#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oa4 n MET 2 N 0.00 2.73 -2.12 2.12 -0.00 -1.26 -4.89 117.12 113.70 2oa4 n MET 2 Ca 0.00 -1.52 -0.42 0.00 -0.00 0.00 0.00 57.70 55.76 2oa4 n MET 2 Cb 0.00 -1.77 -0.03 0.00 -0.00 0.00 0.00 33.22 31.42 2oa4 n MET 2 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 175.97 176.09 2oa4 s PHE 3 N -1.81 3.19 -0.08 3.17 5.36 -1.26 -4.94 117.98 121.61 2oa4 s PHE 3 Ca 0.27 0.93 -0.30 0.00 -0.96 0.00 0.00 56.93 56.87 2oa4 s PHE 3 Cb 0.19 -3.73 -0.03 0.00 -0.34 0.00 0.00 43.02 39.11 2oa4 s PHE 3 CO 0.10 -2.54 1.26 -0.51 -1.46 0.00 0.00 175.22 172.06 2oa4 s LEU 4 N 0.80 4.26 0.00 6.12 2.01 -1.26 -4.72 118.68 125.89 2oa4 s LEU 4 Ca 0.64 1.83 0.00 0.00 0.01 0.00 0.00 54.13 56.61 2oa4 s LEU 4 Cb -0.39 -3.55 0.00 0.00 0.01 0.00 0.00 46.19 42.26 2oa4 s LEU 4 CO 0.33 -0.66 0.00 0.54 1.01 0.00 0.00 176.35 177.56 2oa4 n ARG 5 N 5.68 0.00 -3.99 1.70 5.12 -1.26 -4.79 116.66 119.12 2oa4 n ARG 5 Ca 0.12 0.00 -0.10 0.00 -1.93 0.00 0.00 57.85 55.95 2oa4 n ARG 5 Cb 0.45 0.00 -0.04 0.00 -1.16 0.00 0.00 32.46 31.71 2oa4 n ARG 5 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2oa4 s LYS 6 N 0.00 1.67 -0.22 5.56 1.02 -1.26 -5.03 119.74 121.48 2oa4 s LYS 6 Ca 0.00 -1.33 0.03 0.00 0.02 0.00 0.00 55.97 54.69 2oa4 s LYS 6 Cb 0.00 0.49 0.37 0.00 -0.52 0.00 0.00 37.83 38.16 2oa4 s LYS 6 CO 0.00 -0.71 1.43 0.28 -0.92 0.00 0.00 175.35 175.43 2oa4 n VAL 7 N -0.43 2.04 -3.05 3.17 0.31 -1.26 -4.77 118.33 114.34 2oa4 n VAL 7 Ca -0.02 -0.96 -0.44 0.00 -0.01 0.00 0.00 64.34 62.91 2oa4 n VAL 7 Cb 0.61 -0.66 -0.04 0.00 -0.91 0.00 0.00 33.84 32.84 2oa4 n VAL 7 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2oa4 s GLU 8 N -1.77 3.22 0.00 5.55 2.02 -1.26 -4.35 118.70 122.11 2oa4 s GLU 8 Ca 0.30 -1.43 0.00 0.00 0.02 0.00 0.00 54.97 53.85 2oa4 s GLU 8 Cb 0.25 -4.40 0.00 0.00 0.10 0.00 0.00 34.13 30.08 2oa4 s GLU 8 CO 0.06 -1.61 0.00 0.41 0.02 0.00 0.00 175.26 174.14 2oa4 n GLY 9 N 5.20 0.60 3.52 -1.39 0.00 -1.26 -4.97 105.19 106.88 2oa4 n GLY 9 Ca 0.00 -0.41 -0.43 0.00 0.00 0.00 0.00 46.02 45.18 2oa4 n GLY 9 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2oa4 n PRO 10 N -1.15 3.20 0.24 1.61 -0.04 -1.26 -4.78 135.00 132.82 2oa4 n PRO 10 Ca 0.00 -3.29 0.16 0.00 -0.04 0.00 0.00 63.50 60.33 2oa4 n PRO 10 Cb 0.49 -3.44 0.70 0.00 -0.04 0.00 0.00 33.50 31.21 2oa4 n PRO 10 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2oa4 h ARG 11 N 7.43 0.00 -6.41 0.54 2.47 -1.97 -3.40 114.38 113.03 2oa4 h ARG 11 Ca 0.44 0.00 -0.57 0.00 -1.26 0.00 0.00 59.98 58.59 2oa4 h ARG 11 Cb 0.86 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.13 2oa4 h ARG 11 CO 1.47 0.00 1.16 -1.54 0.56 0.00 0.00 179.97 181.62 2oa4 s SER 12 N -5.18 6.13 0.07 7.04 1.04 -1.26 -4.89 113.70 116.65 2oa4 s SER 12 Ca 0.01 1.04 -0.31 0.00 0.48 0.00 0.00 55.95 57.17 2oa4 s SER 12 Cb 0.09 -2.53 -0.06 0.00 0.10 0.00 0.00 66.02 63.62 2oa4 s SER 12 CO 0.47 -1.56 1.25 0.68 0.98 0.00 0.00 173.24 175.07 2oa4 s VAL 13 N 6.09 3.84 -0.44 5.02 -7.23 -0.36 -4.75 120.40 122.57 2oa4 s VAL 13 Ca 0.70 1.31 -0.16 0.00 -1.81 0.00 0.00 61.98 62.02 2oa4 s VAL 13 Cb -0.18 -3.84 0.04 0.00 0.56 0.00 0.00 36.38 32.96 2oa4 s VAL 13 CO 0.33 0.10 0.40 -0.89 -0.31 0.00 0.00 175.10 174.73 2oa4 s THR 14 N 1.14 5.16 0.60 5.32 2.01 -1.26 -1.06 115.64 127.55 2oa4 s THR 14 Ca 0.60 -0.66 -0.16 0.00 0.31 0.00 0.00 61.69 61.79 2oa4 s