#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wgl s SER 2 N 0.00 -0.29 0.23 1.61 0.01 -1.26 -5.15 113.70 108.86 1wgl s SER 2 Ca 0.00 0.55 -0.30 0.00 1.31 0.00 0.00 55.95 57.51 1wgl s SER 2 Cb 0.00 0.60 -0.09 0.00 0.21 0.00 0.00 66.02 66.74 1wgl s SER 2 CO 0.00 -0.09 1.28 -0.55 0.41 0.00 0.00 173.24 174.29 1wgl s SER 3 N 0.23 6.92 -0.52 2.44 0.15 -1.26 -4.96 113.70 116.71 1wgl s SER 3 Ca 0.04 2.44 -0.28 0.00 0.70 0.00 0.00 55.95 58.85 1wgl s SER 3 Cb -0.05 -2.62 0.03 0.00 -1.71 0.00 0.00 66.02 61.67 1wgl s SER 3 CO -0.10 -0.48 1.10 -0.83 1.20 0.00 0.00 173.24 174.13 1wgl s GLY 4 N 0.02 1.27 0.35 9.45 0.00 -1.26 -4.53 107.32 112.63 1wgl s GLY 4 Ca 0.53 -0.74 0.00 0.00 0.00 0.00 0.00 44.72 44.51 1wgl s GLY 4 CO 0.41 2.35 0.00 1.44 0.00 0.00 0.00 173.10 177.31 1wgl n SER 5 N 7.93 -2.90 -0.07 1.64 7.64 -1.26 -5.02 113.62 121.58 1wgl n SER 5 Ca 0.09 0.67 -0.12 0.00 1.01 0.00 0.00 58.87 60.51 1wgl n SER 5 Cb 0.49 2.81 -0.04 0.00 -1.01 0.00 0.00 64.21 66.45 1wgl n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1wgl n SER 6 N -3.25 1.59 0.00 6.43 7.64 -1.26 -5.07 113.62 119.70 1wgl n SER 6 Ca 0.00 0.26 0.00 0.00 1.01 0.00 0.00 58.87 60.14 1wgl n SER 6 Cb 0.00 -0.61 0.00 0.00 -1.01 0.00 0.00 64.21 62.59 1wgl n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wgl n GLY 7 N 1.93 1.54 2.32 0.23 0.00 -1.26 -4.87 105.19 105.07 1wgl n GLY 7 Ca -0.22 -0.42 -0.21 0.00 0.00 0.00 0.00 46.02 45.18 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 -3.28 -0.40 0.20 0.00 0.15 -1.26 -5.03 113.70 104.08 1wgl s SER 9 Ca 0.48 0.07 0.16 0.00 0.70 0.00 0.00 55.95 57.36 1wgl s SER 9 Cb -0.06 0.40 -0.01 0.00 -1.71 0.00 0.00 66.02 64.65 1wgl s SER 9 CO 0.37 -0.63 1.19 -0.33 1.20 0.00 0.00 173.24 175.05 1wgl h GLU 10 N 2.10 0.00 -0.37 5.44 4.39 -1.99 -3.16 114.58 120.99 1wgl h GLU 10 Ca -0.23 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.41 1wgl h GLU 10 Cb 1.24 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.87 1wgl h GLU 10 CO 0.32 0.37 -0.02 1.49 -1.16 0.00 0.00 179.01 180.02 1wgl h GLU 11 N 0.00 0.66 -0.45 2.33 4.81 -1.99 -0.78 114.58 119.16 1wgl h GLU 11 Ca -0.06 -0.22 -0.10 0.00 -0.13 0.00 0.00 59.36 58.85 1wgl h GLU 11 Cb 1.42 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.73 1wgl h GLU 11 CO 0.05 0.78 -0.10 -0.44 -0.73 0.00 0.00 179.01 178.56 1wgl h ASP 12 N 0.47 0.80 0.00 1.04 3.32 -1.98 -2.18 116.42 117.89 1wgl h ASP 12 Ca 0.10 -0.24 0.00 0.00 0.02 0.00 0.00 57.03 56.91 