#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wx7 h SER 2 N 0.00 0.51 -3.70 1.61 0.02 -2.06 -3.41 113.55 106.52 1wx7 h SER 2 Ca 0.00 -0.91 -0.78 0.00 -0.84 0.00 0.00 61.79 59.26 1wx7 h SER 2 Cb 0.00 -0.17 -0.28 0.00 0.14 0.00 0.00 62.40 62.09 1wx7 h SER 2 CO 0.00 1.57 0.21 -0.44 -1.14 0.00 0.00 176.83 177.03 1wx7 s SER 3 N -7.12 6.87 0.00 3.07 0.01 -1.26 -4.85 113.70 110.42 1wx7 s SER 3 Ca -0.16 -3.17 0.00 0.00 1.31 0.00 0.00 55.95 53.93 1wx7 s SER 3 Cb 0.03 -2.17 0.00 0.00 0.21 0.00 0.00 66.02 64.09 1wx7 s SER 3 CO 0.83 -0.41 0.00 0.61 0.41 0.00 0.00 173.24 174.68 1wx7 n GLY 4 N 3.27 0.86 3.02 3.44 0.00 -1.26 -5.16 105.19 109.36 1wx7 n GLY 4 Ca 0.18 0.42 -0.13 0.00 0.00 0.00 0.00 46.02 46.50 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 2.00 -0.17 0.10 1.61 1.04 -1.26 -5.06 113.70 111.96 1wx7 s SER 5 Ca 0.00 0.34 -0.24 0.00 0.48 0.00 0.00 55.95 56.53 1wx7 s SER 5 Cb 0.00 0.32 -0.13 0.00 0.10 0.00 0.00 66.02 66.31 1wx7 s SER 5 CO 0.00 -0.08 1.71 0.77 0.98 0.00 0.00 173.24 176.61 1wx7 h SER 6 N 6.26 -0.21 -3.83 7.02 4.64 -1.97 -3.48 113.55 121.99 1wx7 h SER 6 Ca -0.30 0.02 -0.12 0.00 -0.47 0.00 0.00 61.79 60.92 1wx7 h SER 6 Cb 1.18 0.08 0.08 0.00 -0.31 0.00 0.00 62.40 63.43 1wx7 h SER 6 CO 0.41 -0.13 -0.35 0.61 -0.87 0.00 0.00 176.83 176.50 1wx7 n GLY 7 N -1.19 0.06 3.17 -0.77 0.00 -1.26 -5.00 105.19 100.20 1wx7 n GLY 7 Ca -0.07 -0.05 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 1wx7 n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wx7 s SER 8 N -3.35 6.24 0.80 1.61 0.01 -1.26 -5.07 113.70 112.69 1wx7 s SER 8 Ca 0.11 -3.56 -0.11 0.00 1.31 0.00 0.00 55.95 53.71 1wx7 s SER 8 Cb -0.01 -1.98 0.07 0.00 0.21 0.00 0.00 66.02 64.31 1wx7 s SER 8 CO 0.31 -0.24 1.09 -2.16 0.41 0.00 0.00 173.24 172.65 1wx7 s PRO 9 N -1.12 2.02 0.30 12.44 0.04 -1.26 -4.93 135.00 142.49 1wx7 s PRO 9 Ca 0.27 1.08 -0.23 0.00 0.04 0.00 0.00 61.00 62.16 1wx7 s PRO 9 Cb -0.09 -1.88 -0.16 0.00 0.04 0.00 0.00 34.50 32.42 1wx7 s PRO 9 CO -0.10 -1.79 0.27 0.00 0.04 0.00 0.00 177.00 175.42 1wx7 n ALA 10 N -3.61 -2.87 -1.05 8.56 0.00 -1.26 -4.93 120.51 115.35 1wx7 n ALA 10 Ca 0.09 0.25 -0.19 0.00 0.00 0.00 0.00 53.44 53.59 1wx7 n ALA 10 Cb 0.54 -1.46 0.24 0.00 0.00 0.00 0.00 19.45 18.76 1wx7 n ALA 10 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1wx7 n PRO 11 N 1.13 -3.05 -3.62 0.00 -0.04 -1.26 -5.10 135.00 123.06 1wx7 n PRO 11 Ca 0.14 -1.66 -0.06 0.00 -0.04 0.00 0.00 63.50 61.88 1wx7 n PRO 11 Cb 0.32 -1.55 -0.05 0.00 -0.04 0.00 0.00 33.50 32.17 1wx7 n PRO 11 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1wx7 s VAL 12 N -2.87 0.00 0.68 0.52 0.11 -1.26 -5.16 120.40 112.42 1wx7 s VAL 12 Ca 0.67 0.00 -0.17 0.00 -2.93 0.00 0.00 61.98 59.56 1wx7 s VAL 12 Cb -0.07 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.74 1wx7 s VAL 12 CO 0.52 0.00 0.61 0.00 -3.33 0.00 0.00 175.10 172.90 1wx7 n GLN 13 N 0.86 0.42 -3.68 1.54 -0.00 -1.26 -5.02 117.38 110.24 1wx7 n GLN 13 Ca -0.06 0.18 -0.13 0.00 -0.00 0.00 0.00 57.00 57.00 1wx7 n GLN 13 Cb 0.58 -1.87 -0.13 0.00 -0.00 0.00 0.00 30.24 28.82 1wx7 n GLN 13 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.06 177.22 1wx7 s ASP 14 N -1.40 0.09 0.00 2.61 1.47 -1.26 -5.10 116.67 113.07 1wx7 s ASP 14 Ca 0.68 0.63 0.00 0.00 1.18 0.00 0.00 52.55 55.04 1wx7 s ASP 