#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pyv n SER 2 N 0.00 0.00 -0.36 0.00 3.41 -1.26 -4.95 113.62 110.46 1pyv n SER 2 Ca 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.52 1pyv n SER 2 Cb 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 63.86 1pyv n SER 2 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1pyv n ARG 3 N -0.40 -0.37 -0.33 4.33 3.00 -1.26 0.17 116.66 121.80 1pyv n ARG 3 Ca 0.00 1.38 0.32 0.00 -0.01 0.00 0.00 57.85 59.54 1pyv n ARG 3 Cb 0.00 -2.03 0.58 0.00 0.00 0.00 0.00 32.46 31.01 1pyv n ARG 3 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50 1pyv n ARG 4 N -4.96 -0.05 0.36 5.56 0.63 -1.26 0.36 116.66 117.30 1pyv n ARG 4 Ca 0.02 1.29 -0.14 0.00 -0.92 0.00 0.00 57.85 58.09 1pyv n ARG 4 Cb 0.22 -2.35 -0.07 0.00 0.45 0.00 0.00 32.46 30.71 1pyv n ARG 4 CO 0.00 0.00 0.00 1.25 -2.51 0.00 0.00 177.63 176.37 1pyv h LEU 5 N 0.00 -0.79 -1.62 6.15 7.12 0.14 0.42 115.31 126.73 1pyv h LEU 5 Ca 0.81 0.03 0.14 0.00 0.13 0.00 0.00 57.88 58.99 1pyv h LEU 5 Cb 2.25 0.20 -0.02 0.00 -0.53 0.00 0.00 40.66 42.56 1pyv h LEU 5 CO -0.67 -0.52 0.66 0.17 -0.13 0.00 0.00 178.44 177.95 1pyv h LEU 6 N -1.04 0.00 0.01 2.25 8.10 0.38 0.97 115.31 125.99 1pyv h LEU 6 Ca -0.10 0.00 -0.00 0.00 0.11 0.00 0.00 57.88 57.89 1pyv h LEU 6 Cb 0.72 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.94 1pyv h LEU 6 CO 0.16 0.00 -0.01 0.00 -4.11 0.00 0.00 178.44 174.48 1pyv h ALA 7 N 1.13 -0.02 0.00 0.17 0.00 -0.16 -3.06 119.26 117.31 1pyv h ALA 7 Ca 0.23 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1pyv h ALA 7 Cb 1.55 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.35 1pyv h ALA 7 CO -0.00 -0.02 -0.04 1.03 0.00 0.00 0.00 179.25 180.22 1pyv h SER 8 N -0.99 0.00 0.28 0.00 0.87 0.30 0.72 113.55 114.73 1pyv h SER 8 Ca -0.00 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.45 1pyv h SER 8 Cb 0.49 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.43 1pyv h SER 8 CO 0.00 0.04 -0.43 0.25 -0.53 0.00 0.00 176.83 176.16 1pyv h LEU 9 N 0.00 0.21 0.04 2.23 7.12 0.72 -1.02 115.31 124.61 1pyv h LEU 9 Ca -0.00 -0.09 -0.07 0.00 0.13 0.00 0.00 57.88 57.85 1pyv h LEU 9 Cb 0.09 -0.06 0.01 0.00 -0.53 0.00 0.00 40.66 40.17 1pyv h LEU 9 CO 0.00 0.62 -0.30 0.25 -0.13 0.00 0.00 178.44 178.89 1pyv h LEU 10 N 0.17 0.20 -0.07 2.25 7.12 -0.81 -3.05 115.31 121.11 1pyv h LEU 10 Ca 0.01 -0.91 0.04 0.00 0.13 0.00 0.00 57.88 57.16 1pyv h LEU 10 Cb 0.84 -0.06 -0.05 0.00 -0.53 0.00 0.00 40.66 40.85 1pyv h LEU 10 CO 0.07 1.09 -0.23 0.03 -0.13 0.00 0.00 178.44 179.26 1pyv h ARG 11 N -0.66 -0.31 -0.68 1.25 3.08 -1.12 1.04 114.38 116.97 1pyv h ARG 11 Ca -0.05 0.02 0.16 0.00 0.07 0.00 0.00 59.98 60.18 1pyv h ARG 11 Cb 1.17 0.07 -0.04 0.00 0.08 0.00 0.00 29.97 31.25 1pyv h ARG 11 CO 0.06 -0.21 0.47 0.37 -1.07 0.00 0.00 179.97 179.59 1pyv h GLN 12 N -0.33 0.22 0.17 0.04 5.75 -1.30 0.66 115.11 120.33 1pyv h GLN 12 Ca 0.08 -0.01 -0.28 0.00 -0.15 0.00 0.00 58.65 58.28 1pyv h GLN 12 Cb 0.45 -0.05 0.03 0.00 1.07 0.00 0.00 27.48 28.98 1pyv h GLN 12 CO -0.26 0.15 -1.22 1.03 -2.65 0.00 0.00 178.83 175.88 1pyv h SER 13 N 0.23 0.77 -0.01 -0.69 0.87 -0.82 -2.28 113.55 111.63 1pyv h SER 13 Ca 0.33 -0.89 -0.00 0.00 -1.23 0.00 0.00 61.79 60.01 1pyv h SER 13 Cb 0.98 -0.25 -0.00 0.00 -0.44 0.00 0.00 62.40 62.69 1pyv h SER 13 CO -0.07 1.59 0.00 0.00 -0.53 0.00 0.00 176.83 177.82 1pyv h ALA 14 N 0.19 0.01 0.00 6.23 0.00 0.30 -1.61 119.26 124.38 1pyv h ALA 14 Ca -0.20 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1pyv h ALA 14 Cb 1.93 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.72 1pyv h ALA 14 CO 0.23 -0.42 0.00 0.00 0.00 0.00 0.00 179.25 179.07 1pyv n GLN 15 N -5.01 0.15 0.17 0.00 10.64 0.21 -1.85 117.38 121.69 1pyv n GLN 15 Ca -0.07 0.42 0.03 0.00 -1.83 0.00 0.00 57.00 55.55 1pyv n GLN 15 Cb 0.10 -1.80 0.30 0.00 -0.86 0.00 0.00 30.24 27.98 1pyv n GLN 15 CO 0.00 0.00 0.00 -0.09 -1.83 0.00 0.00 177.06 175.14 1pyv h ARG 16 N 0.00 0.00 0.00 2.61 1.12 -0.67 -3.46 114.38 113.97 1pyv h ARG 16 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 1pyv h ARG 16 Cb 0.29 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.25 1pyv h ARG 16 CO 0.00 0.45 0.00 0.41 -3.11 0.00 0.00 179.97 177.72 1pyv n GLY 17 N 0.03 1.44 0.27 2.80 0.00 -0.77 -4.51 105.19 104.44 1pyv n GLY 17 Ca -0.01 -0.01 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 1pyv n GLY 17 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1pyv h GLY 18 N 0.00 -0.65 -1.59 -0.02 0.00 -1.87 -3.50 103.07 95.44 1pyv h GLY 18 Ca 0.00 0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.57 1pyv h GLY 18 CO 0.00 -0.23 0.00 0.61 0.00 0.00 0.00 176.54 176.92 1pyv n GLY 19 N 0.08 -0.37 2.00 4.60 0.00 -1.26 -4.95 105.19 105.30 1pyv n GLY 19 Ca -0.08 -0.39 -0.19 0.00 0.00 0.00 0.00 46.02 45.36 1pyv n GLY 19 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1pyv n LEU 20 N -0.21 6.55 0.00 0.99 -0.00 -1.26 -3.85 117.00 119.22 1pyv n LEU 20 Ca 0.00 -3.47 0.00 0.00 -0.00 0.00 0.00 56.01 52.54 1pyv n LEU 20 Cb 0.00 -1.08 0.00 0.00 -0.00 0.00 0.00 43.42 42.34 1pyv n LEU 20 CO 0.00 1.31 0.00 0.00 -0.00 0.00 0.00 177.39 178.70 1pyv n ILE 21 N 0.34 0.00 0.18 1.47 3.06 -1.26 -4.56 119.36 118.59 1pyv n ILE 21 Ca 0.35 0.00 0.19 0.00 -2.50 0.00 0.00 62.75 60.78 1pyv n ILE 21 Cb 0.58 -0.02 0.78 0.00 0.54 0.00 0.00 39.64 41.52 1pyv n ILE 21 CO 0.00 0.00 0.00 -1.28 -2.50 0.00 0.00 176.55 172.77 1pyv h SER 22 N 0.00 0.00 0.00 9.51 0.87 -1.94 -0.65 113.55 121.34 1pyv h SER 22 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1pyv