#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f5h h ILE 1544N 0.00 0.65 0.00 2.46 2.04 -2.05 -0.63 117.51 119.98 3f5h h ILE 1544Ca 0.00 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 3f5h h ILE 1544Cb 0.00 1.07 -0.00 0.00 -0.74 0.00 0.00 36.82 37.15 3f5h h ILE 1544CO 0.00 0.03 -0.03 0.44 0.00 0.00 0.00 178.15 178.59 3f5h h ASP 1545N 0.00 0.00 0.38 1.72 3.32 -2.08 -2.19 116.42 117.57 3f5h h ASP 1545Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3f5h h ASP 1545Cb 0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.62 3f5h h ASP 1545CO 0.00 0.03 -0.28 0.47 -1.72 0.00 0.00 179.24 177.74 3f5h n ASP 1546N -3.23 0.71 -4.81 6.45 8.00 -0.24 -4.91 116.55 118.51 3f5h n ASP 1546Ca -0.02 -0.57 -0.37 0.00 0.71 0.00 0.00 54.79 54.54 3f5h n ASP 1546Cb 0.19 0.09 -0.06 0.00 -0.02 0.00 0.00 41.12 41.32 3f5h n ASP 1546CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3f5h s LEU 1547N -2.66 4.44 0.73 0.64 1.43 -0.82 -5.07 118.68 117.36 3f5h s LEU 1547Ca 0.21 1.34 -0.07 0.00 -1.03 0.00 0.00 54.13 54.58 3f5h s LEU 1547Cb 0.19 -3.26 0.08 0.00 0.03 0.00 0.00 46.19 43.23 3f5h s LEU 1547CO 0.56 0.15 1.04 1.51 0.23 0.00 0.00 176.35 179.85 3f5h s ASP 1548N -1.41 4.63 0.19 2.29 1.47 -1.26 -4.86 116.67 117.72 3f5h s ASP 1548Ca 0.36 0.38 -0.11 0.00 1.18 0.00 0.00 52.55 54.36 3f5h s ASP 1548Cb -0.18 -0.96 0.22 0.00 -0.34 0.00 0.00 42.92 41.66 3f5h s ASP 1548CO 0.21 -1.72 1.74 0.00 0.68 0.00 0.00 175.17 176.08 3f5h h ALA 1549N -0.69 0.68 -0.74 2.11 0.00 -1.99 -1.88 119.26 116.75 3f5h h ALA 1549Ca -0.44 0.08 0.11 0.00 0.00 0.00 0.00 54.91 54.66 3f5h h ALA 1549Cb 1.31 0.05 -0.08 0.00 0.00 0.00 0.00 17.79 19.07 3f5h h ALA 1549CO 0.57 -0.21 0.36 1.49 0.00 0.00 0.00 179.25 181.46 3f5h h GLU 1550N 0.37 0.56 -0.17 0.00 4.81 -1.99 0.23 114.58 118.38 3f5h h GLU 1550Ca 0.27 -0.03 -0.18 0.00 -0.13 0.00 0.00 59.36 59.29 3f5h h GLU 1550Cb 0.31 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.57 3f5h h GLU 1550CO -0.28 0.37 -0.61 0.00 -0.73 0.00 0.00 179.01 177.76 3f5h h ALA 1551N 1.48 0.60 -0.44 2.92 0.00 -1.77 -2.01 119.26 120.04 3f5h h ALA 1551Ca 0.38 -0.54 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 3f5h h ALA 1551Cb 0.47 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 3f5h h ALA 1551CO -0.31 0.70 0.16 -0.07 0.00 0.00 0.00 179.25 179.73 3f5h h LEU 1552N 0.44 0.62 -0.67 0.00 3.38 -0.87 -1.61 115.31 116.59 3f5h h LEU 1552Ca -0.01 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 3f5h h LEU 1552Cb 1.18 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.74 3f5h h LEU 1552CO 0.12 0.64 0.32 0.40 0.09 0.00 0.00 178.44 180.01 3f5h h ILE 1553N 0.56 1.23 -0.25 1.22 2.04 -0.86 -1.93 117.51 119.52 3f5h h ILE 1553Ca 0.14 -0.63 -0.06 0.00 1.00 0.00 0.00 64.86 65.31 3f5h h ILE 1553Cb 0.23 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 3f5h h ILE 1553CO -0.01 0.26 -0.13 -0.09 0.00 0.00 0.00 178.15 178.19 3f5h h ARG 1554N 0.93 0.41 -0.70 2.37 2.43 -1.14 0.50 114.38 