1wgl h ASP 12 Cb 0.49 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.82 1wgl h ASP 12 CO 0.02 0.93 0.00 -0.11 -1.72 0.00 0.00 179.24 178.36 1wgl n LEU 13 N -4.16 0.02 -0.32 1.55 0.00 -1.08 -1.71 117.00 111.29 1wgl n LEU 13 Ca 0.01 0.91 0.32 0.00 0.00 0.00 0.00 56.01 57.26 1wgl n LEU 13 Cb 0.37 -0.45 0.58 0.00 0.00 0.00 0.00 43.42 43.91 1wgl n LEU 13 CO 0.43 -0.45 1.04 1.17 0.00 0.00 0.00 177.39 179.58 1wgl n LYS 14 N -1.86 -0.06 0.31 1.96 0.00 -0.32 0.92 118.16 119.12 1wgl n LYS 14 Ca 0.00 1.32 -0.18 0.00 0.00 0.00 0.00 58.31 59.45 1wgl n LYS 14 Cb 0.00 -2.39 -0.10 0.00 0.00 0.00 0.00 35.03 32.54 1wgl n LYS 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1wgl h ALA 15 N 1.90 -1.17 -0.56 3.14 0.00 -1.14 -1.80 119.26 119.63 1wgl h ALA 15 Ca 0.82 -0.20 0.10 0.00 0.00 0.00 0.00 54.91 55.64 1wgl h ALA 15 Cb 2.23 0.73 -0.08 0.00 0.00 0.00 0.00 17.79 20.66 1wgl h ALA 15 CO -0.72 -1.19 0.11 0.82 0.00 0.00 0.00 179.25 178.27 1wgl h ILE 16 N -1.03 0.66 -0.82 0.00 2.04 0.14 -1.12 117.51 117.39 1wgl h ILE 16 Ca -0.07 -0.08 0.15 0.00 1.00 0.00 0.00 64.86 65.86 1wgl h ILE 16 Cb 0.89 0.40 -0.15 0.00 -0.74 0.00 0.00 36.82 37.22 1wgl h ILE 16 CO -0.05 0.04 -0.30 1.56 0.00 0.00 0.00 178.15 179.41 1wgl h GLN 17 N 0.24 -0.05 -0.65 2.37 1.08 -0.45 0.88 115.11 118.53 1wgl h GLN 17 Ca 0.29 0.00 0.13 0.00 -1.45 0.00 0.00 58.65 57.62 1wgl h GLN 17 Cb 0.42 0.01 -0.09 0.00 -0.05 0.00 0.00 27.48 27.77 1wgl h GLN 17 CO -0.38 -0.03 0.17 0.22 -0.95 0.00 0.00 178.83 177.85 1wgl h ASP 18 N -0.05 0.05 -0.43 1.46 1.82 -0.37 0.56 116.42 119.47 1wgl h ASP 18 Ca 0.34 0.12 -0.08 0.00 -0.39 0.00 0.00 57.03 57.02 1wgl h ASP 18 Cb 0.59 0.15 -0.02 0.00 0.68 0.00 0.00 39.33 40.73 1wgl h ASP 18 CO -0.85 0.02 0.00 0.24 -1.61 0.00 0.00 179.24 177.04 1wgl h MET 19 N 0.30 0.83 -2.45 0.28 2.86 0.68 -3.34 114.93 114.09 1wgl h MET 19 Ca 0.35 -0.23 -0.59 0.00 -2.06 0.00 0.00 59.70 57.17 1wgl h MET 19 Cb 0.54 -0.09 -0.40 0.00 0.06 0.00 0.00 31.60 31.70 1wgl h MET 19 CO -0.42 0.83 -0.83 1.19 1.06 0.00 0.00 176.91 178.73 1wgl n PHE 20 N -4.21 1.10 0.09 -0.22 3.72 0.17 -4.91 117.46 113.19 1wgl n PHE 20 Ca 0.03 -3.78 -0.07 0.00 -0.05 0.00 0.00 57.45 53.58 1wgl n PHE 20 Cb 0.30 -0.25 0.03 0.00 -0.94 0.00 0.00 39.48 38.63 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 4.96 0.18 -0.15 -1.08 0.13 -0.16 -3.23 132.00 132.65 1wgl h PRO 21 Ca 0.18 -0.17 -0.01 0.00 -0.87 0.00 0.00 66.00 65.14 1wgl h PRO 21 Cb 0.82 0.04 -0.01 0.00 0.13 