#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oa4 h MET 2 N 0.00 0.71 -3.95 3.17 1.85 -2.08 -3.45 114.93 111.18 2oa4 h MET 2 Ca 0.00 -0.58 -0.23 0.00 -0.61 0.00 0.00 59.70 58.28 2oa4 h MET 2 Cb 0.00 0.12 -0.26 0.00 0.43 0.00 0.00 31.60 31.89 2oa4 h MET 2 CO 0.00 1.19 -0.72 -0.59 -0.40 0.00 0.00 176.91 176.39 2oa4 s PHE 3 N -3.73 0.19 0.36 1.39 -0.71 -1.26 -5.04 117.98 109.18 2oa4 s PHE 3 Ca -0.09 -0.18 0.00 0.00 -1.04 0.00 0.00 56.93 55.62 2oa4 s PHE 3 Cb 0.09 -0.13 0.00 0.00 -1.21 0.00 0.00 43.02 41.78 2oa4 s PHE 3 CO 0.89 -0.05 0.00 -0.11 -1.34 0.00 0.00 175.22 174.61 2oa4 n LEU 4 N 2.58 -2.99 -4.32 -1.99 7.94 -1.26 -5.01 117.00 111.94 2oa4 n LEU 4 Ca -0.16 0.68 -0.43 0.00 -1.11 0.00 0.00 56.01 54.99 2oa4 n LEU 4 Cb 0.58 2.89 0.00 0.00 0.53 0.00 0.00 43.42 47.42 2oa4 n LEU 4 CO 0.24 0.04 2.17 0.54 -1.11 0.00 0.00 177.39 179.27 2oa4 n ARG 5 N -3.25 3.11 0.00 1.96 1.74 -1.26 -2.53 116.66 116.43 2oa4 n ARG 5 Ca 0.00 -3.10 0.00 0.00 -0.77 0.00 0.00 57.85 53.98 2oa4 n ARG 5 Cb 0.00 -3.42 0.00 0.00 -1.02 0.00 0.00 32.46 28.02 2oa4 n ARG 5 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 2oa4 n LYS 6 N 7.62 0.00 -2.30 5.56 4.81 -1.26 -5.09 118.16 127.51 2oa4 n LYS 6 Ca 0.49 0.00 -0.03 0.00 -0.87 0.00 0.00 58.31 57.91 2oa4 n LYS 6 Cb 0.44 0.00 -0.01 0.00 0.02 0.00 0.00 35.03 35.48 2oa4 n LYS 6 CO 0.00 0.00 0.00 1.33 1.17 0.00 0.00 177.40 179.90 2oa4 n VAL 7 N 0.00 0.00 0.00 3.15 0.24 -1.05 -4.79 118.33 115.88 2oa4 n VAL 7 Ca 0.00 -0.31 0.00 0.00 -2.04 0.00 0.00 64.34 61.99 2oa4 n VAL 7 Cb 0.00 0.14 0.00 0.00 -1.47 0.00 0.00 33.84 32.51 2oa4 n VAL 7 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2oa4 n GLU 8 N -0.10 0.00 -2.74 7.34 -0.58 -1.26 -3.20 120.64 120.10 2oa4 n GLU 8 Ca 0.00 0.00 -0.06 0.00 -0.42 0.00 0.00 57.16 56.68 2oa4 n GLU 8 Cb 0.08 0.00 0.04 0.00 -0.57 0.00 0.00 31.44 30.99 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 0.00 -0.46 3.76 0.62 0.00 -1.26 -5.14 105.19 102.71 2oa4 n GLY 9 Ca 0.00 0.40 -0.41 0.00 0.00 0.00 0.00 46.02 46.01 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 0.67 4.24 0.04 1.61 0.04 -1.20 -4.94 135.00 135.47 2oa4 s PRO 10 Ca 0.30 2.37 -0.26 0.00 0.04 0.00 0.00 61.00 63.45 2oa4 s PRO 10 Cb 0.17 -3.06 -0.17 0.00 0.04 0.00 0.00 34.50 31.48 2oa4 s PRO 10 CO -0.17 -0.40 1.46 -0.09 0.04 0.00 0.00 177.00 177.83 2oa4 h ARG 11 N 4.15 -0.32 -6.42 4.56 2.43 -1.94 -3.45 114.38 113.38 2oa4 h ARG 11 Ca -0.48 0.02 -0.62 0.00 -0.81 0.00 0.00 59.98 58.09 2oa4 h ARG 11 Cb 1.22 0.07 -0.14 0.00 -0.42 0.00 0.00 29.97 30.71 2oa4 h ARG 11 CO 0.72 -0.08 -0.72 -1.12 -1.51 0.00 0.00 179.97 177.26 2oa4 s SER 12 N -5.06 4.20 -0.11 -3.80 0.01 -1.26 -4.68 113.70 103.00 2oa4 s SER 12 Ca -0.15 -0.62 -0.14 0.00 1.31 0.00 0.00 55.95 56.35 2oa4 s SER 12 Cb 0.03 -0.69 -0.05 0.00 0.21 0.00 0.00 66.02 65.53 2oa4 s SER 12 CO 0.61 0.09 0.33 0.68 0.41 0.00 0.00 173.24 175.36 2oa4 s VAL 13 N -1.79 5.25 -0.61 3.43 -7.23 -0.32 -4.89 120.40 114.25 2oa4 s VAL 13 Ca 0.25 0.64 -0.20 0.00 -1.81 0.00 0.00 61.98 60.86 2oa4 s VAL 13 Cb -0.08 -3.65 0.09 0.00 0.56 0.00 0.00 36.38 33.30 2oa4 s VAL 13 CO 0.15 0.45 0.78 -0.89 -0.31 0.00 0.00 175.10 175.28 2oa4 s THR 14 N -0.01 4.67 0.59 5.32 2.01 -1.26 -1.26 115.64 125.71 2oa4 s THR 14 Ca 0.19 -0.80 -0.13 0.00 0.31 0.00 0.00 61.69 61.27 2oa4 s THR 14 Cb -0.14 -4.54 -0.05 0.00 0.01 