THR 14 Cb -0.31 -4.05 -0.03 0.00 0.01 0.00 0.00 72.50 68.11 2oa4 s THR 14 CO 0.29 -0.47 1.06 -0.76 -0.69 0.00 0.00 174.62 174.06 2oa4 s LEU 15 N 1.90 3.50 0.00 4.42 1.43 -1.05 -4.90 118.68 123.98 2oa4 s LEU 15 Ca 0.08 1.83 0.03 0.00 -1.03 0.00 0.00 54.13 55.04 2oa4 s LEU 15 Cb -0.20 -4.53 0.15 0.00 0.03 0.00 0.00 46.19 41.64 2oa4 s LEU 15 CO 0.10 -1.19 0.92 -0.81 0.23 0.00 0.00 176.35 175.61 2oa4 n PRO 16 N -2.04 0.04 0.00 1.29 -0.04 -1.26 -1.32 135.00 131.68 2oa4 n PRO 16 Ca 0.09 0.27 -0.17 0.00 -0.04 0.00 0.00 63.50 63.64 2oa4 n PRO 16 Cb 0.53 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.37 2oa4 n PRO 16 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 2oa4 h ASP 17 N 0.00 0.48 0.00 3.54 3.58 -2.02 -3.48 116.42 118.52 2oa4 h ASP 17 Ca 0.00 -0.78 0.00 0.00 0.42 0.00 0.00 57.03 56.67 2oa4 h ASP 17 Cb 0.03 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 40.93 2oa4 h ASP 17 CO 0.00 1.20 0.00 0.61 -2.88 0.00 0.00 179.24 178.17 2oa4 n GLY 18 N 1.11 1.38 3.74 -0.78 0.00 -0.43 -5.11 105.19 105.09 2oa4 n GLY 18 Ca -0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.97 7.56 -0.02 1.61 0.15 -1.26 -4.84 113.70 115.93 2oa4 s SER 19 Ca 0.00 1.86 -0.06 0.00 0.70 0.00 0.00 55.95 58.45 2oa4 s SER 19 Cb 0.00 -2.59 -0.04 0.00 -1.71 0.00 0.00 66.02 61.67 2oa4 s SER 19 CO 0.00 0.04 0.22 0.27 1.20 0.00 0.00 173.24 174.97 2oa4 s ILE 20 N -0.56 5.38 -0.06 6.45 -5.25 -1.26 -2.54 121.20 123.36 2oa4 s ILE 20 Ca 0.44 0.08 0.04 0.00 -0.99 0.00 0.00 60.65 60.22 2oa4 s ILE 20 Cb -0.24 -3.53 -0.00 0.00 2.95 0.00 0.00 42.46 41.64 2oa4 s ILE 20 CO 0.31 0.41 -0.19 -0.04 -1.79 0.00 0.00 174.94 173.64 2oa4 s MET 21 N -1.65 2.11 0.52 0.37 -1.94 -0.22 -4.95 119.30 113.54 2oa4 s MET 21 Ca 0.25 -0.67 0.04 0.00 -1.71 0.00 0.00 55.69 53.60 2oa4 s MET 21 Cb -0.13 -1.75 0.04 0.00 2.01 0.00 0.00 34.83 35.01 2oa4 s MET 21 CO 0.14 0.21 0.34 0.25 -0.01 0.00 0.00 175.02 175.96 2oa4 n THR 22 N 3.30 0.00 1.80 2.05 -2.24 -1.26 -1.22 114.28 116.71 2oa4 n THR 22 Ca -0.19 -2.13 0.04 0.00 -2.27 0.00 0.00 64.05 59.50 2oa4 n THR 22 Cb 0.53 0.03 0.18 0.00 -2.10 0.00 0.00 70.33 68.96 2oa4 n THR 22 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2oa4 n ARG 23 N -1.67 1.16 -0.01 -0.78 0.00 -1.26 -2.17 116.66 111.92 2oa4 n ARG 23 Ca -0.05 -0.24 -0.04 0.00 -0.00 0.00 0.00 57.85 57.52 2oa4 n ARG 23 Cb 0.61 -1.13 -0.12 0.00 0.00 0.00 0.00 32.46 31.81 2oa4 n ARG 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2oa4 n ALA 24 N -0.38 1.76 0.09 5.13 0.00 -1.26 -4.21 120.51 121.64 2oa4 n ALA 24 Ca 0.06 -0.77 -0.17 0.00 0.00 0.00 0.00 53.44 52.55 2oa4 n ALA 24 Cb 0.08 -0.76 -0.11 0.00 0.00 0.00 0.00 19.45 18.66 2oa4 n ALA 24 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2oa4 h ASP 25 N 0.00 0.59 -2.68 0.00 5.19 -1.82 -3.45 116.42 114.25 2oa4 h ASP 25 Ca -0.27 -0.56 -0.53 0.00 -0.62 0.00 0.00 57.03 55.04 2oa4 h ASP 25 Cb 1.82 -0.19 0.02 0.00 0.18 0.00 0.00 39.33 41.16 2oa4 h ASP 25 CO 0.05 1.40 1.00 -0.22 -3.12 0.00 0.00 179.24 178.35 2oa4 s LEU 26 N -7.52 4.36 0.16 1.55 1.98 -1.10 -4.93 118.68 113.19 2oa4 s LEU 26 Ca -0.06 2.45 -0.34 0.00 -2.89 0.00 0.00 54.13 53.29 2oa4 s LEU 26 Cb 0.07 -3.56 -0.15 0.00 0.66 0.00 0.00 46.19 43.21 2oa4 s LEU 26 CO 0.89 -0.89 1.29 -2.65 -1.89 0.00 0.00 176.35 173.11 2oa4 n PRO 27 N 5.78 1.41 -0.00 0.98 -0.02 -1.26 -4.91 135.00 136.97 2oa4 n PRO 27 Ca 0.16 0.50 -0.10 0.00 -2.02 0.00 0.00 63.50 62.04 2oa4 n PRO 27 Cb 0.41 -2.10 -0.03 0.00 -0.02 0.00 0.00 33.50 31.76 2oa4 n PRO 27 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2oa4 h PRO 28 N 4.09 -0.32 0.00 0.52 0.11 -1.91 -3.45 132.00 131.04 2oa4 h PRO 28 Ca -0.45 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2oa4 h PRO 28 Cb 1.32 0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.50 2oa4 h PRO 28 CO 0.75 -0.21 0.00 0.00 -0.21 0.00 0.00 178.00 178.33 2oa4 n ALA 29 N -2.77 0.64 -0.44 -0.75 0.00 -1.26 -4.94 120.51 110.99 2oa4 n ALA 29 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2oa4 n ALA 29 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.75 2oa4 n ALA 29 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2oa4 n ASN 30 N -2.33 0.59 0.00 0.00 6.94 -1.26 -5.02 115.26 114.18 2oa4 n ASN 30 Ca 0.00 -1.04 0.00 0.00 -0.02 0.00 0.00 54.58 53.52 2oa4 n ASN 30 Cb 0.00 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.42 2oa4 n ASN 30 CO 0.00 0.00 0.00 1.07 -1.03 0.00 0.00 177.26 177.30 2oa4 n THR 31 N -0.02 0.00 0.00 5.53 5.66 -1.26 -3.34 114.28 120.85 2oa4 n THR 31 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2oa4 n THR 31 Cb 0.13 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.91 2oa4 n THR 31 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 175.07 170.88 2oa4 n ARG 32 N 0.00 0.00 0.00 1.09 0.00 -1.26 -4.91 116.66 111.58 2oa4 n ARG 32 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2oa4 n ARG 32 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 2oa4 n ARG 32 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50 2oa4 n ARG 33 N 0.00 0.00 -2.37 -0.14 0.63 -1.24 -5.10 116.66 108.44 2oa4 n ARG 33 Ca 0.00 -0.15 -0.03 0.00 -0.92 0.00 0.00 57.85 56.76 2oa4 n ARG 33 Cb 0.00 -0.51 -0.02 0.00 0.45 0.00 0.00 32.46 32.38 2oa4 n ARG 33 CO 0.00 0.00 0.00 0.91 -2.51 0.00 0.00 177.63 176.03 2oa4 n TRP 34 N -0.00 -3.30 -3.25 -0.14 7.02 -1.21 -5.02 117.44 111.53 2oa4 n TRP 34 Ca 0.00 1.74 -0.35 0.00 -1.02 0.00 0.00 57.50 57.87 2oa4 n TRP 34 Cb 0.32 -3.40 -0.06 0.00 -2.42 0.00 0.00 31.31 25.75 2oa4 n TRP 34 CO 0.00 0.00 0.00 0.14 -2.02 0.00 0.00 177.69 175.81 2oa4 s VAL 35 N -0.82 4.75 0.18 -0.99 -7.23 -1.26 -4.97 120.40 110.06 2oa4 s VAL 35 Ca -0.13 0.96 -0.14 0.00 -1.81 0.00 0.00 61.98 60.86 2oa4 s VAL 35 Cb 0.01 -3.75 0.11 0.00 0.56 0.00 0.00 36.38 33.31 2oa4 s VAL 35 CO 0.61 0.15 1.70 0.00 -0.31 0.00 0.00 175.10 177.25 2oa4 h ALA 36 N 3.27 0.50 -0.49 1.32 0.00 -2.00 -0.53 119.26 121.33 2oa4 h ALA 36 Ca -0.48 0.12 0.06 0.00 0.00 0.00 0.00 54.91 54.61 2oa4 h ALA 36 Cb 1.19 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 19.14 2oa4 h ALA 36 CO 0.66 -0.35 0.33 0.77 0.00 0.00 0.00 179.25 180.66 2oa4 h SER 37 N 0.18 0.35 1.16 0.00 0.02 -2.00 -1.68 113.55 111.57 2oa4 h SER 37 Ca 0.24 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 61.08 2oa4 h SER 37 Cb 0.34 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.79 2oa4 h SER 37 CO -0.35 0.23 -0.89 -0.09 -1.14 0.00 0.00 176.83 174.59 2oa4 h ARG 38 N 0.40 0.00 -0.09 3.45 2.43 -1.54 -2.18 114.38 116.85 2oa4 h ARG 38 Ca 0.21 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.38 2oa4 h ARG 38 Cb 0.34 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.88 2oa4 h ARG 38 CO -0.05 0.32 0.06 0.87 -1.51 0.00 0.00 179.97 179.65 2oa4 h LYS 39 N 0.00 0.12 -0.49 0.20 1.57 -0.35 -0.91 116.57 116.70 2oa4 h