#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 2.16 -0.06 1.61 2.88 -1.26 -4.78 113.62 114.17 1wgl n SER 2 Ca 0.00 -0.56 -0.03 0.00 -1.33 0.00 0.00 58.87 56.95 1wgl n SER 2 Cb 0.00 -1.56 -0.02 0.00 -0.75 0.00 0.00 64.21 61.89 1wgl n SER 2 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1wgl h SER 3 N 18.72 0.00 0.00 -3.46 0.02 -2.14 -3.50 113.55 123.19 1wgl h SER 3 Ca -0.21 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.64 1wgl h SER 3 Cb 1.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.79 1wgl h SER 3 CO 1.16 0.64 0.00 0.61 -1.14 0.00 0.00 176.83 178.10 1wgl n GLY 4 N 1.71 2.26 3.69 -3.77 0.00 -1.26 -5.14 105.19 102.68 1wgl n GLY 4 Ca -0.04 -0.33 -0.30 0.00 0.00 0.00 0.00 46.02 45.35 1wgl n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wgl s SER 5 N 0.00 3.24 -0.16 1.61 0.01 -1.26 -5.05 113.70 112.09 1wgl s SER 5 Ca 0.00 1.89 -0.08 0.00 1.31 0.00 0.00 55.95 59.06 1wgl s SER 5 Cb 0.00 -2.46 0.06 0.00 0.21 0.00 0.00 66.02 63.83 1wgl s SER 5 CO 0.00 -2.85 0.38 -0.55 0.41 0.00 0.00 173.24 170.64 1wgl s SER 6 N -2.99 -0.43 0.00 2.44 0.15 -1.26 -4.95 113.70 106.65 1wgl s SER 6 Ca 0.65 0.84 0.00 0.00 0.70 0.00 0.00 55.95 58.13 1wgl s SER 6 Cb -0.21 0.76 0.00 0.00 -1.71 0.00 0.00 66.02 64.86 1wgl s SER 6 CO 0.58 -0.19 0.00 0.61 1.20 0.00 0.00 173.24 175.44 1wgl n GLY 7 N 4.38 0.59 3.76 9.45 0.00 -1.26 -4.97 105.19 117.14 1wgl n GLY 7 Ca -0.22 -0.22 -0.01 0.00 0.00 0.00 0.00 46.02 45.57 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 -3.15 -0.42 0.44 0.00 0.01 -1.26 -5.02 113.70 104.30 1wgl s SER 9 Ca 0.17 0.54 0.24 0.00 1.31 0.00 0.00 55.95 58.22 1wgl s SER 9 Cb 0.01 0.46 0.62 0.00 0.21 0.00 0.00 66.02 67.32 1wgl s SER 9 CO 0.00 -0.32 1.70 -0.08 0.41 0.00 0.00 173.24 174.96 1wgl h GLU 10 N 2.99 0.00 0.47 12.44 4.81 -2.03 -2.91 114.58 130.35 1wgl h GLU 10 Ca -0.21 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 58.99 1wgl h GLU 10 Cb 1.16 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.55 1wgl h GLU 10 CO 0.27 0.12 -0.23 1.49 -0.73 0.00 0.00 179.01 179.93 1wgl h GLU 11 N 0.00 -0.61 0.15 1.92 4.81 -1.99 -2.18 114.58 116.68 1wgl h GLU 11 Ca -0.00 0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.28 1wgl h GLU 11 Cb 0.91 0.14 -0.03 0.00 0.63 0.00 0.00 28.75 30.40 1wgl h GLU 11 CO 0.02 -0.32 -0.27 0.22 -0.73 0.00 0.00 179.01 177.93 1wgl h ASP 12 N -1.04 -0.76 0.00 1.04 1.82 -1.98 0.92 116.42 116.42 1wgl h ASP 12 Ca -0.06 0.08 0.00 0.00 -0.39 0.00 0.00 57.03 56.66 