0.00 0.00 72.50 67.78 2oa4 s THR 14 CO 0.07 -1.22 1.02 -0.76 -0.69 0.00 0.00 174.62 173.04 2oa4 s LEU 15 N 3.09 3.35 0.00 4.42 1.43 -0.56 -4.92 118.68 125.50 2oa4 s LEU 15 Ca 0.15 1.49 0.03 0.00 -1.03 0.00 0.00 54.13 54.76 2oa4 s LEU 15 Cb -0.22 -4.49 0.14 0.00 0.03 0.00 0.00 46.19 41.65 2oa4 s LEU 15 CO 0.08 -0.83 0.81 -2.65 0.23 0.00 0.00 176.35 173.99 2oa4 n PRO 16 N -2.40 0.05 0.00 1.29 -0.02 -1.26 -0.66 135.00 132.00 2oa4 n PRO 16 Ca 0.06 0.18 0.14 0.00 -2.02 0.00 0.00 63.50 61.86 2oa4 n PRO 16 Cb 0.54 -1.50 0.50 0.00 -0.02 0.00 0.00 33.50 33.02 2oa4 n PRO 16 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2oa4 n ASP 17 N -1.19 1.15 0.00 2.55 9.92 -1.26 -4.91 116.55 122.80 2oa4 n ASP 17 Ca 0.01 -1.16 0.00 0.00 -0.53 0.00 0.00 54.79 53.12 2oa4 n ASP 17 Cb 0.02 0.04 0.00 0.00 -0.64 0.00 0.00 41.12 40.54 2oa4 n ASP 17 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2oa4 n GLY 18 N 1.24 0.46 3.28 0.44 0.00 0.17 -5.05 105.19 105.72 2oa4 n GLY 18 Ca 0.16 -0.88 -0.32 0.00 0.00 0.00 0.00 46.02 44.98 2oa4 n GLY 18 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2oa4 s SER 19 N -2.94 3.17 -0.54 1.61 0.01 -1.23 -4.97 113.70 108.81 2oa4 s SER 19 Ca 0.00 -0.49 -0.19 0.00 1.31 0.00 0.00 55.95 56.58 2oa4 s SER 19 Cb 0.00 -0.96 0.08 0.00 0.21 0.00 0.00 66.02 65.35 2oa4 s SER 19 CO 0.00 0.23 0.64 0.27 0.41 0.00 0.00 173.24 174.79 2oa4 s ILE 20 N -0.09 4.88 -0.17 1.44 -4.36 -1.26 -1.49 121.20 120.15 2oa4 s ILE 20 Ca -0.05 -0.75 -0.07 0.00 -0.26 0.00 0.00 60.65 59.51 2oa4 s ILE 20 Cb -0.14 -4.37 -0.04 0.00 1.25 0.00 0.00 42.46 39.16 2oa4 s ILE 20 CO 0.04 -0.93 0.06 -0.04 0.24 0.00 0.00 174.94 174.31 2oa4 s MET 21 N 2.57 3.86 0.50 0.37 -1.94 -0.39 -4.87 119.30 119.40 2oa4 s MET 21 Ca 0.13 -0.34 0.07 0.00 -1.71 0.00 0.00 55.69 53.84 2oa4 s MET 21 Cb -0.22 -3.16 0.03 0.00 2.01 0.00 0.00 34.83 33.49 2oa4 s MET 21 CO 0.09 0.34 0.51 0.99 -0.01 0.00 0.00 175.02 176.94 2oa4 s THR 22 N 0.19 2.22 0.28 2.05 2.01 -1.26 -1.17 115.64 119.95 2oa4 s THR 22 Ca 0.04 -1.27 0.31 0.00 0.31 0.00 0.00 61.69 61.08 2oa4 s THR 22 Cb -0.12 -2.49 0.31 0.00 0.01 0.00 0.00 72.50 70.21 2oa4 s THR 22 CO 0.01 0.00 1.96 -0.09 -0.69 0.00 0.00 174.62 175.80 2oa4 h ARG 23 N 0.68 0.00 -0.01 4.92 2.43 -1.98 0.82 114.38 121.23 2oa4 h ARG 23 Ca -0.37 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.80 2oa4 h ARG 23 Cb 1.29 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.84 2oa4 h ARG 23 CO 0.52 0.00 -0.20 0.00 -1.51 0.00 0.00 179.97 178.78 2oa4 n ALA 24 N -1.90 2.96 1.06 2.80 0.00 -1.26 -3.75 120.51 120.42 2oa4 n ALA 24 Ca -0.02 -0.47 0.12 0.00 0.00 0.00 0.00 53.44 53.07 2oa4 n ALA 24 Cb 0.11 -1.07 0.15 0.00 0.00 0.00 0.00 19.45 18.64 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 -0.18 2.82 -4.75 0.00 9.92 0.28 -4.90 116.55 119.74 2oa4 n ASP 25 Ca 0.14 -1.94 -0.36 0.00 -0.53 0.00 0.00 54.79 52.10 2oa4 n ASP 25 Cb 0.39 0.00 -0.07 0.00 -0.64 0.00 0.00 41.12 40.80 2oa4 n ASP 25 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2oa4 s LEU 26 N -2.00 4.25 -0.26 0.64 1.43 -1.24 -4.94 118.68 116.56 2oa4 s LEU 26 Ca 0.29 0.37 -0.28 0.00 -1.03 0.00 0.00 54.13 53.48 2oa4 s LEU 26 Cb 0.20 -2.20 -0.04 0.00 0.03 0.00 0.00 46.19 44.18 2oa4 s LEU 26 CO 0.31 0.18 2.15 -2.84 0.23 0.00 0.00 176.35 176.38 2oa4 s PRO 27 N 0.19 3.11 0.33 1.29 0.02 -1.26 -4.87 135.00 133.80 