14 Cb -0.37 0.68 0.00 0.00 -0.34 0.00 0.00 42.92 42.89 1wx7 s ASP 14 CO 0.55 -0.22 0.00 -0.81 0.68 0.00 0.00 175.17 175.38 1wx7 n PRO 15 N 4.99 0.00 -0.80 2.11 -0.04 -1.26 -4.63 135.00 135.38 1wx7 n PRO 15 Ca -0.12 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.29 1wx7 n PRO 15 Cb 0.51 -0.23 0.21 0.00 -0.04 0.00 0.00 33.50 33.94 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 1.27 -1.54 0.54 8.25 -1.26 -5.00 115.22 117.48 1wx7 n HIS 16 Ca 0.00 -1.52 -0.40 0.00 -0.26 0.00 0.00 57.72 55.54 1wx7 n HIS 16 Cb 0.00 -0.51 -0.05 0.00 1.12 0.00 0.00 29.99 30.55 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 -1.03 2.30 -4.95 2.41 -0.00 -1.26 -2.61 117.00 111.85 1wx7 n LEU 17 Ca 0.34 -0.16 -0.21 0.00 -0.00 0.00 0.00 56.01 55.98 1wx7 n LEU 17 Cb 1.08 -1.47 0.00 0.00 -0.00 0.00 0.00 43.42 43.03 1wx7 n LEU 17 CO 0.23 -1.18 0.12 0.27 -0.00 0.00 0.00 177.39 176.83 1wx7 s ILE 18 N 10.41 2.40 -0.05 1.96 -4.36 0.21 -4.85 121.20 126.92 1wx7 s ILE 18 Ca 1.04 -1.22 -0.00 0.00 -0.26 0.00 0.00 60.65 60.21 1wx7 s ILE 18 Cb -0.41 -2.63 -0.03 0.00 1.25 0.00 0.00 42.46 40.64 1wx7 s ILE 18 CO 0.33 0.00 -0.02 -0.75 0.24 0.00 0.00 174.94 174.75 1wx7 s LYS 19 N -4.33 2.86 -0.05 0.37 2.36 -1.26 -0.52 119.74 119.16 1wx7 s LYS 19 Ca 0.50 -0.51 -0.01 0.00 -2.55 0.00 0.00 55.97 53.40 1wx7 s LYS 19 Cb -0.05 -2.70 0.03 0.00 -1.05 0.00 0.00 37.83 34.06 1wx7 s LYS 19 CO 0.30 0.67 0.02 0.08 1.55 0.00 0.00 175.35 177.97 1wx7 s VAL 20 N -0.93 0.18 -0.23 4.02 1.01 0.87 -2.82 120.40 122.50 1wx7 s VAL 20 Ca 0.15 0.23 -0.17 0.00 0.00 0.00 0.00 61.98 62.18 1wx7 s VAL 20 Cb -0.11 -0.36 -0.03 0.00 0.00 0.00 0.00 36.38 35.87 1wx7 s VAL 20 CO 0.04 0.22 0.48 -0.89 0.00 0.00 0.00 175.10 174.95 1wx7 s THR 21 N 1.91 5.12 -0.42 3.92 2.01 -1.01 0.44 115.64 127.62 1wx7 s THR 21 Ca 0.03 0.84 -0.20 0.00 0.31 0.00 0.00 61.69 62.66 1wx7 s THR 21 Cb -0.12 -3.80 0.02 0.00 0.01 0.00 0.00 72.50 68.61 1wx7 s THR 21 CO -0.04 0.16 0.63 -0.69 -0.69 0.00 0.00 174.62 174.00 1wx7 s VAL 22 N 1.83 4.85 -0.45 3.82 1.01 0.34 -0.31 120.40 131.49 1wx7 s VAL 22 Ca 0.21 0.22 -0.18 0.00 0.00 0.00 0.00 61.98 62.23 1wx7 s VAL 22 Cb -0.15 -4.17 0.04 0.00 0.00 0.00 0.00 36.38 32.10 1wx7 s VAL 22 CO 0.09 -0.52 0.51 -0.54 0.00 0.00 0.00 175.10 174.64 1wx7 s LYS 23 N 2.77 3.11 0.21 2.72 1.02 0.47 -2.41 119.74 127.62 1wx7 s LYS 23 Ca 0.23 -0.83 0.09 0.00 0.02 0.00 0.00 55.97 55.48 1wx7 s LYS 23 Cb -0.14 -4.02 -0.04 0.00 -0.52 0.00 0.00 37.83 33.10 1wx7 s LYS 23 CO 0.18 -1.00 -0.08 0.95 -0.92 0.00 0.00 175.35 174.48 1wx7 s THR 24 N 2.29 3.19 -2.00 2.17 -4.23 0.67 0.16 115.64 117.90 1wx7 s THR 24 Ca 0.13 -1.77 0.08 0.00 -1.18 0.00 0.00 61.69 58.96 1wx7 s THR 24 Cb -0.18 -2.62 0.24 0.00 1.34 0.00 0.00 72.50 71.28 1wx7 s THR 24 CO 0.13 -0.19 0.95 -0.81 -0.54 0.00 0.00 174.62 174.16 1wx7 n PRO 25 N -0.21 0.49 0.00 3.99 -0.04 -1.26 -2.53 135.00 135.43 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 2.71 -3.86 0.54 4.76 -1.26 -5.12 118.16 115.17 1wx7 n LYS 26 Ca 0.06 0.00 -0.00 0.00 -2.87 0.00 0.00 58.31 55.50 1wx7 n LYS 26 Cb 0.03 -0.89 0.01 0.00 -1.84 0.00 0.00 35.03 32.34 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 -2.33 -0.02 -0.14 4.39 1.01 -1.05 -5.18 116.67 113.35 1wx7 s ASP 27 Ca 0.00 -0.40 -0.11 0.00 0.71 0.00 0.00 52.55 52.75 1wx7 s ASP 27 Cb 0.00 