#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oa4 s MET 2 N 0.00 4.10 -1.13 0.03 0.00 -1.26 -3.73 119.30 117.30 2oa4 s MET 2 Ca 0.00 0.98 0.00 0.00 0.00 0.00 0.00 55.69 56.67 2oa4 s MET 2 Cb 0.00 -2.21 0.00 0.00 0.00 0.00 0.00 34.83 32.62 2oa4 s MET 2 CO 0.00 -0.07 0.00 0.34 0.00 0.00 0.00 175.02 175.29 2oa4 n PHE 3 N -0.91 -0.43 -3.41 3.16 7.35 -1.26 -4.96 117.46 117.00 2oa4 n PHE 3 Ca 0.06 0.00 -0.44 0.00 -0.76 0.00 0.00 57.45 56.31 2oa4 n PHE 3 Cb 0.54 -2.63 -0.04 0.00 0.35 0.00 0.00 39.48 37.69 2oa4 n PHE 3 CO 0.00 0.00 0.00 -1.17 -0.76 0.00 0.00 176.76 174.83 2oa4 s LEU 4 N -3.36 6.30 -1.56 -2.13 2.96 -1.24 -4.64 118.68 115.01 2oa4 s LEU 4 Ca 0.00 -2.46 0.00 0.00 -0.22 0.00 0.00 54.13 51.45 2oa4 s LEU 4 Cb 0.00 -2.13 0.00 0.00 0.50 0.00 0.00 46.19 44.56 2oa4 s LEU 4 CO 0.00 -0.61 0.00 0.54 -1.32 0.00 0.00 176.35 174.96 2oa4 n ARG 5 N 4.24 -1.83 -0.27 1.98 1.74 -1.26 -4.81 116.66 116.45 2oa4 n ARG 5 Ca 0.05 0.88 0.10 0.00 -0.77 0.00 0.00 57.85 58.11 2oa4 n ARG 5 Cb 0.43 -5.49 0.27 0.00 -1.02 0.00 0.00 32.46 26.66 2oa4 n ARG 5 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2oa4 n LYS 6 N -2.85 2.38 -4.37 5.56 5.02 -1.26 -4.19 118.16 118.43 2oa4 n LYS 6 Ca -0.21 -2.12 -0.19 0.00 -2.02 0.00 0.00 58.31 53.77 2oa4 n LYS 6 Cb 0.65 -1.48 -0.14 0.00 -0.02 0.00 0.00 35.03 34.05 2oa4 n LYS 6 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2oa4 s VAL 7 N -1.29 0.90 -0.44 -0.18 1.01 -1.26 -4.41 120.40 114.72 2oa4 s VAL 7 Ca 0.40 -0.70 -0.17 0.00 0.00 0.00 0.00 61.98 61.50 2oa4 s VAL 7 Cb 0.21 -0.79 0.02 0.00 0.00 0.00 0.00 36.38 35.82 2oa4 s VAL 7 CO 0.28 0.09 0.61 -0.62 0.00 0.00 0.00 175.10 175.47 2oa4 n GLU 8 N 2.37 -2.32 -1.05 2.72 -0.58 -1.26 -4.62 120.64 115.89 2oa4 n GLU 8 Ca -0.16 2.05 0.00 0.00 -0.42 0.00 0.00 57.16 58.63 2oa4 n GLU 8 Cb 0.56 -5.38 0.00 0.00 -0.57 0.00 0.00 31.44 26.05 2oa4 n GLU 8 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2oa4 n GLY 9 N -0.34 0.70 3.74 0.62 0.00 -1.26 -5.03 105.19 103.62 2oa4 n GLY 9 Ca 0.10 -0.40 -0.30 0.00 0.00 0.00 0.00 46.02 45.42 2oa4 n GLY 9 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2oa4 s PRO 10 N -2.32 1.71 -0.05 1.61 0.04 -1.26 -4.75 135.00 129.98 2oa4 s PRO 10 Ca 0.00 0.93 0.12 0.00 0.04 0.00 0.00 61.00 62.09 2oa4 s PRO 10 Cb 0.00 -1.85 -0.23 0.00 0.04 0.00 0.00 34.50 32.46 2oa4 s PRO 10 CO 0.00 -1.96 0.65 -2.13 0.04 0.00 0.00 177.00 173.60 2oa4 n ARG 11 N -3.71 0.64 -3.52 4.56 0.63 -1.26 -4.82 116.66 109.17 2oa4 n ARG 11 Ca 0.08 0.30 -0.38 0.00 -0.92 0.00 0.00 57.85 56.93 2oa4 n ARG 11 Cb 0.54 -1.79 -0.06 0.00 0.45 0.00 0.00 32.46 31.60 2oa4 n ARG 11 CO 0.00 0.00 0.00 -1.12 -2.51 0.00 0.00 177.63 174.00 2oa4 s SER 12 N -6.14 6.78 0.02 6.15 0.01 -1.26 -4.86 113.70 114.39 2oa4 s SER 12 Ca -0.06 0.93 0.03 0.00 1.31 0.00 0.00 55.95 58.16 2oa4 s SER 12 Cb 0.08 -2.24 -0.04 0.00 0.21 0.00 0.00 66.02 64.03 2oa4 s SER 12 CO 0.82 0.33 -0.02 0.68 0.41 0.00 0.00 173.24 175.46 2oa4 s VAL 13 N -1.04 3.99 -0.29 3.43 -7.23 -0.44 -4.91 120.40 113.91 2oa4 s VAL 13 Ca 0.23 -0.71 -0.10 0.00 -1.81 0.00 0.00 61.98 59.58 2oa4 s VAL 13 Cb -0.16 -2.79 -0.03 0.00 0.56 0.00 0.00 36.38 33.95 2oa4 s VAL 13 CO 0.13 0.34 0.17 -0.89 -0.31 0.00 0.00 175.10 174.53 2oa4 s THR 14 N -1.10 4.99 0.55 5.32 2.01 -1.26 0.05 115.64 126.21 2oa4 s THR 14 Ca 0.20 -0.04 -0.17 0.00 0.31 0.00 0.00 61.69 61.98 2oa4 s THR 14 Cb -0.11 -3.42 -0.05 0.00 0.01 