2oa4 s PRO 27 Ca 0.12 1.87 0.04 0.00 0.02 0.00 0.00 61.00 63.05 2oa4 s PRO 27 Cb -0.12 -4.35 0.65 0.00 0.02 0.00 0.00 34.50 30.70 2oa4 s PRO 27 CO 0.01 -2.13 1.91 -1.35 -0.33 0.00 0.00 177.00 175.11 2oa4 h PRO 28 N 14.89 0.86 0.00 5.54 0.11 -1.96 -3.43 132.00 148.01 2oa4 h PRO 28 Ca -0.39 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2oa4 h PRO 28 Cb 1.23 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2oa4 h PRO 28 CO 0.99 0.57 0.00 0.00 -0.21 0.00 0.00 178.00 179.35 2oa4 n ALA 29 N -2.41 0.00 -3.56 -0.75 0.00 -1.26 -4.66 120.51 107.87 2oa4 n ALA 29 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.29 2oa4 n ALA 29 Cb 0.28 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.60 2oa4 n ALA 29 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2oa4 s ASN 30 N -0.79 3.16 0.82 0.00 -0.87 -1.26 -5.04 114.94 110.96 2oa4 s ASN 30 Ca 0.00 -2.43 -0.11 0.00 -1.57 0.00 0.00 52.86 48.75 2oa4 s ASN 30 Cb 0.00 -0.66 0.08 0.00 -0.02 0.00 0.00 41.25 40.65 2oa4 s ASN 30 CO 0.00 -0.28 1.09 0.28 -2.57 0.00 0.00 177.10 175.62 2oa4 s THR 31 N 0.70 3.09 0.23 1.60 -1.32 -1.26 -4.96 115.64 113.73 2oa4 s THR 31 Ca 0.19 0.35 -0.05 0.00 -1.21 0.00 0.00 61.69 60.97 2oa4 s THR 31 Cb -0.22 -2.85 0.13 0.00 -1.51 0.00 0.00 72.50 68.05 2oa4 s THR 31 CO -0.01 -0.46 1.75 0.03 -2.21 0.00 0.00 174.62 173.72 2oa4 h ARG 32 N -1.27 1.00 -2.57 7.08 -0.00 -2.03 -3.40 114.38 113.18 2oa4 h ARG 32 Ca -0.46 -0.24 -0.32 0.00 -0.50 0.00 0.00 59.98 58.47 2oa4 h ARG 32 Cb 1.25 -0.13 -0.36 0.00 0.00 0.00 0.00 29.97 30.73 2oa4 h ARG 32 CO 0.53 0.91 -0.63 1.03 0.00 0.00 0.00 179.97 181.81 2oa4 s ARG 33 N -5.22 0.18 -1.03 0.04 0.52 -1.26 -5.08 118.95 107.10 2oa4 s ARG 33 Ca -0.11 0.23 -0.23 0.00 -0.52 0.00 0.00 55.73 55.10 2oa4 s ARG 33 Cb 0.15 -1.15 0.00 0.00 0.52 0.00 0.00 34.95 34.47 2oa4 s ARG 33 CO 0.83 -0.63 1.73 -1.58 0.02 0.00 0.00 175.30 175.67 2oa4 s TRP 34 N 2.32 2.22 0.57 -0.53 0.52 -1.26 -4.89 118.94 117.90 2oa4 s TRP 34 Ca 0.06 -0.23 0.02 0.00 0.02 0.00 0.00 56.10 55.97 2oa4 s TRP 34 Cb -0.15 -4.38 0.05 0.00 -1.15 0.00 0.00 33.47 27.84 2oa4 s TRP 34 CO -0.12 -1.77 0.80 0.14 0.02 0.00 0.00 176.95 176.03 2oa4 s VAL 35 N 7.50 2.56 0.22 4.03 -7.23 -1.26 -4.91 120.40 121.30 2oa4 s VAL 35 Ca 0.59 -0.70 -0.08 0.00 -1.81 0.00 0.00 61.98 59.97 2oa4 s VAL 35 Cb -0.02 -2.85 0.16 0.00 0.56 0.00 0.00 36.38 34.22 2oa4 s VAL 35 CO -0.02 0.00 1.77 0.00 -0.31 0.00 0.00 175.10 176.54 2oa4 h ALA 36 N 0.01 0.88 -0.51 1.32 0.00 -2.00 -0.61 119.26 118.36 2oa4 h ALA 36 Ca -0.40 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.54 2oa4 h ALA 36 Cb 1.29 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 2oa4 h ALA 36 CO 0.48 -0.09 0.19 0.77 0.00 0.00 0.00 179.25 180.60 2oa4 h SER 37 N 0.53 0.67 -0.15 0.00 0.02 -1.98 -2.09 113.55 110.55 2oa4 h SER 37 Ca 0.32 -0.09 -0.03 0.00 -0.84 0.00 0.00 61.79 61.16 2oa4 h SER 37 Cb 0.34 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 2oa4 h SER 37 CO -0.27 0.62 -0.01 0.03 -1.14 0.00 0.00 176.83 176.06 2oa4 h ARG 38 N 0.73 0.28 0.34 3.45 2.47 -1.54 -2.21 114.38 117.90 2oa4 h ARG 38 Ca 0.17 -0.09 -0.00 0.00 -1.26 0.00 0.00 59.98 58.80 2oa4 h ARG 38 Cb 0.17 -0.02 -0.02 0.00 -1.65 0.00 0.00 29.97 28.44 2oa4 h ARG 38 CO -0.01 0.52 -0.36 0.87 0.56 0.00 0.00 179.97 181.54 2oa4 h LYS 39 N 0.01 -0.71 -0.92 0.04 1.57 -0.72 -1.17 116.57 114.67 