 43.02 40.27 1wx7 s PHE 61 CO -0.13 0.11 0.00 0.00 1.83 0.00 0.00 175.22 177.03 1wx7 n ALA 62 N 1.81 -0.60 -1.48 11.12 0.00 -1.26 0.26 120.51 130.37 1wx7 n ALA 62 Ca -0.17 0.14 -0.09 0.00 0.00 0.00 0.00 53.44 53.32 1wx7 n ALA 62 Cb 0.52 -1.55 -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 -0.67 0.79 2.90 0.00 0.00 -1.26 -5.01 105.19 101.95 1wx7 n GLY 63 Ca -0.15 -0.61 -0.13 0.00 0.00 0.00 0.00 46.02 45.12 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 -3.16 0.15 -0.29 1.61 -2.85 0.14 -5.11 119.74 110.23 1wx7 s LYS 64 Ca 0.00 -0.09 -0.29 0.00 -1.00 0.00 0.00 55.97 54.59 1wx7 s LYS 64 Cb 0.00 -0.13 -0.01 0.00 -2.06 0.00 0.00 37.83 35.64 1wx7 s LYS 64 CO 0.00 0.03 1.41 0.42 0.10 0.00 0.00 175.35 177.32 1wx7 s ILE 65 N -0.12 3.97 0.49 3.79 -1.09 -1.26 -1.30 121.20 125.69 1wx7 s ILE 65 Ca -0.00 1.09 -0.23 0.00 -2.23 0.00 0.00 60.65 59.28 1wx7 s ILE 65 Cb -0.01 -4.02 -0.08 0.00 -1.58 0.00 0.00 42.46 36.77 1wx7 s ILE 65 CO -0.00 -0.45 1.18 0.18 -1.23 0.00 0.00 174.94 174.62 1wx7 n LEU 66 N 8.03 4.07 -4.94 2.97 4.77 -1.04 -4.98 117.00 125.88 1wx7 n LEU 66 Ca 0.16 1.00 -0.26 0.00 -0.03 0.00 0.00 56.01 56.88 1wx7 n LEU 66 Cb 0.46 -1.47 -0.03 0.00 -2.33 0.00 0.00 43.42 40.05 1wx7 n LEU 66 CO 0.64 -1.04 -0.04 -0.54 -1.33 0.00 0.00 177.39 175.08 1wx7 s LYS 67 N -2.46 3.47 0.04 3.23 -0.14 -1.26 -4.87 119.74 117.75 1wx7 s LYS 67 Ca 0.67 -0.52 -0.28 0.00 -1.36 0.00 0.00 55.97 54.48 1wx7 s LYS 67 Cb -0.47 -2.91 -0.17 0.00 -1.68 0.00 0.00 37.83 32.60 1wx7 s LYS 67 CO 0.53 0.46 1.44 -0.44 -0.76 0.00 0.00 175.35 176.58 1wx7 h ASP 68 N 1.97 -0.52 0.00 2.83 5.19 -1.95 -2.62 116.42 121.32 1wx7 h ASP 68 Ca -0.49 -0.06 0.00 0.00 -0.62 0.00 0.00 57.03 55.87 1wx7 h ASP 68 Cb 1.20 0.13 0.00 0.00 0.18 0.00 0.00 39.33 40.84 1wx7 h ASP 68 CO 0.68 -0.25 0.00 -0.81 -3.12 0.00 0.00 179.24 175.73 1wx7 n PRO 69 N -5.29 0.49 -3.55 3.56 -0.04 -1.26 -3.36 135.00 125.55 1wx7 n PRO 69 Ca -0.11 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 62.94 1wx7 n PRO 69 Cb 0.29 -1.31 -0.10 0.00 -0.04 0.00 0.00 33.50 32.34 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 -1.81 5.82 0.88 3.54 1.01 -0.99 -5.04 116.67 120.09 1wx7 s ASP 70 Ca 0.15 -1.13 -0.10 0.00 0.71 0.00 0.00 