LYS 39 Ca -0.07 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.72 2oa4 h LYS 39 Cb 1.39 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 33.65 2oa4 h LYS 39 CO 0.05 0.10 0.33 0.82 -0.57 0.00 0.00 179.45 180.17 2oa4 h ILE 40 N 0.10 1.09 -0.13 1.86 5.03 -1.41 -1.17 117.51 122.89 2oa4 h ILE 40 Ca 0.03 -0.21 -0.09 0.00 -0.12 0.00 0.00 64.86 64.47 2oa4 h ILE 40 Cb 0.01 0.42 -0.01 0.00 -3.03 0.00 0.00 36.82 34.21 2oa4 h ILE 40 CO -0.01 0.11 -0.31 0.00 -0.68 0.00 0.00 178.15 177.27 2oa4 h ALA 41 N 1.70 1.25 0.37 1.87 0.00 -0.84 -2.67 119.26 120.94 2oa4 h ALA 41 Ca 0.19 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2oa4 h ALA 41 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2oa4 h ALA 41 CO -0.04 0.51 -0.18 0.28 0.00 0.00 0.00 179.25 179.81 2oa4 h VAL 42 N 0.22 0.61 -0.86 0.00 2.07 0.10 0.24 116.25 118.63 2oa4 h VAL 42 Ca 0.03 -0.41 0.03 0.00 0.82 0.00 0.00 66.70 67.17 2oa4 h VAL 42 Cb 0.66 0.81 -0.05 0.00 -1.52 0.00 0.00 31.29 31.19 2oa4 h VAL 42 CO 0.05 0.08 0.56 -0.37 0.02 0.00 0.00 177.57 177.91 2oa4 h VAL 43 N -0.75 1.16 -0.29 2.57 -1.51 -1.51 0.46 116.25 116.38 2oa4 h VAL 43 Ca -0.05 -0.37 -0.12 0.00 -1.23 0.00 0.00 66.70 64.93 2oa4 h VAL 43 Cb 0.51 -0.02 -0.00 0.00 -2.13 0.00 0.00 31.29 29.65 2oa4 h VAL 43 CO 0.08 0.20 -0.29 0.03 -1.23 0.00 0.00 177.57 176.37 2oa4 h ARG 44 N 1.08 0.70 -0.73 5.19 3.08 -1.43 -1.89 114.38 120.39 2oa4 h ARG 44 Ca 0.34 -0.37 -0.05 0.00 0.07 0.00 0.00 59.98 59.96 2oa4 h ARG 44 Cb -0.00 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.03 2oa4 h ARG 44 CO -0.09 0.98 0.24 0.78 -1.07 0.00 0.00 179.97 180.81 2oa4 h GLY 45 N 0.44 1.19 0.00 0.04 0.00 0.46 -2.30 103.07 102.89 2oa4 h GLY 45 Ca 0.05 -0.68 0.00 0.00 0.00 0.00 0.00 47.33 46.70 2oa4 h GLY 45 CO 0.07 0.64 -0.11 -0.39 0.00 0.00 0.00 176.54 176.75 2oa4 h VAL 46 N 1.07 0.00 -0.47 4.60 -1.51 -0.99 -0.67 116.25 118.28 2oa4 h VAL 46 Ca 0.24 -0.76 -0.04 0.00 -1.23 0.00 0.00 66.70 64.91 2oa4 h VAL 46 Cb 0.27 0.00 -0.02 0.00 -2.13 0.00 0.00 31.29 29.41 2oa4 h VAL 46 CO -0.01 0.00 0.14 0.40 -1.23 0.00 0.00 177.57 176.87 2oa4 h ILE 47 N -0.76 1.19 0.00 7.19 2.04 -1.34 -1.13 117.51 124.70 2oa4 h ILE 47 Ca 0.00 -0.67 -0.24 0.00 1.00 0.00 0.00 64.86 64.95 2oa4 h ILE 47 Cb 0.11 0.69 -0.04 0.00 -0.74 0.00 0.00 36.82 36.84 2oa4 h ILE 47 CO 0.00 0.25 -2.06 0.00 0.00 0.00 0.00 178.15 176.34 2oa4 n TYR 48 N -4.32 0.26 0.00 1.37 4.19 -0.89 -4.82 117.16 112.95 2oa4 n TYR 48 Ca 0.03 0.09 0.00 0.00 3.31 0.00 0.00 57.90 61.33 2oa4 n TYR 48 Cb 0.19 -0.91 0.00 0.00 0.49 0.00 0.00 39.34 39.11 2oa4 n TYR 48 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 2oa4 n GLY 49 N 1.55 -0.46 0.12 2.98 0.00 -0.96 -5.03 105.19 103.40 2oa4 n GLY 49 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 2oa4 n GLY 49 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2oa4 n LEU 50 N -2.41 0.00 -4.50 0.99 4.32 -0.30 -4.97 117.00 110.13 2oa4 n LEU 50 Ca 0.00 0.00 -0.24 0.00 -0.02 0.00 0.00 56.01 55.75 2oa4 n LEU 50 Cb 0.00 -0.16 -0.10 0.00 -1.62 0.00 0.00 43.42 41.53 2oa4 n LEU 50 CO 0.00 -0.22 -0.39 0.27 -1.22 0.00 0.00 177.39 175.82 2oa4 s ILE 51 N -0.45 2.12 0.87 -0.08 -4.36 -0.91 -4.97 121.20 113.41 2oa4 s ILE 51 Ca 0.00 -2.21 -0.14 0.00 -0.26 0.00 0.00 60.65 58.04 2oa4 s ILE 51 Cb 0.00 -2.54 0.20 0.00 1.25 0.00 0.00 42.46 41.37 2oa4 s ILE 51 CO 0.00 -0.26 1.18 0.35 0.24 0.00 0.00 174.94 176.45 2oa4 