2oa4 h LYS 39 Ca 0.04 0.05 0.03 0.00 -1.87 0.00 0.00 60.65 58.90 2oa4 h LYS 39 Cb 0.40 0.16 -0.05 0.00 0.08 0.00 0.00 32.23 32.82 2oa4 h LYS 39 CO 0.01 -0.47 0.61 0.82 -0.57 0.00 0.00 179.45 179.84 2oa4 h ILE 40 N -0.74 1.18 -0.17 1.86 2.04 -1.48 -1.76 117.51 118.45 2oa4 h ILE 40 Ca -0.02 -0.41 -0.03 0.00 1.00 0.00 0.00 64.86 65.40 2oa4 h ILE 40 Cb 0.67 -0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 2oa4 h ILE 40 CO -0.08 0.22 -0.05 0.00 0.00 0.00 0.00 178.15 178.24 2oa4 h ALA 41 N 1.45 1.62 -0.15 1.87 0.00 -0.84 -2.53 119.26 120.68 2oa4 h ALA 41 Ca 0.36 -0.15 -0.17 0.00 0.00 0.00 0.00 54.91 54.95 2oa4 h ALA 41 Cb -0.04 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.67 2oa4 h ALA 41 CO -0.10 0.28 -0.57 0.28 0.00 0.00 0.00 179.25 179.14 2oa4 h VAL 42 N 0.24 1.32 0.17 0.00 2.07 -0.34 0.43 116.25 120.15 2oa4 h VAL 42 Ca 0.05 -1.83 -0.00 0.00 0.82 0.00 0.00 66.70 65.74 2oa4 h VAL 42 Cb 0.25 2.02 -0.01 0.00 -1.52 0.00 0.00 31.29 32.03 2oa4 h VAL 42 CO 0.01 0.57 -0.19 0.58 0.02 0.00 0.00 177.57 178.56 2oa4 h VAL 43 N 0.33 0.00 0.00 2.57 2.07 -1.10 -1.27 116.25 118.85 2oa4 h VAL 43 Ca -0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.49 2oa4 h VAL 43 Cb 1.20 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 2oa4 h VAL 43 CO 0.12 0.00 0.00 -2.11 0.02 0.00 0.00 177.57 175.60 2oa4 n ARG 44 N -3.48 0.42 -0.02 1.57 -4.01 -1.08 -1.28 116.66 108.78 2oa4 n ARG 44 Ca -0.04 0.01 -0.16 0.00 -1.04 0.00 0.00 57.85 56.62 2oa4 n ARG 44 Cb 0.17 -1.50 -0.11 0.00 -3.04 0.00 0.00 32.46 27.98 2oa4 n ARG 44 CO 0.00 0.00 0.00 0.78 -3.04 0.00 0.00 177.63 175.37 2oa4 h GLY 45 N 4.87 0.33 0.65 2.89 0.00 -0.49 -2.44 103.07 108.89 2oa4 h GLY 45 Ca 0.00 -0.54 -0.27 0.00 0.00 0.00 0.00 47.33 46.52 2oa4 h GLY 45 CO 0.00 0.48 -1.33 -0.39 0.00 0.00 0.00 176.54 175.30 2oa4 h VAL 46 N -0.27 1.13 -0.39 4.60 -1.51 -1.19 -2.62 116.25 116.00 2oa4 h VAL 46 Ca -0.04 -2.45 -0.04 0.00 -1.23 0.00 0.00 66.70 62.93 2oa4 h VAL 46 Cb 1.09 2.83 -0.02 0.00 -2.13 0.00 0.00 31.29 33.07 2oa4 h VAL 46 CO 0.08 0.73 0.07 0.40 -1.23 0.00 0.00 177.57 177.62 2oa4 h ILE 47 N -0.26 1.24 -0.00 7.19 2.04 -1.34 -1.96 117.51 124.42 2oa4 h ILE 47 Ca -0.27 -0.83 0.00 0.00 1.00 0.00 0.00 64.86 64.76 2oa4 h ILE 47 Cb 1.79 1.03 0.00 0.00 -0.74 0.00 0.00 36.82 38.90 2oa4 h ILE 47 CO 0.10 0.28 -0.82 0.00 0.00 0.00 0.00 178.15 177.71 2oa4 n TYR 48 N -4.55 0.00 0.00 1.37 9.36 -0.92 -4.74 117.16 117.68 2oa4 n TYR 48 Ca -0.01 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.21 2oa4 n TYR 48 Cb 0.22 -0.06 0.00 0.00 -0.63 0.00 0.00 39.34 38.87 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 1.49 -0.41 0.13 2.98 0.00 -0.99 -5.01 105.19 103.38 2oa4 n GLY 49 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 -1.98 0.00 0.00 0.99 4.77 -0.76 -5.01 117.00 115.01 2oa4 n LEU 50 Ca 0.00 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.72 2oa4 n LEU 50 Cb 0.00 -0.17 -0.06 0.00 -2.33 0.00 0.00 43.42 40.86 2oa4 n LEU 50 CO 0.00 -0.24 -0.19 2.30 -1.33 0.00 0.00 177.39 177.93 2oa4 n ILE 51 N -1.91 0.00 -1.93 -0.08 -6.64 -1.08 -5.03 119.36 102.70 2oa4 n ILE 51 Ca 0.00 -2.02 -0.29 0.00 -1.77 0.00 0.00 62.75 58.67 2oa4 n ILE 51 Cb 0.00 0.47 0.13 0.00 -1.44 0.00 0.00 39.64 38.80 2oa4 n ILE 51 CO 0.00 0.00 0.00 0.42 -1.77 0.00 0.00 176.55 175.20 2oa4 s THR 52 N -2.60 2.01 -0.58 7.28 -4.23 -1.26 -4.18 115.64 112.08 2oa4 s THR 52 Ca 0.03 -0.01 0.21 0.00 -1.18 0.00 0.00 61.69 60.74 2oa4 s THR 52 Cb 0.00 -2.99 0.22 0.00 1.34 0.00 0.00 72.50 71.06 2oa4 s THR 52 CO 0.02 0.00 1.65 -0.11 -0.54 0.00 0.00 174.62 175.64 2oa4 n LEU 53 N -3.51 0.52 0.17 4.79 7.94 -1.26 -1.56 117.00 124.10 2oa4 n LEU 53 Ca 0.11 0.63 -0.13 0.00 -1.11 0.00 0.00 56.01 55.52 2oa4 n LEU 53 Cb 0.60 -0.57 -0.07 0.00 0.53 0.00 0.00 43.42 43.91 2oa4 n LEU 53 CO 0.52 -0.52 0.46 0.00 -1.11 0.00 0.00 177.39 176.74 2oa4 h ALA 54 N 2.30 -0.47 -0.57 1.96 0.00 -1.98 -0.04 119.26 120.45 2oa4 h ALA 54 Ca 0.00 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 2oa4 h ALA 54 Cb 0.32 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2oa4 h ALA 54 CO 0.00 -0.56 0.15 1.49 0.00 0.00 0.00 179.25 180.33 2oa4 h GLU 55 N -0.89 0.91 0.00 0.00 4.22 -1.89 0.82 114.58 117.75 2oa4 h GLU 55 Ca -0.05 -0.21 0.00 0.00 0.08 0.00 0.00 59.36 59.18 2oa4 h GLU 55 Cb 0.53 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.66 2oa4 h GLU 55 CO 0.08 0.84 0.00 0.00 -2.18 0.00 0.00 179.01 177.75 2oa4 h ALA 56 N 1.03 1.00 0.02 2.92 0.00 -1.31 0.12 119.26 123.04 2oa4 h ALA 56 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.73 2oa4 h ALA 56 Cb 0.32 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.06 2oa4 h ALA 56 CO -0.00 0.00 -2.23 1.17 0.00 0.00 0.00 179.25 178.19 2oa4 n LYS 57 N -2.88 0.68 -0.20 0.00 4.81 -0.03 -0.81 118.16 119.74 2oa4 n LYS 57 Ca -0.02 0.15 -0.04 0.00 -0.87 0.00 0.00 58.31 57.52 2oa4 n LYS 57 Cb 0.08 -1.60 0.13 0.00 0.02 0.00 0.00 35.03 33.66 2oa4 n LYS 57 CO 0.00 0.00 0.00 1.96 1.17 0.00 0.00 177.40 180.53 2oa4 h GLN 58 N 0.01 0.99 0.00 1.64 4.20 -0.14 -1.08 115.11 120.73 2oa4 h GLN 58 Ca -0.49 -0.20 -0.25 0.00 0.06 0.00 0.00 58.65 57.76 2oa4 h GLN 58 Cb 2.05 -0.15 -0.04 0.00 0.30 0.00 0.00 27.48 29.65 2oa4 h GLN 58 CO 0.01 0.85 -1.79 2.41 -0.67 0.00 0.00 178.83 179.64 2oa4 n THR 59 N -4.27 1.51 -0.69 -0.54 -1.04 0.34 -4.66 114.28 104.93 2oa4 n THR 59 Ca 0.05 -0.14 0.08 0.00 -2.04 0.00 0.00 64.05 62.01 2oa4 n THR 59 Cb 0.22 -2.09 0.31 0.00 -1.82 0.00 0.00 70.33 66.95 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 -4.36 1.30 -0.31 -1.42 4.02 -0.44 -4.69 117.16 111.26 2oa4 n TYR 60 Ca -0.36 -0.68 0.14 0.00 -0.01 0.00 0.00 57.90 56.99 2oa4 n TYR 60 Cb 0.71 -0.27 0.37 0.00 -0.02 0.00 0.00 39.34 40.13 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 3.22 1.43 0.00 2.72 0.00 0.40 -3.44 103.07 107.40 2oa4 h GLY 61 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.02 2oa4 h GLY 61 CO 0.24 0.01 0.00 1.04 0.00 0.00 0.00 176.54 177.82 2oa4 n LEU 62 N -4.64 0.00 -3.59 3.11 4.77 -1.26 -4.23 117.00 111.16 2oa4 n LEU 62 Ca 0.21 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 56.03 2oa4 n LEU 62 Cb 0.56 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.59 2oa4 n LEU 62 CO 0.26 0.00 0.37 -0.55 -1.33 0.00 0.00 177.39 176.14 2oa4 s SER 63 N -4.00 -0.62 0.24 -1.43 0.15 -1.26 -5.01 113.70 101.77 2oa4 s SER 63 Ca 0.00 0.85 -0.05 0.00 0.70 0.00 0.00 55.95 57.45 2oa4 s SER 63 Cb 0.00 0.78 0.35 0.00 -1.71 0.00 0.00 66.02 65.44 2oa4 s SER 63 CO 0.00 -0.47 1.83 -0.78 1.20 0.00 0.00 173.24 175.02 2oa4 h ASP 64 N 3.77 0.76 -0.86 5.45 1.82 -2.00 -0.86 116.42 124.50 2oa4 h ASP 64 Ca -0.28 0.03 -0.03 0.00 -0.39 0.00 0.00 57.03 56.36 2oa4 h ASP 64 Cb 1.15 -0.13 -0.04 0.00 0.68 