#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 2.51 -1.69 1.61 0.15 -1.26 -4.83 113.70 110.19 1wx7 s SER 2 Ca 0.00 -0.56 -0.16 0.00 0.70 0.00 0.00 55.95 55.93 1wx7 s SER 2 Cb 0.00 -0.67 0.14 0.00 -1.71 0.00 0.00 66.02 63.78 1wx7 s SER 2 CO 0.00 -0.23 0.67 -1.20 1.20 0.00 0.00 173.24 173.69 1wx7 n SER 3 N 5.01 -2.51 0.00 5.45 7.64 -1.26 -4.80 113.62 123.15 1wx7 n SER 3 Ca -0.10 -1.06 0.00 0.00 1.01 0.00 0.00 58.87 58.72 1wx7 n SER 3 Cb 0.48 -2.56 0.00 0.00 -1.01 0.00 0.00 64.21 61.12 1wx7 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wx7 n GLY 4 N -1.49 -1.65 2.27 0.23 0.00 -1.26 -5.05 105.19 98.25 1wx7 n GLY 4 Ca 0.01 0.87 -0.30 0.00 0.00 0.00 0.00 46.02 46.61 1wx7 n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1wx7 n SER 5 N 0.00 6.06 -4.15 1.61 3.41 -1.26 -4.84 113.62 114.46 1wx7 n SER 5 Ca 0.00 -3.77 -0.16 0.00 -0.26 0.00 0.00 58.87 54.68 1wx7 n SER 5 Cb 0.00 -0.64 -0.11 0.00 -0.26 0.00 0.00 64.21 63.20 1wx7 n SER 5 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1wx7 s SER 6 N -2.77 1.44 0.00 4.04 0.15 -1.26 -5.10 113.70 110.20 1wx7 s SER 6 Ca 0.55 -0.67 0.00 0.00 0.70 0.00 0.00 55.95 56.54 1wx7 s SER 6 Cb 0.44 -0.01 0.00 0.00 -1.71 0.00 0.00 66.02 64.74 1wx7 s SER 6 CO -0.05 -0.16 0.00 0.61 1.20 0.00 0.00 173.24 174.84 1wx7 n GLY 7 N 1.08 4.12 3.48 9.45 0.00 -1.26 -5.16 105.19 116.89 1wx7 n GLY 7 Ca -0.20 -1.18 0.01 0.00 0.00 0.00 0.00 46.02 44.65 1wx7 n GLY 7 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wx7 s SER 8 N 0.00 -0.43 1.12 1.61 1.04 -1.26 -5.18 113.70 110.61 1wx7 s SER 8 Ca 0.00 0.63 -0.10 0.00 0.48 0.00 0.00 55.95 56.95 1wx7 s SER 8 Cb 0.00 1.37 0.15 0.00 0.10 0.00 0.00 66.02 67.64 1wx7 s SER 8 CO 0.00 -0.09 0.54 -0.81 0.98 0.00 0.00 173.24 173.86 1wx7 n PRO 9 N 4.30 -2.06 -1.49 4.02 -0.04 -1.26 -4.93 135.00 133.53 1wx7 n PRO 9 Ca -0.13 -0.86 -0.43 0.00 -0.04 0.00 0.00 63.50 62.05 1wx7 n PRO 9 Cb 0.55 -0.80 0.00 0.00 -0.04 0.00 0.00 33.50 33.21 1wx7 n PRO 9 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1wx7 n ALA 10 N -3.92 -1.16 -1.21 0.55 0.00 -1.26 -4.94 120.51 108.57 1wx7 n ALA 10 Ca -0.10 0.23 -0.30 0.00 0.00 0.00 0.00 53.44 53.27 1wx7 n ALA 10 Cb 0.29 -1.84 0.14 0.00 0.00 0.00 0.00 19.45 18.03 1wx7 n ALA 10 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1wx7 s PRO 11 N -1.59 1.26 -0.26 0.00 0.04 -1.26 -5.08 135.00 128.10 1wx7 s PRO 11 Ca 0.63 0.82 -0.27 0.00 0.04 0.00 0.00 61.00 62.22 1wx7 s PRO 11 Cb -0.64 -1.81 0.16 0.00 0.04 0.00 0.00 34.50 32.26 1wx7 s PRO 11 CO 0.58 -2.24 1.25 0.54 0.04 0.00 0.00 177.00 177.17 1wx7 s VAL 12 N -2.93 0.00 0.10 -0.36 0.11 -1.26 -5.18 120.40 110.88 1wx7 s VAL 12 Ca 0.63 0.00 0.10 0.00 -2.93 0.00 0.00 61.98 59.78 1wx7 s VAL 12 Cb -0.18 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.63 1wx7 s VAL 12 CO 0.57 0.00 -0.26 -1.10 -3.33 0.00 0.00 175.10 170.98 1wx7 s GLN 13 N -0.43 1.47 0.04 1.54 -0.21 -1.26 -5.15 119.66 115.66 1wx7 s GLN 13 Ca 0.05 -1.25 -0.05 0.00 0.02 0.00 0.00 55.36 54.13 1wx7 s GLN 13 Cb -0.03 -1.84 -0.01 0.00 1.00 0.00 0.00 33.01 32.12 1wx7 s GLN 13 CO -0.08 0.45 0.08 -0.51 -2.12 0.00 0.00 175.29 173.11 1wx7 s ASP 14 N -1.80 0.20 0.00 5.90 1.01 -1.26 -5.12 116.67 115.60 1wx7 s ASP 14 Ca 0.12 -0.56 0.00 0.00 0.71 0.00 0.00 52.55 52.83 1wx7 s ASP 14 Cb -0.10 0.22 0.00 0.00 1.01 0.00 0.00 42.92 44.05 1wx7 