1wgl h ASP 12 Cb 0.57 0.28 0.00 0.00 0.68 0.00 0.00 39.33 40.87 1wgl h ASP 12 CO 0.11 -0.37 0.00 0.18 -1.61 0.00 0.00 179.24 177.55 1wgl n LEU 13 N -5.38 0.00 -0.29 2.28 4.77 -1.10 0.19 117.00 117.47 1wgl n LEU 13 Ca -0.07 0.93 0.00 0.00 -0.03 0.00 0.00 56.01 56.85 1wgl n LEU 13 Cb 0.29 -0.43 0.07 0.00 -2.33 0.00 0.00 43.42 41.02 1wgl n LEU 13 CO 0.26 -0.43 0.66 0.11 -1.33 0.00 0.00 177.39 176.66 1wgl h LYS 14 N 0.00 -0.04 0.16 3.23 1.57 -1.29 1.56 116.57 121.77 1wgl h LYS 14 Ca 0.00 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1wgl h LYS 14 Cb 0.00 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.27 1wgl h LYS 14 CO 0.00 -0.02 -0.52 0.00 -0.57 0.00 0.00 179.45 178.33 1wgl h ALA 15 N 1.57 -1.00 0.44 3.86 0.00 0.12 0.18 119.26 124.43 1wgl h ALA 15 Ca 0.35 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1wgl h ALA 15 Cb 0.59 0.87 -0.02 0.00 0.00 0.00 0.00 17.79 19.23 1wgl h ALA 15 CO -0.84 -1.13 -0.44 0.82 0.00 0.00 0.00 179.25 177.67 1wgl h ILE 16 N -0.78 0.13 -0.97 0.00 2.04 0.47 -2.17 117.51 116.24 1wgl h ILE 16 Ca -0.01 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.04 1wgl h ILE 16 Cb 0.77 0.13 -0.18 0.00 -0.74 0.00 0.00 36.82 36.80 1wgl h ILE 16 CO -0.26 0.00 -0.26 1.67 0.00 0.00 0.00 178.15 179.30 1wgl n GLN 17 N -5.52 -0.10 -0.10 2.37 0.00 0.51 0.15 117.38 114.68 1wgl n GLN 17 Ca -0.11 1.51 -0.05 0.00 -0.00 0.00 0.00 57.00 58.34 1wgl n GLN 17 Cb 0.42 -2.25 0.01 0.00 0.00 0.00 0.00 30.24 28.42 1wgl n GLN 17 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.06 177.28 1wgl h ASP 18 N 0.00 -0.28 -0.28 1.69 1.82 -0.05 0.32 116.42 119.64 1wgl h ASP 18 Ca 0.45 0.10 0.01 0.00 -0.39 0.00 0.00 57.03 57.20 1wgl h ASP 18 Cb 0.69 0.20 -0.01 0.00 0.68 0.00 0.00 39.33 40.89 1wgl h ASP 18 CO -0.99 -0.10 0.18 0.24 -1.61 0.00 0.00 179.24 176.96 1wgl h MET 19 N 0.02 0.32 -2.42 0.28 2.86 0.19 -3.29 114.93 112.89 1wgl h MET 19 Ca 0.17 -0.02 -0.59 0.00 -2.06 0.00 0.00 59.70 57.20 1wgl h MET 19 Cb 0.26 -0.07 -0.39 0.00 0.06 0.00 0.00 31.60 31.46 1wgl h MET 19 CO -0.35 0.21 -0.92 1.19 1.06 0.00 0.00 176.91 178.10 1wgl n PHE 20 N -4.50 -0.12 0.11 -0.22 3.72 0.58 -4.94 117.46 112.09 1wgl n PHE 20 Ca 0.01 -3.51 -0.04 0.00 -0.05 0.00 0.00 57.45 53.87 1wgl n PHE 20 Cb 0.10 0.04 0.06 0.00 -0.94 0.00 0.00 39.48 38.74 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 5.36 0.04 -0.46 -1.08 0.13 -0.59 -3.18 132.00 132.22 1wgl h PRO 21 Ca 0.23 -0.04 -0.05 0.00 -0.87 0.00 0.00 66.00 65.27 1wgl h PRO 21 