0.32 0.04 0.00 1.01 0.00 0.00 42.92 44.30 1wx7 s ASP 27 CO 0.00 -0.63 0.36 -1.59 0.21 0.00 0.00 175.17 173.51 1wx7 s LYS 28 N -2.28 0.38 0.30 8.23 0.00 -1.26 -0.24 119.74 124.87 1wx7 s LYS 28 Ca 0.22 0.58 0.04 0.00 0.00 0.00 0.00 55.97 56.81 1wx7 s LYS 28 Cb -0.00 0.10 -0.03 0.00 0.00 0.00 0.00 37.83 37.90 1wx7 s LYS 28 CO 0.01 -0.09 0.27 -2.00 0.00 0.00 0.00 175.35 173.55 1wx7 s GLU 29 N 0.65 1.64 -0.06 1.78 2.56 -1.01 -4.98 118.70 119.28 1wx7 s GLU 29 Ca -0.04 -1.87 0.04 0.00 0.00 0.00 0.00 54.97 53.10 1wx7 s GLU 29 Cb -0.05 0.33 -0.02 0.00 2.00 0.00 0.00 34.13 36.39 1wx7 s GLU 29 CO -0.04 -0.61 -0.16 -0.51 -0.56 0.00 0.00 175.26 173.38 1wx7 s ASP 30 N -3.30 3.86 0.30 -1.70 1.01 -1.26 -0.50 116.67 115.09 1wx7 s ASP 30 Ca 0.39 -0.26 0.08 0.00 0.71 0.00 0.00 52.55 53.47 1wx7 s ASP 30 Cb 0.03 -0.90 -0.06 0.00 1.01 0.00 0.00 42.92 43.01 1wx7 s ASP 30 CO 0.23 0.31 -0.09 -0.36 0.21 0.00 0.00 175.17 175.47 1wx7 s PHE 31 N -0.54 2.15 -0.17 4.23 0.40 0.17 -4.95 117.98 119.27 1wx7 s PHE 31 Ca 0.07 -0.58 -0.01 0.00 -0.60 0.00 0.00 56.93 55.81 1wx7 s PHE 31 Cb -0.11 -1.19 0.05 0.00 0.51 0.00 0.00 43.02 42.27 1wx7 s PHE 31 CO 0.01 0.44 -0.01 -1.54 0.70 0.00 0.00 175.22 174.83 1wx7 s SER 32 N -3.51 2.78 0.12 1.36 1.04 -1.26 -0.09 113.70 114.14 1wx7 s SER 32 Ca 0.30 -0.69 -0.10 0.00 0.48 0.00 0.00 55.95 55.94 1wx7 s SER 32 Cb 0.02 -0.74 0.00 0.00 0.10 0.00 0.00 66.02 65.41 1wx7 s SER 32 CO 0.14 -0.24 0.26 0.68 0.98 0.00 0.00 173.24 175.06 1wx7 s VAL 33 N 1.75 0.11 0.29 5.02 -7.23 0.32 -4.93 120.40 115.73 1wx7 s VAL 33 Ca 0.00 -1.12 -0.29 0.00 -1.81 0.00 0.00 61.98 58.76 1wx7 s VAL 33 Cb -0.16 -1.45 -0.10 0.00 0.56 0.00 0.00 36.38 35.24 1wx7 s VAL 33 CO -0.07 -0.49 1.10 0.42 -0.31 0.00 0.00 175.10 175.76 1wx7 s THR 34 N -3.88 3.46 0.48 5.32 -4.23 -1.26 0.64 115.64 116.18 1wx7 s THR 34 Ca 0.08 1.45 0.24 0.00 -1.18 0.00 0.00 61.69 62.28 1wx7 s THR 34 Cb 0.04 -3.91 0.42 0.00 1.34 0.00 0.00 72.50 70.38 1wx7 s THR 34 CO -0.08 0.33 1.90 -2.24 -0.54 0.00 0.00 174.62 173.99 1wx7 h ASP 35 N 3.71 0.18 0.45 3.99 2.03 -1.86 0.46 116.42 125.38 1wx7 h ASP 35 Ca -0.47 0.02 -0.02 0.00 -0.73 0.00 0.00 57.03 55.83 1wx7 h ASP 35 Cb 1.21 -0.02 -0.00 0.00 -0.83 0.00 0.00 39.33 39.69 1wx7 h ASP 35 CO 0.66 0.08 -0.09 0.00 -1.03 0.00 0.00 179.24 178.86 1wx7 h THR 36 N 0.18 0.40 -2.97 1.15 1.03 -1.91 -1.91 112.91 108.88 1wx7 h THR 36 Ca 0.40 -0.49 -0.59 0.00 -0.01 0.00 0.00 66.41 65.72 1wx7 h THR 36 Cb 1.29 1.35 0.14 0.00 -1.07 0.00 0.00 68.15 69.85 1wx7 h THR 36 CO -0.07 0.09 0.08 0.00 -0.01 0.00 0.00 175.52 175.60 1wx7 s THR 38 N -1.31 3.69 0.12 0.00 -4.23 -1.26 -1.29 115.64 111.36 1wx7 s THR 38 Ca 0.64 -0.57 -0.17 0.00 -1.18 0.00 0.00 61.69 60.41 1wx7 s THR 38 Cb -0.56 -3.36 -0.03 0.00 1.34 0.00 0.00 72.50 69.90 1wx7 s THR 38 CO 0.56 -0.25 1.68 0.40 -0.54 0.00 0.00 174.62 176.48 1wx7 h ILE 39 N 0.35 1.18 -0.27 2.99 1.08 -1.63 -2.54 117.51 118.67 1wx7 h ILE 39 Ca -0.45 -0.54 -0.01 0.00 -0.39 0.00 0.00 64.86 63.47 1wx7 h ILE 39 Cb 1.26 0.89 -0.01 0.00 -3.07 0.00 0.00 36.82 35.89 1wx7 h ILE 39 CO 0.56 0.19 0.12 0.06 -0.69 0.00 0.00 178.15 178.39 1wx7 h GLN 40 N 0.42 0.37 -0.58 2.37 -0.00 -1.86 -2.26 115.11 113.57 1wx7 h GLN 40 Ca 0.12 -0.04 -0.03 0.00 -0.00 0.00 0.00 58.65 58.70 1wx7 h GLN 40 Cb 0.16 -0.08 -0.03 0.00 -0.00 0.00 0.00 