s ASP 14 CO 0.05 -0.50 0.00 -0.81 0.21 0.00 0.00 175.17 174.11 1wx7 n PRO 15 N 0.77 0.00 -0.86 8.23 -0.04 -1.26 -4.60 135.00 137.23 1wx7 n PRO 15 Ca -0.19 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.20 1wx7 n PRO 15 Cb 0.58 -0.23 0.21 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 1.55 -1.57 0.54 8.25 -1.26 -4.99 115.22 117.75 1wx7 n HIS 16 Ca 0.00 -1.54 -0.39 0.00 -0.26 0.00 0.00 57.72 55.53 1wx7 n HIS 16 Cb 0.00 -0.58 -0.03 0.00 1.12 0.00 0.00 29.99 30.50 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 -1.00 2.67 -4.90 2.41 -0.00 -1.26 -2.07 117.00 112.85 1wx7 n LEU 17 Ca 0.38 -0.24 -0.20 0.00 -0.00 0.00 0.00 56.01 55.95 1wx7 n LEU 17 Cb 1.17 -1.57 -0.02 0.00 -0.00 0.00 0.00 43.42 42.99 1wx7 n LEU 17 CO 0.28 -1.24 0.03 0.27 -0.00 0.00 0.00 177.39 176.73 1wx7 s ILE 18 N 10.76 2.72 -0.05 1.96 -4.36 0.22 -4.85 121.20 127.60 1wx7 s ILE 18 Ca 0.99 -1.27 -0.01 0.00 -0.26 0.00 0.00 60.65 60.10 1wx7 s ILE 18 Cb -0.24 -3.00 -0.03 0.00 1.25 0.00 0.00 42.46 40.44 1wx7 s ILE 18 CO 0.30 0.00 0.02 -0.75 0.24 0.00 0.00 174.94 174.75 1wx7 s LYS 19 N -4.18 2.97 -0.06 0.37 2.36 -1.26 -0.21 119.74 119.74 1wx7 s LYS 19 Ca 0.50 -0.45 -0.01 0.00 -2.55 0.00 0.00 55.97 53.45 1wx7 s LYS 19 Cb -0.05 -2.80 0.03 0.00 -1.05 0.00 0.00 37.83 33.97 1wx7 s LYS 19 CO 0.29 0.68 0.01 0.08 1.55 0.00 0.00 175.35 177.96 1wx7 s VAL 20 N -0.99 0.26 -0.24 4.02 1.01 1.00 -2.53 120.40 122.93 1wx7 s VAL 20 Ca 0.16 0.15 -0.16 0.00 0.00 0.00 0.00 61.98 62.13 1wx7 s VAL 20 Cb -0.11 -0.42 -0.03 0.00 0.00 0.00 0.00 36.38 35.81 1wx7 s VAL 20 CO 0.06 0.22 0.44 -0.89 0.00 0.00 0.00 175.10 174.93 1wx7 s THR 21 N 1.76 5.15 -0.43 3.92 2.01 -0.88 0.46 115.64 127.61 1wx7 s THR 21 Ca 0.01 0.74 -0.21 0.00 0.31 0.00 0.00 61.69 62.55 1wx7 s THR 21 Cb -0.13 -3.76 0.02 0.00 0.01 0.00 0.00 72.50 68.65 1wx7 s THR 21 CO -0.04 0.17 0.64 -0.69 -0.69 0.00 0.00 174.62 174.02 1wx7 s VAL 22 N 1.83 4.83 -0.45 3.82 1.01 0.17 -0.12 120.40 131.50 1wx7 s VAL 22 Ca 0.19 0.16 -0.18 0.00 0.00 0.00 0.00 61.98 62.15 1wx7 s VAL 22 Cb -0.15 -4.19 0.03 0.00 0.00 0.00 0.00 36.38 32.07 1wx7 s VAL 22 CO 0.09 -0.57 0.50 -0.54 0.00 0.00 0.00 175.10 174.58 1wx7 s LYS 23 N 2.82 3.11 0.21 2.72 1.02 0.70 -1.94 119.74 128.38 1wx7 s LYS 23 Ca 0.23 -0.79 0.09 0.00 0.02 0.00 0.00 55.97 55.51 1wx7 s LYS 23 Cb -0.14 -4.01 -0.04 0.00 -0.52 0.00 0.00 37.83 33.12 1wx7 s LYS 23 CO 0.19 -0.97 -0.03 0.95 -0.92 0.00 0.00 175.35 174.56 1wx7 s THR 24 N 2.28 3.43 -2.00 2.17 -4.23 0.13 0.15 115.64 117.57 1wx7 s THR 24 Ca 0.13 -1.70 0.08 0.00 -1.18 0.00 0.00 61.69 59.02 1wx7 s THR 24 Cb -0.18 -2.76 0.24 0.00 1.34 0.00 0.00 72.50 71.14 1wx7 s THR 24 CO 0.13 -0.22 0.95 -0.81 -0.54 0.00 0.00 174.62 174.14 1wx7 n PRO 25 N -0.38 0.49 0.00 3.99 -0.04 -1.26 -2.38 135.00 135.42 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 0.57 -1.27 0.00 0.00 -0.04 0.00 0.00 33.50 32.76 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 -0.77 2.06 -3.96 0.54 4.76 -1.26 -5.12 118.16 114.40 1wx7 n LYS 26 Ca 0.06 0.00 0.03 0.00 -2.87 0.00 0.00 58.31 55.53 1wx7 n LYS 26 Cb 0.03 -0.86 0.01 0.00 -1.84 0.00 0.00 35.03 32.37 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 -1.78 0.00 -0.10 4.39 1.01 -1.00 -5.17 116.67 114.01 1wx7 s ASP 27 Ca 0.00 -0.19 -0.07 0.00 0.71 0.00 0.00 52.55 53.00 1wx7 s ASP 27 Cb 0.00 0.14 0.04 0.00 