#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wgl n SER 2 N 0.00 2.91 -3.86 1.61 2.88 -1.26 -4.82 113.62 111.08 1wgl n SER 2 Ca 0.00 -2.69 -0.10 0.00 -1.33 0.00 0.00 58.87 54.75 1wgl n SER 2 Cb 0.00 -1.60 -0.09 0.00 -0.75 0.00 0.00 64.21 61.77 1wgl n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1wgl s SER 3 N 6.22 0.06 0.04 -3.46 1.04 -1.26 -5.17 113.70 111.18 1wgl s SER 3 Ca 0.66 -0.39 0.03 0.00 0.48 0.00 0.00 55.95 56.74 1wgl s SER 3 Cb 0.02 0.27 -0.02 0.00 0.10 0.00 0.00 66.02 66.39 1wgl s SER 3 CO 0.14 -0.54 -0.11 -0.83 0.98 0.00 0.00 173.24 172.89 1wgl s GLY 4 N -2.06 0.63 -0.87 7.32 0.00 -1.26 -5.05 107.32 106.03 1wgl s GLY 4 Ca -0.06 -0.77 -0.23 0.00 0.00 0.00 0.00 44.72 43.67 1wgl s GLY 4 CO -0.04 -0.79 1.91 -1.26 0.00 0.00 0.00 173.10 172.93 1wgl n SER 5 N 1.70 2.62 -4.54 1.64 2.88 -1.26 -4.85 113.62 111.81 1wgl n SER 5 Ca -0.20 -2.68 -0.25 0.00 -1.33 0.00 0.00 58.87 54.41 1wgl n SER 5 Cb 0.55 -1.30 -0.10 0.00 -0.75 0.00 0.00 64.21 62.61 1wgl n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1wgl s SER 6 N 5.62 3.80 0.00 -3.46 0.15 -1.26 -5.13 113.70 113.42 1wgl s SER 6 Ca 0.62 -1.11 0.00 0.00 0.70 0.00 0.00 55.95 56.16 1wgl s SER 6 Cb 0.09 -0.38 0.00 0.00 -1.71 0.00 0.00 66.02 64.02 1wgl s SER 6 CO 0.14 -0.15 0.00 0.61 1.20 0.00 0.00 173.24 175.04 1wgl n GLY 7 N -0.78 0.67 3.93 9.45 0.00 -1.26 -4.94 105.19 112.26 1wgl n GLY 7 Ca -0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.72 1wgl n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wgl s SER 9 N -4.49 0.04 0.08 0.00 0.01 -1.26 -5.04 113.70 103.04 1wgl s SER 9 Ca 0.59 -0.39 0.14 0.00 1.31 0.00 0.00 55.95 57.60 1wgl s SER 9 Cb -0.11 0.30 -0.13 0.00 0.21 0.00 0.00 66.02 66.29 1wgl s SER 9 CO 0.44 -0.58 0.96 -0.08 0.41 0.00 0.00 173.24 174.40 1wgl h GLU 10 N 3.38 0.00 -0.12 12.44 4.57 -1.99 -2.91 114.58 129.95 1wgl h GLU 10 Ca -0.32 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 57.77 1wgl h GLU 10 Cb 1.19 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.78 1wgl h GLU 10 CO 0.49 0.47 -0.28 0.93 -1.18 0.00 0.00 179.01 179.44 1wgl h GLU 11 N 0.00 0.40 -0.14 1.92 4.39 -2.00 -2.71 114.58 116.45 1wgl h GLU 11 Ca -0.14 -0.27 -0.03 0.00 0.34 0.00 0.00 59.36 59.26 1wgl h GLU 11 Cb 1.67 0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 30.36 1wgl h GLU 11 CO 0.07 0.88 -0.01 0.38 -1.16 0.00 0.00 179.01 179.16 1wgl h ASP 12 N -0.01 0.25 0.00 1.42 2.03 -1.99 -2.64 116.42 115.48 1wgl h ASP 12 Ca -0.00 -0.34 0.00 0.00 -0.73 0.00 0.00 57.03 55.96 1wgl h ASP 12 