27.48 27.54 1wx7 h GLN 40 CO -0.01 0.30 0.24 1.96 -0.00 0.00 0.00 178.83 181.32 1wx7 h GLN 41 N 0.38 0.87 -0.52 0.06 4.20 -1.81 -2.91 115.11 115.37 1wx7 h GLN 41 Ca 0.10 -0.15 -0.06 0.00 0.06 0.00 0.00 58.65 58.59 1wx7 h GLN 41 Cb 0.06 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.68 1wx7 h GLN 41 CO -0.01 0.74 0.10 1.25 -0.67 0.00 0.00 178.83 180.24 1wx7 h LEU 42 N 0.81 0.82 -0.86 1.46 5.85 -1.18 -3.05 115.31 119.16 1wx7 h LEU 42 Ca 0.20 -0.25 0.18 0.00 0.84 0.00 0.00 57.88 58.84 1wx7 h LEU 42 Cb 0.19 -0.22 -0.16 0.00 0.37 0.00 0.00 40.66 40.84 1wx7 h LEU 42 CO -0.02 0.86 -0.17 0.11 -0.34 0.00 0.00 178.44 178.88 1wx7 h LYS 43 N 0.74 0.01 0.00 1.25 1.79 -1.25 1.39 116.57 120.50 1wx7 h LYS 43 Ca 0.16 -0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.60 1wx7 h LYS 43 Cb 0.38 -0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.02 1wx7 h LYS 43 CO 0.01 0.01 -0.14 0.93 -1.08 0.00 0.00 179.45 179.18 1wx7 h GLU 44 N 0.01 0.00 0.02 3.15 5.08 -1.54 0.35 114.58 121.65 1wx7 h GLU 44 Ca 0.43 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.79 1wx7 h GLU 44 Cb 0.69 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.94 1wx7 h GLU 44 CO -0.86 0.14 -0.01 0.93 -1.00 0.00 0.00 179.01 178.20 1wx7 h GLU 45 N 0.00 -0.03 0.00 2.33 4.39 0.17 -3.25 114.58 118.19 1wx7 h GLU 45 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1wx7 h GLU 45 Cb 0.26 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.92 1wx7 h GLU 45 CO 0.02 0.67 0.00 0.44 -1.16 0.00 0.00 179.01 178.97 1wx7 n ILE 46 N -4.75 0.67 -0.23 3.13 -5.35 0.58 -2.95 119.36 110.46 1wx7 n ILE 46 Ca -0.09 0.01 -0.06 0.00 -0.27 0.00 0.00 62.75 62.34 1wx7 n ILE 46 Cb 0.35 -0.85 0.09 0.00 -1.74 0.00 0.00 39.64 37.48 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 1.01 0.79 7.28 0.87 -0.34 0.22 113.55 123.38 1wx7 h SER 47 Ca 0.00 -0.21 -0.17 0.00 -1.23 0.00 0.00 61.79 60.19 1wx7 h SER 47 Cb 0.51 -0.26 -0.03 0.00 -0.44 0.00 0.00 62.40 62.17 1wx7 h SER 47 CO 0.00 0.97 -1.31 0.06 -0.53 0.00 0.00 176.83 176.02 1wx7 h GLN 48 N 1.02 0.00 -0.02 2.24 3.07 -1.64 0.17 115.11 119.96 1wx7 h GLN 48 Ca 0.21 0.00 -0.24 0.00 0.09 0.00 0.00 58.65 58.71 1wx7 h GLN 48 Cb 0.35 0.00 0.02 0.00 0.08 0.00 0.00 27.48 27.93 1wx7 h GLN 48 CO 0.00 0.35 -0.94 -0.09 0.09 0.00 0.00 178.83 178.24 1wx7 h ARG 49 N 0.00 0.66 0.00 0.06 1.12 -1.40 -3.29 114.38 111.53 1wx7 h ARG 49 Ca -0.15 -0.69 0.00 0.00 -1.11 0.00 0.00 59.98 58.03 1wx7 h ARG 49 Cb 1.59 0.19 0.00 0.00 -0.01 0.00 0.00 29.97 31.75 1wx7 h ARG 49 CO 0.05 1.28 -0.94 1.19 -3.11 0.00 0.00 179.97 178.45 1wx7 n PHE 50 N -3.93 0.01 -2.96 2.20 3.72 0.74 -4.99 117.46 112.26 1wx7 n PHE 50 Ca -0.11 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.18 1wx7 n PHE 50 Cb 0.83 -0.08 0.06 0.00 -0.94 0.00 0.00 39.48 39.35 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 -1.54 -4.34 -3.71 -1.08 4.76 -0.38 -5.04 118.16 106.82 1wx7 n LYS 51 Ca 0.04 0.53 -0.15 0.00 -2.87 0.00 0.00 58.31 55.87 1wx7 n LYS 51 Cb 0.34 -4.63 -0.15 0.00 -1.84 0.00 0.00 35.03 28.76 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 -3.22 -0.27 0.30 7.82 0.00 0.47 -5.00 121.76 121.85 1wx7 s ALA 52 Ca 0.07 0.68 -0.27 0.00 0.00 0.00 0.00 51.96 52.44 1wx7 s ALA 52 Cb -0.03 -0.64 -0.14 0.00 0.00 0.00 0.00 23.12 22.31 1wx7 s ALA 52 CO 0.46 -0.34 