0.00 0.00 72.50 68.92 2oa4 s THR 14 CO 0.11 0.21 1.05 -0.76 -0.69 0.00 0.00 174.62 174.54 2oa4 s LEU 15 N 1.70 3.63 0.45 4.42 1.43 0.12 -4.91 118.68 125.52 2oa4 s LEU 15 Ca 0.06 1.87 0.28 0.00 -1.03 0.00 0.00 54.13 55.32 2oa4 s LEU 15 Cb -0.16 -4.54 1.54 0.00 0.03 0.00 0.00 46.19 43.06 2oa4 s LEU 15 CO 0.09 -1.03 1.86 -0.65 0.23 0.00 0.00 176.35 176.84 2oa4 h PRO 16 N 0.86 0.00 0.00 1.29 0.11 -1.98 0.13 132.00 132.41 2oa4 h PRO 16 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2oa4 h PRO 16 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2oa4 h PRO 16 CO 0.58 0.00 0.00 -0.44 -0.21 0.00 0.00 178.00 177.93 2oa4 h ASP 17 N 0.00 0.00 0.00 -2.05 3.32 -2.03 -3.46 116.42 112.20 2oa4 h ASP 17 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2oa4 h ASP 17 Cb 0.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.67 2oa4 h ASP 17 CO 0.00 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.13 2oa4 n GLY 18 N 0.26 0.68 3.89 2.75 0.00 0.46 -5.08 105.19 108.15 2oa4 n GLY 18 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 2oa4 n GLY 18 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2oa4 s SER 19 N -2.62 6.37 -0.21 1.61 0.15 -1.24 -4.88 113.70 112.88 2oa4 s SER 19 Ca 0.00 0.42 -0.10 0.00 0.70 0.00 0.00 55.95 56.97 2oa4 s SER 19 Cb 0.00 -2.03 -0.05 0.00 -1.71 0.00 0.00 66.02 62.23 2oa4 s SER 19 CO 0.00 0.35 0.13 0.27 1.20 0.00 0.00 173.24 175.19 2oa4 s ILE 20 N -1.15 5.37 -0.05 6.45 -4.36 -1.26 0.12 121.20 126.33 2oa4 s ILE 20 Ca 0.20 0.18 0.04 0.00 -0.26 0.00 0.00 60.65 60.81 2oa4 s ILE 20 Cb -0.12 -3.46 -0.02 0.00 1.25 0.00 0.00 42.46 40.10 2oa4 s ILE 20 CO 0.10 0.43 -0.17 -0.04 0.24 0.00 0.00 174.94 175.50 2oa4 s MET 21 N 0.47 2.52 0.26 0.37 -1.94 0.11 -4.94 119.30 116.15 2oa4 s MET 21 Ca 0.08 -0.75 0.02 0.00 -1.71 0.00 0.00 55.69 53.32 2oa4 s MET 21 Cb -0.11 -2.33 -0.05 0.00 2.01 0.00 0.00 34.83 34.34 2oa4 s MET 21 CO -0.01 0.56 0.09 0.99 -0.01 0.00 0.00 175.02 176.64 2oa4 s THR 22 N -0.58 0.66 0.40 2.05 2.01 -1.26 -1.33 115.64 117.59 2oa4 s THR 22 Ca 0.08 -2.00 0.11 0.00 0.31 0.00 0.00 61.69 60.19 2oa4 s THR 22 Cb -0.11 -2.64 0.15 0.00 0.01 0.00 0.00 72.50 69.91 2oa4 s THR 22 CO 0.01 -0.02 1.92 -0.09 -0.69 0.00 0.00 174.62 175.75 2oa4 h ARG 23 N 2.36 0.17 -0.00 4.92 2.43 -1.96 -0.51 114.38 121.79 2oa4 h ARG 23 Ca -0.39 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.74 2oa4 h ARG 23 Cb 1.24 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.77 2oa4 h ARG 23 CO 0.62 0.34 -0.02 0.00 -1.51 0.00 0.00 179.97 179.40 2oa4 n ALA 24 N -2.49 2.60 1.06 2.80 0.00 -1.26 -2.51 120.51 120.72 2oa4 n ALA 24 Ca -0.01 -0.19 0.12 0.00 0.00 0.00 0.00 53.44 53.36 2oa4 n ALA 24 Cb 0.28 -1.46 0.13 0.00 0.00 0.00 0.00 19.45 18.40 2oa4 n ALA 24 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2oa4 n ASP 25 N -1.09 2.47 -4.83 0.00 8.00 -0.21 -4.90 116.55 115.99 2oa4 n ASP 25 Ca 0.17 -1.76 -0.38 0.00 0.71 0.00 0.00 54.79 53.54 2oa4 n ASP 25 Cb 0.21 0.14 -0.06 0.00 -0.02 0.00 0.00 41.12 41.39 2oa4 n ASP 25 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2oa4 s LEU 26 N -2.16 4.47 -0.39 0.64 1.43 -1.04 -4.88 118.68 116.75 2oa4 s LEU 26 Ca 0.26 0.99 -0.39 0.00 -1.03 0.00 0.00 54.13 53.96 2oa4 s LEU 26 Cb 0.20 -2.63 -0.15 0.00 0.03 0.00 0.00 46.19 43.64 2oa4 s LEU 26 CO 0.39 0.30 2.09 -2.65 0.23 0.00 0.00 176.35 176.71 2oa4 n PRO 27 N 1.91 0.71 -1.13 1.29 -0.02 -1.26 -4.81 135.00 131.70 2oa4 