1.01 0.00 0.00 42.92 44.11 1wx7 s ASP 27 CO 0.00 -0.28 0.25 -1.59 0.21 0.00 0.00 175.17 173.76 1wx7 s LYS 28 N -2.05 0.24 0.22 8.23 0.00 -1.26 0.19 119.74 125.30 1wx7 s LYS 28 Ca 0.28 0.46 0.00 0.00 0.00 0.00 0.00 55.97 56.71 1wx7 s LYS 28 Cb -0.00 -0.01 -0.05 0.00 0.00 0.00 0.00 37.83 37.77 1wx7 s LYS 28 CO -0.01 -0.11 0.09 -2.00 0.00 0.00 0.00 175.35 173.32 1wx7 s GLU 29 N 0.80 1.26 -0.03 1.78 -6.30 -0.82 -4.97 118.70 110.42 1wx7 s GLU 29 Ca -0.06 -1.66 0.04 0.00 -2.50 0.00 0.00 54.97 50.79 1wx7 s GLU 29 Cb -0.07 -0.02 -0.03 0.00 0.00 0.00 0.00 34.13 34.01 1wx7 s GLU 29 CO -0.05 -0.31 -0.12 -0.51 0.02 0.00 0.00 175.26 174.29 1wx7 s ASP 30 N -3.22 4.21 0.22 -1.70 1.01 -1.26 0.44 116.67 116.38 1wx7 s ASP 30 Ca 0.35 -0.19 0.07 0.00 0.71 0.00 0.00 52.55 53.49 1wx7 s ASP 30 Cb 0.07 -0.91 -0.05 0.00 1.01 0.00 0.00 42.92 43.05 1wx7 s ASP 30 CO 0.11 0.32 -0.10 -0.36 0.21 0.00 0.00 175.17 175.35 1wx7 s PHE 31 N -0.83 1.71 -0.20 4.23 0.40 0.17 -4.96 117.98 118.51 1wx7 s PHE 31 Ca 0.13 -0.66 -0.00 0.00 -0.60 0.00 0.00 56.93 55.79 1wx7 s PHE 31 Cb -0.11 -0.88 0.05 0.00 0.51 0.00 0.00 43.02 42.60 1wx7 s PHE 31 CO 0.03 0.27 -0.04 -1.54 0.70 0.00 0.00 175.22 174.64 1wx7 s SER 32 N -3.33 3.21 0.09 1.36 1.04 -1.26 -0.00 113.70 114.81 1wx7 s SER 32 Ca 0.24 -0.87 -0.11 0.00 0.48 0.00 0.00 55.95 55.69 1wx7 s SER 32 Cb 0.01 -0.95 0.01 0.00 0.10 0.00 0.00 66.02 65.19 1wx7 s SER 32 CO 0.08 -0.22 0.25 0.68 0.98 0.00 0.00 173.24 175.00 1wx7 s VAL 33 N 1.59 0.12 0.31 5.02 -7.23 0.71 -4.93 120.40 115.99 1wx7 s VAL 33 Ca -0.02 -1.00 -0.28 0.00 -1.81 0.00 0.00 61.98 58.87 1wx7 s VAL 33 Cb -0.17 -1.27 -0.10 0.00 0.56 0.00 0.00 36.38 35.41 1wx7 s VAL 33 CO -0.07 -0.55 1.14 0.42 -0.31 0.00 0.00 175.10 175.73 1wx7 s THR 34 N -3.75 3.32 0.53 5.32 -4.23 -1.26 0.73 115.64 116.29 1wx7 s THR 34 Ca 0.04 1.28 0.28 0.00 -1.18 0.00 0.00 61.69 62.11 1wx7 s THR 34 Cb 0.04 -3.80 0.44 0.00 1.34 0.00 0.00 72.50 70.52 1wx7 s THR 34 CO -0.11 0.27 1.94 -2.24 -0.54 0.00 0.00 174.62 173.94 1wx7 h ASP 35 N 3.51 0.03 0.57 3.99 3.04 -1.77 0.46 116.42 126.24 1wx7 h ASP 35 Ca -0.47 0.00 -0.03 0.00 -3.24 0.00 0.00 57.03 53.29 1wx7 h ASP 35 Cb 1.22 -0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 39.50 1wx7 h ASP 35 CO 0.66 0.01 -0.13 0.00 -2.04 0.00 0.00 179.24 177.74 1wx7 h THR 36 N 0.03 0.46 -3.04 1.15 1.03 -1.91 -2.14 112.91 108.48 1wx7 h THR 36 Ca 0.35 -0.66 -0.58 0.00 -0.01 0.00 0.00 66.41 65.51 1wx7 h THR 36 Cb 1.35 1.46 0.17 0.00 -1.07 0.00 0.00 68.15 70.06 1wx7 h THR 36 CO -0.01 0.13 -0.34 0.00 -0.01 0.00 0.00 175.52 175.28 1wx7 s THR 38 N -1.71 5.18 0.13 0.00 -4.23 -1.26 -1.66 115.64 112.09 1wx7 s THR 38 Ca 0.69 -1.00 -0.18 0.00 -1.18 0.00 0.00 61.69 60.02 1wx7 s THR 38 Cb -0.44 -3.80 -0.04 0.00 1.34 0.00 0.00 72.50 69.57 1wx7 s THR 38 CO 0.54 -0.31 1.79 0.40 -0.54 0.00 0.00 174.62 176.50 1wx7 h ILE 39 N 1.26 1.07 -0.10 2.99 1.08 -1.66 -1.74 117.51 120.40 1wx7 h ILE 39 Ca -0.51 -0.13 0.03 0.00 -0.39 0.00 0.00 64.86 63.86 1wx7 h ILE 39 Cb 1.23 0.67 -0.00 0.00 -3.07 0.00 0.00 36.82 35.64 1wx7 h ILE 39 CO 0.62 0.07 0.09 0.06 -0.69 0.00 0.00 178.15 178.29 1wx7 h GLN 40 N 0.37 0.00 0.04 2.37 3.07 -1.85 -2.31 115.11 116.80 1wx7 h GLN 40 Ca 0.10 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.84 1wx7 h GLN 40 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.52 1wx7 