0.87 1.58 0.00 0.00 0.00 175.76 178.33 1wx7 n HIS 53 N 4.70 0.77 0.89 0.00 -0.00 -1.26 -4.14 115.22 116.18 1wx7 n HIS 53 Ca -0.17 0.73 0.08 0.00 0.46 0.00 0.00 57.72 58.82 1wx7 n HIS 53 Cb 0.51 -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 0.72 0.40 0.00 1.57 -0.04 -1.26 -2.21 135.00 134.18 1wx7 n PRO 54 Ca 0.11 0.04 0.14 0.00 -0.04 0.00 0.00 63.50 63.76 1wx7 n PRO 54 Cb 0.32 -1.50 0.60 0.00 -0.04 0.00 0.00 33.50 32.88 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 1.02 0.00 3.54 9.92 -1.26 -4.01 116.55 124.68 1wx7 n ASP 55 Ca 0.10 -1.22 0.00 0.00 -0.53 0.00 0.00 54.79 53.14 1wx7 n ASP 55 Cb 0.07 0.01 0.00 0.00 -0.64 0.00 0.00 41.12 40.56 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 -0.29 2.59 -1.68 -1.24 10.64 -0.94 -4.96 117.38 121.50 1wx7 n GLN 56 Ca 0.19 0.00 -0.48 0.00 -1.83 0.00 0.00 57.00 54.88 1wx7 n GLN 56 Cb 0.30 -0.84 -0.05 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 -1.44 3.42 -4.29 2.61 4.77 -1.16 -2.52 117.00 118.38 1wx7 n LEU 57 Ca 0.00 0.99 -0.33 0.00 -0.03 0.00 0.00 56.01 56.64 1wx7 n LEU 57 Cb 0.28 -1.39 -0.15 0.00 -2.33 0.00 0.00 43.42 39.83 1wx7 n LEU 57 CO 0.00 -0.08 -0.47 -0.69 -1.33 0.00 0.00 177.39 174.81 1wx7 s VAL 58 N 3.48 2.75 -0.20 4.08 1.01 -0.21 -4.97 120.40 126.35 1wx7 s VAL 58 Ca 0.90 -0.74 -0.09 0.00 0.00 0.00 0.00 61.98 62.05 1wx7 s VAL 58 Cb -0.68 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.50 1wx7 s VAL 58 CO 0.48 0.51 0.10 -0.76 0.00 0.00 0.00 175.10 175.44 1wx7 s LEU 59 N 0.74 3.98 -0.08 3.92 1.43 -1.26 -0.09 118.68 127.32 1wx7 s LEU 59 Ca -0.06 0.13 0.03 0.00 -1.03 0.00 0.00 54.13 53.20 1wx7 s LEU 59 Cb -0.15 -2.02 0.01 0.00 0.03 0.00 0.00 46.19 44.05 1wx7 s LEU 59 CO 0.01 0.16 -0.17 -0.63 0.23 0.00 0.00 176.35 175.95 1wx7 s ILE 60 N 0.47 1.55 -0.19 -0.59 1.01 -0.95 -2.54 121.20 119.96 1wx7 s ILE 60 Ca 0.05 -0.72 -0.16 0.00 0.00 0.00 0.00 60.65 59.82 1wx7 s ILE 60 Cb -0.12 -1.38 0.05 0.00 0.01 0.00 0.00 42.46 41.02 1wx7 s ILE 60 CO -0.00 0.45 0.50 0.12 0.00 0.00 0.00 174.94 176.01 1wx7 s PHE 61 N 0.58 -0.58 -1.75 3.97 2.19 -0.83 -2.79 117.98 118.77 1wx7 s PHE 61 Ca -0.15 1.37 0.00 0.00 0.33 0.00 0.00 56.93 58.48 1wx7 s PHE 61 Cb -0.17 0.22 0.00 0.00 -1.31 0.00 0.00 43.02 41.76 1wx7 s PHE 61 CO 0.05 -0.28 0.00 0.00 1.83 0.00 0.00 175.22 176.82 1wx7 n ALA 62 N 3.03 -0.50 -1.56 11.12 0.00 -1.26 -1.41 120.51 129.94 1wx7 n ALA 62 Ca -0.15 0.20 -0.11 0.00 0.00 0.00 0.00 53.44 53.37 1wx7 n ALA 62 Cb 0.56 -2.03 -0.04 0.00 0.00 0.00 0.00 19.45 17.94 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 -0.91 0.92 3.08 0.00 0.00 -1.26 -5.00 105.19 102.01 1wx7 n GLY 63 Ca -0.22 -0.48 -0.13 0.00 0.00 0.00 0.00 46.02 45.20 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 -3.38 0.23 -0.18 1.61 -2.85 -0.50 -5.12 119.74 109.56 1wx7 s LYS 64 Ca 0.00 0.33 -0.29 0.00 -1.00 0.00 0.00 55.97 55.01 1wx7 s LYS 64 Cb 0.00 0.07 -0.03 0.00 -2.06 0.00 0.00 37.83 35.80 1wx7 s LYS 64 CO 0.00 -0.06 1.60 0.42 0.10 0.00 0.00 175.35 177.41 1wx7 s ILE 65 N 0.34 3.71 0.45 3.79 -1.09 -1.26 -1.96 121.20 125.18 1wx7 s ILE 65 Ca -0.02 0.82 -0.23 0.00 -2.23 0.00 0.00 60.65 58.99 1wx7 s ILE 65 Cb -0.03 -3.66 -0.10 0.00 -1.58 0.00 0.00 42.46 37.09 1wx7 s ILE 65 CO -0.01 -0.22 0.98 0.18 -1.23 0.00 0.00 174.94 174.63 1wx7 n LEU 66 N 8.01 2.68 -4.91 