n THR 52 N -0.71 0.00 0.93 8.37 -2.24 -1.26 -3.36 114.28 116.01 2oa4 n THR 52 Ca -0.05 -0.92 0.11 0.00 -2.27 0.00 0.00 64.05 60.92 2oa4 n THR 52 Cb 0.63 -1.52 0.53 0.00 -2.10 0.00 0.00 70.33 67.87 2oa4 n THR 52 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 2oa4 n LEU 53 N 0.00 0.00 0.31 3.22 7.94 -1.26 -2.06 117.00 125.16 2oa4 n LEU 53 Ca 0.15 0.40 -0.13 0.00 -1.11 0.00 0.00 56.01 55.32 2oa4 n LEU 53 Cb 0.52 -0.40 -0.06 0.00 0.53 0.00 0.00 43.42 44.01 2oa4 n LEU 53 CO 0.38 -0.09 0.36 0.00 -1.11 0.00 0.00 177.39 176.92 2oa4 h ALA 54 N 2.93 -0.89 -0.47 1.96 0.00 -1.98 0.35 119.26 121.15 2oa4 h ALA 54 Ca 0.00 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.62 2oa4 h ALA 54 Cb 0.31 0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 2oa4 h ALA 54 CO 0.00 -0.83 -0.13 1.49 0.00 0.00 0.00 179.25 179.78 2oa4 h GLU 55 N -1.14 0.88 0.00 0.00 4.57 -1.93 -1.80 114.58 115.16 2oa4 h GLU 55 Ca -0.09 -0.32 0.00 0.00 -1.18 0.00 0.00 59.36 57.78 2oa4 h GLU 55 Cb 0.64 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.17 2oa4 h GLU 55 CO 0.14 0.96 0.00 0.00 -1.18 0.00 0.00 179.01 178.93 2oa4 n ALA 56 N -2.49 1.57 -0.01 2.92 0.00 -0.87 -1.51 120.51 120.11 2oa4 n ALA 56 Ca 0.01 0.05 -0.22 0.00 0.00 0.00 0.00 53.44 53.29 2oa4 n ALA 56 Cb 0.39 -1.32 -0.14 0.00 0.00 0.00 0.00 19.45 18.39 2oa4 n ALA 56 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2oa4 h LYS 57 N 0.00 0.22 -0.71 0.00 3.64 -0.11 0.16 116.57 119.77 2oa4 h LYS 57 Ca 0.00 -0.38 -0.04 0.00 -1.27 0.00 0.00 60.65 58.97 2oa4 h LYS 57 Cb 0.28 0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 32.21 2oa4 h LYS 57 CO 0.00 1.18 0.30 1.96 -2.27 0.00 0.00 179.45 180.62 2oa4 h GLN 58 N -0.27 1.04 0.00 1.90 4.20 -0.93 -1.09 115.11 119.97 2oa4 h GLN 58 Ca -0.35 -0.17 -0.42 0.00 0.06 0.00 0.00 58.65 57.77 2oa4 h GLN 58 Cb 1.80 -0.18 -0.06 0.00 0.30 0.00 0.00 27.48 29.33 2oa4 h GLN 58 CO 0.03 0.83 -2.38 2.41 -0.67 0.00 0.00 178.83 179.06 2oa4 n THR 59 N -4.30 1.45 -0.83 -0.54 -1.04 -0.57 -4.69 114.28 103.75 2oa4 n THR 59 Ca 0.07 -0.34 0.08 0.00 -2.04 0.00 0.00 64.05 61.82 2oa4 n THR 59 Cb 0.16 -1.89 0.28 0.00 -1.82 0.00 0.00 70.33 67.07 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 -4.20 1.11 -0.35 -1.42 4.01 -0.41 -4.80 117.16 111.10 2oa4 n TYR 60 Ca -0.50 -0.78 0.26 0.00 -0.16 0.00 0.00 57.90 56.73 2oa4 n TYR 60 Cb 0.85 -0.30 0.52 0.00 -0.31 0.00 0.00 39.34 40.09 2oa4 n TYR 60 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2oa4 h GLY 61 N 2.41 1.82 0.00 2.72 0.00 0.62 -3.44 103.07 107.19 2oa4 h GLY 61 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.12 2oa4 h GLY 61 CO 0.24 -0.44 0.00 1.04 0.00 0.00 0.00 176.54 177.38 2oa4 n LEU 62 N -4.93 0.00 -3.63 3.11 4.77 -1.26 -4.25 117.00 110.80 2oa4 n LEU 62 Ca 0.32 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 56.15 2oa4 n LEU 62 Cb 1.06 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 42.08 2oa4 n LEU 62 CO 0.14 0.00 0.29 -0.44 -1.33 0.00 0.00 177.39 176.04 2oa4 s SER 63 N -4.00 -0.54 0.37 -1.43 0.01 -1.26 -5.02 113.70 101.83 2oa4 s SER 63 Ca 0.00 0.77 0.09 0.00 1.31 0.00 0.00 55.95 58.12 2oa4 s SER 63 Cb 0.00 0.75 0.84 0.00 0.21 0.00 0.00 66.02 67.82 2oa4 s SER 63 CO 0.00 -0.41 1.91 -2.24 0.41 0.00 0.00 173.24 172.90 2oa4 h ASP 64 N 4.06 0.61 -0.53 2.44 2.03 -2.00 0.09 116.42 123.12 2oa4 h ASP 64 Ca -0.28 0.02 -0.05 0.00 -0.73 0.00 0.00 57.03 