h GLN 40 CO -0.03 0.00 -0.02 1.96 0.09 0.00 0.00 178.83 180.83 1wx7 h GLN 41 N 0.00 -0.05 -0.72 0.06 4.20 -1.68 -3.25 115.11 113.67 1wx7 h GLN 41 Ca 0.05 0.00 0.07 0.00 0.06 0.00 0.00 58.65 58.83 1wx7 h GLN 41 Cb 0.22 0.01 -0.06 0.00 0.30 0.00 0.00 27.48 27.95 1wx7 h GLN 41 CO -0.00 0.44 0.40 1.25 -0.67 0.00 0.00 178.83 180.25 1wx7 h LEU 42 N -0.58 0.57 -0.89 1.46 5.85 -1.01 -2.30 115.31 118.41 1wx7 h LEU 42 Ca -0.01 0.04 0.20 0.00 0.84 0.00 0.00 57.88 58.95 1wx7 h LEU 42 Cb 0.52 -0.07 -0.17 0.00 0.37 0.00 0.00 40.66 41.31 1wx7 h LEU 42 CO 0.01 0.35 -0.14 0.11 -0.34 0.00 0.00 178.44 178.43 1wx7 h LYS 43 N 0.71 0.02 -0.37 1.25 1.79 -1.47 1.35 116.57 119.84 1wx7 h LYS 43 Ca 0.33 -0.00 0.05 0.00 -2.18 0.00 0.00 60.65 58.85 1wx7 h LYS 43 Cb 0.26 -0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.88 1wx7 h LYS 43 CO -0.21 0.01 0.25 0.93 -1.08 0.00 0.00 179.45 179.35 1wx7 h GLU 44 N 0.02 0.29 0.36 3.15 5.08 -1.49 0.29 114.58 122.27 1wx7 h GLU 44 Ca 0.46 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.79 1wx7 h GLU 44 Cb 0.77 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.96 1wx7 h GLU 44 CO -0.89 0.19 -0.17 0.93 -1.00 0.00 0.00 179.01 178.07 1wx7 h GLU 45 N 0.30 -0.46 0.00 2.33 4.39 0.17 -3.24 114.58 118.07 1wx7 h GLU 45 Ca 0.16 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.89 1wx7 h GLU 45 Cb 0.25 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 1wx7 h GLU 45 CO -0.03 -0.31 0.00 -0.84 -1.16 0.00 0.00 179.01 176.67 1wx7 h ILE 46 N -1.13 0.00 -0.91 3.13 3.07 -0.97 -2.40 117.51 118.30 1wx7 h ILE 46 Ca -0.05 -0.11 0.03 0.00 1.55 0.00 0.00 64.86 66.28 1wx7 h ILE 46 Cb 0.37 0.96 -0.05 0.00 -0.27 0.00 0.00 36.82 37.82 1wx7 h ILE 46 CO 0.08 0.00 0.59 -1.28 -1.05 0.00 0.00 178.15 176.49 1wx7 h SER 47 N 0.00 0.99 0.28 2.16 0.87 -0.44 0.27 113.55 117.68 1wx7 h SER 47 Ca 0.00 -0.01 -0.34 0.00 -1.23 0.00 0.00 61.79 60.21 1wx7 h SER 47 Cb 0.12 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.84 1wx7 h SER 47 CO 0.00 0.69 -1.76 0.06 -0.53 0.00 0.00 176.83 175.28 1wx7 h GLN 48 N 1.16 0.27 -0.42 2.24 3.07 -1.54 0.54 115.11 120.43 1wx7 h GLN 48 Ca 0.36 -0.45 -0.05 0.00 0.09 0.00 0.00 58.65 58.60 1wx7 h GLN 48 Cb -0.02 0.17 -0.02 0.00 0.08 0.00 0.00 27.48 27.69 1wx7 h GLN 48 CO -0.11 1.13 0.06 -0.09 0.09 0.00 0.00 178.83 179.91 1wx7 h ARG 49 N 0.07 0.64 0.00 0.06 9.65 -1.32 -2.91 114.38 120.57 1wx7 h ARG 49 Ca -0.33 -0.13 0.00 0.00 -1.10 0.00 0.00 59.98 58.42 1wx7 h ARG 49 Cb 2.05 -0.10 0.00 0.00 -1.39 0.00 0.00 29.97 30.53 1wx7 h ARG 49 CO 0.13 0.61 -0.93 1.19 2.80 0.00 0.00 179.97 183.78 1wx7 n PHE 50 N -4.29 0.00 -2.99 2.20 3.72 0.95 -5.01 117.46 112.04 1wx7 n PHE 50 Ca 0.02 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.31 1wx7 n PHE 50 Cb 0.23 -0.06 0.06 0.00 -0.94 0.00 0.00 39.48 38.77 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 -1.50 -4.59 -3.70 -1.08 4.76 0.30 -5.03 118.16 107.32 1wx7 n LYS 51 Ca 0.02 0.58 -0.15 0.00 -2.87 0.00 0.00 58.31 55.89 1wx7 n LYS 51 Cb 0.28 -4.81 -0.15 0.00 -1.84 0.00 0.00 35.03 28.52 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 -0.24 0.27 7.82 0.00 0.16 -4.99 121.76 121.55 1wx7 s ALA 52 Ca 0.03 0.64 -0.28 0.00 0.00 0.00 0.00 51.96 52.35 1wx7 s ALA 52 Cb -0.01 -0.68 -0.15 0.00 0.00 0.00 0.00 23.12 22.28 1wx7 s ALA 52 CO 0.50 -0.39 0.87 1.58 0.00 0.00 0.00 