n PRO 27 Ca -0.13 0.21 -0.33 0.00 -2.02 0.00 0.00 63.50 61.22 2oa4 n PRO 27 Cb 0.52 -2.07 -0.02 0.00 -0.02 0.00 0.00 33.50 31.91 2oa4 n PRO 27 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2oa4 n PRO 28 N 7.43 2.71 0.00 0.52 -0.02 -1.26 -4.72 135.00 139.66 2oa4 n PRO 28 Ca 0.43 -1.92 0.00 0.00 -2.02 0.00 0.00 63.50 59.99 2oa4 n PRO 28 Cb 0.12 -2.74 0.00 0.00 -0.02 0.00 0.00 33.50 30.85 2oa4 n PRO 28 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2oa4 n ALA 29 N 4.62 0.00 0.03 3.55 0.00 -1.26 -4.09 120.51 123.37 2oa4 n ALA 29 Ca 0.59 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 54.01 2oa4 n ALA 29 Cb 0.23 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.68 2oa4 n ALA 29 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2oa4 h ASN 30 N 0.00 -0.09 -4.05 0.00 4.21 -1.98 -3.49 115.58 110.18 2oa4 h ASN 30 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 2oa4 h ASN 30 Cb 0.00 0.02 0.00 0.00 -1.12 0.00 0.00 38.32 37.22 2oa4 h ASN 30 CO 0.00 0.03 -0.44 0.41 -1.29 0.00 0.00 177.43 176.14 2oa4 n THR 31 N -2.81 -3.12 -3.20 2.81 -1.04 -1.26 -4.82 114.28 100.84 2oa4 n THR 31 Ca -0.01 1.18 -0.46 0.00 -2.04 0.00 0.00 64.05 62.72 2oa4 n THR 31 Cb 0.04 -1.70 -0.02 0.00 -1.82 0.00 0.00 70.33 66.83 2oa4 n THR 31 CO 0.00 0.00 0.00 -0.60 -0.64 0.00 0.00 175.07 173.83 2oa4 s ARG 32 N -4.63 3.57 -0.02 -2.82 3.52 -1.26 -4.76 118.95 112.56 2oa4 s ARG 32 Ca 0.00 -2.20 -0.01 0.00 -0.13 0.00 0.00 55.73 53.38 2oa4 s ARG 32 Cb 0.00 -4.57 0.01 0.00 -1.56 0.00 0.00 34.95 28.83 2oa4 s ARG 32 CO 0.00 -1.44 0.03 -2.13 -0.81 0.00 0.00 175.30 170.94 2oa4 n ARG 33 N 4.84 -1.46 -2.59 5.12 0.63 -1.26 -4.88 116.66 117.07 2oa4 n ARG 33 Ca 0.16 1.42 -0.41 0.00 -0.92 0.00 0.00 57.85 58.10 2oa4 n ARG 33 Cb 0.47 -1.89 -0.03 0.00 0.45 0.00 0.00 32.46 31.46 2oa4 n ARG 33 CO 0.00 0.00 0.00 -1.58 -2.51 0.00 0.00 177.63 173.54 2oa4 s TRP 34 N -0.18 2.56 0.76 -0.14 0.52 -1.26 -4.98 118.94 116.22 2oa4 s TRP 34 Ca -0.03 -0.84 -0.10 0.00 0.02 0.00 0.00 56.10 55.15 2oa4 s TRP 34 Cb 0.00 -4.67 0.06 0.00 -1.15 0.00 0.00 33.47 27.72 2oa4 s TRP 34 CO 0.08 -1.91 1.11 0.14 0.02 0.00 0.00 176.95 176.39 2oa4 s VAL 35 N 4.85 2.39 0.23 4.03 -7.23 -1.26 -4.90 120.40 118.51 2oa4 s VAL 35 Ca 0.45 0.01 -0.07 0.00 -1.81 0.00 0.00 61.98 60.55 2oa4 s VAL 35 Cb -0.01 -3.10 0.20 0.00 0.56 0.00 0.00 36.38 34.03 2oa4 s VAL 35 CO -0.09 -0.12 1.88 0.00 -0.31 0.00 0.00 175.10 176.46 2oa4 h ALA 36 N -0.83 1.11 -0.14 1.32 0.00 -2.00 -0.96 119.26 117.75 2oa4 h ALA 36 Ca -0.45 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 2oa4 h ALA 36 Cb 1.31 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 2oa4 h ALA 36 CO 0.64 0.39 0.05 0.77 0.00 0.00 0.00 179.25 181.10 2oa4 h SER 37 N 1.07 0.17 -0.10 0.00 0.02 -1.99 -2.08 113.55 110.63 2oa4 h SER 37 Ca 0.33 -0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 61.20 2oa4 h SER 37 Cb -0.01 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.49 2oa4 h SER 37 CO -0.11 0.17 -0.21 0.03 -1.14 0.00 0.00 176.83 175.56 2oa4 h ARG 38 N 0.20 0.33 0.08 3.45 2.47 -1.55 -2.31 114.38 117.04 2oa4 h ARG 38 Ca 0.05 -0.21 -0.00 0.00 -1.26 0.00 0.00 59.98 58.55 2oa4 h ARG 38 Cb 0.05 0.03 0.00 0.00 -1.65 0.00 0.00 29.97 28.40 2oa4 h ARG 38 CO -0.01 0.81 -0.04 0.87 0.56 0.00 0.00 179.97 182.17 2oa4 h LYS 39 N -0.11 -0.10 -0.36 0.04 1.57 -1.14 -2.26 116.57 114.21 2oa4 h LYS 39 Ca 0.00 