h SER 22 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1pyv h SER 22 CO 0.00 0.00 -0.83 -2.11 -0.53 0.00 0.00 176.83 173.36 1pyv n ARG 23 N -3.51 0.00 0.00 2.24 1.85 -1.26 -4.46 116.66 111.53 1pyv n ARG 23 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.89 1pyv n ARG 23 Cb 0.50 -0.85 0.00 0.00 -1.05 0.00 0.00 32.46 31.06 1pyv n ARG 23 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1pyv n SER 24 N -2.41 0.00 0.13 2.89 7.64 -1.17 0.19 113.62 120.89 1pyv n SER 24 Ca 0.00 0.00 0.10 0.00 1.01 0.00 0.00 58.87 59.98 1pyv n SER 24 Cb 0.41 0.00 0.50 0.00 -1.01 0.00 0.00 64.21 64.11 1pyv n SER 24 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1pyv n LEU 25 N 0.00 0.54 0.21 -3.43 7.99 -1.20 -0.82 117.00 120.30 1pyv n LEU 25 Ca 0.00 0.69 0.11 0.00 -0.01 0.00 0.00 56.01 56.80 1pyv n LEU 25 Cb 0.00 -0.69 0.21 0.00 -0.11 0.00 0.00 43.42 42.83 1pyv n LEU 25 CO 0.00 -0.73 0.77 1.23 -1.51 0.00 0.00 177.39 177.16 1pyv h GLY 26 N 1.06 0.00 1.00 -0.72 0.00 -0.97 -2.71 103.07 100.74 1pyv h GLY 26 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1pyv h GLY 26 CO 0.00 0.00 -0.82 3.43 0.00 0.00 0.00 176.54 179.15 1pyv h ASN 27 N 0.00 0.00 0.01 0.19 4.21 0.41 -3.27 115.58 117.14 1pyv h ASN 27 Ca -0.00 -0.18 0.00 0.00 1.21 0.00 0.00 56.30 57.33 1pyv h ASN 27 Cb 1.01 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.21 1pyv h ASN 27 CO 0.01 0.09 -0.18 -1.20 -1.29 0.00 0.00 177.43 174.86 1pyv n SER 28 N -2.26 2.16 0.06 5.81 7.64 -1.14 -4.15 113.62 121.74 1pyv n SER 28 Ca 0.02 -1.61 -0.13 0.00 1.01 0.00 0.00 58.87 58.16 1pyv n SER 28 Cb 0.47 0.16 -0.08 0.00 -1.01 0.00 0.00 64.21 63.75 1pyv n SER 28 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1pyv h ILE 29 N 3.11 1.04 0.00 0.44 1.08 -1.53 1.45 117.51 123.11 1pyv h ILE 29 Ca 0.00 -0.50 0.00 0.00 -0.39 0.00 0.00 64.86 63.97 1pyv h ILE 29 Cb 0.77 1.36 0.00 0.00 -3.07 0.00 0.00 36.82 35.88 1pyv h ILE 29 CO 0.00 0.12 0.00 -0.81 -0.69 0.00 0.00 178.15 176.77 1pyv n PRO 30 N -5.04 0.17 -0.15 2.37 -0.04 -1.26 -2.28 135.00 128.77 1pyv n PRO 30 Ca -0.08 0.27 0.04 0.00 -0.04 0.00 0.00 63.50 63.68 1pyv n PRO 30 Cb 0.17 -1.75 0.12 0.00 -0.04 0.00 0.00 33.50 32.00 1pyv n PRO 30 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1pyv n LYS 31 N -2.05 1.69 -1.81 0.54 4.81 -0.99 -4.84 118.16 115.51 1pyv n LYS 31 Ca 0.04 -0.97 -0.06 0.00 -0.87 0.00 0.00 58.31 56.44 1pyv n LYS 31 Cb 0.31 -1.26 -0.01 0.00 0.02 0.00 0.00 35.03 34.09 1pyv n LYS 31 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1pyv n SER 32 N 0.27 -2.95 -1.55 3.14 2.88 -0.97 -2.51 113.62 111.94 1pyv n SER 32 Ca 0.09 0.05 -0.15 0.00 -1.33 0.00 0.00 58.87 57.53 1pyv n SER 32 Cb 0.26 -1.86 -0.02 0.00 -0.75 0.00 0.00 64.21 61.84 1pyv n SER 32 