0.00 0.00 39.33 41.00 2oa4 h ASP 64 CO 0.29 0.47 0.43 -0.33 -1.61 0.00 0.00 179.24 178.50 2oa4 h GLU 65 N 0.89 1.22 0.75 0.28 4.39 -1.97 -0.39 114.58 119.75 2oa4 h GLU 65 Ca 0.38 -0.17 -0.04 0.00 0.34 0.00 0.00 59.36 59.87 2oa4 h GLU 65 Cb 0.24 -0.23 0.01 0.00 -0.10 0.00 0.00 28.75 28.67 2oa4 h GLU 65 CO -0.20 0.92 -0.37 1.49 -1.16 0.00 0.00 179.01 179.70 2oa4 h GLU 66 N 1.22 -0.98 -0.49 2.33 4.57 -1.51 0.21 114.58 119.92 2oa4 h GLU 66 Ca 0.30 0.07 -0.02 0.00 -1.18 0.00 0.00 59.36 58.52 2oa4 h GLU 66 Cb 0.09 0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 28.88 2oa4 h GLU 66 CO -0.04 -0.65 0.20 0.35 -1.18 0.00 0.00 179.01 177.69 2oa4 h PHE 67 N -1.02 0.69 -0.87 0.92 3.04 -1.41 -1.65 116.94 116.64 2oa4 h PHE 67 Ca -0.10 -0.03 0.00 0.00 3.98 0.00 0.00 57.97 61.82 2oa4 h PHE 67 Cb 0.78 -0.22 -0.04 0.00 2.56 0.00 0.00 35.95 39.03 2oa4 h PHE 67 CO 0.04 0.54 0.55 -0.97 -2.02 0.00 0.00 178.31 176.45 2oa4 h ASN 68 N 0.69 1.03 0.42 0.41 -0.73 -0.95 -1.80 115.58 114.65 2oa4 h ASN 68 Ca 0.17 -0.05 -0.05 0.00 1.87 0.00 0.00 56.30 58.24 2oa4 h ASN 68 Cb 0.13 -0.26 -0.01 0.00 0.27 0.00 0.00 38.32 38.45 2oa4 h ASN 68 CO -0.02 0.77 -0.25 -1.28 -0.37 0.00 0.00 177.43 176.28 2oa4 h SER 69 N 1.19 0.00 -0.21 1.15 0.87 0.01 -0.89 113.55 115.68 2oa4 h SER 69 Ca 0.32 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.86 2oa4 h SER 69 Cb -0.09 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 61.86 2oa4 h SER 69 CO -0.06 0.25 0.06 -0.50 -0.53 0.00 0.00 176.83 176.04 2oa4 h TRP 70 N 0.00 0.35 -0.39 2.24 6.55 -1.01 0.09 115.95 123.78 2oa4 h TRP 70 Ca -0.00 -0.04 -0.11 0.00 0.95 0.00 0.00 58.89 59.69 2oa4 h TRP 70 Cb 0.52 -0.10 -0.02 0.00 -0.86 0.00 0.00 29.16 28.71 2oa4 h TRP 70 CO 0.00 0.43 -0.20 0.28 -1.05 0.00 0.00 178.44 177.90 2oa4 h VAL 71 N 0.16 1.27 -0.12 1.49 2.07 -1.31 -1.87 116.25 117.94 2oa4 h VAL 71 Ca 0.07 -1.29 -0.04 0.00 0.82 0.00 0.00 66.70 66.26 2oa4 h VAL 71 Cb 0.25 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 2oa4 h VAL 71 CO -0.00 0.43 -0.09 -1.28 0.02 0.00 0.00 177.57 176.65 2oa4 h SER 72 N 0.66 0.16 0.82 0.57 0.87 -0.90 0.37 113.55 116.10 2oa4 h SER 72 Ca 0.10 -0.03 -0.16 0.00 -1.23 0.00 0.00 61.79 60.47 2oa4 h SER 72 Cb 0.69 -0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.59 2oa4 h SER 72 CO 0.05 0.28 -0.77 0.00 -0.53 0.00 0.00 176.83 175.87 2oa4 h ALA 73 N 1.74 0.70 -0.01 6.23 0.00 -0.48 -3.14 119.26 124.29 2oa4 h ALA 73 Ca 0.04 -0.70 0.00 0.00 0.00 0.00 0.00 54.91 54.25 2oa4 h ALA 73 Cb 0.28 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2oa4 h ALA 73 CO 0.02 0.96 -0.22 1.28 0.00 0.00 0.00 179.25 181.29 2oa4 n LEU 74 N -3.58 0.80 0.10 0.00 4.77 -0.58 -3.92 117.00 114.59 2oa4 n LEU 74 Ca -0.01 -0.15 -0.13 0.00 -0.03 0.00 0.00 56.01 55.70 2oa4 n LEU 74 Cb 0.76 -0.16 -0.08 0.00 -2.33 0.00 0.00 43.42 41.61 2oa4 n LEU 74 CO 0.44 0.15 0.73 0.00 -1.33 0.00 0.00 177.39 177.38 2oa4 h ALA 75 N 3.61 -0.20 -0.72 -1.18 0.00 -0.92 -3.34 119.26 116.52 2oa4 h ALA 75 Ca 0.00 -0.11 -0.31 0.00 0.00 0.00 0.00 54.91 54.49 2oa4 h ALA 75 Cb 0.46 0.08 -0.12 0.00 0.00 0.00 0.00 17.79 18.20 2oa4 h ALA 75 CO 0.00 -0.53 -0.28 -1.91 0.00 0.00 0.00 179.25 176.53 2oa4 n GLU 76 N -5.10 -1.26 0.01 0.00 4.07 -1.25 -4.44 120.64 112.67 2oa4 n GLU 76 Ca -0.09 1.02 0.00 0.00 -0.06 0.00 0.00 57.16 58.03 2oa4 n GLU 76 Cb 0.16 -5.26 0.00 