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.81 2oa4 h LYS 39 Cb 0.80 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.12 2oa4 h LYS 39 CO 0.05 0.14 0.24 0.82 -0.57 0.00 0.00 179.45 180.13 2oa4 h ILE 40 N -0.34 1.04 -0.16 1.86 2.04 -1.49 -0.80 117.51 119.66 2oa4 h ILE 40 Ca -0.01 -0.14 -0.07 0.00 1.00 0.00 0.00 64.86 65.64 2oa4 h ILE 40 Cb 0.29 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 2oa4 h ILE 40 CO 0.02 0.07 -0.22 0.00 0.00 0.00 0.00 178.15 178.02 2oa4 h ALA 41 N 1.79 1.32 0.23 1.87 0.00 -1.04 -1.85 119.26 121.58 2oa4 h ALA 41 Ca 0.14 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 2oa4 h ALA 41 Cb 0.08 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2oa4 h ALA 41 CO -0.03 0.46 -0.11 0.28 0.00 0.00 0.00 179.25 179.84 2oa4 h VAL 42 N 0.26 0.83 -0.67 0.00 2.07 -0.57 0.12 116.25 118.29 2oa4 h VAL 42 Ca 0.04 -0.68 0.01 0.00 0.82 0.00 0.00 66.70 66.89 2oa4 h VAL 42 Cb 0.54 1.20 -0.03 0.00 -1.52 0.00 0.00 31.29 31.48 2oa4 h VAL 42 CO 0.04 0.14 0.44 -0.37 0.02 0.00 0.00 177.57 177.84 2oa4 h VAL 43 N -0.68 1.17 -0.53 2.57 -1.51 -1.46 0.11 116.25 115.93 2oa4 h VAL 43 Ca -0.03 -0.32 -0.02 0.00 -1.23 0.00 0.00 66.70 65.10 2oa4 h VAL 43 Cb 0.47 0.19 -0.02 0.00 -2.13 0.00 0.00 31.29 29.80 2oa4 h VAL 43 CO 0.05 0.17 0.24 0.03 -1.23 0.00 0.00 177.57 176.83 2oa4 h ARG 44 N 0.91 0.77 -0.06 5.19 3.08 -1.35 -2.16 114.38 120.76 2oa4 h ARG 44 Ca 0.25 -0.12 -0.02 0.00 0.07 0.00 0.00 59.98 60.15 2oa4 h ARG 44 Cb -0.10 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 29.81 2oa4 h ARG 44 CO -0.05 0.65 -0.04 0.78 -1.07 0.00 0.00 179.97 180.24 2oa4 h GLY 45 N 0.71 0.15 0.41 0.04 0.00 -0.01 -2.60 103.07 101.76 2oa4 h GLY 45 Ca 0.18 -0.14 -0.02 0.00 0.00 0.00 0.00 47.33 47.35 2oa4 h GLY 45 CO -0.02 0.13 -0.07 -0.39 0.00 0.00 0.00 176.54 176.19 2oa4 h VAL 46 N -0.27 1.51 -0.35 4.60 -1.51 -0.87 0.92 116.25 120.28 2oa4 h VAL 46 Ca 0.01 -1.60 -0.01 0.00 -1.23 0.00 0.00 66.70 63.87 2oa4 h VAL 46 Cb 0.51 2.55 -0.02 0.00 -2.13 0.00 0.00 31.29 32.20 2oa4 h VAL 46 CO 0.01 0.43 0.17 0.40 -1.23 0.00 0.00 177.57 177.35 2oa4 h ILE 47 N -0.56 1.16 0.02 7.19 2.04 -1.50 -1.98 117.51 123.88 2oa4 h ILE 47 Ca -0.00 -0.45 -0.34 0.00 1.00 0.00 0.00 64.86 65.07 2oa4 h ILE 47 Cb 0.73 0.82 -0.05 0.00 -0.74 0.00 0.00 36.82 37.58 2oa4 h ILE 47 CO 0.01 0.17 -2.02 0.00 0.00 0.00 0.00 178.15 176.31 2oa4 n TYR 48 N -4.74 0.68 -0.09 1.37 9.36 -0.98 -4.75 117.16 118.00 2oa4 n TYR 48 Ca -0.01 0.21 -0.15 0.00 3.32 0.00 0.00 57.90 61.27 2oa4 n TYR 48 Cb 0.10 -1.11 -0.05 0.00 -0.63 0.00 0.00 39.34 37.65 2oa4 n TYR 48 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2oa4 n GLY 49 N 1.75 -0.44 0.00 2.98 0.00 0.10 -5.00 105.19 104.58 2oa4 n GLY 49 Ca -0.27 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.53 2oa4 n GLY 49 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2oa4 n LEU 50 N -4.24 0.61 -4.01 0.99 7.94 0.03 -4.98 117.00 113.34 2oa4 n LEU 50 Ca -0.27 0.04 -0.13 0.00 -1.11 0.00 0.00 56.01 54.53 2oa4 n LEU 50 Cb 0.61 -0.14 -0.02 0.00 0.53 0.00 0.00 43.42 44.41 2oa4 n LEU 50 CO 0.12 -0.14 0.25 0.27 -1.11 0.00 0.00 177.39 176.79 2oa4 s ILE 51 N -0.27 0.00 0.82 1.96 -5.25 -0.84 -5.03 121.20 112.58 2oa4 s ILE 51 Ca 0.00 -1.44 -0.12 0.00 -0.99 0.00 0.00 60.65 58.11 2oa4 s ILE 51 Cb 0.00 -2.74 0.08 0.00 2.95 0.00 0.00 42.46 42.75 2oa4 s ILE 51 CO 0.00 0.00 1.11 0.42 -1.79 0.00 0.00 174.94 174.68 2oa4 s THR 52 N -2.76 2.84 0.31 8.37 -4.23 -1.26 -4.25 115.64 114.67 2oa4 s THR 52 Ca 0.27 0.27 0.38 0.00 -1.18 0.00 0.00 61.69 61.43 2oa4 s THR 52 Cb -0.02 -3.02 0.41 0.00 1.34 0.00 0.00 72.50 71.21 2oa4 s THR 52 CO 0.19 -0.36 2.13 0.25 -0.54 0.00 0.00 174.62 176.29 2oa4 h LEU 53 N -1.17 0.00 0.01 4.79 5.85 -1.97 -2.49 115.31 120.33 2oa4 h LEU 53 Ca -0.48 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.24 2oa4 h LEU 53 Cb 1.28 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.31 2oa4 h LEU 53 CO 0.60 0.00 -0.02 0.00 -0.34 0.00 0.00 178.44 178.68 2oa4 h ALA 54 N 2.00 -0.03 0.03 1.25 0.00 -1.98 0.60 119.26 121.13 2oa4 h ALA 54 Ca 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2oa4 h ALA 54 Cb 0.31 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2oa4 h ALA 54 CO 0.00 -0.52 -0.01 1.49 0.00 0.00 0.00 179.25 180.21 2oa4 h GLU 55 N -0.04 -0.04 -0.90 0.00 4.22 -1.84 -2.44 114.58 113.55 2oa4 h GLU 55 Ca 0.00 0.00 0.08 0.00 0.08 0.00 0.00 59.36 59.53 2oa4 h GLU 55 Cb 0.04 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.23 2oa4 h GLU 55 CO -0.01 0.42 0.55 0.00 -2.18 0.00 0.00 179.01 177.80 2oa4 h ALA 56 N 0.44 1.28 -0.30 2.92 0.00 -1.42 -1.24 119.26 120.93 2oa4 h ALA 56 Ca -0.00 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 2oa4 h ALA 56 Cb 0.47 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2oa4 h ALA 56 CO 0.01 0.24 -0.12 -0.22 0.00 0.00 0.00 179.25 179.16 2oa4 h LYS 57 N 0.96 0.61 -0.30 0.00 3.64 0.24 1.06 116.57 122.77 2oa4 h LYS 57 Ca 0.41 -0.26 -0.09 0.00 -1.27 0.00 0.00 60.65 59.45 2oa4 h LYS 57 Cb 0.29 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 2oa4 h LYS 57 CO -0.21 0.83 -0.19 1.96 -2.27 0.00 0.00 179.45 179.57 2oa4 h GLN 58 N 0.37 0.56 0.00 1.90 4.20 -1.07 -1.36 115.11 119.71 2oa4 h GLN 58 Ca 0.07 -0.19 -0.19 0.00 0.06 0.00 0.00 58.65 58.40 2oa4 h GLN 58 Cb 0.63 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.34 2oa4 h GLN 58 CO 0.04 0.72 -1.62 2.41 -0.67 0.00 0.00 178.83 179.71 2oa4 n THR 59 N -4.15 1.51 -0.72 -0.54 -1.04 -0.50 -4.67 114.28 104.17 2oa4 n THR 59 Ca 0.00 -0.07 0.08 0.00 -2.04 0.00 0.00 64.05 62.02 2oa4 n THR 59 Cb 0.38 -2.16 0.30 0.00 -1.82 0.00 0.00 70.33 67.03 2oa4 n THR 59 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 2oa4 n TYR 60 N -4.37 1.24 0.30 -1.42 4.02 0.31 -4.67 117.16 112.57 2oa4 n TYR 60 Ca -0.30 -0.70 0.16 0.00 -0.01 0.00 0.00 57.90 57.05 2oa4 n TYR 60 Cb 0.67 -0.28 0.77 0.00 -0.02 0.00 0.00 39.34 40.48 2oa4 n TYR 60 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 2oa4 h GLY 61 N 2.99 0.00 0.00 2.72 0.00 0.12 -3.45 103.07 105.45 2oa4 h GLY 61 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2oa4 h GLY 61 CO 0.23 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.81 2oa4 n LEU 62 N -2.73 0.00 -3.72 3.11 4.32 -1.26 -4.30 117.00 112.42 2oa4 n LEU 62 Ca -0.00 0.00 -0.14 0.00 -0.02 0.00 0.00 56.01 55.85 2oa4 n LEU 62 Cb 0.17 0.00 -0.08 0.00 -1.62 0.00 0.00 43.42 41.89 2oa4 n LEU 62 CO 0.20 0.00 0.09 -0.55 -1.22 0.00 0.00 177.39 175.91 2oa4 s SER 63 N -4.00 -0.25 0.20 -1.43 0.15 -1.26 -5.05 113.70 102.06 2oa4 s SER 63 Ca 0.00 0.11 -0.14 0.00 0.70 0.00 0.00 55.95 56.62 2oa4 s SER 63 Cb 0.00 0.36 0.22 0.00 -1.71 0.00 0.00 66.02 64.89 2oa4 s SER 63 CO 0.00 -0.53 1.64 -0.78 1.20 0.00 0.00 173.24 174.77 2oa4 h ASP 64 N 3.53 -0.50 -0.76 5.45 1.82 -2.01 -1.44 116.42 122.52 2oa4 h ASP 64 Ca -0.30 0.17 0.15 0.00 -0.39 0.00 0.00 57.03 