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1pyv n ALA 33 N -0.49 -0.39 -0.37 -1.46 0.00 0.49 -4.84 120.51 113.46 1pyv n ALA 33 Ca -0.07 0.14 0.35 0.00 0.00 0.00 0.00 53.44 53.86 1pyv n ALA 33 Cb 0.44 -1.67 0.61 0.00 0.00 0.00 0.00 19.45 18.84 1pyv n ALA 33 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1pyv n SER 34 N -0.70 0.29 -3.58 0.00 2.88 -1.04 -0.94 113.62 110.53 1pyv n SER 34 Ca -0.17 1.53 -0.30 0.00 -1.33 0.00 0.00 58.87 58.61 1pyv n SER 34 Cb 0.60 -0.75 -0.07 0.00 -0.75 0.00 0.00 64.21 63.24 1pyv n SER 34 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1pyv n ARG 35 N -5.01 2.70 -3.36 -1.46 5.12 -1.26 -4.92 116.66 108.46 1pyv n ARG 35 Ca 0.38 -4.63 -0.25 0.00 -1.93 0.00 0.00 57.85 51.42 1pyv n ARG 35 Cb 1.37 -2.30 -0.10 0.00 -1.16 0.00 0.00 32.46 30.28 1pyv n ARG 35 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1pyv s ALA 36 N -2.36 0.81 -0.23 7.54 0.00 -0.12 -4.87 121.76 122.53 1pyv s ALA 36 Ca 0.37 -1.98 -0.05 0.00 0.00 0.00 0.00 51.96 50.30 1pyv s ALA 36 Cb 0.10 -1.72 0.11 0.00 0.00 0.00 0.00 23.12 21.62 1pyv s ALA 36 CO -0.02 -2.05 0.43 0.45 0.00 0.00 0.00 175.76 174.57 1pyv s SER 37 N 0.56 -0.23 0.00 0.00 0.15 -1.26 -4.79 113.70 108.13 1pyv s SER 37 Ca 0.27 0.78 0.00 0.00 0.70 0.00 0.00 55.95 57.69 1pyv s SER 37 Cb -0.06 1.39 0.00 0.00 -1.71 0.00 0.00 66.02 65.64 1pyv s SER 37 CO -0.11 -0.25 0.00 -0.24 1.20 0.00 0.00 173.24 173.84 1pyv n SER 38 N 5.39 0.00 -1.62 5.45 2.88 -1.26 -4.41 113.62 120.06 1pyv n SER 38 Ca -0.07 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.45 1pyv n SER 38 Cb 0.50 0.00 0.23 0.00 -0.75 0.00 0.00 64.21 64.19 1pyv n SER 38 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1pyv n ARG 39 N 0.00 3.08 0.00 -1.46 1.74 -1.26 -3.54 116.66 115.22 1pyv n ARG 39 Ca 0.00 -2.17 0.00 0.00 -0.77 0.00 0.00 57.85 54.91 1pyv n ARG 39 Cb 0.00 -1.96 0.00 0.00 -1.02 0.00 0.00 32.46 29.48 1pyv n ARG 39 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1pyv n ALA 40 N 0.05 1.25 -0.07 7.54 0.00 -1.26 -4.62 120.51 123.40 1pyv n ALA 40 Ca 0.28 -0.55 -0.12 0.00 0.00 0.00 0.00 53.44 53.04 1pyv n ALA 40 Cb 1.06 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 20.41 1pyv n ALA 40 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1pyv h SER 41 N 0.00 0.00 0.47 0.00 0.02 -1.93 0.36 113.55 112.48 1pyv h SER 41 Ca 0.00 -0.79 -0.19 0.00 -0.84 0.00 0.00 61.79 59.97 1pyv h SER 41 Cb 0.69 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.22 1pyv h SER 41 CO 0.00 0.96 -0.82 1.55 -1.14 0.00 0.00 176.83 177.38 1pyv h PRO 42 N -1.00 0.26 0.09 3.45 0.13 -1.87 -3.24 132.00 129.81 1pyv h PRO 42 Ca -0.03 -0.25 -0.30 0.00 -0.87 0.00 0.00 66.00 64.55 1pyv h PRO 42 Cb 0.86 0.06 -0.02 0.00 0.13 0.00 0.00 31.00 32.04 1pyv h PRO 42 CO -0.02 0.94 -1.56 0.87 -0.23 0.00 