Cb 0.88 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.00 1wgl h PRO 21 CO 0.45 0.78 0.11 -2.95 -0.23 0.00 0.00 178.00 176.15 1wgl h ASN 22 N 0.02 0.70 -2.31 1.44 7.08 -1.92 -3.44 115.58 117.15 1wgl h ASN 22 Ca -0.01 -0.23 -0.37 0.00 -3.08 0.00 0.00 56.30 52.61 1wgl h ASN 22 Cb 1.34 -0.19 0.20 0.00 -2.08 0.00 0.00 38.32 37.59 1wgl h ASN 22 CO 0.10 0.76 -0.65 0.23 -2.08 0.00 0.00 177.43 175.79 1wgl n MET 23 N -4.49 -2.33 -3.84 4.14 2.81 -1.20 -4.96 117.12 107.25 1wgl n MET 23 Ca 0.01 -0.68 -0.35 0.00 -1.81 0.00 0.00 57.70 54.87 1wgl n MET 23 Cb 0.22 -1.68 -0.08 0.00 -0.71 0.00 0.00 33.22 30.96 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 -2.07 6.04 0.10 7.83 -1.08 -1.26 -5.01 116.67 121.22 1wgl s ASP 24 Ca 0.52 0.21 -0.33 0.00 -0.52 0.00 0.00 52.55 52.42 1wgl s ASP 24 Cb -0.11 -2.04 -0.14 0.00 -1.46 0.00 0.00 42.92 39.17 1wgl s ASP 24 CO 0.54 0.21 1.58 1.56 0.52 0.00 0.00 175.17 179.58 1wgl h GLN 25 N 6.48 -0.80 -1.01 4.34 4.20 -1.92 -0.37 115.11 126.02 1wgl h GLN 25 Ca -0.41 0.05 0.42 0.00 0.06 0.00 0.00 58.65 58.77 1wgl h GLN 25 Cb 1.16 0.18 -0.18 0.00 0.30 0.00 0.00 27.48 28.95 1wgl h GLN 25 CO 0.72 -0.53 0.55 1.05 -0.67 0.00 0.00 178.83 179.95 1wgl h GLU 26 N -0.83 0.00 0.32 1.46 4.11 -1.99 0.64 114.58 118.30 1wgl h GLU 26 Ca -0.02 -0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.39 1wgl h GLU 26 Cb 0.77 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.02 1wgl h GLU 26 CO -0.14 0.00 -0.16 0.28 0.07 0.00 0.00 179.01 179.07 1wgl h VAL 27 N 0.00 0.55 -0.70 -1.06 2.07 -1.65 -0.74 116.25 114.72 1wgl h VAL 27 Ca 0.85 -0.73 0.12 0.00 0.82 0.00 0.00 66.70 67.76 1wgl h VAL 27 Cb 2.26 0.85 -0.13 0.00 -1.52 0.00 0.00 31.29 32.76 1wgl h VAL 27 CO -0.76 0.11 -0.35 0.40 0.02 0.00 0.00 177.57 177.00 1wgl h ILE 28 N -0.91 0.12 -0.93 4.57 2.04 0.17 0.64 117.51 123.22 1wgl h ILE 28 Ca -0.04 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.84 1wgl h ILE 28 Cb 0.52 0.12 -0.05 0.00 -0.74 0.00 0.00 36.82 36.67 1wgl h ILE 28 CO 0.07 0.00 0.61 0.03 0.00 0.00 0.00 178.15 178.87 1wgl h ARG 29 N -0.12 1.18 -0.02 2.37 3.08 -0.77 0.18 114.38 120.28 1wgl h ARG 29 Ca 0.26 -0.07 0.01 0.00 0.07 0.00 0.00 59.98 60.25 1wgl h ARG 29 Cb 0.56 -0.27 -0.00 0.00 0.08 0.00 0.00 29.97 30.35 1wgl h ARG 29 CO -0.76 0.78 0.05 1.03 -1.07 0.00 0.00 179.97 180.00 1wgl h SER 30 N 1.21 0.00 0.00 7.04 0.87 0.17 0.36 113.55 123.21 1wgl h SER 30 Ca 0.36 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.77 1wgl h SER 30 