2.97 4.77 -1.05 -4.98 117.00 124.49 1wx7 n LEU 66 Ca 0.18 0.99 -0.30 0.00 -0.03 0.00 0.00 56.01 56.85 1wx7 n LEU 66 Cb 0.45 -1.35 -0.04 0.00 -2.33 0.00 0.00 43.42 40.15 1wx7 n LEU 66 CO 0.63 -1.61 0.04 -0.54 -1.33 0.00 0.00 177.39 174.59 1wx7 s LYS 67 N -2.12 3.58 0.08 3.23 -0.14 -1.26 -4.90 119.74 118.21 1wx7 s LYS 67 Ca 0.65 -0.17 -0.31 0.00 -1.36 0.00 0.00 55.97 54.78 1wx7 s LYS 67 Cb -0.53 -2.82 -0.18 0.00 -1.68 0.00 0.00 37.83 32.62 1wx7 s LYS 67 CO 0.55 0.42 1.64 -0.44 -0.76 0.00 0.00 175.35 176.76 1wx7 h ASP 68 N 2.42 -0.69 0.00 2.83 5.19 -1.95 -2.05 116.42 122.17 1wx7 h ASP 68 Ca -0.47 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 55.97 1wx7 h ASP 68 Cb 1.18 0.19 0.00 0.00 0.18 0.00 0.00 39.33 40.87 1wx7 h ASP 68 CO 0.70 -0.47 0.00 -0.81 -3.12 0.00 0.00 179.24 175.54 1wx7 n PRO 69 N -5.43 0.49 -3.49 3.56 -0.04 -1.26 -3.30 135.00 125.53 1wx7 n PRO 69 Ca -0.12 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 62.91 1wx7 n PRO 69 Cb 0.32 -1.32 -0.10 0.00 -0.04 0.00 0.00 33.50 32.37 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 -1.82 5.98 0.97 3.54 1.11 -0.77 -5.03 116.67 120.65 1wx7 s ASP 70 Ca 0.15 -1.11 -0.11 0.00 0.18 0.00 0.00 52.55 51.66 1wx7 s ASP 70 Cb 0.07 -2.12 0.18 0.00 1.07 0.00 0.00 42.92 42.12 1wx7 s ASP 70 CO 0.12 -0.50 1.10 -0.94 1.18 0.00 0.00 175.17 176.13 1wx7 s SER 71 N 1.95 2.57 0.46 0.27 1.04 -1.26 -3.70 113.70 115.03 1wx7 s SER 71 Ca 0.04 1.87 0.20 0.00 0.48 0.00 0.00 55.95 58.53 1wx7 s SER 71 Cb -0.21 -2.43 1.18 0.00 0.10 0.00 0.00 66.02 64.66 1wx7 s SER 71 CO 0.07 -3.26 1.92 -0.07 0.98 0.00 0.00 173.24 172.88 1wx7 h LEU 72 N -1.98 0.27 -0.07 2.42 3.38 -0.37 0.71 115.31 119.66 1wx7 h LEU 72 Ca -0.49 0.02 -0.25 0.00 0.09 0.00 0.00 57.88 57.25 1wx7 h LEU 72 Cb 1.29 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 42.01 1wx7 h LEU 72 CO 0.47 0.13 -1.04 0.00 0.09 0.00 0.00 178.44 178.09 1wx7 h ALA 73 N 1.65 0.25 0.00 1.53 0.00 -1.65 0.73 119.26 121.77 1wx7 h ALA 73 Ca 0.37 -0.74 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1wx7 h ALA 73 Cb 1.04 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1wx7 h ALA 73 CO -0.09 0.81 0.00 1.96 0.00 0.00 0.00 179.25 181.93 1wx7 h GLN 74 N 0.23 0.00 0.00 0.00 4.20 -1.26 -2.92 115.11 115.36 1wx7 h GLN 74 Ca -0.11 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.50 1wx7 h GLN 74 Cb 1.69 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.45 1wx7 h GLN 74 CO 0.18 0.00 -1.18 0.00 -0.67 0.00 0.00 178.83 177.17 1wx7 n GLY 76 N 1.31 1.29 3.76 0.00 0.00 -1.01 -4.89 105.19 105.65 1wx7 n GLY 76 Ca -0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.57 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 4.39 0.19 1.61 1.01 0.25 -4.99 120.40 120.86 1wx7 s VAL 77 Ca 0.00 1.80 0.03 0.00 0.00 0.00 0.00 61.98 63.81 1wx7 s VAL 77 Cb 0.00 -4.19 -0.01 0.00 0.00 0.00 0.00 36.38 32.18 1wx7 s VAL 77 CO 0.00 0.47 0.11 0.54 0.00 0.00 0.00 175.10 176.22 1wx7 n ARG 78 N 1.92 0.49 -2.43 2.72 5.12 -1.26 -4.08 116.66 119.14 1wx7 n ARG 78 Ca -0.04 -1.73 -0.39 0.00 -1.93 0.00 0.00 57.85 53.76 1wx7 n ARG 78 Cb 0.49 1.16 -0.03 0.00 -1.16 0.00 0.00 32.46 32.92 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 -2.72 116.67 118.53 1wx7 s ASP 79 Ca 0.15 -0.81 0.00 0.00 1.18 0.00 0.00 52.55 53.07 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 