119.18 3f5h h ARG 1554Ca 0.23 -0.11 -0.07 0.00 -0.81 0.00 0.00 59.98 59.22 3f5h h ARG 1554Cb 0.12 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.59 3f5h h ARG 1554CO -0.03 0.54 0.15 0.52 -1.51 0.00 0.00 179.97 179.65 3f5h h MET 1555N 0.38 1.14 0.17 0.20 2.86 -0.61 0.12 114.93 119.19 3f5h h MET 1555Ca 0.07 -0.28 -0.30 0.00 -2.06 0.00 0.00 59.70 57.14 3f5h h MET 1555Cb 0.46 -0.14 0.02 0.00 0.06 0.00 0.00 31.60 31.99 3f5h h MET 1555CO 0.03 1.01 -1.33 0.00 1.06 0.00 0.00 176.91 177.68 3f5h h ALA 1556N 1.08 0.02 0.00 6.32 0.00 -0.85 -3.38 119.26 122.45 3f5h h ALA 1556Ca 0.22 -0.88 -0.01 0.00 0.00 0.00 0.00 54.91 54.24 3f5h h ALA 1556Cb 0.40 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 3f5h h ALA 1556CO 0.01 0.89 -1.63 1.28 0.00 0.00 0.00 179.25 179.80 3f5h n LEU 1557N -3.59 0.00 0.00 0.00 4.77 0.12 -5.11 117.00 113.19 3f5h n LEU 1557Ca -0.11 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 3f5h n LEU 1557Cb 1.05 0.01 0.00 0.00 -2.33 0.00 0.00 43.42 42.15 3f5h n LEU 1557CO 0.56 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.24 3f5h n GLY 1558N 1.74 -0.46 0.24 -0.72 0.00 0.42 -4.39 105.19 102.02 3f5h n GLY 1558Ca -0.03 -1.55 0.11 0.00 0.00 0.00 0.00 46.02 44.55 3f5h n GLY 1558CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3f5h h PRO 1559N 0.00 0.00 -0.17 1.61 0.13 -1.95 -2.15 132.00 129.46 3f5h h PRO 1559Ca 0.00 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.12 3f5h h PRO 1559Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 3f5h h PRO 1559CO 0.00 0.17 0.05 -0.09 -0.23 0.00 0.00 178.00 177.91 3f5h h ARG 1560N 0.00 0.26 -0.21 0.86 2.43 -1.97 0.18 114.38 115.94 3f5h h ARG 1560Ca -0.00 -0.06 0.01 0.00 -0.81 0.00 0.00 59.98 59.12 3f5h h ARG 1560Cb 0.53 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.03 3f5h h ARG 1560CO 0.02 0.38 0.10 -0.97 -1.51 0.00 0.00 179.97 177.99 3f5h h ASN 1561N 0.10 0.15 0.06 -3.80 -0.73 -1.67 -0.61 115.58 109.07 3f5h h ASN 1561Ca 0.05 0.01 -0.16 0.00 1.87 0.00 0.00 56.30 58.07 3f5h h ASN 1561Cb 0.23 -0.02 -0.01 0.00 0.27 0.00 0.00 38.32 38.79 3f5h h ASN 1561CO -0.00 0.12 -0.56 0.71 -0.37 0.00 0.00 177.43 177.32 3f5h h THR 1562N 0.22 1.33 -0.43 -3.57 1.35 -1.25 -0.81 112.91 109.75 3f5h h THR 1562Ca 0.08 -1.82 -0.10 0.00 -0.55 0.00 0.00 66.41 64.02 3f5h h THR 1562Cb 0.02 1.80 -0.02 0.00 -1.73 0.00 0.00 68.15 68.22 3f5h h THR 1562CO -0.06 0.56 -0.13 -0.03 -0.25 0.00 0.00 175.52 175.61 3f5h h MET 1 N 0.40 0.80 -0.29 4.72 1.85 -0.89 -0.93 114.93 120.60 3f5h h MET 1 Ca 0.01 -0.28 -0.03 0.00 -0.61 0.00 0.00 59.70 58.79 3f5h h MET 1 Cb 1.10 -0.06 -0.01 0.00 0.43 0.00 0.00 31.60 33.06 3f5h h MET 1 CO 0.10 0.89 0.07 1.15 -0.40 0.00 0.00 176.91 178.72 3f5h h THR 2 N 0.72 1.22 -0.43 -0.77 2.02 -0.86 -0.84 112.91 113.96 3f5h h THR 2 Ca 0.12 -0.72 -0.08 0.00 0.77 0.00 0.00 66.41 66.50 3f5h h THR 2 Cb 0.62 1.14 -0.02 0.00 -1.74 0.00 0.00 68.15 68.15 3f5h h THR 2 CO 0.04 0.24 -0.05 0.77 0.37 0.00 0.00 175.52 176.89 