Cb 0.88 -0.07 0.00 0.00 -0.83 0.00 0.00 39.33 39.31 1wgl h ASP 12 CO 0.06 0.53 0.00 -0.11 -1.03 0.00 0.00 179.24 178.69 1wgl n LEU 13 N -4.74 0.00 -0.34 0.15 0.00 -1.10 -0.83 117.00 110.15 1wgl n LEU 13 Ca -0.06 0.94 0.14 0.00 0.00 0.00 0.00 56.01 57.04 1wgl n LEU 13 Cb 0.23 -0.44 0.29 0.00 0.00 0.00 0.00 43.42 43.49 1wgl n LEU 13 CO 0.36 -0.44 0.78 0.29 0.00 0.00 0.00 177.39 178.37 1wgl n LYS 14 N -2.47 -0.08 -0.15 1.96 4.76 -1.02 0.96 118.16 122.12 1wgl n LYS 14 Ca 0.00 1.46 -0.10 0.00 -2.87 0.00 0.00 58.31 56.80 1wgl n LYS 14 Cb 0.00 -2.32 -0.05 0.00 -1.84 0.00 0.00 35.03 30.82 1wgl n LYS 14 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1wgl h ALA 15 N 1.95 -0.42 0.55 7.82 0.00 -0.59 0.27 119.26 128.85 1wgl h ALA 15 Ca 0.59 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.55 1wgl h ALA 15 Cb 1.22 0.92 0.00 0.00 0.00 0.00 0.00 17.79 19.93 1wgl h ALA 15 CO -0.92 -0.86 -0.29 0.82 0.00 0.00 0.00 179.25 178.00 1wgl h ILE 16 N -0.30 0.41 -0.96 0.00 2.04 0.19 -2.63 117.51 116.25 1wgl h ILE 16 Ca 0.15 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.11 1wgl h ILE 16 Cb 0.58 0.41 -0.12 0.00 -0.74 0.00 0.00 36.82 36.94 1wgl h ILE 16 CO -0.61 0.00 -0.52 0.00 0.00 0.00 0.00 178.15 177.02 1wgl n GLN 17 N -5.43 -0.38 -0.27 2.37 1.13 0.11 0.17 117.38 115.08 1wgl n GLN 17 Ca -0.12 1.45 0.09 0.00 -1.94 0.00 0.00 57.00 56.48 1wgl n GLN 17 Cb 0.33 -2.14 0.23 0.00 0.11 0.00 0.00 30.24 28.76 1wgl n GLN 17 CO 0.00 0.00 0.00 0.22 -1.44 0.00 0.00 177.06 175.84 1wgl h ASP 18 N 0.00 -0.02 0.28 1.08 3.58 -0.34 0.75 116.42 121.75 1wgl h ASP 18 Ca 0.20 0.17 -0.13 0.00 0.42 0.00 0.00 57.03 57.68 1wgl h ASP 18 Cb 0.44 0.24 -0.01 0.00 1.72 0.00 0.00 39.33 41.71 1wgl h ASP 18 CO -0.91 -0.10 -0.53 0.24 -2.88 0.00 0.00 179.24 175.06 1wgl h MET 19 N 0.24 0.28 -2.54 0.28 2.86 0.18 -3.37 114.93 112.87 1wgl h MET 19 Ca 0.48 -0.17 -0.60 0.00 -2.06 0.00 0.00 59.70 57.35 1wgl h MET 19 Cb 0.88 0.02 -0.39 0.00 0.06 0.00 0.00 31.60 32.17 1wgl h MET 19 CO -0.59 0.74 -0.88 1.19 1.06 0.00 0.00 176.91 178.44 1wgl n PHE 20 N -3.93 0.13 -0.03 -0.22 3.72 0.46 -4.96 117.46 112.63 1wgl n PHE 20 Ca -0.02 -3.56 -0.13 0.00 -0.05 0.00 0.00 57.45 53.69 1wgl n PHE 20 Cb 0.57 0.03 -0.11 0.00 -0.94 0.00 0.00 39.48 39.04 1wgl n PHE 20 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1wgl h PRO 21 N 5.54 -0.03 -0.97 -1.08 0.13 -0.29 -3.25 132.00 132.05 1wgl h PRO 21 Ca 0.24 0.00 0.31 0.00 -0.87 0.00 0.00 66.00 65.68 1wgl h PRO 21 Cb 0.87 0.01 -0.15 0.00 0.13 0.00 0.00 31.00 31.85 1wgl h PRO 