175.76 178.31 1wx7 n HIS 53 N 4.84 0.76 0.83 0.00 -0.00 -1.26 -4.15 115.22 116.25 1wx7 n HIS 53 Ca -0.14 0.76 0.08 0.00 0.46 0.00 0.00 57.72 58.88 1wx7 n HIS 53 Cb 0.51 -2.17 0.42 0.00 -0.12 0.00 0.00 29.99 28.63 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 0.77 0.35 0.00 1.57 -0.04 -1.26 -2.14 135.00 134.25 1wx7 n PRO 54 Ca 0.12 0.07 0.14 0.00 -0.04 0.00 0.00 63.50 63.79 1wx7 n PRO 54 Cb 0.31 -1.50 0.55 0.00 -0.04 0.00 0.00 33.50 32.82 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 -1.14 1.04 0.00 3.54 2.03 -1.26 -4.06 116.55 116.70 1wx7 n ASP 55 Ca 0.09 -1.14 0.00 0.00 0.52 0.00 0.00 54.79 54.26 1wx7 n ASP 55 Cb 0.09 0.02 0.00 0.00 -0.72 0.00 0.00 41.12 40.51 1wx7 n ASP 55 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1wx7 n GLN 56 N -0.35 2.79 -1.64 -0.67 10.64 -0.91 -4.97 117.38 122.27 1wx7 n GLN 56 Ca 0.17 0.00 -0.44 0.00 -1.83 0.00 0.00 57.00 54.90 1wx7 n GLN 56 Cb 0.31 -0.93 -0.02 0.00 -0.86 0.00 0.00 30.24 28.75 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 -1.88 2.61 -3.83 2.61 4.77 -1.15 -2.52 117.00 117.61 1wx7 n LEU 57 Ca 0.00 1.18 -0.25 0.00 -0.03 0.00 0.00 56.01 56.91 1wx7 n LEU 57 Cb 0.43 -1.37 -0.17 0.00 -2.33 0.00 0.00 43.42 39.97 1wx7 n LEU 57 CO 0.00 -0.91 -0.41 -0.69 -1.33 0.00 0.00 177.39 174.05 1wx7 s VAL 58 N -0.82 0.72 -0.14 4.08 1.01 -0.35 -4.92 120.40 119.97 1wx7 s VAL 58 Ca 0.60 -0.18 -0.14 0.00 0.00 0.00 0.00 61.98 62.26 1wx7 s VAL 58 Cb -0.66 -0.86 -0.05 0.00 0.00 0.00 0.00 36.38 34.81 1wx7 s VAL 58 CO 0.58 0.24 0.31 -0.76 0.00 0.00 0.00 175.10 175.47 1wx7 s LEU 59 N 1.82 4.27 -0.05 3.92 1.43 -1.26 0.19 118.68 129.00 1wx7 s LEU 59 Ca 0.04 0.56 0.05 0.00 -1.03 0.00 0.00 54.13 53.75 1wx7 s LEU 59 Cb -0.13 -2.40 -0.01 0.00 0.03 0.00 0.00 46.19 43.68 1wx7 s LEU 59 CO -0.07 0.12 -0.20 -0.63 0.23 0.00 0.00 176.35 175.80 1wx7 s ILE 60 N 0.30 1.65 -0.28 -0.59 1.01 -0.88 -2.63 121.20 119.77 1wx7 s ILE 60 Ca 0.18 -0.84 -0.17 0.00 0.00 0.00 0.00 60.65 59.81 1wx7 s ILE 60 Cb -0.13 -1.40 0.08 0.00 0.01 0.00 0.00 42.46 41.02 1wx7 s ILE 60 CO 0.05 0.47 0.71 0.12 0.00 0.00 0.00 174.94 176.29 1wx7 s PHE 61 N -0.08 -1.00 -0.96 3.97 2.19 -0.41 -2.72 117.98 118.98 1wx7 s PHE 61 Ca -0.03 2.05 -0.03 0.00 0.33 0.00 0.00 56.93 59.25 1wx7 s PHE 61 Cb -0.12 0.57 0.00 0.00 -1.31 0.00 0.00 43.02 42.16 1wx7 s PHE 61 CO 0.02 -0.49 0.44 0.00 1.83 0.00 0.00 175.22 177.03 1wx7 n ALA 62 N 4.03 -0.64 -1.84 11.12 0.00 -1.26 -2.41 120.51 129.51 1wx7 n ALA 62 Ca -0.19 0.20 -0.20 0.00 0.00 0.00 0.00 53.44 53.25 1wx7 n ALA 62 Cb 0.58 -2.81 -0.06 0.00 0.00 0.00 0.00 19.45 17.16 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 -1.27 1.13 3.13 0.00 0.00 -1.26 -4.96 105.19 101.95 1wx7 n GLY 63 Ca -0.06 -0.06 -0.12 0.00 0.00 0.00 0.00 46.02 45.78 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 -4.11 0.46 -0.36 1.61 -2.85 -1.01 -5.12 119.74 108.36 1wx7 s LYS 64 Ca 0.00 -0.20 -0.29 0.00 -1.00 0.00 0.00 55.97 54.48 1wx7 s LYS 64 Cb 0.00 0.20 0.02 0.00 -2.06 0.00 0.00 37.83 35.99 1wx7 s LYS 64 CO 0.00 -0.11 1.10 0.42 0.10 0.00 0.00 175.35 176.86 1wx7 s ILE 65 N -1.03 4.42 0.35 3.79 -1.09 -1.26 -1.29 121.20 125.09 1wx7 s ILE 65 Ca -0.11 1.59 -0.26 0.00 -2.23 0.00 0.00 60.65 59.64 1wx7 s ILE 65 Cb -0.06 -4.45 -0.12 0.00 -1.58 0.00 0.00 42.46 36.25 1wx7 s ILE 65 CO 0.02 -0.61 1.06 0.18 -1.23 0.00 0.00 174.94 