3f5h h SER 3 N 0.30 0.71 -0.30 4.18 4.64 -1.03 -0.21 113.55 121.85 3f5h h SER 3 Ca 0.09 -0.18 0.02 0.00 -0.47 0.00 0.00 61.79 61.25 3f5h h SER 3 Cb 0.29 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.17 3f5h h SER 3 CO 0.00 0.81 0.15 -1.28 -0.87 0.00 0.00 176.83 175.65 3f5h h SER 4 N 0.68 0.23 -0.59 4.97 0.87 -0.99 -1.26 113.55 117.47 3f5h h SER 4 Ca 0.13 0.01 -0.09 0.00 -1.23 0.00 0.00 61.79 60.61 3f5h h SER 4 Cb 0.49 -0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.40 3f5h h SER 4 CO 0.03 0.17 0.03 0.78 -0.53 0.00 0.00 176.83 177.31 3f5h h ASN 5 N 0.32 0.99 -0.70 6.23 2.35 -0.77 -1.16 115.58 122.84 3f5h h ASN 5 Ca 0.12 -0.29 0.01 0.00 -0.55 0.00 0.00 56.30 55.59 3f5h h ASN 5 Cb 0.03 -0.26 -0.04 0.00 0.05 0.00 0.00 38.32 38.10 3f5h h ASN 5 CO -0.08 1.04 0.46 -0.33 -1.65 0.00 0.00 177.43 176.87 3f5h h GLU 6 N 0.91 0.92 -0.53 0.81 5.08 -0.85 -0.28 114.58 120.64 3f5h h GLU 6 Ca 0.17 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 58.38 3f5h h GLU 6 Cb 0.51 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 3f5h h GLU 6 CO 0.02 0.61 -0.06 0.37 -1.00 0.00 0.00 179.01 178.95 3f5h h GLN 7 N 0.94 0.94 -0.67 2.33 4.15 -1.00 -0.81 115.11 120.99 3f5h h GLN 7 Ca 0.26 -0.31 -0.00 0.00 0.77 0.00 0.00 58.65 59.37 3f5h h GLN 7 Cb -0.10 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 27.48 3f5h h GLN 7 CO -0.06 0.96 0.40 -0.07 -1.93 0.00 0.00 178.83 178.14 3f5h h LEU 8 N 0.85 0.81 -0.31 -2.39 3.38 -0.80 -0.27 115.31 116.58 3f5h h LEU 8 Ca 0.15 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 3f5h h LEU 8 Cb 0.58 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 3f5h h LEU 8 CO 0.04 0.63 0.13 0.58 0.09 0.00 0.00 178.44 179.90 3f5h h VAL 9 N 0.91 1.18 -0.53 1.22 2.07 -0.82 0.10 116.25 120.37 3f5h h VAL 9 Ca 0.24 -0.54 0.06 0.00 0.82 0.00 0.00 66.70 67.28 3f5h h VAL 9 Cb -0.03 0.96 -0.05 0.00 -1.52 0.00 0.00 31.29 30.65 3f5h h VAL 9 CO -0.04 0.19 0.23 0.44 0.02 0.00 0.00 177.57 178.41 3f5h h ASP 10 N 0.35 0.29 -0.37 0.57 3.32 -0.96 0.11 116.42 119.74 3f5h h ASP 10 Ca 0.10 0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.18 3f5h h ASP 10 Cb 0.18 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 3f5h h ASP 10 CO -0.01 0.20 0.16 0.00 -1.72 0.00 0.00 179.24 177.87 3f5h h ALA 11 N 1.33 0.48 -0.49 3.45 0.00 -0.79 -1.57 119.26 121.67 3f5h h ALA 11 Ca 0.25 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 3f5h h ALA 11 Cb 0.22 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3f5h h ALA 11 CO -0.21 0.07 -0.10 1.25 0.00 0.00 0.00 179.25 180.25 3f5h h LEU 12 N 0.45 0.88 -0.12 0.00 5.85 -0.55 -0.33 115.31 121.50 3f5h h LEU 12 Ca 0.12 -0.27 0.02 0.00 0.84 0.00 0.00 57.88 58.59 3f5h h LEU 12 Cb 0.17 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.94 3f5h h LEU 12 CO -0.01 1.00 0.00 -0.09 -0.34 0.00 0.00 178.44 179.00 3f5h h ARG 13 N 0.80 0.05 -0.27 1.25 2.43 -0.72 0.50 114.38 118.42 3f5h h ARG 13 Ca 0.13 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.31 