0.00 0.00 31.00 31.99 1wgl h PRO 21 CO 0.56 0.88 0.07 -2.95 -0.23 0.00 0.00 178.00 176.33 1wgl h ASN 22 N 0.11 0.19 -2.16 1.44 -1.07 -1.91 -3.44 115.58 108.74 1wgl h ASN 22 Ca -0.03 -0.13 -0.39 0.00 0.07 0.00 0.00 56.30 55.82 1wgl h ASN 22 Cb 1.39 -0.05 0.21 0.00 -2.07 0.00 0.00 38.32 37.80 1wgl h ASN 22 CO 0.12 0.26 -0.92 0.23 0.07 0.00 0.00 177.43 177.19 1wgl n MET 23 N -4.91 -1.87 -3.39 4.14 2.81 -1.22 -4.94 117.12 107.74 1wgl n MET 23 Ca -0.05 -0.54 -0.38 0.00 -1.81 0.00 0.00 57.70 54.92 1wgl n MET 23 Cb 0.10 -1.61 -0.06 0.00 -0.71 0.00 0.00 33.22 30.93 1wgl n MET 23 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1wgl s ASP 24 N -1.89 6.78 0.06 7.83 1.01 -1.26 -5.00 116.67 124.21 1wgl s ASP 24 Ca 0.50 0.93 -0.32 0.00 0.71 0.00 0.00 52.55 54.37 1wgl s ASP 24 Cb -0.09 -2.28 -0.19 0.00 1.01 0.00 0.00 42.92 41.38 1wgl s ASP 24 CO 0.57 0.18 1.58 1.56 0.21 0.00 0.00 175.17 179.27 1wgl h GLN 25 N 5.57 -0.83 -0.96 8.23 4.20 -1.91 0.18 115.11 129.58 1wgl h GLN 25 Ca -0.47 0.06 0.28 0.00 0.06 0.00 0.00 58.65 58.58 1wgl h GLN 25 Cb 1.20 0.19 -0.04 0.00 0.30 0.00 0.00 27.48 29.13 1wgl h GLN 25 CO 0.68 -0.54 0.96 0.93 -0.67 0.00 0.00 178.83 180.19 1wgl h GLU 26 N -0.89 0.00 0.00 1.46 3.07 -1.98 0.36 114.58 116.59 1wgl h GLU 26 Ca -0.09 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.74 1wgl h GLU 26 Cb 0.67 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.58 1wgl h GLU 26 CO 0.14 0.00 -0.27 0.28 -1.40 0.00 0.00 179.01 177.76 1wgl h VAL 27 N 0.00 0.69 -1.16 3.13 2.07 -1.74 -1.71 116.25 117.53 1wgl h VAL 27 Ca 0.46 -1.59 0.33 0.00 0.82 0.00 0.00 66.70 66.72 1wgl h VAL 27 Cb 2.38 1.37 -0.06 0.00 -1.52 0.00 0.00 31.29 33.46 1wgl h VAL 27 CO -0.00 0.23 0.81 0.40 0.02 0.00 0.00 177.57 179.03 1wgl h ILE 28 N -1.00 0.42 0.11 4.57 2.04 0.16 0.94 117.51 124.74 1wgl h ILE 28 Ca -0.05 -0.03 -0.29 0.00 1.00 0.00 0.00 64.86 65.48 1wgl h ILE 28 Cb 0.59 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 1wgl h ILE 28 CO -0.03 0.02 -1.47 -0.09 0.00 0.00 0.00 178.15 176.58 1wgl h ARG 29 N 0.10 0.23 0.00 2.37 2.43 -0.76 -2.73 114.38 116.02 1wgl h ARG 29 Ca 0.58 -0.39 0.00 0.00 -0.81 0.00 0.00 59.98 59.36 1wgl h ARG 29 Cb 2.10 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 31.79 1wgl h ARG 29 CO -0.09 1.09 0.00 0.45 -1.51 0.00 0.00 179.97 179.91 1wgl n SER 30 N -3.44 0.56 -0.10 -3.80 2.88 0.30 -0.85 113.62 109.17 1wgl n SER 30 Ca -0.14 0.68 -0.17 0.00 -1.33 0.00 0.00 58.87 57.91 1wgl n