174.36 1wx7 n LEU 66 N 7.14 2.44 -4.91 2.97 4.77 -1.08 -4.98 117.00 123.36 1wx7 n LEU 66 Ca 0.12 1.12 -0.27 0.00 -0.03 0.00 0.00 56.01 56.95 1wx7 n LEU 66 Cb 0.48 -1.35 -0.02 0.00 -2.33 0.00 0.00 43.42 40.19 1wx7 n LEU 66 CO 0.62 -1.27 0.22 -0.54 -1.33 0.00 0.00 177.39 175.10 1wx7 s LYS 67 N -1.80 3.59 0.03 3.23 -0.14 -1.26 -4.89 119.74 118.49 1wx7 s LYS 67 Ca 0.60 -0.06 -0.27 0.00 -1.36 0.00 0.00 55.97 54.88 1wx7 s LYS 67 Cb -0.61 -2.62 -0.17 0.00 -1.68 0.00 0.00 37.83 32.75 1wx7 s LYS 67 CO 0.59 0.15 1.36 -0.44 -0.76 0.00 0.00 175.35 176.26 1wx7 h ASP 68 N 1.28 -0.45 0.00 2.83 5.19 -1.95 -2.74 116.42 120.58 1wx7 h ASP 68 Ca -0.48 -0.10 0.00 0.00 -0.62 0.00 0.00 57.03 55.83 1wx7 h ASP 68 Cb 1.20 0.12 0.00 0.00 0.18 0.00 0.00 39.33 40.82 1wx7 h ASP 68 CO 0.64 -0.15 0.00 -0.81 -3.12 0.00 0.00 179.24 175.80 1wx7 n PRO 69 N -5.23 0.49 -3.53 3.56 -0.04 -1.26 -3.32 135.00 125.67 1wx7 n PRO 69 Ca -0.10 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 62.94 1wx7 n PRO 69 Cb 0.28 -1.29 -0.10 0.00 -0.04 0.00 0.00 33.50 32.35 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 -1.79 5.87 0.84 3.54 1.11 -1.03 -5.04 116.67 120.16 1wx7 s ASP 70 Ca 0.13 -1.22 -0.12 0.00 0.18 0.00 0.00 52.55 51.52 1wx7 s ASP 70 Cb 0.06 -2.07 0.10 0.00 1.07 0.00 0.00 42.92 42.08 1wx7 s ASP 70 CO 0.10 -0.51 1.16 -0.94 1.18 0.00 0.00 175.17 176.16 1wx7 s SER 71 N 2.02 3.52 0.36 0.27 1.04 -1.26 -3.89 113.70 115.75 1wx7 s SER 71 Ca 0.03 2.20 0.14 0.00 0.48 0.00 0.00 55.95 58.80 1wx7 s SER 71 Cb -0.22 -2.57 0.98 0.00 0.10 0.00 0.00 66.02 64.32 1wx7 s SER 71 CO 0.06 -2.71 1.76 -0.07 0.98 0.00 0.00 173.24 173.26 1wx7 h LEU 72 N -1.28 0.57 -0.64 2.42 3.38 -0.67 0.53 115.31 119.61 1wx7 h LEU 72 Ca -0.45 0.10 -0.15 0.00 0.09 0.00 0.00 57.88 57.48 1wx7 h LEU 72 Cb 1.27 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 42.02 1wx7 h LEU 72 CO 0.45 0.12 -0.64 0.00 0.09 0.00 0.00 178.44 178.46 1wx7 h ALA 73 N 1.66 0.85 0.00 1.53 0.00 -1.62 0.49 119.26 122.17 1wx7 h ALA 73 Ca 0.60 -0.57 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1wx7 h ALA 73 Cb 1.32 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1wx7 h ALA 73 CO -0.36 0.77 -0.38 1.96 0.00 0.00 0.00 179.25 181.24 1wx7 h GLN 74 N 0.11 0.00 0.02 0.00 4.20 -0.39 -3.22 115.11 115.83 1wx7 h GLN 74 Ca -0.01 0.00 -0.25 0.00 0.06 0.00 0.00 58.65 58.45 1wx7 h GLN 74 Cb 1.15 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.90 1wx7 h GLN 74 CO 0.09 0.38 -1.29 0.00 -0.67 0.00 0.00 178.83 177.34 1wx7 n GLY 76 N 1.46 1.45 3.82 0.00 0.00 -0.80 -4.93 105.19 106.19 1wx7 n GLY 76 Ca -0.08 0.00 -0.36 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 -1.87 4.61 0.24 1.61 1.01 0.17 -5.00 120.40 121.16 1wx7 s VAL 77 Ca 0.00 1.21 0.05 0.00 0.00 0.00 0.00 61.98 63.24 1wx7 s VAL 77 Cb 0.00 -3.83 -0.02 0.00 0.00 0.00 0.00 36.38 32.53 1wx7 s VAL 77 CO 0.00 0.19 0.18 0.54 0.00 0.00 0.00 175.10 176.01 1wx7 n ARG 78 N 0.68 0.35 -2.35 2.72 5.12 -1.26 -4.14 116.66 117.78 1wx7 n ARG 78 Ca -0.02 -2.36 -0.37 0.00 -1.93 0.00 0.00 57.85 53.16 1wx7 n ARG 78 Cb 0.51 1.82 -0.03 0.00 -1.16 0.00 0.00 32.46 33.60 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 -2.66 5.88 0.00 0.55 2.15 -1.26 -2.62 116.67 118.71 1wx7 s ASP 79 Ca 0.26 -0.70 0.00 0.00 0.43 0.00 0.00 52.55 52.54 1wx7 s ASP 79 Cb 0.01 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 