56.67 2oa4 h ASP 64 Cb 1.18 0.35 -0.10 0.00 0.68 0.00 0.00 39.33 41.44 2oa4 h ASP 64 CO 0.41 -0.18 0.28 -0.33 -1.61 0.00 0.00 179.24 177.81 2oa4 h GLU 65 N 0.02 0.39 0.44 0.28 5.08 -1.97 0.27 114.58 119.09 2oa4 h GLU 65 Ca 0.29 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.60 2oa4 h GLU 65 Cb 0.44 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.61 2oa4 h GLU 65 CO -0.59 0.26 -0.21 1.49 -1.00 0.00 0.00 179.01 178.96 2oa4 h GLU 66 N 0.40 -0.57 -0.66 2.33 4.57 -1.62 -2.56 114.58 116.47 2oa4 h GLU 66 Ca 0.43 0.04 0.04 0.00 -1.18 0.00 0.00 59.36 58.68 2oa4 h GLU 66 Cb 0.69 0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 29.37 2oa4 h GLU 66 CO -0.44 -0.38 0.44 0.35 -1.18 0.00 0.00 179.01 177.80 2oa4 h PHE 67 N -0.76 0.75 -0.62 0.92 3.57 -1.31 -1.49 116.94 118.00 2oa4 h PHE 67 Ca -0.06 0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.52 2oa4 h PHE 67 Cb 0.45 -0.25 -0.05 0.00 2.79 0.00 0.00 35.95 38.89 2oa4 h PHE 67 CO 0.07 0.43 0.33 -0.97 -2.23 0.00 0.00 178.31 175.94 2oa4 h ASN 68 N 0.77 0.47 0.06 0.41 -0.73 -0.48 -2.04 115.58 114.04 2oa4 h ASN 68 Ca 0.27 0.03 -0.06 0.00 1.87 0.00 0.00 56.30 58.41 2oa4 h ASN 68 Cb 0.09 -0.05 -0.01 0.00 0.27 0.00 0.00 38.32 38.61 2oa4 h ASN 68 CO -0.07 0.31 -0.18 0.28 -0.37 0.00 0.00 177.43 177.39 2oa4 h SER 69 N 0.61 0.22 0.13 1.15 0.02 -0.83 -1.40 113.55 113.44 2oa4 h SER 69 Ca 0.28 -0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.17 2oa4 h SER 69 Cb 0.19 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.67 2oa4 h SER 69 CO -0.19 0.42 -0.06 -0.50 -1.14 0.00 0.00 176.83 175.36 2oa4 h TRP 70 N 0.22 -0.16 -0.25 3.45 6.55 -1.23 -0.40 115.95 124.13 2oa4 h TRP 70 Ca 0.04 -0.00 -0.13 0.00 0.95 0.00 0.00 58.89 59.75 2oa4 h TRP 70 Cb 0.45 0.05 -0.01 0.00 -0.86 0.00 0.00 29.16 28.79 2oa4 h TRP 70 CO 0.01 0.00 -0.39 0.28 -1.05 0.00 0.00 178.44 177.29 2oa4 h VAL 71 N -0.29 1.30 -0.71 1.49 2.07 -1.38 -1.82 116.25 116.91 2oa4 h VAL 71 Ca -0.02 -1.54 -0.03 0.00 0.82 0.00 0.00 66.70 65.93 2oa4 h VAL 71 Cb 0.23 1.52 -0.03 0.00 -1.52 0.00 0.00 31.29 31.49 2oa4 h VAL 71 CO 0.03 0.49 0.32 -1.28 0.02 0.00 0.00 177.57 177.14 2oa4 h SER 72 N 0.48 0.95 0.84 0.57 0.87 -1.09 0.28 113.55 116.45 2oa4 h SER 72 Ca 0.04 -0.15 -0.10 0.00 -1.23 0.00 0.00 61.79 60.35 2oa4 h SER 72 Cb 0.88 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.59 2oa4 h SER 72 CO 0.08 0.83 -0.48 0.00 -0.53 0.00 0.00 176.83 176.73 2oa4 h ALA 73 N 1.15 0.94 0.00 6.23 0.00 -0.85 -0.08 119.26 126.64 2oa4 h ALA 73 Ca 0.24 -0.43 -0.16 0.00 0.00 0.00 0.00 54.91 54.56 2oa4 h ALA 73 Cb 0.16 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2oa4 h ALA 73 CO -0.03 0.60 -0.93 -0.07 0.00 0.00 0.00 179.25 178.82 2oa4 h LEU 74 N 0.00 0.00 0.05 0.00 3.38 -0.89 -3.30 115.31 114.56 2oa4 h LEU 74 Ca -0.00 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.76 2oa4 h LEU 74 Cb 1.02 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.79 2oa4 h LEU 74 CO 0.06 0.67 -0.85 0.00 0.09 0.00 0.00 178.44 178.42 2oa4 h ALA 75 N 1.33 0.03 0.00 1.53 0.00 -0.20 -3.47 119.26 118.47 2oa4 h ALA 75 Ca -0.06 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.19 2oa4 h ALA 75 Cb 1.57 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.43 2oa4 h ALA 75 CO 0.08 0.48 0.00 0.39 0.00 0.00 0.00 179.25 180.19 2oa4 n GLU 76 N -4.06 0.00 0.00 0.00 -0.58 -0.07 -4.39 120.64 111.54 2oa4 n GLU 76 Ca -0.12 