52.55 52.18 1wx7 s ASP 70 Cb 0.07 -2.06 0.13 0.00 1.01 0.00 0.00 42.92 42.07 1wx7 s ASP 70 CO 0.11 -0.46 1.13 -0.94 0.21 0.00 0.00 175.17 175.23 1wx7 s SER 71 N 1.81 3.28 0.37 0.27 1.04 -1.26 -3.87 113.70 115.34 1wx7 s SER 71 Ca 0.03 2.09 0.13 0.00 0.48 0.00 0.00 55.95 58.68 1wx7 s SER 71 Cb -0.21 -2.55 0.94 0.00 0.10 0.00 0.00 66.02 64.30 1wx7 s SER 71 CO 0.06 -2.86 1.83 -0.07 0.98 0.00 0.00 173.24 173.18 1wx7 h LEU 72 N -1.70 0.57 -0.45 2.42 3.38 -0.76 0.21 115.31 118.97 1wx7 h LEU 72 Ca -0.43 0.06 -0.18 0.00 0.09 0.00 0.00 57.88 57.42 1wx7 h LEU 72 Cb 1.26 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.96 1wx7 h LEU 72 CO 0.44 0.22 -0.74 0.00 0.09 0.00 0.00 178.44 178.45 1wx7 h ALA 73 N 1.62 0.66 0.00 1.53 0.00 -1.64 0.58 119.26 122.01 1wx7 h ALA 73 Ca 0.51 -0.63 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 1wx7 h ALA 73 Cb 1.04 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 1wx7 h ALA 73 CO -0.25 0.81 -0.14 1.96 0.00 0.00 0.00 179.25 181.62 1wx7 h GLN 74 N 0.17 0.00 0.00 0.00 4.20 -0.99 -3.10 115.11 115.39 1wx7 h GLN 74 Ca -0.03 0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.45 1wx7 h GLN 74 Cb 1.31 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 29.05 1wx7 h GLN 74 CO 0.12 0.14 -1.43 0.00 -0.67 0.00 0.00 178.83 177.00 1wx7 n GLY 76 N 1.45 1.36 3.76 0.00 0.00 -0.85 -4.95 105.19 105.96 1wx7 n GLY 76 Ca -0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.52 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 4.13 0.19 1.61 1.01 0.20 -4.99 120.40 120.55 1wx7 s VAL 77 Ca 0.00 1.99 0.03 0.00 0.00 0.00 0.00 61.98 64.00 1wx7 s VAL 77 Cb 0.00 -4.23 -0.01 0.00 0.00 0.00 0.00 36.38 32.14 1wx7 s VAL 77 CO 0.00 0.41 0.10 0.54 0.00 0.00 0.00 175.10 176.15 1wx7 n ARG 78 N 1.26 0.53 -2.43 2.72 5.12 -1.26 -4.08 116.66 118.51 1wx7 n ARG 78 Ca -0.01 -1.74 -0.39 0.00 -1.93 0.00 0.00 57.85 53.78 1wx7 n ARG 78 Cb 0.48 1.14 -0.03 0.00 -1.16 0.00 0.00 32.46 32.88 1wx7 n ARG 78 CO 0.00 0.00 0.00 0.16 -1.93 0.00 0.00 177.63 175.86 1wx7 s ASP 79 N -2.24 6.06 0.00 0.55 1.47 -1.26 -2.79 116.67 118.46 1wx7 s ASP 79 Ca 0.15 -0.79 0.00 0.00 1.18 0.00 0.00 52.55 53.09 1wx7 s ASP 79 Cb 0.01 -2.56 0.00 0.00 -0.34 0.00 0.00 42.92 40.03 1wx7 s