SER 30 Cb 1.03 -0.79 -0.07 0.00 -0.75 0.00 0.00 64.21 63.64 1wgl n SER 30 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1wgl n VAL 31 N -2.17 1.50 -0.35 2.46 0.31 0.01 -2.85 118.33 117.25 1wgl n VAL 31 Ca 0.01 -0.02 0.10 0.00 -0.01 0.00 0.00 64.34 64.41 1wgl n VAL 31 Cb 0.14 -2.15 0.29 0.00 -0.91 0.00 0.00 33.84 31.21 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 0.85 -0.43 7.52 5.85 -1.31 1.63 115.31 128.41 1wgl h LEU 32 Ca -0.28 0.06 -0.17 0.00 0.84 0.00 0.00 57.88 58.33 1wgl h LEU 32 Cb 1.12 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 42.04 1wgl h LEU 32 CO -0.17 0.40 -0.78 -0.33 -0.34 0.00 0.00 178.44 177.21 1wgl h GLU 33 N 0.88 0.09 -0.00 1.25 4.39 -1.19 1.47 114.58 121.47 1wgl h GLU 33 Ca 0.52 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 60.13 1wgl h GLU 33 Cb 0.67 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.34 1wgl h GLU 33 CO -0.30 0.82 -0.19 0.00 -1.16 0.00 0.00 179.01 178.19 1wgl n ALA 34 N -2.43 2.81 -1.14 3.43 0.00 0.82 -3.22 120.51 120.78 1wgl n ALA 34 Ca -0.02 -0.21 -0.04 0.00 0.00 0.00 0.00 53.44 53.18 1wgl n ALA 34 Cb 0.75 -1.33 0.26 0.00 0.00 0.00 0.00 19.45 19.13 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 -1.43 3.00 -1.10 0.00 1.13 0.52 -4.88 117.38 114.61 1wgl n GLN 35 Ca 0.08 -3.05 -0.04 0.00 -1.94 0.00 0.00 57.00 52.05 1wgl n GLN 35 Cb 0.33 -2.04 -0.02 0.00 0.11 0.00 0.00 30.24 28.62 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 -0.54 -1.57 -1.05 -1.09 5.12 -1.20 -1.63 116.66 114.70 1wgl n ARG 36 Ca 0.37 0.56 0.00 0.00 -1.93 0.00 0.00 57.85 56.84 1wgl n ARG 36 Cb 1.23 -4.81 0.00 0.00 -1.16 0.00 0.00 32.46 27.72 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 0.10 1.02 3.86 -0.13 0.00 0.50 -4.29 105.19 106.25 1wgl n GLY 37 Ca -0.04 -0.30 -0.37 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.43 6.56 -0.21 1.61 0.01 -0.64 -4.63 114.94 115.21 1wgl s ASN 38 Ca 0.00 0.67 -0.20 0.00 -0.71 0.00 0.00 52.86 52.61 1wgl s ASN 38 Cb 0.00 -2.14 -0.19 0.00 0.41 0.00 0.00 41.25 39.33 1wgl s ASN 38 CO 0.00 0.37 0.19 1.17 -1.51 0.00 0.00 177.10 177.32 1wgl n LYS 39 N 1.87 0.58 0.01 -0.60 4.81 -1.26 -2.97 118.16 120.61 1wgl n LYS 39 Ca -0.17 0.54 -0.13 0.00 -0.87 0.00 0.00 58.31 57.68 1wgl n LYS 39 Cb 0.54 -1.73 -0.09 0.00 0.02 0.00 0.00 35.03 33.77 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 -0.93 -0.03 -0.72 3.14 5.19 -1.98 0.18 116.42 121.26 1wgl h ASP 40 Ca -0.38 -0.37 0.06 0.00 -0.62 0.00 0.00 57.03 