21 CO 0.46 0.67 0.45 -0.97 -0.23 0.00 0.00 178.00 178.38 1wgl h ASN 22 N -0.77 0.31 -4.11 1.44 -1.24 -1.93 -3.40 115.58 105.87 1wgl h ASN 22 Ca -0.00 0.20 -0.53 0.00 0.71 0.00 0.00 56.30 56.68 1wgl h ASN 22 Cb 0.71 0.20 0.20 0.00 0.73 0.00 0.00 38.32 40.16 1wgl h ASN 22 CO 0.00 -0.18 0.14 0.23 -1.29 0.00 0.00 177.43 176.33 1wgl n MET 23 N -5.14 -0.24 -3.01 6.67 2.81 -1.23 -4.96 117.12 112.03 1wgl n MET 23 Ca 0.29 -0.00 -0.40 0.00 -1.81 0.00 0.00 57.70 55.78 1wgl n MET 23 Cb 0.93 -2.32 -0.05 0.00 -0.71 0.00 0.00 33.22 31.08 1wgl n MET 23 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1wgl s ASP 24 N -2.38 7.11 0.06 7.83 2.15 -1.26 -4.98 116.67 125.20 1wgl s ASP 24 Ca 0.68 1.33 -0.25 0.00 0.43 0.00 0.00 52.55 54.73 1wgl s ASP 24 Cb -0.25 -2.44 -0.12 0.00 -0.30 0.00 0.00 42.92 39.81 1wgl s ASP 24 CO 0.57 -0.05 1.40 -0.61 -0.17 0.00 0.00 175.17 176.30 1wgl h GLN 25 N 6.22 -0.65 -1.00 4.34 4.15 -1.92 0.94 115.11 127.20 1wgl h GLN 25 Ca -0.43 0.04 0.38 0.00 0.77 0.00 0.00 58.65 59.42 1wgl h GLN 25 Cb 1.20 0.15 -0.18 0.00 0.21 0.00 0.00 27.48 28.86 1wgl h GLN 25 CO 0.73 -0.43 0.45 0.93 -1.93 0.00 0.00 178.83 178.58 1wgl h GLU 26 N -0.67 0.05 0.27 1.69 3.07 -2.00 0.72 114.58 117.72 1wgl h GLU 26 Ca -0.03 -0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.81 1wgl h GLU 26 Cb 0.61 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.51 1wgl h GLU 26 CO -0.09 0.03 -0.13 0.28 -1.40 0.00 0.00 179.01 177.70 1wgl h VAL 27 N 0.05 0.77 -0.87 3.13 2.07 -1.69 -1.00 116.25 118.71 1wgl h VAL 27 Ca 0.79 -0.52 0.20 0.00 0.82 0.00 0.00 66.70 67.98 1wgl h VAL 27 Cb 1.98 1.05 -0.16 0.00 -1.52 0.00 0.00 31.29 32.65 1wgl h VAL 27 CO -0.77 0.11 -0.10 0.40 0.02 0.00 0.00 177.57 177.23 1wgl h ILE 28 N -0.65 0.16 -0.40 4.57 2.04 0.29 0.72 117.51 124.24 1wgl h ILE 28 Ca -0.04 -0.01 -0.02 0.00 1.00 0.00 0.00 64.86 65.79 1wgl h ILE 28 Cb 0.46 0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 1wgl h ILE 28 CO 0.06 0.01 0.16 0.03 0.00 0.00 0.00 178.15 178.41 1wgl h ARG 29 N 0.03 0.59 0.00 2.37 3.08 -1.02 0.63 114.38 120.06 1wgl h ARG 29 Ca 0.46 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 60.41 1wgl h ARG 29 Cb 0.80 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.76 1wgl h ARG 29 CO -0.84 0.55 0.07 0.77 -1.07 0.00 0.00 179.97 179.46 1wgl h SER 30 N 0.49 0.00 0.00 7.04 0.02 0.17 0.64 113.55 121.92 1wgl h SER 30 Ca 0.13 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.87 1wgl h SER 30 Cb 0.18 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.69 