0.00 -0.06 0.00 0.00 31.44 26.29 2oa4 n GLU 76 CO 0.00 0.00 0.00 0.72 -0.06 0.00 0.00 177.13 177.79 2oa4 n HIS 77 N -2.45 -0.01 -0.16 4.31 8.25 -1.26 -5.15 115.22 118.75 2oa4 n HIS 77 Ca -0.15 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.31 2oa4 n HIS 77 Cb 0.55 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.66 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 3.48 -0.95 4.59 -1.41 0.00 -1.26 -4.74 105.19 104.90 2oa4 n GLY 78 Ca 0.00 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 44.96 2oa4 n GLY 78 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2oa4 n LYS 79 N 1.48 0.00 -2.58 1.61 4.76 -1.26 -4.76 118.16 117.41 2oa4 n LYS 79 Ca 0.00 0.00 -0.43 0.00 -2.87 0.00 0.00 58.31 55.01 2oa4 n LYS 79 Cb 0.00 -0.40 0.00 0.00 -1.84 0.00 0.00 35.03 32.79 2oa4 n LYS 79 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2oa4 n ASP 80 N 0.77 4.92 -0.92 4.39 -0.08 -1.26 -4.68 116.55 119.69 2oa4 n ASP 80 Ca 0.00 -2.95 0.04 0.00 -1.51 0.00 0.00 54.79 50.37 2oa4 n ASP 80 Cb 0.00 -1.65 0.17 0.00 2.34 0.00 0.00 41.12 41.97 2oa4 n ASP 80 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2oa4 n ALA 81 N 6.73 2.86 -0.07 -1.67 0.00 -1.26 -4.02 120.51 123.09 2oa4 n ALA 81 Ca 0.44 -0.74 -0.16 0.00 0.00 0.00 0.00 53.44 52.99 2oa4 n ALA 81 Cb 0.43 -1.02 -0.14 0.00 0.00 0.00 0.00 19.45 18.72 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 0.35 1.88 -1.71 0.00 4.77 -1.26 -4.29 117.00 116.73 2oa4 n LEU 82 Ca 0.12 0.08 -0.06 0.00 -0.03 0.00 0.00 56.01 56.12 2oa4 n LEU 82 Cb 0.52 -0.48 0.27 0.00 -2.33 0.00 0.00 43.42 41.40 2oa4 n LEU 82 CO 0.12 0.73 0.96 0.29 -1.33 0.00 0.00 177.39 178.16 2oa4 n LYS 83 N -3.17 3.10 -1.69 3.23 5.02 -1.26 -4.61 118.16 118.78 2oa4 n LYS 83 Ca -0.34 -3.06 -0.44 0.00 -2.02 0.00 0.00 58.31 52.44 2oa4 n LYS 83 Cb 1.05 -2.09 -0.04 0.00 -0.02 0.00 0.00 35.03 33.94 2oa4 n LYS 83 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2oa4 n VAL 84 N -0.50 0.12 0.00 -0.18 0.31 -1.26 -4.83 118.33 111.98 2oa4 n VAL 84 Ca 0.39 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.70 2oa4 n VAL 84 Cb 1.29 -1.86 0.00 0.00 -0.91 0.00 0.00 33.84 32.36 2oa4 n VAL 84 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2oa4 n THR 85 N 4.02 0.00 0.30 2.52 -2.24 -1.25 0.26 114.28 117.89 2oa4 n THR 85 Ca 0.17 1.40 0.17 0.00 -2.27 0.00 0.00 64.05 63.52 2oa4 n THR 85 Cb 0.33 -2.12 0.94 0.00 -2.10 0.00 0.00 70.33 67.38 2oa4 n THR 85 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2oa4 h ALA 86 N -1.54 1.27 0.00 6.98 0.00 -1.91 -1.09 119.26 122.96 2oa4 h ALA 86 Ca 0.00 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2oa4 h ALA 86 Cb 0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 2oa4 h ALA 86 CO 0.00 0.04 -0.18 1.25 0.00 0.00 0.00 179.25 180.36 2oa4 h LEU 87 N 0.00 0.00 -1.09 0.00 7.12 -1.79 -2.71 115.31 116.84 2oa4 h LEU 87 Ca -0.00 -0.93 -0.09 0.00 0.13 0.00 0.00 57.88 56.99 2oa4 h LEU 87 Cb 0.13 -0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.25 2oa4 h LEU 87 CO 0.00 1.07 -0.44 0.50 -0.13 0.00 0.00 178.44 179.45 2oa4 h LYS 88 N -1.00 0.00 0.24 1.25 3.64 0.01 0.19 116.57 120.91 2oa4 h LYS 88 Ca -0.05 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 2oa4 h LYS 88 Cb 1.05 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 2oa4 h LYS 88 CO -0.03 0.44 -0.12 0.87 -2.27 0.00 0.00 179.45 178.34 2oa4 