ASP 79 CO 0.10 -1.89 0.00 0.61 0.68 0.00 0.00 175.17 174.68 1wx7 n GLY 80 N 6.20 1.61 3.96 2.12 0.00 -1.10 -4.81 105.19 113.18 1wx7 n GLY 80 Ca 0.22 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.01 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 0.13 0.99 1.43 -1.12 -4.97 118.68 118.48 1wx7 s LEU 81 Ca 0.00 0.16 0.08 0.00 -1.03 0.00 0.00 54.13 53.35 1wx7 s LEU 81 Cb 0.00 -3.02 -0.04 0.00 0.03 0.00 0.00 46.19 43.16 1wx7 s LEU 81 CO 0.00 -1.06 -0.20 -0.89 0.23 0.00 0.00 176.35 174.44 1wx7 s THR 82 N -2.77 1.77 -0.06 5.49 2.01 -1.26 -1.96 115.64 118.86 1wx7 s THR 82 Ca 0.55 -1.74 -0.02 0.00 0.31 0.00 0.00 61.69 60.79 1wx7 s THR 82 Cb -0.10 -1.71 0.03 0.00 0.01 0.00 0.00 72.50 70.73 1wx7 s THR 82 CO 0.39 -0.19 0.06 -0.69 -0.69 0.00 0.00 174.62 173.50 1wx7 s VAL 83 N -1.62 -0.03 -0.57 3.82 1.01 0.85 -4.91 120.40 118.95 1wx7 s VAL 83 Ca 0.11 0.30 -0.27 0.00 0.00 0.00 0.00 61.98 62.11 1wx7 s VAL 83 Cb -0.08 -0.27 -0.00 0.00 0.00 0.00 0.00 36.38 36.03 1wx7 s VAL 83 CO 0.05 0.13 1.60 -1.00 0.00 0.00 0.00 175.10 175.88 1wx7 s HIS 84 N 2.13 2.02 0.22 5.22 3.76 -1.14 -0.17 115.29 127.33 1wx7 s HIS 84 Ca 0.05 0.55 -0.12 0.00 -0.15 0.00 0.00 55.06 55.39 1wx7 s HIS 84 Cb -0.13 -4.28 -0.07 0.00 1.11 0.00 0.00 32.58 29.21 1wx7 s HIS 84 CO -0.04 -2.22 0.58 -1.17 -0.85 0.00 0.00 174.74 171.04 1wx7 s LEU 85 N 7.14 4.20 -0.20 0.89 2.96 0.44 -1.93 118.68 132.17 1wx7 s LEU 85 Ca 0.59 1.02 -0.04 0.00 -0.22 0.00 0.00 54.13 55.49 1wx7 s LEU 85 Cb -0.13 -3.64 0.07 0.00 0.50 0.00 0.00 46.19 42.99 1wx7 s LEU 85 CO 0.24 -0.05 0.07 -0.69 -1.32 0.00 0.00 176.35 174.60 1wx7 s VAL 86 N -1.75 0.23 -0.13 1.68 1.01 0.11 -4.11 120.40 117.44 1wx7 s VAL 86 Ca 0.46 -0.47 -0.29 0.00 0.00 0.00 0.00 61.98 61.68 1wx7 s VAL 86 Cb -0.12 -0.88 -0.01 0.00 0.00 0.00 0.00 36.38 35.37 1wx7 s VAL 86 CO 0.20 -0.32 1.09 -0.63 0.00 0.00 0.00 175.10 175.44 1wx7 s ILE 87 N 1.98 4.58 0.19 2.22 1.09 -1.26 -2.07 121.20 127.94 1wx7 s ILE 87 Ca 0.02 1.88 0.03 0.00 -1.10 0.00 0.00 60.65 61.48 1wx7 s ILE 87 Cb -0.17 -4.21 -0.11 0.00 -1.06 0.00 0.00 42.46 36.91 1wx7 s ILE 87 CO -0.12 -0.06 1.44 0.11 -0.10 0.00 0.00 174.94 176.21 1wx7 h LYS 88 N 7.39 0.20 -5.85 2.79 1.79 -1.86 -3.48 116.57 117.55 1wx7 h