55.99 2oa4 h ASP 64 Cb 1.16 -0.10 -0.02 0.00 -0.83 0.00 0.00 39.33 39.54 2oa4 h ASP 64 CO 0.29 0.34 0.14 -0.08 -1.03 0.00 0.00 179.24 178.89 2oa4 h GLU 65 N 0.66 0.85 0.15 4.15 4.81 -1.96 0.69 114.58 123.92 2oa4 h GLU 65 Ca 0.39 -0.20 -0.01 0.00 -0.13 0.00 0.00 59.36 59.41 2oa4 h GLU 65 Cb 0.60 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.87 2oa4 h GLU 65 CO -0.16 0.80 -0.07 1.49 -0.73 0.00 0.00 179.01 180.34 2oa4 h GLU 66 N 0.74 -0.19 -0.26 1.92 4.57 -1.43 -2.22 114.58 117.72 2oa4 h GLU 66 Ca 0.17 0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.34 2oa4 h GLU 66 Cb 0.33 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.95 2oa4 h GLU 66 CO 0.00 -0.12 0.08 0.35 -1.18 0.00 0.00 179.01 178.14 2oa4 h PHE 67 N -0.21 0.42 0.00 0.92 3.04 -0.94 -2.67 116.94 117.49 2oa4 h PHE 67 Ca -0.02 -0.04 -0.03 0.00 3.98 0.00 0.00 57.97 61.85 2oa4 h PHE 67 Cb 0.17 -0.12 -0.00 0.00 2.56 0.00 0.00 35.95 38.55 2oa4 h PHE 67 CO -0.06 0.47 -0.15 -2.95 -2.02 0.00 0.00 178.31 173.60 2oa4 h ASN 68 N 0.25 0.00 0.25 0.41 7.08 -0.88 -2.10 115.58 120.59 2oa4 h ASN 68 Ca 0.08 0.00 -0.06 0.00 -3.08 0.00 0.00 56.30 53.24 2oa4 h ASN 68 Cb 0.25 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 36.48 2oa4 h ASN 68 CO -0.00 0.15 -0.28 0.28 -2.08 0.00 0.00 177.43 175.50 2oa4 h SER 69 N 0.00 0.05 -0.20 6.14 0.02 -1.04 0.40 113.55 118.91 2oa4 h SER 69 Ca -0.00 -0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 60.87 2oa4 h SER 69 Cb 0.64 -0.01 -0.00 0.00 0.14 0.00 0.00 62.40 63.16 2oa4 h SER 69 CO 0.02 0.33 -0.12 -0.50 -1.14 0.00 0.00 176.83 175.42 2oa4 h TRP 70 N 0.05 0.52 -0.39 3.45 6.55 -1.34 -0.70 115.95 124.08 2oa4 h TRP 70 Ca 0.01 -0.14 -0.11 0.00 0.95 0.00 0.00 58.89 59.60 2oa4 h TRP 70 Cb 0.52 -0.12 -0.01 0.00 -0.86 0.00 0.00 29.16 28.70 2oa4 h TRP 70 CO 0.00 0.75 -0.17 0.28 -1.05 0.00 0.00 178.44 178.25 2oa4 h VAL 71 N 0.13 1.28 0.00 1.49 2.07 -1.43 -2.38 116.25 117.41 2oa4 h VAL 71 Ca 0.04 -1.30 -0.04 0.00 0.82 0.00 0.00 66.70 66.23 2oa4 h VAL 71 Cb 0.63 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 2oa4 h VAL 71 CO 0.03 0.43 -0.18 0.28 0.02 0.00 0.00 177.57 178.16 2oa4 h SER 72 N 0.61 0.00 0.43 0.57 0.02 -0.20 0.23 113.55 115.20 2oa4 h SER 72 Ca 0.09 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.89 2oa4 h SER 72 Cb 0.72 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.25 2oa4 h SER 72 CO 0.05 0.18 -0.63 0.00 -1.14 0.00 0.00 176.83 175.30 2oa4 h ALA 73 N 1.82 0.85 0.00 3.77 0.00 -0.85 -0.80 119.26 124.05 2oa4 h ALA 73 Ca -0.00 -0.56 -0.17 0.00 0.00 0.00 0.00 54.91 54.18 2oa4 h ALA 73 Cb 0.33 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2oa4 h ALA 73 CO 0.02 0.75 -0.79 -0.07 0.00 0.00 0.00 179.25 179.16 2oa4 h LEU 74 N 0.14 0.00 -0.61 0.00 3.38 -0.74 -3.06 115.31 114.42 2oa4 h LEU 74 Ca -0.01 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 2oa4 h LEU 74 Cb 1.13 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.86 2oa4 h LEU 74 CO 0.09 0.79 -0.63 0.00 0.09 0.00 0.00 178.44 178.79 2oa4 h ALA 75 N 1.21 0.85 0.00 1.53 0.00 -0.38 -3.47 119.26 118.99 2oa4 h ALA 75 Ca -0.01 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.33 2oa4 h ALA 75 Cb 1.45 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.14 2oa4 h ALA 75 CO 0.10 0.79 0.00 -1.91 0.00 0.00 0.00 179.25 178.23 2oa4 n GLU 76 N -3.62 0.00 -4.05 0.00 4.07 -0.33 -4.75 120.64 111.97 2oa4 