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.62 2oa4 n GLU 76 Cb 0.80 -0.08 0.00 0.00 -0.57 0.00 0.00 31.44 31.59 2oa4 n GLU 76 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 2oa4 n HIS 77 N 0.00 0.00 0.00 -0.32 8.25 -1.26 -5.00 115.22 116.89 2oa4 n HIS 77 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2oa4 n HIS 77 Cb 0.00 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.08 2oa4 n HIS 77 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2oa4 n GLY 78 N 2.31 2.94 0.19 -1.41 0.00 -1.26 -4.82 105.19 103.14 2oa4 n GLY 78 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 2oa4 n GLY 78 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2oa4 h LYS 79 N 0.64 0.00 -1.08 1.61 1.63 -1.96 -2.95 116.57 114.46 2oa4 h LYS 79 Ca 0.00 0.00 -0.56 0.00 -0.85 0.00 0.00 60.65 59.24 2oa4 h LYS 79 Cb 0.00 0.00 -0.26 0.00 -0.60 0.00 0.00 32.23 31.37 2oa4 h LYS 79 CO 0.00 0.38 0.72 -0.40 -3.45 0.00 0.00 179.45 176.71 2oa4 n ASP 80 N -3.97 6.29 0.00 4.20 5.75 -1.26 -4.53 116.55 123.03 2oa4 n ASP 80 Ca -0.02 -3.57 0.06 0.00 -0.01 0.00 0.00 54.79 51.25 2oa4 n ASP 80 Cb 0.43 -0.94 0.30 0.00 -1.03 0.00 0.00 41.12 39.88 2oa4 n ASP 80 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2oa4 n ALA 81 N -0.75 1.75 0.55 2.12 0.00 -1.12 -0.30 120.51 122.77 2oa4 n ALA 81 Ca 0.55 -0.06 0.12 0.00 0.00 0.00 0.00 53.44 54.06 2oa4 n ALA 81 Cb 0.92 -1.18 0.21 0.00 0.00 0.00 0.00 19.45 19.40 2oa4 n ALA 81 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2oa4 h LEU 82 N 0.00 0.00 0.00 0.00 5.85 -1.88 -3.43 115.31 115.85 2oa4 h LEU 82 Ca 0.00 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.56 2oa4 h LEU 82 Cb 0.08 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.11 2oa4 h LEU 82 CO 0.00 0.08 0.00 1.17 -0.34 0.00 0.00 178.44 179.35 2oa4 n LYS 83 N -2.20 0.00 -2.93 1.25 4.81 0.60 -4.92 118.16 114.77 2oa4 n LYS 83 Ca 0.04 0.00 -0.01 0.00 -0.87 0.00 0.00 58.31 57.47 2oa4 n LYS 83 Cb 0.45 0.00 -0.01 0.00 0.02 0.00 0.00 35.03 35.49 2oa4 n LYS 83 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2oa4 n VAL 84 N 0.00 -2.83 -0.28 3.15 0.31 -1.05 -2.89 118.33 114.74 2oa4 n VAL 84 Ca 0.00 0.45 0.09 0.00 -0.01 0.00 0.00 64.34 64.87 2oa4 n VAL 84 Cb 0.00 -3.07 0.24 0.00 -0.91 0.00 0.00 33.84 30.10 2oa4 n VAL 84 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 2oa4 h THR 85 N 4.87 0.49 0.00 2.52 1.35 -1.95 0.52 112.91 120.70 2oa4 h THR 85 Ca -0.08 -0.12 -0.08 0.00 -0.55 0.00 0.00 66.41 65.58 2oa4 h THR 85 Cb 0.19 0.13 -0.01 0.00 -1.73 0.00 0.00 68.15 66.73 2oa4 h THR 85 CO 0.00 0.06 -0.36 0.00 -0.25 0.00 0.00 175.52 174.97 2oa4 h ALA 86 N 1.66 1.03 0.09 6.62 0.00 -1.97 -2.06 119.26 124.64 2oa4 h ALA 86 Ca 0.49 -0.33 -0.33 0.00 0.00 0.00 0.00 54.91 54.74 2oa4 h ALA 86 Cb 0.87 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 2oa4 h ALA 86 CO -0.52 0.45 -1.81 -0.11 0.00 0.00 0.00 179.25 177.26 2oa4 n LEU 87 N -3.57 2.43 -0.35 0.00 -0.00 0.90 -2.05 117.00 114.35 2oa4 n LEU 87 Ca -0.00 0.27 -0.03 0.00 -0.00 0.00 0.00 56.01 56.25 2oa4 n LEU 87 Cb 0.49 -1.08 0.10 0.00 -0.00 0.00 0.00 43.42 42.93 2oa4 n LEU 87 CO 0.36 0.70 1.26 0.50 -0.00 0.00 0.00 177.39 180.21 2oa4 h LYS 88 N -0.22 1.25 -0.35 1.96 3.64 -0.03 0.92 116.57 123.74 2oa4 h LYS 88 Ca -0.41 -0.09 -0.06 0.00 -1.27 0.00 0.00 60.65 58.82 2oa4 h LYS 88 Cb 1.84 -0.28 -0.01 0.00 -0.41 0.00 0.00 32.23 33.37 2oa4 h LYS 88 CO 0.00 0.84 -0.03 -0.22 -2.27 0.00 