3f5h h ARG 13 Cb 0.62 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.14 3f5h h ARG 13 CO 0.04 0.03 0.16 0.00 -1.51 0.00 0.00 179.97 178.69 3f5h h ALA 14 N 1.10 0.33 -0.83 2.80 0.00 -1.05 -0.22 119.26 121.39 3f5h h ALA 14 Ca 0.06 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.97 3f5h h ALA 14 Cb 0.06 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 3f5h h ALA 14 CO -0.09 -0.22 0.55 1.03 0.00 0.00 0.00 179.25 180.52 3f5h h SER 15 N 0.33 0.95 0.24 0.00 0.87 -0.82 -1.47 113.55 113.64 3f5h h SER 15 Ca 0.10 -0.02 -0.13 0.00 -1.23 0.00 0.00 61.79 60.51 3f5h h SER 15 Cb -0.01 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.70 3f5h h SER 15 CO -0.04 0.68 -0.51 -0.07 -0.53 0.00 0.00 176.83 176.36 3f5h h LEU 16 N 1.12 0.33 -0.72 2.23 3.38 -0.71 -0.35 115.31 120.59 3f5h h LEU 16 Ca 0.30 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 3f5h h LEU 16 Cb -0.12 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 3f5h h LEU 16 CO -0.07 0.78 0.38 0.11 0.09 0.00 0.00 178.44 179.73 3f5h h LYS 17 N 0.24 1.01 -0.61 1.13 1.57 -0.76 -0.68 116.57 118.47 3f5h h LYS 17 Ca 0.01 -0.13 -0.03 0.00 -1.87 0.00 0.00 60.65 58.63 3f5h h LYS 17 Cb 0.98 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 33.07 3f5h h LYS 17 CO 0.08 0.77 0.26 1.49 -0.57 0.00 0.00 179.45 181.48 3f5h h GLU 18 N 1.00 0.89 -0.40 3.15 4.57 -1.08 -1.19 114.58 121.52 3f5h h GLU 18 Ca 0.25 -0.15 0.07 0.00 -1.18 0.00 0.00 59.36 58.35 3f5h h GLU 18 Cb 0.06 -0.15 -0.06 0.00 -0.16 0.00 0.00 28.75 28.44 3f5h h GLU 18 CO -0.04 0.75 0.04 -0.97 -1.18 0.00 0.00 179.01 177.61 3f5h h ASN 19 N 0.84 -0.07 -0.37 1.04 -0.73 -0.88 -0.22 115.58 115.18 3f5h h ASN 19 Ca 0.20 0.08 0.03 0.00 1.87 0.00 0.00 56.30 58.49 3f5h h ASN 19 Cb 0.17 0.12 -0.03 0.00 0.27 0.00 0.00 38.32 38.85 3f5h h ASN 19 CO -0.02 0.00 0.17 -0.08 -0.37 0.00 0.00 177.43 177.13 3f5h h GLU 20 N 0.16 0.33 -0.59 6.67 4.81 -0.77 -0.96 114.58 124.24 3f5h h GLU 20 Ca 0.20 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.40 3f5h h GLU 20 Cb 0.26 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.53 3f5h h GLU 20 CO -0.29 0.22 0.35 0.93 -0.73 0.00 0.00 179.01 179.50 3f5h h GLU 21 N 0.34 0.80 -0.37 1.92 4.39 -0.94 -0.39 114.58 120.34 3f5h h GLU 21 Ca 0.16 -0.07 0.02 0.00 0.34 0.00 0.00 59.36 59.80 3f5h h GLU 21 Cb 0.10 -0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 28.56 3f5h h GLU 21 CO -0.13 0.57 0.21 -0.07 -1.16 0.00 0.00 179.01 178.44 3f5h h LEU 22 N 0.79 0.35 -0.90 1.33 3.38 -0.77 0.07 115.31 119.56 3f5h h LEU 22 Ca 0.21 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 3f5h h LEU 22 Cb -0.02 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 3f5h h LEU 22 CO -0.04 0.25 0.49 0.03 0.09 0.00 0.00 178.44 179.26 3f5h h ARG 23 N 0.44 1.25 -0.50 1.13 3.08 -0.92 -0.41 114.38 118.45 3f5h h ARG 23 Ca 0.15 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 3f5h h ARG 23 Cb 0.00 -0.25 -0.02 0.00 0.08 0.00 0.00 