40.07 1wx7 s ASP 79 CO 0.18 -2.03 0.00 0.61 -0.17 0.00 0.00 175.17 173.76 1wx7 n GLY 80 N 6.29 1.61 3.96 2.66 0.00 -1.05 -4.81 105.19 113.85 1wx7 n GLY 80 Ca 0.25 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.05 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 3.38 0.15 0.99 1.43 -1.08 -4.97 118.68 118.58 1wx7 s LEU 81 Ca 0.00 0.13 0.09 0.00 -1.03 0.00 0.00 54.13 53.32 1wx7 s LEU 81 Cb 0.00 -3.00 -0.04 0.00 0.03 0.00 0.00 46.19 43.18 1wx7 s LEU 81 CO 0.00 -1.01 -0.22 -0.89 0.23 0.00 0.00 176.35 174.46 1wx7 s THR 82 N -2.72 1.98 -0.09 5.49 2.01 -1.26 -2.08 115.64 118.97 1wx7 s THR 82 Ca 0.54 -1.81 -0.02 0.00 0.31 0.00 0.00 61.69 60.71 1wx7 s THR 82 Cb -0.10 -1.85 0.04 0.00 0.01 0.00 0.00 72.50 70.60 1wx7 s THR 82 CO 0.39 -0.13 0.04 -0.69 -0.69 0.00 0.00 174.62 173.53 1wx7 s VAL 83 N -1.55 0.17 -0.57 3.82 1.01 0.83 -4.91 120.40 119.20 1wx7 s VAL 83 Ca 0.14 0.12 -0.27 0.00 0.00 0.00 0.00 61.98 61.96 1wx7 s VAL 83 Cb -0.08 -0.46 0.00 0.00 0.00 0.00 0.00 36.38 35.84 1wx7 s VAL 83 CO 0.07 0.11 1.59 -1.00 0.00 0.00 0.00 175.10 175.86 1wx7 s HIS 84 N 2.05 2.03 0.23 5.22 3.76 -1.10 -0.22 115.29 127.26 1wx7 s HIS 84 Ca 0.04 0.54 -0.13 0.00 -0.15 0.00 0.00 55.06 55.36 1wx7 s HIS 84 Cb -0.13 -4.29 -0.08 0.00 1.11 0.00 0.00 32.58 29.19 1wx7 s HIS 84 CO -0.05 -2.21 0.61 -1.17 -0.85 0.00 0.00 174.74 171.07 1wx7 s LEU 85 N 7.06 4.20 -0.16 0.89 2.96 0.39 -2.07 118.68 131.96 1wx7 s LEU 85 Ca 0.59 1.09 -0.04 0.00 -0.22 0.00 0.00 54.13 55.54 1wx7 s LEU 85 Cb -0.12 -3.66 0.06 0.00 0.50 0.00 0.00 46.19 42.96 1wx7 s LEU 85 CO 0.24 -0.05 0.08 -0.69 -1.32 0.00 0.00 176.35 174.60 1wx7 s VAL 86 N -1.74 -0.00 -0.17 1.68 1.01 0.13 -4.19 120.40 117.12 1wx7 s VAL 86 Ca 0.46 -0.15 -0.27 0.00 0.00 0.00 0.00 61.98 62.02 1wx7 s VAL 86 Cb -0.12 -0.59 -0.01 0.00 0.00 0.00 0.00 36.38 35.66 1wx7 s VAL 86 CO 0.20 -0.21 0.92 -0.63 0.00 0.00 0.00 175.10 175.38 1wx7 s ILE 87 N 2.10 4.81 0.13 2.22 1.09 -1.26 -1.21 121.20 129.07 1wx7 s ILE 87 Ca 0.02 1.83 -0.11 0.00 -1.10 0.00 0.00 60.65 61.29 1wx7 s ILE 87 Cb -0.16 -4.22 -0.10 0.00 -1.06 0.00 0.00 42.46 36.92 1wx7 s ILE 87 CO -0.08 -0.03 1.40 0.11 -0.10 0.00 0.00 174.94 176.24 1wx7 h LYS 88 N 7.30 0.86 -5.34 2.79 1.79 -1.85 -3.48 116.57 118.65 1wx7 h LYS 88 Ca -0.27 -0.57 -0.35 0.00 -2.18 0.00 0.00 60.65 57.28 1wx7 h LYS 88 Cb 1.12 0.08 0.13 0.00 -1.58 0.00 0.00 32.23 31.97 1wx7 h LYS 88 CO 0.87 1.20 -0.62 0.54 -1.08 0.00 0.00 179.45 180.36 1wx7 n ARG 89 N -3.99 -7.02 0.02 3.15 5.12 -1.26 -4.93 116.66 107.74 1wx7 n ARG 89 Ca -0.05 0.75 -0.22 0.00 -1.93 0.00 0.00 57.85 56.40 1wx7 n ARG 89 Cb 0.65 -5.54 -0.14 0.00 -1.16 0.00 0.00 32.46 26.27 1wx7 n ARG 89 CO 0.00 0.00 0.00 1.96 -1.93 0.00 0.00 177.63 177.66 1wx7 h GLN 90 N -2.34 0.28 -4.35 5.56 4.20 -1.93 -3.47 115.11 113.04 1wx7 h GLN 90 Ca -0.51 -0.47 -0.48 0.00 0.06 0.00 0.00 58.65 57.24 1wx7 h GLN 90 Cb 1.33 0.18 0.08 0.00 0.30 0.00 0.00 27.48 29.37 1wx7 h GLN 90 CO 0.50 1.23 -0.40 1.58 -0.67 0.00 0.00 178.83 181.06 1wx7 n HIS 91 N -3.88 -0.41 -0.10 2.96 -0.00 -1.26 -4.92 115.22 107.61 1wx7 n HIS 91 Ca -0.24 0.69 -0.13 0.00 0.46 0.00 0.00 57.72 58.50 1wx7 n HIS 91 Cb 0.93 -1.42 -0.05 0.00 -0.12 0.00 0.00 29.99 29.33 1wx7 n HIS 91 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 1wx7 n ARG 92 N 0.74 0.53 -1.51 1.57 1.74 -1.26 -5.01 116.66 113.46 1wx7 n ARG 92 Ca 0.13 0.31 -0.30 0.00 -0.77 0.00 0.00 57.85 57.22 1wx7 n ARG 92 Cb 0.19 -1.52 0.20 0.00 -1.02 0.00 0.00 32.46 30.31 1wx7 n ARG 92 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1wx7 s ALA 93 N -2.76 1.46 0.03 7.54 0.00 -1.26 -5.00 121.76 121.76 1wx7 s ALA 93 Ca -0.28 -1.02 -0.26 0.00 0.00 0.00 0.00 51.96 50.41 1wx7 s ALA 93 Cb 0.06 -2.85 -0.14 0.00 0.00 0.00 0.00 23.12 20.19 1wx7 s ALA 93 CO 0.41 -2.94 1.22 1.98 0.00 0.00 0.00 175.76 176.43 1wx7 h MET 94 N -2.05 -0.89 0.00 0.00 4.05 -2.04 -3.49 114.93 110.51 1wx7 h MET 94 Ca -0.45 0.06 0.00 0.00 -0.28 0.00 0.00 59.70 59.03 1wx7 h MET 94 Cb 1.27 0.20 0.00 0.00 -0.80 0.00 0.00 31.60 32.27 1wx7 h MET 94 CO 0.39 -0.59 0.00 0.41 0.23 0.00 0.00 176.91 177.34 1wx7 n GLY 95 N -1.00 0.80 3.97 1.39 0.00 -1.26 -4.92 105.19 104.17 1wx7 n GLY 95 Ca -0.11 -0.75 -0.22 0.00 0.00 0.00 0.00 46.02 44.93 1wx7 n GLY 95 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1wx7 s ASN 96 N -1.70 5.01 0.15 1.61 -0.87 -1.26 -5.05 114.94 112.84 1wx7 s ASN 96 Ca 0.00 -0.06 0.10 0.00 -1.57 0.00 0.00 52.86 51.33 1wx7 s ASN 96 Cb 0.00 -0.68 -0.04 0.00 -0.02 0.00 0.00 41.25 40.51 1wx7 s ASN 96 CO 0.00 -1.36 -0.23 -1.83 -2.57 0.00 0.00 177.10 171.11 1wx7 s GLU 97 N -4.89 1.38 -0.01 -0.60 4.04 -1.26 -5.14 118.70 112.21 1wx7 s GLU 97 Ca 0.60 -1.39 0.04 0.00 0.04 0.00 0.00 54.97 54.25 1wx7 s GLU 97 Cb -0.09 -1.70 -0.03 0.00 0.02 0.00 0.00 34.13 32.33 1wx7 s GLU 97 CO 0.40 0.38 -0.10 0.00 -1.84 0.00 0.00 175.26 174.10 1wx7 s PRO 99 N -1.19 0.42 -0.16 0.00 0.04 -1.26 -4.96 135.00 127.89 1wx7 s PRO 99 Ca 0.15 0.52 -0.29 0.00 0.04 0.00 0.00 61.00 61.42 1wx7 s PRO 99 Cb -0.11 -1.74 -0.02 0.00 0.04 0.00 0.00 34.50 32.68 1wx7 s PRO 99 CO 0.05 -2.74 1.32 0.00 0.04 0.00 0.00 177.00 175.66 1wx7 s ALA 100 N -2.96 3.63 0.05 8.56 0.00 -1.26 -5.02 121.76 124.77 1wx7 s ALA 100 Ca 0.65 0.48 0.05 0.00 0.00 0.00 0.00 51.96 53.15 1wx7 s ALA 100 Cb -0.19 -3.65 -0.04 0.00 0.00 0.00 0.00 23.12 19.25 1wx7 s ALA 100 CO 0.58 -1.26 -0.06 0.45 0.00 0.00 0.00 175.76 175.47 1wx7 s SER 101 N 2.23 4.65 0.00 0.00 0.15 -1.26 -5.11 113.70 114.35 1wx7 s SER 101 Ca 0.57 -0.23 0.00 0.00 0.70 0.00 0.00 55.95 57.00 1wx7 s SER 101 Cb -0.23 -1.03 0.00 0.00 -1.71 0.00 0.00 66.02 63.05 1wx7 s SER 101 CO 0.17 0.23 0.00 0.61 1.20 0.00 0.00 173.24 175.45 1wx7 n GLY 102 N 1.06 0.51 0.00 9.45 0.00 -1.26 -4.99 105.19 109.96 1wx7 n GLY 102 Ca -0.14 -0.71 0.07 0.00 0.00 0.00 0.00 46.02 45.24 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 0.49 -1.29 1.61 -0.04 -1.26 -4.87 135.00 129.63 1wx7 n PRO 103 Ca 0.00 0.00 -0.50 0.00 -0.04 0.00 0.00 63.50 62.96 1wx7 n PRO 103 Cb 0.00 -1.48 -0.07 0.00 -0.04 0.00 0.00 33.50 31.91 1wx7 n PRO 103 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1wx7 n SER 104 N -0.98 0.45 -4.71 3.54 2.88 -1.26 -4.93 113.62 108.61 1wx7 n SER 104 Ca 0.11 0.94 -0.23 0.00 -1.33 0.00 0.00 58.87 58.36 1wx7 n SER 104 Cb 0.05 -0.72 -0.06 0.00 -0.75 0.00 0.00 64.21 62.73 1wx7 n SER 104 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1wx7 s SER 105 N 1.12 4.93 0.00 -3.46 0.01 -1.26 -5.24 113.70 109.80 1wx7 s SER 105 Ca 0.78 -0.48 0.00 0.00 1.31 0.00 0.00 55.95 57.56 1wx7 s SER 105 Cb -1.10 -1.07 0.00 0.00 0.21 0.00 0.00 66.02 64.06 1wx7 s SER 105 CO 0.55 -0.00 0.00 0.61 0.41 0.00 0.00 173.24 174.80