0.11 -1.89 0.00 0.61 0.68 0.00 0.00 175.17 174.68 1wx7 n GLY 80 N 6.25 1.35 3.95 2.12 0.00 -1.13 -4.83 105.19 112.90 1wx7 n GLY 80 Ca 0.23 0.00 -0.23 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 3.25 0.20 0.99 1.43 -1.10 -4.97 118.68 118.48 1wx7 s LEU 81 Ca 0.00 0.28 0.10 0.00 -1.03 0.00 0.00 54.13 53.48 1wx7 s LEU 81 Cb 0.00 -3.11 -0.04 0.00 0.03 0.00 0.00 46.19 43.07 1wx7 s LEU 81 CO 0.00 -1.12 -0.19 -0.89 0.23 0.00 0.00 176.35 174.37 1wx7 s THR 82 N -2.86 2.06 -0.11 5.49 2.01 -1.26 -2.40 115.64 118.57 1wx7 s THR 82 Ca 0.55 -2.08 -0.04 0.00 0.31 0.00 0.00 61.69 60.44 1wx7 s THR 82 Cb -0.10 -2.02 0.05 0.00 0.01 0.00 0.00 72.50 70.43 1wx7 s THR 82 CO 0.41 -0.32 0.11 -0.69 -0.69 0.00 0.00 174.62 173.43 1wx7 s VAL 83 N -2.17 -0.15 -0.54 3.82 1.01 0.57 -4.91 120.40 118.04 1wx7 s VAL 83 Ca 0.21 0.14 -0.27 0.00 0.00 0.00 0.00 61.98 62.06 1wx7 s VAL 83 Cb -0.05 -0.39 -0.01 0.00 0.00 0.00 0.00 36.38 35.93 1wx7 s VAL 83 CO 0.09 -0.03 1.67 -1.00 0.00 0.00 0.00 175.10 175.83 1wx7 s HIS 84 N 2.20 1.93 0.12 5.22 3.76 -1.12 -0.39 115.29 127.00 1wx7 s HIS 84 Ca 0.04 0.62 -0.13 0.00 -0.15 0.00 0.00 55.06 55.44 1wx7 s HIS 84 Cb -0.14 -4.22 -0.06 0.00 1.11 0.00 0.00 32.58 29.27 1wx7 s HIS 84 CO -0.07 -2.31 0.49 -1.17 -0.85 0.00 0.00 174.74 170.84 1wx7 s LEU 85 N 7.48 4.34 -0.16 0.89 2.96 0.43 -2.25 118.68 132.37 1wx7 s LEU 85 Ca 0.63 0.97 -0.02 0.00 -0.22 0.00 0.00 54.13 55.49 1wx7 s LEU 85 Cb -0.14 -3.17 0.05 0.00 0.50 0.00 0.00 46.19 43.44 1wx7 s LEU 85 CO 0.25 0.13 0.02 -0.69 -1.32 0.00 0.00 176.35 174.73 1wx7 s VAL 86 N -1.44 0.52 -0.24 1.68 1.01 0.87 -4.06 120.40 118.74 1wx7 s VAL 86 Ca 0.36 -0.41 -0.26 0.00 0.00 0.00 0.00 61.98 61.68 1wx7 s VAL 86 Cb -0.15 -0.93 0.00 0.00 0.00 0.00 0.00 36.38 35.30 1wx7 s VAL 86 CO 0.19 -0.08 0.90 -0.63 0.00 0.00 0.00 175.10 175.48 1wx7 s ILE 87 N 1.87 4.78 0.27 2.22 1.09 -1.26 -1.05 121.20 129.13 1wx7 s ILE 87 Ca 0.01 1.71 0.08 0.00 -1.10 0.00 0.00 60.65 61.35 1wx7 s ILE 87 Cb -0.16 -4.19 -0.01 0.00 -1.06 0.00 0.00 42.46 37.04 1wx7 s ILE 87 CO -0.07 -0.12 1.63 0.11 -0.10 0.00 0.00 174.94 176.38 1wx7 h LYS 88 N 7.63 0.10 -5.91 2.79 1.79 -1.87 -3.48 116.57 117.63 1wx7 h LYS 88 Ca -0.22 -0.06 -0.40 0.00 -2.18 0.00 0.00 60.65 57.78 1wx7 h LYS 88 Cb 1.08 0.01 0.11 0.00 -1.58 0.00 0.00 32.23 31.85 1wx7 h LYS 88 CO 0.91 0.64 -0.71 0.54 -1.08 0.00 0.00 179.45 179.75 1wx7 n ARG 89 N -3.88 -7.25 -2.10 3.15 5.12 -1.26 -4.91 116.66 105.52 1wx7 n ARG 89 Ca -0.02 0.78 -0.29 0.00 -1.93 0.00 0.00 57.85 56.40 1wx7 n ARG 89 Cb 0.58 -5.79 0.02 0.00 -1.16 0.00 0.00 32.46 26.11 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 -4.80 3.30 0.04 5.56 6.02 -1.26 -4.66 117.38 121.58 1wx7 n GLN 90 Ca -0.04 -4.10 0.00 0.00 -0.01 0.00 0.00 57.00 52.85 1wx7 n GLN 90 Cb 0.57 -2.27 0.00 0.00 1.02 0.00 0.00 30.24 29.57 1wx7 n GLN 90 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 177.06 177.63 1wx7 n HIS 91 N -0.62 -0.63 -3.89 1.08 -0.00 -1.26 -4.99 115.22 104.90 1wx7 n HIS 91 Ca 0.46 0.11 -0.27 0.00 0.46 0.00 0.00 57.72 58.48 1wx7 n HIS 91 Cb 0.70 0.31 0.01 0.00 -0.12 0.00 0.00 29.99 30.89 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 -3.04 -4.60 -0.50 1.57 1.74 -1.26 -4.93 116.66 105.65 1wx7 n ARG 92 Ca 0.00 0.54 -0.29 0.00 -0.77 0.00 0.00 57.85 57.33 