Cb -0.06 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 61.88 1wgl h SER 30 CO -0.10 0.00 -1.01 0.52 -0.53 0.00 0.00 176.83 175.70 1wgl n VAL 31 N -3.35 1.49 -0.26 2.23 0.31 0.22 -2.65 118.33 116.33 1wgl n VAL 31 Ca -0.02 0.06 0.05 0.00 -0.01 0.00 0.00 64.34 64.41 1wgl n VAL 31 Cb 0.13 -2.18 0.18 0.00 -0.91 0.00 0.00 33.84 31.06 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 0.32 -0.90 7.52 5.85 -0.35 1.61 115.31 128.37 1wgl h LEU 32 Ca -0.22 0.10 -0.08 0.00 0.84 0.00 0.00 57.88 58.52 1wgl h LEU 32 Cb 1.00 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.08 1wgl h LEU 32 CO -0.13 0.13 -0.40 -0.33 -0.34 0.00 0.00 178.44 177.37 1wgl h GLU 33 N 0.48 0.00 -0.01 1.25 4.39 -0.46 1.56 114.58 121.79 1wgl h GLU 33 Ca 0.41 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.11 1wgl h GLU 33 Cb 0.60 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.25 1wgl h GLU 33 CO -0.38 0.40 -0.25 0.00 -1.16 0.00 0.00 179.01 177.62 1wgl n ALA 34 N -2.31 3.06 -1.10 3.43 0.00 0.15 -3.49 120.51 120.25 1wgl n ALA 34 Ca -0.00 -0.36 0.06 0.00 0.00 0.00 0.00 53.44 53.14 1wgl n ALA 34 Cb 0.52 -1.18 0.23 0.00 0.00 0.00 0.00 19.45 19.02 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 -0.85 2.48 -1.10 0.00 1.13 0.50 -4.91 117.38 114.63 1wgl n GLN 35 Ca 0.12 -2.88 -0.03 0.00 -1.94 0.00 0.00 57.00 52.26 1wgl n GLN 35 Cb 0.33 -1.80 -0.01 0.00 0.11 0.00 0.00 30.24 28.87 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 -0.76 -1.56 -1.13 -1.09 5.12 -1.11 -1.62 116.66 114.51 1wgl n ARG 36 Ca 0.23 0.55 0.00 0.00 -1.93 0.00 0.00 57.85 56.70 1wgl n ARG 36 Cb 0.89 -4.79 0.00 0.00 -1.16 0.00 0.00 32.46 27.40 1wgl n ARG 36 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1wgl n GLY 37 N 0.07 1.02 3.88 -0.13 0.00 0.53 -4.53 105.19 106.03 1wgl n GLY 37 Ca -0.03 -0.33 -0.34 0.00 0.00 0.00 0.00 46.02 45.32 1wgl n GLY 37 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1wgl s ASN 38 N -2.46 6.54 -0.20 1.61 0.01 -0.64 -4.76 114.94 115.04 1wgl s ASN 38 Ca 0.00 0.63 -0.16 0.00 -0.71 0.00 0.00 52.86 52.61 1wgl s ASN 38 Cb 0.00 -2.11 -0.12 0.00 0.41 0.00 0.00 41.25 39.43 1wgl s ASN 38 CO 0.00 0.19 -0.05 1.17 -1.51 0.00 0.00 177.10 176.89 1wgl n LYS 39 N 0.82 0.54 -0.03 -0.60 4.81 -1.26 -3.23 118.16 119.20 1wgl n LYS 39 Ca -0.08 0.47 -0.12 0.00 -0.87 0.00 0.00 58.31 57.71 1wgl n LYS 39 Cb 0.52 -1.65 -0.06 0.00 0.02 0.00 0.00 35.03 33.86 1wgl n LYS 39 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 1wgl h ASP 40 N -1.00 0.19 -0.99 3.14 5.19 -1.98 0.40 116.42 121.37 1wgl h ASP 40 Ca -0.29 -0.24 0.07 0.00 -0.62 0.00 0.00 57.03 55.95 1wgl h ASP 40 Cb 1.12 -0.05 -0.07 0.00 0.18 0.00 0.00 39.33 40.51 1wgl h ASP 40 CO -0.17 0.38 0.64 0.00 -3.12 0.00 0.00 179.24 176.97 1wgl h ALA 41 N 0.81 1.44 0.60 3.45 0.00 -1.95 0.13 119.26 123.75 1wgl h ALA 41 Ca 0.04 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1wgl h ALA 41 Cb 0.27 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 17.78 1wgl h ALA 41 CO 0.00 0.40 -0.29 0.00 0.00 0.00 0.00 179.25 179.36 1wgl h ALA 42 N 1.48 -0.81 -0.88 0.00 0.00 -1.45 -2.51 119.26 115.09 1wgl h ALA 42 Ca 0.43 -0.18 0.11 0.00 0.00 0.00 0.00 54.91 55.27 1wgl h ALA 42 Cb 0.21 0.31 -0.13 0.00 0.00 0.00 0.00 17.79 18.19 1wgl h ALA 42 CO -0.18 -0.75 -0.50 0.82 0.00 0.00 0.00 179.25 178.64 1wgl h ILE 43 N -1.21 0.02 -0.94 0.00 2.04 0.09 1.57 117.51 119.08 1wgl h ILE 43 Ca -0.08 0.00 0.23 0.00 1.00 0.00 0.00 64.86 66.01 1wgl h ILE 43 Cb 0.62 0.02 -0.13 0.00 -0.74 0.00 0.00 36.82 36.59 1wgl h ILE 43 CO 0.14 0.00 0.47 -1.13 0.00 0.00 0.00 178.15 177.63 1wgl h ASN 44 N -0.07 0.46 0.63 1.72 -1.24 -1.02 1.24 115.58 117.30 1wgl h ASN 44 Ca 0.22 0.15 -0.03 0.00 0.71 0.00 0.00 56.30 57.34 1wgl h ASN 44 Cb 0.51 0.10 0.01 0.00 0.73 0.00 0.00 38.32 39.66 1wgl h ASN 44 CO -0.89 0.03 -0.30 -1.28 -1.29 0.00 0.00 177.43 173.71 1wgl h SER 45 N 0.46 -0.71 -0.08 1.15 0.87 0.24 -2.38 113.55 113.11 1wgl h SER 45 Ca 0.60 -0.02 0.04 0.00 -1.23 0.00 0.00 61.79 61.18 1wgl h SER 45 Cb 1.14 0.18 -0.05 0.00 -0.44 0.00 0.00 62.40 63.23 1wgl h SER 45 CO -0.51 -0.35 -0.26 -0.07 -0.53 0.00 0.00 176.83 175.10 1wgl h LEU 46 N -1.12 -0.80 -0.81 2.23 3.38 0.14 -0.25 115.31 118.07 1wgl h LEU 46 Ca -0.09 0.12 0.07 0.00 0.09 0.00 0.00 57.88 58.08 1wgl h LEU 46 Cb 0.69 0.34 -0.10 0.00 0.09 0.00 0.00 40.66 41.68 1wgl h LEU 46 CO 0.14 -0.32 -0.50 -0.07 0.09 0.00 0.00 178.44 177.78 1wgl h LEU 47 N -0.36 -1.83 -0.30 1.67 3.38 0.15 0.23 115.31 118.24 1wgl h LEU 47 Ca 0.09 0.28 0.07 0.00 0.09 0.00 0.00 57.88 58.40 1wgl h LEU 47 Cb 0.49 0.80 -0.07 0.00 0.09 0.00 0.00 40.66 41.97 1wgl h LEU 47 CO -0.29 -0.21 -0.20 -0.61 0.09 0.00 0.00 178.44 177.23 1wgl h GLN 48 N -0.03 -0.16 -6.45 1.13 -0.00 -0.87 -3.41 115.11 105.32 1wgl h GLN 48 Ca 0.13 0.01 -0.62 0.00 -0.00 0.00 0.00 58.65 58.18 1wgl h GLN 48 Cb 0.36 0.04 0.07 0.00 0.00 0.00 0.00 27.48 27.95 1wgl h GLN 48 CO -0.78 -0.11 0.54 -1.33 0.00 0.00 0.00 178.83 177.16 1wgl n MET 49 N -5.36 1.69 0.00 