55.73 1wgl h ASP 40 Cb 1.37 0.01 -0.04 0.00 0.18 0.00 0.00 39.33 40.85 1wgl h ASP 40 CO -0.21 0.35 0.47 0.00 -3.12 0.00 0.00 179.24 176.74 1wgl h ALA 41 N 0.53 1.71 0.22 3.45 0.00 -1.95 0.15 119.26 123.37 1wgl h ALA 41 Ca -0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1wgl h ALA 41 Cb 0.40 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1wgl h ALA 41 CO 0.01 0.18 -0.11 0.00 0.00 0.00 0.00 179.25 179.33 1wgl h ALA 42 N 1.61 -0.30 -0.45 0.00 0.00 -1.40 -0.73 119.26 117.99 1wgl h ALA 42 Ca 0.31 -0.20 0.09 0.00 0.00 0.00 0.00 54.91 55.12 1wgl h ALA 42 Cb 0.26 0.12 -0.09 0.00 0.00 0.00 0.00 17.79 18.08 1wgl h ALA 42 CO -0.10 -0.46 -0.12 0.82 0.00 0.00 0.00 179.25 179.39 1wgl h ILE 43 N -0.72 0.54 -0.68 0.00 2.04 0.00 0.66 117.51 119.35 1wgl h ILE 43 Ca -0.03 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.89 1wgl h ILE 43 Cb 0.49 0.54 -0.05 0.00 -0.74 0.00 0.00 36.82 37.05 1wgl h ILE 43 CO 0.05 0.00 0.38 -1.13 0.00 0.00 0.00 178.15 177.45 1wgl h ASN 44 N -0.01 0.58 -0.30 1.72 -0.73 -0.71 0.56 115.58 116.69 1wgl h ASN 44 Ca 0.22 0.03 -0.00 0.00 1.87 0.00 0.00 56.30 58.41 1wgl h ASN 44 Cb 0.34 -0.09 -0.01 0.00 0.27 0.00 0.00 38.32 38.83 1wgl h ASN 44 CO -0.47 0.37 0.17 -1.28 -0.37 0.00 0.00 177.43 175.86 1wgl h SER 45 N 0.71 0.37 0.38 1.15 0.87 0.79 -1.70 113.55 116.13 1wgl h SER 45 Ca 0.30 -0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 60.77 1wgl h SER 45 Cb 0.17 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.04 1wgl h SER 45 CO -0.18 0.34 -0.18 -0.07 -0.53 0.00 0.00 176.83 176.21 1wgl h LEU 46 N 0.38 -0.43 -0.66 2.23 3.38 0.11 0.13 115.31 120.44 1wgl h LEU 46 Ca 0.11 -0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.12 1wgl h LEU 46 Cb 0.04 0.11 -0.09 0.00 0.09 0.00 0.00 40.66 40.81 1wgl h LEU 46 CO -0.02 -0.25 -0.53 -0.07 0.09 0.00 0.00 178.44 177.66 1wgl h LEU 47 N -0.58 -1.87 0.45 1.67 3.38 0.25 -1.86 115.31 116.74 1wgl h LEU 47 Ca -0.05 0.27 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 1wgl h LEU 47 Cb 0.44 0.80 -0.02 0.00 0.09 0.00 0.00 40.66 41.97 1wgl h LEU 47 CO 0.09 -0.29 -0.42 -0.61 0.09 0.00 0.00 178.44 177.30 1wgl h GLN 48 N -0.17 -0.83 -6.19 1.13 -0.00 -1.22 -3.43 115.11 104.41 1wgl h GLN 48 Ca 0.11 0.06 -0.65 0.00 -0.00 0.00 0.00 58.65 58.16 1wgl h GLN 48 Cb 0.46 0.19 0.10 0.00 0.00 0.00 0.00 27.48 28.23 1wgl h GLN 48 CO -0.72 -0.55 -0.19 -1.33 0.00 0.00 0.00 178.83 176.04 1wgl n MET 49 N -4.98 0.57 0.00 1.69 2.81 0.45 -4.71 