LYS 88 Ca -0.28 -0.19 -0.37 0.00 -2.18 0.00 0.00 60.65 57.63 1wx7 h LYS 88 Cb 1.12 0.05 0.12 0.00 -1.58 0.00 0.00 32.23 31.94 1wx7 h LYS 88 CO 0.90 0.88 -0.81 0.54 -1.08 0.00 0.00 179.45 179.89 1wx7 n ARG 89 N -3.73 -5.37 -2.62 3.15 1.74 -1.26 -4.94 116.66 103.64 1wx7 n ARG 89 Ca -0.03 0.74 -0.10 0.00 -0.77 0.00 0.00 57.85 57.68 1wx7 n ARG 89 Cb 0.74 -5.50 0.03 0.00 -1.02 0.00 0.00 32.46 26.71 1wx7 n ARG 89 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 1wx7 n GLN 90 N -4.13 2.00 -3.81 5.56 -0.06 -1.26 -5.03 117.38 110.66 1wx7 n GLN 90 Ca -0.27 -3.64 -0.29 0.00 -2.00 0.00 0.00 57.00 50.80 1wx7 n GLN 90 Cb 0.67 -1.65 -0.16 0.00 -4.06 0.00 0.00 30.24 25.03 1wx7 n GLN 90 CO 0.00 0.00 0.00 -1.58 -0.20 0.00 0.00 177.06 175.28 1wx7 s HIS 91 N -3.50 1.55 -1.07 3.69 2.46 -1.26 -5.00 115.29 112.17 1wx7 s HIS 91 Ca 0.33 -1.24 -0.22 0.00 0.47 0.00 0.00 55.06 54.40 1wx7 s HIS 91 Cb 0.39 -1.28 0.05 0.00 -0.13 0.00 0.00 32.58 31.61 1wx7 s HIS 91 CO -0.02 -0.69 1.54 0.50 -2.47 0.00 0.00 174.74 173.60 1wx7 s ARG 92 N 1.68 3.59 0.53 2.88 3.52 -1.26 -4.97 118.95 124.92 1wx7 s ARG 92 Ca -0.02 -1.24 -0.04 0.00 -0.13 0.00 0.00 55.73 54.30 1wx7 s ARG 92 Cb -0.18 -5.37 0.11 0.00 -1.56 0.00 0.00 34.95 27.95 1wx7 s ARG 92 CO -0.09 -2.32 0.73 0.00 -0.81 0.00 0.00 175.30 172.81 1wx7 n ALA 93 N 9.19 -0.31 -0.27 6.12 0.00 -1.26 -4.93 120.51 129.05 1wx7 n ALA 93 Ca 0.37 -1.20 0.03 0.00 0.00 0.00 0.00 53.44 52.63 1wx7 n ALA 93 Cb 0.50 0.10 0.09 0.00 0.00 0.00 0.00 19.45 20.14 1wx7 n ALA 93 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1wx7 n MET 94 N -2.44 -0.09 0.00 0.00 0.00 -1.26 -4.85 117.12 108.48 1wx7 n MET 94 Ca 0.11 1.16 0.00 0.00 -0.00 0.00 0.00 57.70 58.96 1wx7 n MET 94 Cb 0.38 -1.72 0.00 0.00 0.00 0.00 0.00 33.22 31.87 1wx7 n MET 94 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1wx7 n GLY 95 N -1.44 -0.38 3.57 -5.12 0.00 -1.26 -5.18 105.19 95.38 1wx7 n GLY 95 Ca 0.11 0.61 -0.09 0.00 0.00 0.00 0.00 46.02 46.65 1wx7 n GLY 95 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wx7 s ASN 96 N 2.00 -0.32 -1.31 1.61 4.22 -1.26 -4.99 114.94 114.89 1wx7 s ASN 96 Ca 0.00 0.24 -0.04 0.00 -2.14 0.00 0.00 52.86 50.92 1wx7 s ASN 96 Cb 0.00 0.28 0.01 0.00 1.28 0.00 