1.69 2.81 0.80 -4.63 117.12 114.13 1wgl n MET 49 Ca 0.00 0.61 0.00 0.00 -1.81 0.00 0.00 57.70 56.50 1wgl n MET 49 Cb 0.27 -2.25 0.00 0.00 -0.71 0.00 0.00 33.22 30.53 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 2.46 0.36 3.37 3.03 0.00 -1.26 -4.90 105.19 108.25 1wgl n GLY 50 Ca 0.15 -1.76 -0.45 0.00 0.00 0.00 0.00 46.02 43.96 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 -0.84 2.98 0.77 1.61 2.02 -1.26 -5.06 118.70 118.91 1wgl s GLU 51 Ca 0.00 -1.46 -0.14 0.00 0.02 0.00 0.00 54.97 53.39 1wgl s GLU 51 Cb 0.00 -4.18 0.06 0.00 0.10 0.00 0.00 34.13 30.11 1wgl s GLU 51 CO 0.00 -1.12 1.22 -1.21 0.02 0.00 0.00 175.26 174.17 1wgl s GLU 52 N 1.63 1.89 0.15 1.61 2.02 -1.26 -4.95 118.70 119.79 1wgl s GLU 52 Ca 0.04 1.79 -0.30 0.00 0.02 0.00 0.00 54.97 56.52 1wgl s GLU 52 Cb -0.26 -1.80 -0.07 0.00 0.10 0.00 0.00 34.13 32.10 1wgl s GLU 52 CO 0.06 -2.03 1.13 -1.25 0.02 0.00 0.00 175.26 173.18 1wgl s PRO 53 N -3.99 4.54 -0.07 0.39 0.04 -1.26 -4.37 135.00 130.29 1wgl s PRO 53 Ca 0.75 1.74 -0.01 0.00 0.04 0.00 0.00 61.00 63.51 1wgl s PRO 53 Cb -0.30 -3.29 0.01 0.00 0.04 0.00 0.00 34.50 30.96 1wgl s PRO 53 CO 0.48 -0.02 0.03 0.43 0.04 0.00 0.00 177.00 177.96 1wgl n SER 54 N 2.74 -6.46 -3.53 6.66 7.64 -1.26 -5.03 113.62 114.38 1wgl n SER 54 Ca 0.04 0.83 -0.13 0.00 1.01 0.00 0.00 58.87 60.62 1wgl n SER 54 Cb 0.46 -2.53 -0.04 0.00 -1.01 0.00 0.00 64.21 61.09 1wgl n SER 54 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1wgl s GLY 55 N -0.77 -0.47 1.02 0.23 0.00 -1.26 -5.18 107.32 100.89 1wgl s GLY 55 Ca -0.03 0.52 -0.17 0.00 0.00 0.00 0.00 44.72 45.03 1wgl s GLY 55 CO 0.21 0.21 1.12 -1.55 0.00 0.00 0.00 173.10 173.08 1wgl n PRO 56 N 0.10 -2.08 -3.11 2.90 -0.04 -1.26 -5.01 135.00 126.50 1wgl n PRO 56 Ca -0.18 -1.75 -0.40 0.00 -0.04 0.00 0.00 63.50 61.13 1wgl n PRO 56 Cb 0.62 -1.38 -0.06 0.00 -0.04 0.00 0.00 33.50 32.64 1wgl n PRO 56 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1wgl s SER 57 N -4.86 6.74 -0.46 3.54 1.04 -1.26 -5.03 113.70 113.42 1wgl s SER 57 Ca 0.67 0.90 -0.10 0.00 0.48 0.00 0.00 55.95 57.91 1wgl s SER 57 Cb -0.04 -2.36 0.10 0.00 0.10 0.00 0.00 66.02 63.83 1wgl s SER 57 CO 0.49 -0.23 0.33 -0.55 0.98 0.00 0.00 173.24 174.26 1wgl s SER 58 N 1.09 5.74 0.00 7.02 0.15 -1.26 -5.33 113.70 121.11 1wgl s SER 58 Ca 0.30 -1.74 0.00 0.00 0.70 0.00 0.00 55.95 55.21 1wgl s SER 58 Cb -0.16 -2.03 0.00 0.00 -1.71 0.00 0.00 66.02 62.12 1wgl s SER 58 CO 0.11 -0.65 0.00 0.61 1.20 0.00 0.00 173.24 174.51