n GLU 76 Ca -0.01 0.00 -0.34 0.00 -0.06 0.00 0.00 57.16 56.75 2oa4 n GLU 76 Cb 0.66 0.00 -0.10 0.00 -0.06 0.00 0.00 31.44 31.94 2oa4 n GLU 76 CO 0.00 0.00 0.00 -3.38 -0.06 0.00 0.00 177.13 173.69 2oa4 s HIS 77 N 0.00 3.21 -1.42 4.31 -3.43 -1.26 -4.90 115.29 111.79 2oa4 s HIS 77 Ca 0.00 -0.00 -0.14 0.00 -0.80 0.00 0.00 55.06 54.12 2oa4 s HIS 77 Cb 0.00 -2.07 0.03 0.00 -1.43 0.00 0.00 32.58 29.11 2oa4 s HIS 77 CO 0.00 0.10 2.22 0.41 -2.00 0.00 0.00 174.74 175.47 2oa4 n GLY 78 N 3.61 4.31 0.00 -1.38 0.00 -1.26 -4.28 105.19 106.19 2oa4 n GLY 78 Ca -0.17 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.28 2oa4 n GLY 78 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2oa4 n LYS 79 N 6.13 0.00 -2.15 1.61 4.81 -1.26 -4.96 118.16 122.34 2oa4 n LYS 79 Ca 0.52 0.00 -0.41 0.00 -0.87 0.00 0.00 58.31 57.55 2oa4 n LYS 79 Cb 0.39 0.00 -0.00 0.00 0.02 0.00 0.00 35.03 35.44 2oa4 n LYS 79 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 2oa4 n ASP 80 N -0.94 6.44 0.11 3.14 5.75 -1.26 -4.64 116.55 125.15 2oa4 n ASP 80 Ca 0.00 -3.11 0.10 0.00 -0.01 0.00 0.00 54.79 51.78 2oa4 n ASP 80 Cb 0.00 -1.43 0.45 0.00 -1.03 0.00 0.00 41.12 39.11 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 2.96 1.50 1.33 2.12 0.00 -1.26 -1.49 120.51 125.68 2oa4 n ALA 81 Ca 0.51 0.08 0.14 0.00 0.00 0.00 0.00 53.44 54.17 2oa4 n ALA 81 Cb 0.31 -1.33 0.72 0.00 0.00 0.00 0.00 19.45 19.15 2oa4 n ALA 81 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2oa4 n LEU 82 N -2.08 0.00 -0.00 0.00 4.77 -1.26 -2.62 117.00 115.81 2oa4 n LEU 82 Ca 0.02 0.31 0.09 0.00 -0.03 0.00 0.00 56.01 56.39 2oa4 n LEU 82 Cb 0.17 -0.31 -0.11 0.00 -2.33 0.00 0.00 43.42 40.84 2oa4 n LEU 82 CO 0.16 -0.01 -0.10 1.17 -1.33 0.00 0.00 177.39 177.28 2oa4 n LYS 83 N -1.31 0.69 -2.34 3.23 0.00 -0.55 -4.72 118.16 113.16 2oa4 n LYS 83 Ca 0.13 -0.01 -0.43 0.00 0.00 0.00 0.00 58.31 58.00 2oa4 n LYS 83 Cb 0.24 -1.41 -0.02 0.00 0.00 0.00 0.00 35.03 33.84 2oa4 n LYS 83 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 2oa4 s VAL 84 N -2.84 4.00 0.20 3.15 1.01 -1.08 -4.91 120.40 119.94 2oa4 s VAL 84 Ca 0.06 1.12 -0.13 0.00 0.00 0.00 0.00 61.98 63.03 2oa4 s VAL 84 Cb 0.14 -4.06 0.19 0.00 0.00 0.00 0.00 36.38 32.65 2oa4 s VAL 84 CO 0.79 -0.47 1.65 0.74 0.00 0.00 0.00 175.10 177.80 2oa4 h THR 85 N 6.08 0.48 -0.02 3.92 2.02 -1.90 0.54 112.91 124.03 2oa4 h THR 85 Ca -0.28 -0.02 -0.13 0.00 0.77 0.00 0.00 66.41 66.76 2oa4 h THR 85 Cb 1.11 0.41 -0.02 0.00 -1.74 0.00 0.00 68.15 67.92 2oa4 h THR 85 CO 1.03 0.01 -0.57 0.00 0.37 0.00 0.00 175.52 176.36 2oa4 h ALA 86 N 1.55 1.01 0.11 6.16 0.00 -1.95 -1.41 119.26 124.72 2oa4 h ALA 86 Ca 0.29 -0.52 -0.21 0.00 0.00 0.00 0.00 54.91 54.47 2oa4 h ALA 86 Cb 0.46 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.16 2oa4 h ALA 86 CO -0.54 0.72 -1.01 1.25 0.00 0.00 0.00 179.25 179.66 2oa4 h LEU 87 N 0.05 0.36 -1.37 0.00 7.12 -1.48 -2.74 115.31 117.25 2oa4 h LEU 87 Ca -0.00 -0.89 -0.03 0.00 0.13 0.00 0.00 57.88 57.08 2oa4 h LEU 87 Cb 1.03 -0.12 -0.02 0.00 -0.53 0.00 0.00 40.66 41.02 2oa4 h LEU 87 CO 0.08 1.46 0.09 0.50 -0.13 0.00 0.00 178.44 180.43 2oa4 h LYS 88 N -0.44 0.51 0.70 1.25 3.64 -0.01 0.13 116.57 122.34 2oa4 h LYS 88 Ca -0.21 -0.08 -0.03 0.00 -1.27 0.00 0.00 60.65 59.06 2oa4 h LYS 88 Cb 1.61 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 33.34 2oa4 h LYS 88 CO 0.08 0.47 -0.43 -0.22 -2.27 0.00 