h LYS 89 N 0.00 -0.31 -0.56 1.90 1.57 -1.29 0.84 116.57 118.72 2oa4 h LYS 89 Ca -0.00 0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.75 2oa4 h LYS 89 Cb 0.81 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.17 2oa4 h LYS 89 CO 0.06 -0.11 0.17 -0.92 -0.57 0.00 0.00 179.45 178.08 2oa4 h TYR 90 N -0.46 0.90 -0.34 -1.35 3.20 -1.21 0.21 116.97 117.92 2oa4 h TYR 90 Ca -0.03 -0.09 -0.16 0.00 3.14 0.00 0.00 58.73 61.58 2oa4 h TYR 90 Cb 0.35 -0.26 -0.00 0.00 1.54 0.00 0.00 36.73 38.35 2oa4 h TYR 90 CO -0.02 0.76 -0.43 -0.09 -1.64 0.00 0.00 178.16 176.75 2oa4 h ARG 91 N 0.78 0.89 -0.02 1.82 2.43 -0.94 -3.06 114.38 116.28 2oa4 h ARG 91 Ca 0.18 -0.50 -0.18 0.00 -0.81 0.00 0.00 59.98 58.66 2oa4 h ARG 91 Cb 0.28 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.86 2oa4 h ARG 91 CO -0.01 1.15 -0.79 0.37 -1.51 0.00 0.00 179.97 179.18 2oa4 h GLN 92 N 0.69 0.23 0.00 0.20 5.75 -0.72 -3.09 115.11 118.17 2oa4 h GLN 92 Ca 0.04 -0.22 -0.01 0.00 -0.15 0.00 0.00 58.65 58.31 2oa4 h GLN 92 Cb 1.02 0.05 -0.00 0.00 1.07 0.00 0.00 27.48 29.63 2oa4 h GLN 92 CO 0.10 0.91 -0.07 1.25 -2.65 0.00 0.00 178.83 178.37 2oa4 h LEU 93 N 0.14 0.00 -0.01 -2.39 5.85 -0.88 0.35 115.31 118.37 2oa4 h LEU 93 Ca -0.03 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.69 2oa4 h LEU 93 Cb 1.38 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.41 2oa4 h LEU 93 CO 0.12 0.07 -0.12 0.18 -0.34 0.00 0.00 178.44 178.36 2oa4 n LEU 94 N -3.41 0.14 -4.73 2.25 4.32 -1.16 -4.77 117.00 109.63 2oa4 n LEU 94 Ca -0.02 0.35 -0.35 0.00 -0.02 0.00 0.00 56.01 55.97 2oa4 n LEU 94 Cb 0.22 -0.41 -0.08 0.00 -1.62 0.00 0.00 43.42 41.52 2oa4 n LEU 94 CO 0.27 0.03 -0.22 -1.61 -1.22 0.00 0.00 177.39 174.64 2oa4 s GLU 95 N -2.95 3.70 -0.29 3.23 2.02 0.11 -4.97 118.70 119.55 2oa4 s GLU 95 Ca 0.15 -0.27 -0.01 0.00 0.02 0.00 0.00 54.97 54.87 2oa4 s GLU 95 Cb 0.19 -3.18 0.20 0.00 0.10 0.00 0.00 34.13 31.44 2oa4 s GLU 95 CO 0.56 0.50 2.01 0.72 0.02 0.00 0.00 175.26 179.07 2oa4 n HIS 96 N 2.83 1.41 -2.77 1.61 8.25 -1.26 -4.94 115.22 120.35 2oa4 n HIS 96 Ca -0.18 -1.88 -0.36 0.00 -0.26 0.00 0.00 57.72 55.04 2oa4 n HIS 96 Cb 0.53 -0.91 -0.06 0.00 1.12 0.00 0.00 29.99 30.67 2oa4 n HIS 96 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2oa4 s HIS 97 N -1.66 3.58 -0.14 4.41 5.04 -1.26 -4.97 115.29 120.28 2oa4 s HIS 97 Ca 0.28 1.74 -0.29 0.00 -1.54 0.00 0.00 55.06 55.25 2oa4 s HIS 97 Cb 0.22 -2.92 -0.05 0.00 0.04 0.00 0.00 32.58 29.87 2oa4 s HIS 97 CO -0.00 0.08 1.84 -1.01 -2.34 0.00 0.00 174.74 173.30 2oa4 s HIS 98 N -1.73 1.69 0.24 3.88 3.76 -1.26 -4.96 115.29 116.91 2oa4 s HIS 98 Ca 0.53 0.27 -0.30 0.00 -0.15 0.00 0.00 55.06 55.41 2oa4 s HIS 98 Cb -0.17 -4.03 -0.10 0.00 1.11 0.00 0.00 32.58 29.39 2oa4 s HIS 98 CO 0.22 -3.91 1.41 -3.38 -0.85 0.00 0.00 174.74 168.23 2oa4 s HIS 99 N 5.60 3.07 -1.39 1.40 -3.43 -1.26 -4.91 115.29 114.37 2oa4 s HIS 99 Ca 0.82 1.07 -0.14 0.00 -0.80 0.00 0.00 55.06 56.02 2oa4 s HIS 99 Cb -0.32 -3.77 0.07 0.00 -1.43 0.00 0.00 32.58 27.13 2oa4 s HIS 99 CO 0.33 -2.49 2.05 0.72 -2.00 0.00 0.00 174.74 173.36 2oa4 n HIS 100 N 2.34 3.66 -0.48 0.38 8.25 -1.26 -5.32 115.22 122.79 2oa4 n HIS 100 Ca 0.06 -2.94 0.00 0.00 -0.26 0.00 0.00 57.72 54.59 2oa4 n HIS 100 Cb 0.41 -2.44 0.00 0.00 1.12 0.00 0.00 29.99 29.08 2oa4 n HIS 100 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56