0.00 178.00 178.00 1pyv h LYS 43 N 0.16 0.19 -0.82 0.86 1.57 -1.82 -3.38 116.57 113.32 1pyv h LYS 43 Ca -0.04 -0.32 0.07 0.00 -1.87 0.00 0.00 60.65 58.50 1pyv h LYS 43 Cb 1.42 0.12 -0.10 0.00 0.08 0.00 0.00 32.23 33.75 1pyv h LYS 43 CO 0.13 1.01 -0.49 0.78 -0.57 0.00 0.00 179.45 180.31 1pyv h GLY 44 N 2.05 -1.17 -0.64 3.86 0.00 -0.29 1.61 103.07 108.49 1pyv h GLY 44 Ca -0.25 0.86 0.37 0.00 0.00 0.00 0.00 47.33 48.32 1pyv h GLY 44 CO 0.14 -0.14 0.88 -2.75 0.00 0.00 0.00 176.54 174.67 1pyv h PHE 45 N -0.00 0.24 0.02 5.60 3.57 -1.73 1.85 116.94 126.48 1pyv h PHE 45 Ca 0.13 0.01 -0.26 0.00 3.53 0.00 0.00 57.97 61.38 1pyv h PHE 45 Cb 0.34 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 38.98 1pyv h PHE 45 CO -1.01 -0.02 -1.39 1.25 -2.23 0.00 0.00 178.31 174.91 1pyv h LEU 46 N 0.11 0.05 -0.40 0.59 5.85 0.15 -3.15 115.31 118.52 1pyv h LEU 46 Ca 0.66 -0.08 -0.18 0.00 0.84 0.00 0.00 57.88 59.12 1pyv h LEU 46 Cb 2.33 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 43.34 1pyv h LEU 46 CO -0.14 1.07 -0.77 -0.07 -0.34 0.00 0.00 178.44 178.18 1pyv h LEU 47 N 0.01 0.36 -1.01 2.25 -0.00 1.13 -2.65 115.31 115.41 1pyv h LEU 47 Ca -0.16 -0.25 -0.08 0.00 -0.00 0.00 0.00 57.88 57.38 1pyv h LEU 47 Cb 1.91 -0.11 -0.02 0.00 -0.00 0.00 0.00 40.66 42.45 1pyv h LEU 47 CO 0.11 1.00 -0.14 -1.13 -0.00 0.00 0.00 178.44 178.29 1pyv h ASN 48 N 0.19 0.54 -0.17 -0.43 -1.24 0.20 -2.39 115.58 112.29 1pyv h ASN 48 Ca -0.03 -0.15 -0.13 0.00 0.71 0.00 0.00 56.30 56.70 1pyv h ASN 48 Cb 1.35 -0.15 -0.01 0.00 0.73 0.00 0.00 38.32 40.24 1pyv h ASN 48 CO 0.12 0.71 -0.33 0.03 -1.29 0.00 0.00 177.43 176.67 1pyv h ARG 49 N 0.51 0.68 0.00 6.67 3.08 -1.48 -0.12 114.38 123.73 1pyv h ARG 49 Ca 0.09 -0.32 -0.04 0.00 0.07 0.00 0.00 59.98 59.79 1pyv h ARG 49 Cb 0.54 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.57 1pyv h ARG 49 CO 0.03 0.92 -0.17 0.00 -1.07 0.00 0.00 179.97 179.68 1pyv h ALA 50 N 1.06 1.65 0.00 0.04 0.00 -1.08 -0.73 119.26 120.20 1pyv h ALA 50 Ca 0.06 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 1pyv h ALA 50 Cb 0.84 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 1pyv h ALA 50 CO 0.07 0.21 -0.96 0.28 0.00 0.00 0.00 179.25 178.85 1pyv h VAL 51 N 0.00 0.68 -0.01 0.00 2.07 -1.00 -3.33 116.25 114.67 1pyv h VAL 51 Ca -0.00 -2.10 -0.00 0.00 0.82 0.00 0.00 66.70 65.42 1pyv h VAL 51 Cb 0.31 2.22 -0.00 0.00 -1.52 0.00 0.00 31.29 32.30 1pyv h VAL 51 CO 0.02 0.39 -0.00 -0.61 0.02 0.00 0.00 177.57 177.39 1pyv h GLN 52 N 0.00 0.01 0.00 1.57 -0.00 0.39 -3.51 115.11 113.57 1pyv h GLN 52 Ca -0.08 -0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.57 1pyv h GLN 52 Cb 1.48 -0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.96 1pyv h GLN 52 CO 0.06 0.34 0.00 0.66 0.00 0.00 0.00 178.83 179.88