0.00 179.45 177.08 2oa4 h LYS 89 N 0.50 -1.02 -0.63 1.90 3.64 -1.28 0.46 116.57 120.14 2oa4 h LYS 89 Ca 0.12 0.07 -0.07 0.00 -1.27 0.00 0.00 60.65 59.50 2oa4 h LYS 89 Cb 0.19 0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 32.22 2oa4 h LYS 89 CO -0.00 -0.68 0.11 -0.92 -2.27 0.00 0.00 179.45 175.68 2oa4 h TYR 90 N -1.06 1.10 -0.54 1.91 3.20 -1.16 0.33 116.97 120.75 2oa4 h TYR 90 Ca -0.09 -0.15 -0.12 0.00 3.14 0.00 0.00 58.73 61.51 2oa4 h TYR 90 Cb 0.86 -0.30 -0.02 0.00 1.54 0.00 0.00 36.73 38.81 2oa4 h TYR 90 CO -0.10 0.94 -0.12 -0.09 -1.64 0.00 0.00 178.16 177.14 2oa4 h ARG 91 N 0.95 1.04 0.00 1.82 2.43 -0.71 -2.34 114.38 117.57 2oa4 h ARG 91 Ca 0.19 -0.39 0.00 0.00 -0.81 0.00 0.00 59.98 58.97 2oa4 h ARG 91 Cb 0.42 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.91 2oa4 h ARG 91 CO 0.01 1.08 -0.20 0.37 -1.51 0.00 0.00 179.97 179.73 2oa4 h GLN 92 N 0.91 0.00 0.00 0.20 5.75 -0.72 -3.16 115.11 118.09 2oa4 h GLN 92 Ca 0.14 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.64 2oa4 h GLN 92 Cb 0.69 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.24 2oa4 h GLN 92 CO 0.05 0.00 0.00 -0.11 -2.65 0.00 0.00 178.83 176.12 2oa4 n LEU 93 N -2.25 0.07 -2.42 -2.39 7.94 0.11 -3.43 117.00 114.64 2oa4 n LEU 93 Ca 0.05 0.51 -0.31 0.00 -1.11 0.00 0.00 56.01 55.15 2oa4 n LEU 93 Cb 0.44 -0.49 0.04 0.00 0.53 0.00 0.00 43.42 43.94 2oa4 n LEU 93 CO 0.32 -0.06 1.45 0.18 -1.11 0.00 0.00 177.39 178.18 2oa4 n LEU 94 N -1.57 7.20 0.20 -1.96 4.32 -1.11 -4.56 117.00 119.52 2oa4 n LEU 94 Ca 0.06 -4.18 0.14 0.00 -0.02 0.00 0.00 56.01 52.01 2oa4 n LEU 94 Cb 0.32 -1.06 0.63 0.00 -1.62 0.00 0.00 43.42 41.68 2oa4 n LEU 94 CO 0.25 1.54 0.93 -0.33 -1.22 0.00 0.00 177.39 178.55 2oa4 h GLU 95 N 2.32 0.00 -2.08 3.23 5.08 -1.81 -3.22 114.58 118.09 2oa4 h GLU 95 Ca 0.50 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.58 2oa4 h GLU 95 Cb 0.62 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.79 2oa4 h GLU 95 CO 1.26 0.00 0.08 -2.39 -1.00 0.00 0.00 179.01 176.96 2oa4 n HIS 96 N -2.58 0.44 -3.72 4.33 1.44 -1.26 -4.77 115.22 109.09 2oa4 n HIS 96 Ca 0.01 -1.70 -0.13 0.00 -2.01 0.00 0.00 57.72 53.88 2oa4 n HIS 96 Cb 0.22 -1.64 -0.09 0.00 0.12 0.00 0.00 29.99 28.59 2oa4 n HIS 96 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 2oa4 s HIS 97 N 0.69 -0.47 0.33 -1.40 5.65 -1.22 -5.17 115.29 113.70 2oa4 s HIS 97 Ca 0.66 1.13 -0.09 0.00 0.25 0.00 0.00 55.06 57.00 2oa4 s HIS 97 Cb 0.32 0.17 -0.07 0.00 -1.18 0.00 0.00 32.58 31.82 2oa4 s HIS 97 CO -0.04 -0.26 0.66 -1.01 -0.65 0.00 0.00 174.74 173.44 2oa4 s HIS 98 N 0.06 3.45 0.82 3.88 0.09 -1.26 -5.08 115.29 117.26 2oa4 s HIS 98 Ca -0.01 0.92 -0.12 0.00 -0.00 0.00 0.00 55.06 55.85 2oa4 s HIS 98 Cb -0.03 -2.32 0.09 0.00 -0.00 0.00 0.00 32.58 30.31 2oa4 s HIS 98 CO 0.01 0.07 1.14 -3.38 -0.00 0.00 0.00 174.74 172.59 2oa4 s HIS 99 N -2.13 2.86 -0.18 1.40 -3.43 -1.26 -5.01 115.29 107.54 2oa4 s HIS 99 Ca 0.49 0.89 -0.28 0.00 -0.80 0.00 0.00 55.06 55.36 2oa4 s HIS 99 Cb -0.11 -3.34 -0.00 0.00 -1.43 0.00 0.00 32.58 27.70 2oa4 s HIS 99 CO 0.27 -1.86 0.96 -1.58 -2.00 0.00 0.00 174.74 170.53 2oa4 s HIS 100 N -3.39 3.40 -2.00 0.38 2.46 -1.26 -5.33 115.29 109.55 2oa4 s HIS 100 Ca 0.62 1.42 0.16 0.00 0.47 0.00 0.00 55.06 57.72 2oa4 s HIS 100 Cb -0.13 -3.16 0.13 0.00 -0.13 0.00 0.00 32.58 29.29 2oa4 s HIS 100 CO 0.52 -0.34 1.01 1.58 -2.47 0.00 0.00 174.74 175.03