29.97 29.79 3f5h h ARG 23 CO -0.07 0.91 0.27 0.87 -1.07 0.00 0.00 179.97 180.89 3f5h h LYS 24 N 1.26 0.70 -0.63 0.04 1.57 -0.70 -0.73 116.57 118.07 3f5h h LYS 24 Ca 0.32 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 59.00 3f5h h LYS 24 Cb 0.03 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.17 3f5h h LYS 24 CO -0.05 0.54 0.34 0.93 -0.57 0.00 0.00 179.45 180.64 3f5h h GLU 25 N 0.66 0.89 -0.64 3.15 5.08 -0.71 -1.77 114.58 121.25 3f5h h GLU 25 Ca 0.18 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3f5h h GLU 25 Cb 0.05 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.10 3f5h h GLU 25 CO -0.03 0.69 0.41 1.03 -1.00 0.00 0.00 179.01 180.11 3f5h h SER 26 N 0.87 0.75 -0.32 1.42 0.87 -0.84 -2.08 113.55 114.22 3f5h h SER 26 Ca 0.22 -0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 60.72 3f5h h SER 26 Cb 0.06 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 61.82 3f5h h SER 26 CO -0.03 0.56 0.07 0.03 -0.53 0.00 0.00 176.83 176.93 3f5h h ARG 27 N 0.87 0.51 -0.60 2.24 3.08 -0.89 -0.60 114.38 118.99 3f5h h ARG 27 Ca 0.23 -0.12 0.08 0.00 0.07 0.00 0.00 59.98 60.24 3f5h h ARG 27 Cb -0.07 -0.07 -0.07 0.00 0.08 0.00 0.00 29.97 29.84 3f5h h ARG 27 CO -0.05 0.58 0.25 0.00 -1.07 0.00 0.00 179.97 179.67 3f5h h ARG 28 N 0.35 0.43 -0.47 0.04 3.08 -1.12 -0.29 114.38 116.40 3f5h h ARG 28 Ca 0.10 -0.03 -0.13 0.00 0.07 0.00 0.00 59.98 59.99 3f5h h ARG 28 Cb 0.30 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 3f5h h ARG 28 CO 0.00 0.29 -0.22 0.00 -1.07 0.00 0.00 179.97 178.97 3f5h h ARG 29 N 0.45 0.97 -0.98 0.04 3.08 -1.23 0.14 114.38 116.84 3f5h h ARG 29 Ca 0.29 -0.41 0.05 0.00 0.07 0.00 0.00 59.98 59.98 3f5h h ARG 29 Cb 0.33 -0.03 -0.06 0.00 0.08 0.00 0.00 29.97 30.28 3f5h h ARG 29 CO -0.27 1.08 0.64 0.00 -1.07 0.00 0.00 179.97 180.35 3f5h h ALA 30 N 0.90 1.38 0.01 0.04 0.00 -0.57 0.11 119.26 121.15 3f5h h ALA 30 Ca 0.11 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 3f5h h ALA 30 Cb 0.79 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3f5h h ALA 30 CO 0.07 0.50 -0.00 -0.44 0.00 0.00 0.00 179.25 179.37 3f5h h ASP 31 N 1.21 -0.01 -0.67 0.00 3.32 -0.58 -2.01 116.42 117.68 3f5h h ASP 31 Ca 0.40 -0.41 0.14 0.00 0.02 0.00 0.00 57.03 57.19 3f5h h ASP 31 Cb 0.06 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 39.50 3f5h h ASP 31 CO -0.14 0.40 -0.01 0.03 -1.72 0.00 0.00 179.24 177.80 3f5h h ARG 32 N -0.43 0.10 0.00 3.56 3.08 -0.50 0.57 114.38 120.76 3f5h h ARG 32 Ca -0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 3f5h h ARG 32 Cb 0.42 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.45 3f5h h ARG 32 CO 0.00 0.06 0.00 0.54 -1.07 0.00 0.00 179.97 179.51 3f5h n ARG 33 N -5.32 0.21 -0.70 0.04 1.74 0.37 -5.09 116.66 107.92 3f5h n ARG 33 Ca 0.11 0.13 0.00 0.00 -0.77 0.00 0.00 57.85 57.32 3f5h n ARG 33 Cb 0.40 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.34 3f5h n ARG 33 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15