0.00 179.45 177.77 2oa4 h LYS 89 N 1.28 0.64 -0.13 1.90 3.64 -1.49 -1.58 116.57 120.83 2oa4 h LYS 89 Ca 0.34 -0.22 0.03 0.00 -1.27 0.00 0.00 60.65 59.54 2oa4 h LYS 89 Cb -0.12 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.62 2oa4 h LYS 89 CO -0.07 0.77 -0.06 -0.92 -2.27 0.00 0.00 179.45 176.90 2oa4 h TYR 90 N 0.44 -0.14 -0.08 1.91 3.20 -0.78 0.56 116.97 122.08 2oa4 h TYR 90 Ca 0.09 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.98 2oa4 h TYR 90 Cb 0.51 0.08 -0.00 0.00 1.54 0.00 0.00 36.73 38.86 2oa4 h TYR 90 CO 0.04 -0.10 0.03 -0.09 -1.64 0.00 0.00 178.16 176.41 2oa4 h ARG 91 N -0.05 0.11 -0.95 1.82 2.43 -0.81 0.17 114.38 117.10 2oa4 h ARG 91 Ca 0.07 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.23 2oa4 h ARG 91 Cb 0.16 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.64 2oa4 h ARG 91 CO -0.17 0.22 0.63 0.37 -1.51 0.00 0.00 179.97 179.51 2oa4 h GLN 92 N -0.02 1.25 -0.16 0.20 4.15 -1.00 0.19 115.11 119.72 2oa4 h GLN 92 Ca 0.03 -0.08 -0.12 0.00 0.77 0.00 0.00 58.65 59.25 2oa4 h GLN 92 Cb 0.15 -0.28 -0.01 0.00 0.21 0.00 0.00 27.48 27.54 2oa4 h GLN 92 CO -0.00 0.83 -0.43 1.25 -1.93 0.00 0.00 178.83 178.55 2oa4 h LEU 93 N 1.29 0.40 -0.08 -2.39 5.85 0.33 -0.91 115.31 119.79 2oa4 h LEU 93 Ca 0.35 -0.18 -0.08 0.00 0.84 0.00 0.00 57.88 58.81 2oa4 h LEU 93 Cb -0.15 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 40.78 2oa4 h LEU 93 CO -0.07 0.78 -0.28 -0.07 -0.34 0.00 0.00 178.44 178.45 2oa4 h LEU 94 N 0.31 0.38 -0.20 2.25 4.07 0.13 -3.25 115.31 119.00 2oa4 h LEU 94 Ca 0.03 -0.63 0.03 0.00 0.08 0.00 0.00 57.88 57.39 2oa4 h LEU 94 Cb 0.88 -0.11 -0.03 0.00 1.08 0.00 0.00 40.66 42.48 2oa4 h LEU 94 CO 0.07 0.94 0.00 -0.33 -1.08 0.00 0.00 178.44 178.05 2oa4 h GLU 95 N -0.16 0.07 -4.76 1.13 5.08 -0.61 -3.45 114.58 111.87 2oa4 h GLU 95 Ca -0.01 -0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.02 2oa4 h GLU 95 Cb 0.92 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 30.11 2oa4 h GLU 95 CO 0.06 0.04 -0.46 1.58 -1.00 0.00 0.00 179.01 179.23 2oa4 n HIS 96 N -5.13 -1.67 0.31 4.33 -0.00 -0.35 -4.86 115.22 107.84 2oa4 n HIS 96 Ca -0.02 0.29 -0.14 0.00 0.46 0.00 0.00 57.72 58.30 2oa4 n HIS 96 Cb 0.11 -2.98 -0.07 0.00 -0.12 0.00 0.00 29.99 26.93 2oa4 n HIS 96 CO 0.00 0.00 0.00 1.12 0.46 0.00 0.00 176.34 177.92 2oa4 h HIS 97 N -0.63 -0.75 -3.93 1.57 2.07 -1.88 -3.47 115.15 108.12 2oa4 h HIS 97 Ca -0.38 -0.02 -0.11 0.00 -2.85 0.00 0.00 60.37 57.01 2oa4 h HIS 97 Cb 1.26 0.25 -0.12 0.00 2.57 0.00 0.00 27.41 31.37 2oa4 h HIS 97 CO 0.67 -0.42 -0.30 -1.01 -3.07 0.00 0.00 177.93 173.80 2oa4 s HIS 98 N -4.74 0.52 0.06 6.12 3.76 -1.26 -5.17 115.29 114.58 2oa4 s HIS 98 Ca -0.14 -0.86 0.09 0.00 -0.15 0.00 0.00 55.06 53.99 2oa4 s HIS 98 Cb 0.02 -0.06 -0.03 0.00 1.11 0.00 0.00 32.58 33.62 2oa4 s HIS 98 CO 0.46 -0.80 -0.24 -3.38 -0.85 0.00 0.00 174.74 169.93 2oa4 s HIS 99 N -4.02 2.07 0.31 1.40 -3.43 -1.26 -5.13 115.29 105.23 2oa4 s HIS 99 Ca 0.23 -0.39 -0.19 0.00 -0.80 0.00 0.00 55.06 53.90 2oa4 s HIS 99 Cb 0.03 -1.21 0.04 0.00 -1.43 0.00 0.00 32.58 30.00 2oa4 s HIS 99 CO 0.05 0.15 0.77 -3.38 -2.00 0.00 0.00 174.74 170.33 2oa4 s HIS 100 N -0.87 -0.06 0.00 0.38 -3.43 -1.26 -5.29 115.29 104.76 2oa4 s HIS 100 Ca 0.10 -0.48 0.00 0.00 -0.80 0.00 0.00 55.06 53.88 2oa4 s HIS 100 Cb -0.10 0.76 0.00 0.00 -1.43 0.00 0.00 32.58 31.81 2oa4 s HIS 100 CO 0.03 -1.34 0.45 0.72 -2.00 0.00 0.00 174.74 172.60