1wgl h SER 30 CO -0.01 0.00 -1.32 0.52 -1.14 0.00 0.00 176.83 174.88 1wgl n VAL 31 N -2.51 1.51 -0.37 2.27 0.31 0.16 -2.79 118.33 116.91 1wgl n VAL 31 Ca -0.02 -0.03 0.01 0.00 -0.01 0.00 0.00 64.34 64.29 1wgl n VAL 31 Cb 0.12 -2.11 0.15 0.00 -0.91 0.00 0.00 33.84 31.08 1wgl n VAL 31 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1wgl h LEU 32 N -1.00 1.06 -0.46 7.52 5.85 -0.16 0.49 115.31 128.60 1wgl h LEU 32 Ca -0.32 -0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.25 1wgl h LEU 32 Cb 1.17 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.96 1wgl h LEU 32 CO -0.19 0.71 -0.39 -0.33 -0.34 0.00 0.00 178.44 177.90 1wgl h GLU 33 N 1.22 0.85 0.00 1.25 4.39 0.08 0.53 114.58 122.90 1wgl h GLU 33 Ca 0.41 -0.44 0.00 0.00 0.34 0.00 0.00 59.36 59.66 1wgl h GLU 33 Cb 0.06 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.72 1wgl h GLU 33 CO -0.14 1.09 0.00 0.00 -1.16 0.00 0.00 179.01 178.79 1wgl n ALA 34 N -2.53 2.03 -1.62 3.43 0.00 -0.56 -2.91 120.51 118.35 1wgl n ALA 34 Ca -0.02 -0.07 -0.31 0.00 0.00 0.00 0.00 53.44 53.04 1wgl n ALA 34 Cb 0.54 -1.37 0.06 0.00 0.00 0.00 0.00 19.45 18.67 1wgl n ALA 34 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1wgl n GLN 35 N -1.59 3.05 -4.18 0.00 1.13 0.16 -4.89 117.38 111.06 1wgl n GLN 35 Ca 0.05 -3.64 -0.36 0.00 -1.94 0.00 0.00 57.00 51.12 1wgl n GLN 35 Cb 0.27 -2.29 -0.05 0.00 0.11 0.00 0.00 30.24 28.28 1wgl n GLN 35 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1wgl n ARG 36 N -0.83 -1.66 -3.40 -1.09 1.74 -1.15 0.11 116.66 110.39 1wgl n ARG 36 Ca 0.55 0.20 -0.17 0.00 -0.77 0.00 0.00 57.85 57.66 1wgl n ARG 36 Cb 0.76 -4.81 0.08 0.00 -1.02 0.00 0.00 32.46 27.48 1wgl n ARG 36 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wgl n GLY 37 N -1.08 -0.35 3.06 -0.13 0.00 0.18 -4.98 105.19 101.89 1wgl n GLY 37 Ca 0.09 0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 1wgl n GLY 37 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1wgl s ASN 38 N -4.11 4.94 0.09 1.61 3.84 0.29 -4.97 114.94 116.64 1wgl s ASN 38 Ca 0.11 -2.19 -0.33 0.00 0.21 0.00 0.00 52.86 50.66 1wgl s ASN 38 Cb -0.05 -1.71 -0.14 0.00 -0.55 0.00 0.00 41.25 38.80 1wgl s ASN 38 CO 0.70 -0.43 1.51 0.50 -2.79 0.00 0.00 177.10 176.59 1wgl h LYS 39 N 7.69 -0.76 -0.61 0.43 3.64 -1.88 0.64 116.57 125.71 1wgl h LYS 39 Ca -0.07 0.05 0.06 0.00 -1.27 0.00 0.00 60.65 59.42 1wgl h LYS 39 Cb 1.02 0.17 -0.09 0.00 -0.41 0.00 0.00 32.23 32.92 1wgl h LYS 39 CO 0.60 -0.51 -0.57 -0.44 -2.27 0.00 0.00 179.45 176.27 1wgl h ASP 40 N -0.79 -1.96 -0.72 4.20 5.19 -1.97 1.58 116.42 121.94 1wgl h ASP 40 Ca -0.03 0.27 0.14 0.00 -0.62 0.00 0.00 57.03 56.80 1wgl h ASP 40 Cb 0.75 0.83 -0.10 0.00 0.18 0.00 0.00 39.33 40.99 1wgl h ASP 40 CO -0.19 -0.34 0.25 0.00 -3.12 0.00 0.00 179.24 175.83 1wgl h ALA 41 N 0.14 0.98 0.02 3.45 0.00 -1.83 0.28 119.26 122.30 1wgl h ALA 41 Ca 0.10 0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1wgl h ALA 41 Cb 0.53 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1wgl h ALA 41 CO -0.71 -0.26 -0.01 0.00 0.00 0.00 0.00 179.25 178.27 1wgl h ALA 42 N 1.55 -0.02 -0.94 0.00 0.00 0.51 0.60 119.26 120.96 1wgl h ALA 42 Ca 0.40 -0.01 0.23 0.00 0.00 0.00 0.00 54.91 55.52 1wgl h ALA 42 Cb 0.62 0.01 -0.12 0.00 0.00 0.00 0.00 17.79 18.29 1wgl h ALA 42 CO -0.42 -0.51 0.48 0.82 0.00 0.00 0.00 179.25 179.62 1wgl h ILE 43 N -0.03 0.52 -0.25 0.00 2.04 0.39 1.32 117.51 121.50 1wgl h ILE 43 Ca -0.00 -0.17 -0.06 0.00 1.00 0.00 0.00 64.86 65.62 1wgl h ILE 43 Cb 0.02 -0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.08 1wgl h ILE 43 CO 0.00 0.09 -0.09 -1.13 0.00 0.00 0.00 178.15 177.02 1wgl h ASN 44 N 0.50 0.52 -0.59 1.72 -1.24 -0.33 0.17 115.58 116.34 1wgl h ASN 44 Ca 0.59 -0.39 -0.01 0.00 0.71 0.00 0.00 56.30 57.20 1wgl h ASN 44 Cb 1.10 -0.14 -0.03 0.00 0.73 0.00 0.00 38.32 39.98 1wgl h ASN 44 CO -0.49 0.79 0.31 0.28 -1.29 0.00 0.00 177.43 177.03 1wgl h SER 45 N 0.25 0.74 0.34 1.15 0.02 0.20 -2.09 113.55 114.15 1wgl h SER 45 Ca 0.06 -0.11 -0.02 0.00 -0.84 0.00 0.00 61.79 60.89 1wgl h SER 45 Cb 0.58 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.93 1wgl h SER 45 CO 0.03 0.64 -0.16 -0.07 -1.14 0.00 0.00 176.83 176.12 1wgl h LEU 46 N 0.79 -0.39 -0.78 5.07 3.38 0.16 0.68 115.31 124.22 1wgl h LEU 46 Ca 0.20 -0.11 0.07 0.00 0.09 0.00 0.00 57.88 58.14 1wgl h LEU 46 Cb 0.07 0.10 -0.10 0.00 0.09 0.00 0.00 40.66 40.82 1wgl h LEU 46 CO -0.03 -0.12 -0.53 -0.07 0.09 0.00 0.00 178.44 177.79 1wgl h LEU 47 N -0.66 -1.90 0.44 1.67 3.38 -0.50 -0.83 115.31 116.91 1wgl h LEU 47 Ca -0.05 0.28 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 1wgl h LEU 47 Cb 0.47 0.83 -0.02 0.00 0.09 0.00 0.00 40.66 42.03 1wgl h LEU 47 CO 0.08 -0.25 -0.39 -0.61 0.09 0.00 0.00 178.44 177.36 1wgl h GLN 48 N -0.08 -0.80 -6.08 1.13 -0.00 -1.35 -3.43 115.11 104.49 1wgl h GLN 48 Ca 0.13 0.05 -0.64 0.00 -0.00 0.00 0.00 58.65 58.20 1wgl h GLN 48 Cb 0.41 0.18 0.14 0.00 0.00 0.00 0.00 27.48 28.21 1wgl h GLN 48 CO -0.78 -0.53 -0.65 -1.33 0.00 0.00 0.00 178.83 175.54 1wgl n MET 49 N -5.50 0.17 -0.41 1.69 2.81 0.23 -4.59 117.12 111.52 1wgl n MET 49 Ca -0.11 0.06 0.06 0.00 -1.81 0.00 0.00 57.70 55.90 1wgl n MET 49 Cb 0.39 -1.13 -0.01 0.00 -0.71 0.00 0.00 33.22 31.76 1wgl n MET 49 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1wgl n GLY 50 N 2.06 -1.72 2.88 3.03 0.00 -1.26 -4.89 105.19 105.30 1wgl n GLY 50 Ca 0.14 -1.24 -0.15 0.00 0.00 0.00 0.00 46.02 44.77 1wgl n GLY 50 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wgl s GLU 51 N -0.82 0.21 -0.06 1.61 2.02 -1.26 -5.09 118.70 115.31 1wgl s GLU 51 Ca 0.00 0.48 0.05 0.00 0.02 0.00 0.00 54.97 55.52 1wgl s GLU 51 Cb 0.00 -0.62 -0.01 0.00 0.10 0.00 0.00 34.13 33.60 1wgl s GLU 51 CO 0.00 -0.52 -0.23 -2.00 0.02 0.00 0.00 175.26 172.54 1wgl s GLU 52 N 2.41 2.46 0.40 1.61 -6.30 -1.26 -5.12 118.70 112.90 1wgl s GLU 52 Ca 0.06 -0.82 -0.24 0.00 -2.50 0.00 0.00 54.97 51.47 1wgl s GLU 52 Cb -0.14 -2.03 -0.09 0.00 0.00 0.00 0.00 34.13 31.87 1wgl s GLU 52 CO -0.12 0.30 1.05 -1.25 0.02 0.00 0.00 175.26 175.26 1wgl s PRO 53 N 0.02 4.13 -0.03 4.30 0.04 -1.26 -4.41 135.00 137.79 1wgl s PRO 53 Ca -0.07 1.52 -0.00 0.00 0.04 0.00 0.00 61.00 62.48 1wgl s PRO 53 Cb -0.14 -2.52 0.00 0.00 0.04 0.00 0.00 34.50 31.88 1wgl s PRO 53 CO 0.04 -0.17 0.01 0.43 0.04 0.00 0.00 177.00 177.35 1wgl n SER 54 N -0.12 -6.75 -2.92 6.66 7.64 -1.26 -5.01 113.62 111.86 1wgl n SER 54 Ca 0.05 0.63 -0.16 0.00 1.01 0.00 0.00 58.87 60.40 1wgl n SER 54 Cb 0.50 -2.03 -0.06 0.00 -1.01 0.00 0.00 64.21 61.61 1wgl n SER 54 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wgl n GLY 55 N 1.47 3.26 3.56 0.23 0.00 -1.26 -5.08 105.19 107.37 1wgl n GLY 55 Ca -0.01 -1.92 -0.35 0.00 0.00 0.00 0.00 46.02 43.74 1wgl n GLY 55 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wgl s PRO 56 N -3.09 3.06 -0.19 1.61 0.04 -1.26 -4.94 135.00 130.22 1wgl s PRO 56 Ca 0.26 -0.57 -0.29 0.00 0.04 0.00 0.00 61.00 60.43 1wgl s PRO 56 Cb 0.01 -5.07 -0.03 0.00 0.04 0.00 0.00 34.50 29.45 1wgl s PRO 56 CO 0.18 -2.72 1.69 -1.12 0.04 0.00 0.00 177.00 175.07 1wgl s SER 57 N 6.37 6.32 -0.55 6.66 0.01 -1.26 -4.95 113.70 126.30 1wgl s SER 57 Ca 0.57 1.74 -0.17 0.00 1.31 0.00 0.00 55.95 59.40 1wgl s SER 57 Cb -0.04 -2.53 0.11 0.00 0.21 0.00 0.00 66.02 63.77 1wgl s SER 57 CO -0.02 -1.29 0.56 -0.44 0.41 0.00 0.00 173.24 172.47 1wgl s SER 58 N 4.56 6.19 0.00 2.44 0.01 -1.26 -5.31 113.70 120.32 1wgl s SER 58 Ca 0.75 -1.61 0.00 0.00 1.31 0.00 0.00 55.95 56.40 1wgl s SER 58 Cb -0.27 -2.24 0.00 0.00 0.21 0.00 0.00 66.02 63.72 1wgl s SER 58 CO 0.31 -0.93 0.00 0.61 0.41 0.00 0.00 173.24 173.64