1wx7 n ARG 92 Cb 0.12 -5.15 0.25 0.00 -1.02 0.00 0.00 32.46 26.66 1wx7 n ARG 92 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1wx7 n ALA 93 N -4.46 -2.85 -3.28 7.54 0.00 -1.26 -4.93 120.51 111.26 1wx7 n ALA 93 Ca -0.13 -1.15 -0.46 0.00 0.00 0.00 0.00 53.44 51.70 1wx7 n ALA 93 Cb 0.60 -1.99 -0.01 0.00 0.00 0.00 0.00 19.45 18.05 1wx7 n ALA 93 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1wx7 s MET 94 N -4.36 3.86 -0.04 0.00 -1.94 -1.26 -4.84 119.30 110.72 1wx7 s MET 94 Ca 0.68 -2.71 -0.04 0.00 -1.71 0.00 0.00 55.69 51.91 1wx7 s MET 94 Cb -0.25 -4.55 0.01 0.00 2.01 0.00 0.00 34.83 32.06 1wx7 s MET 94 CO 0.65 -1.33 0.07 0.41 -0.01 0.00 0.00 175.02 174.81 1wx7 n GLY 95 N 3.60 -5.35 3.55 -0.03 0.00 -1.26 -4.78 105.19 100.93 1wx7 n GLY 95 Ca 0.20 0.58 -0.39 0.00 0.00 0.00 0.00 46.02 46.41 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 -0.58 6.06 -0.71 1.61 2.47 -1.26 -4.92 114.94 117.60 1wx7 s ASN 96 Ca -0.08 -0.74 -0.30 0.00 0.42 0.00 0.00 52.86 52.16 1wx7 s ASN 96 Cb 0.01 -2.56 -0.15 0.00 -1.45 0.00 0.00 41.25 37.10 1wx7 s ASN 96 CO 0.23 -1.89 2.51 -1.84 -3.72 0.00 0.00 177.10 172.39 1wx7 n GLU 97 N 9.12 0.53 -3.40 0.43 0.00 -1.26 -4.89 120.64 121.16 1wx7 n GLU 97 Ca 0.20 0.03 -0.38 0.00 0.00 0.00 0.00 57.16 57.02 1wx7 n GLU 97 Cb 0.50 -2.36 -0.06 0.00 0.00 0.00 0.00 31.44 29.51 1wx7 n GLU 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1wx7 h PRO 99 N 5.87 0.00 -4.85 0.00 0.13 -2.04 -3.41 132.00 127.70 1wx7 h PRO 99 Ca -0.45 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.01 1wx7 h PRO 99 Cb 1.19 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 32.07 1wx7 h PRO 99 CO 0.70 0.00 -0.63 0.00 -0.23 0.00 0.00 178.00 177.84 1wx7 s ALA 100 N -3.46 3.07 -0.28 -0.56 0.00 -1.26 -5.06 121.76 114.21 1wx7 s ALA 100 Ca 0.03 -1.35 -0.24 0.00 0.00 0.00 0.00 51.96 50.39 1wx7 s ALA 100 Cb 0.09 -2.10 0.13 0.00 0.00 0.00 0.00 23.12 21.24 1wx7 s ALA 100 CO 0.44 -0.78 1.08 -1.12 0.00 0.00 0.00 175.76 175.38 1wx7 s SER 101 N 1.53 -0.40 0.00 0.00 0.01 -1.26 -5.09 113.70 108.48 1wx7 s SER 101 Ca 0.04 0.77 0.00 0.00 1.31 0.00 0.00 55.95 58.07 1wx7 s SER 101 Cb -0.16 0.80 0.00 0.00 0.21 0.00 0.00 66.02 66.87 1wx7 s SER 101 CO 0.02 -0.13 0.00 0.61 0.41 0.00 0.00 173.24 174.15 1wx7 n GLY 102 N 2.22 0.71 3.74 3.44 0.00 -1.26 -5.10 105.19 108.94 1wx7 n GLY 102 Ca -0.12 -0.66 -0.41 0.00 0.00 0.00 0.00 46.02 44.82 1wx7 n GLY 102 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wx7 s PRO 103 N -0.33 4.40 -0.07 1.61 0.04 -1.26 -5.02 135.00 134.36 1wx7 s PRO 103 Ca 0.00 2.05 -0.29 0.00 0.04 0.00 0.00 61.00 62.79 1wx7 s PRO 103 Cb 0.00 -3.19 0.11 0.00 0.04 0.00 0.00 34.50 31.46 1wx7 s PRO 103 CO 0.00 -0.23 0.90 -1.12 0.04 0.00 0.00 177.00 176.58 1wx7 s SER 104 N 0.28 -0.42 -0.09 6.66 0.01 -1.26 -5.06 113.70 113.82 1wx7 s SER 104 Ca 0.56 0.27 0.04 0.00 1.31 0.00 0.00 55.95 58.13 1wx7 s SER 104 Cb -0.36 0.38 -0.24 0.00 0.21 0.00 0.00 66.02 66.00 1wx7 s SER 104 CO 0.39 -0.51 0.47 -1.54 0.41 0.00 0.00 173.24 172.45 1wx7 n SER 105 N 0.33 1.46 0.00 2.44 3.41 -1.26 -5.26 113.62 114.74 1wx7 n SER 105 Ca -0.11 0.28 0.00 0.00 -0.26 0.00 0.00 58.87 58.78 1wx7 n SER 105 Cb 0.60 -0.40 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 1wx7 n SER 105 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49