0.00 41.25 42.83 1wx7 s ASN 96 CO 0.00 -0.37 0.98 -0.62 -2.04 0.00 0.00 177.10 175.05 1wx7 n GLU 97 N 0.40 -6.47 -2.68 3.55 -0.58 -1.26 -4.95 120.64 108.65 1wx7 n GLU 97 Ca -0.08 0.76 -0.40 0.00 -0.42 0.00 0.00 57.16 57.02 1wx7 n GLU 97 Cb 0.59 -5.67 -0.06 0.00 -0.57 0.00 0.00 31.44 25.73 1wx7 n GLU 97 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1wx7 s PRO 99 N -1.27 3.94 1.02 0.00 0.04 -1.26 -4.99 135.00 132.48 1wx7 s PRO 99 Ca 0.42 1.84 -0.16 0.00 0.04 0.00 0.00 61.00 63.14 1wx7 s PRO 99 Cb -0.27 -2.59 0.02 0.00 0.04 0.00 0.00 34.50 31.69 1wx7 s PRO 99 CO 0.34 -0.42 -0.03 0.00 0.04 0.00 0.00 177.00 176.94 1wx7 n ALA 100 N -0.12 -3.74 0.07 8.56 0.00 -1.26 -4.94 120.51 119.08 1wx7 n ALA 100 Ca 0.05 -0.90 -0.10 0.00 0.00 0.00 0.00 53.44 52.49 1wx7 n ALA 100 Cb 0.47 -1.55 -0.07 0.00 0.00 0.00 0.00 19.45 18.31 1wx7 n ALA 100 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1wx7 h SER 101 N -1.62 -0.23 -5.00 0.00 4.64 -1.95 -3.49 113.55 105.90 1wx7 h SER 101 Ca -0.47 -0.27 0.07 0.00 -0.47 0.00 0.00 61.79 60.65 1wx7 h SER 101 Cb 1.32 0.06 -0.05 0.00 -0.31 0.00 0.00 62.40 63.42 1wx7 h SER 101 CO 0.33 0.31 0.22 -0.83 -0.87 0.00 0.00 176.83 175.99 1wx7 s GLY 102 N -3.24 -0.08 0.04 -0.77 0.00 -1.26 -5.11 107.32 96.90 1wx7 s GLY 102 Ca -0.11 -0.31 -0.31 0.00 0.00 0.00 0.00 44.72 43.99 1wx7 s GLY 102 CO 0.40 -0.10 1.42 2.56 0.00 0.00 0.00 173.10 177.38 1wx7 s PRO 103 N -3.92 4.29 0.24 2.90 0.04 -1.26 -5.01 135.00 132.28 1wx7 s PRO 103 Ca 0.11 2.03 -0.06 0.00 0.04 0.00 0.00 61.00 63.12 1wx7 s PRO 103 Cb -0.06 -3.49 -0.02 0.00 0.04 0.00 0.00 34.50 30.98 1wx7 s PRO 103 CO 0.07 -0.55 0.32 -1.54 0.04 0.00 0.00 177.00 175.34 1wx7 s SER 104 N 1.71 0.20 -0.16 6.66 1.04 -1.26 -5.11 113.70 116.79 1wx7 s SER 104 Ca 0.65 -1.23 0.01 0.00 0.48 0.00 0.00 55.95 55.86 1wx7 s SER 104 Cb -0.34 0.51 0.03 0.00 0.10 0.00 0.00 66.02 66.31 1wx7 s SER 104 CO 0.28 -1.03 -0.14 -0.44 0.98 0.00 0.00 173.24 172.89 1wx7 s SER 105 N -3.12 2.86 0.00 7.02 0.01 -1.26 -5.26 113.70 113.95 1wx7 s SER 105 Ca 0.31 -0.57 0.29 0.00 1.31 0.00 0.00 55.95 57.29 1wx7 s SER 105 Cb 0.03 -1.23 1.25 0.00 0.21 0.00 0.00 66.02 66.27 1wx7 s SER 105 CO 0.12 -0.06 1.86 0.61 0.41 0.00 0.00 173.24 176.18