117.12 112.95 1wgl n MET 49 Ca -0.10 0.20 0.00 0.00 -1.81 0.00 0.00 57.70 55.99 1wgl n MET 49 Cb 0.39 -1.40 0.00 0.00 -0.71 0.00 0.00 33.22 31.49 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 1.71 -0.85 3.17 3.03 0.00 -1.26 -4.86 105.19 106.13 1wgl n GLY 50 Ca 0.15 0.56 -0.11 0.00 0.00 0.00 0.00 46.02 46.62 1wgl n GLY 50 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1wgl s GLU 51 N 0.00 0.28 0.36 1.61 -1.05 -1.26 -4.92 118.70 113.73 1wgl s GLU 51 Ca 0.00 0.78 -0.14 0.00 -0.15 0.00 0.00 54.97 55.46 1wgl s GLU 51 Cb 0.00 0.03 -0.08 0.00 -0.44 0.00 0.00 34.13 33.64 1wgl s GLU 51 CO 0.00 -0.21 0.77 -1.83 0.95 0.00 0.00 175.26 174.94 1wgl s GLU 52 N 1.87 3.94 -1.21 -4.83 -1.05 -1.26 -4.94 118.70 111.21 1wgl s GLU 52 Ca -0.05 0.64 -0.08 0.00 -0.15 0.00 0.00 54.97 55.33 1wgl s GLU 52 Cb -0.10 -2.39 -0.07 0.00 -0.44 0.00 0.00 34.13 31.13 1wgl s GLU 52 CO -0.11 0.06 2.45 -0.35 0.95 0.00 0.00 175.26 178.27 1wgl n PRO 53 N -0.74 2.74 0.10 -4.83 -0.04 -1.26 -3.57 135.00 127.40 1wgl n PRO 53 Ca 0.03 -1.80 0.00 0.00 -0.04 0.00 0.00 63.50 61.70 1wgl n PRO 53 Cb 0.53 -2.63 0.00 0.00 -0.04 0.00 0.00 33.50 31.37 1wgl n PRO 53 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1wgl n SER 54 N 4.10 -0.99 -2.72 3.54 2.88 -1.26 -5.17 113.62 113.99 1wgl n SER 54 Ca 0.59 0.38 -0.10 0.00 -1.33 0.00 0.00 58.87 58.41 1wgl n SER 54 Cb 0.18 1.08 0.01 0.00 -0.75 0.00 0.00 64.21 64.74 1wgl n SER 54 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wgl n GLY 55 N 0.40 1.33 3.78 0.46 0.00 -1.23 -5.17 105.19 104.75 1wgl n GLY 55 Ca 0.00 -1.33 -0.29 0.00 0.00 0.00 0.00 46.02 44.39 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 -2.26 0.56 -0.29 1.61 0.04 -1.26 -4.36 135.00 129.04 1wgl s PRO 56 Ca 0.18 0.07 -0.12 0.00 0.04 0.00 0.00 61.00 61.17 1wgl s PRO 56 Cb -0.04 -1.79 0.11 0.00 0.04 0.00 0.00 34.50 32.82 1wgl s PRO 56 CO 0.13 -2.55 0.66 -1.12 0.04 0.00 0.00 177.00 174.16 1wgl s SER 57 N -4.18 -1.05 0.29 6.66 0.01 -1.26 -5.02 113.70 109.15 1wgl s SER 57 Ca 0.67 1.54 -0.29 0.00 1.31 0.00 0.00 55.95 59.18 1wgl s SER 57 Cb -0.11 1.90 -0.10 0.00 0.21 0.00 0.00 66.02 67.91 1wgl s SER 57 CO 0.54 -0.23 1.36 -0.44 0.41 0.00 0.00 173.24 174.88 1wgl s SER 58 N 2.36 6.73 0.00 2.44 0.01 -1.26 -5.08 113.70 118.90 1wgl s SER 58 Ca -0.08 2.65 0.00 0.00 1.31 0.00 0.00 55.95 59.84 1wgl s SER 58 Cb -0.09 -2.64 0.00 0.00 0.21 0.00 0.00 66.02 63.50 1wgl s SER 58 CO -0.19 -0.60 0.00 0.61 0.41 0.00 0.00 173.24 173.46