#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oa9 s ASN 2 N 0.00 4.05 0.32 0.00 0.01 -1.26 -0.14 114.94 117.92 1oa9 s ASN 2 Ca 0.00 -0.37 -0.16 0.00 -0.71 0.00 0.00 52.86 51.62 1oa9 s ASN 2 Cb 0.00 -0.73 0.03 0.00 0.41 0.00 0.00 41.25 40.96 1oa9 s ASN 2 CO 0.00 0.25 0.68 -0.83 -1.51 0.00 0.00 177.10 175.69 1oa9 s GLY 3 N -1.57 0.32 0.17 0.66 0.00 -0.33 -4.66 107.32 101.92 1oa9 s GLY 3 Ca 0.16 -0.67 0.05 0.00 0.00 0.00 0.00 44.72 44.27 1oa9 s GLY 3 CO 0.07 -0.34 -0.10 -0.86 0.00 0.00 0.00 173.10 171.87 1oa9 s GLN 4 N -3.29 1.17 0.25 2.90 0.00 -0.70 -1.87 119.66 118.11 1oa9 s GLN 4 Ca 0.16 -1.52 0.05 0.00 -0.00 0.00 0.00 55.36 54.06 1oa9 s GLN 4 Cb -0.04 -0.76 -0.05 0.00 0.00 0.00 0.00 33.01 32.15 1oa9 s GLN 4 CO 0.10 0.09 -0.05 -1.54 0.00 0.00 0.00 175.29 173.89 1oa9 s SER 5 N -3.23 2.37 0.21 12.60 1.04 -1.19 -1.96 113.70 123.54 1oa9 s SER 5 Ca 0.20 -1.18 0.04 0.00 0.48 0.00 0.00 55.95 55.49 1oa9 s SER 5 Cb 0.02 -0.09 -0.01 0.00 0.10 0.00 0.00 66.02 66.03 1oa9 s SER 5 CO 0.03 -0.39 0.14 0.35 0.98 0.00 0.00 173.24 174.36 1oa9 n THR 6 N -0.49 0.00 -3.99 2.02 -2.24 -0.93 -4.42 114.28 104.22 1oa9 n THR 6 Ca -0.06 -1.45 -0.11 0.00 -2.27 0.00 0.00 64.05 60.16 1oa9 n THR 6 Cb 0.63 0.66 -0.12 0.00 -2.10 0.00 0.00 70.33 69.40 1oa9 n THR 6 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1oa9 s ARG 7 N -2.85 0.32 0.02 -0.78 1.70 -1.26 -1.46 118.95 114.63 1oa9 s ARG 7 Ca 0.20 -0.50 -0.29 0.00 -0.47 0.00 0.00 55.73 54.67 1oa9 s ARG 7 Cb 0.01 -0.05 0.10 0.00 -0.57 0.00 0.00 34.95 34.44 1oa9 s ARG 7 CO 0.14 -0.00 0.99 1.52 -1.08 0.00 0.00 175.30 176.87 1oa9 s TYR 8 N -1.08 -0.22 -0.29 5.89 -0.85 -0.47 -4.55 117.35 115.78 1oa9 s TYR 8 Ca -0.10 0.05 -0.01 0.00 -0.52 0.00 0.00 57.07 56.49 1oa9 s TYR 8 Cb -0.08 0.57 0.19 0.00 0.38 0.00 0.00 41.96 43.02 1oa9 s TYR 8 CO -0.00 -0.56 0.74 -0.46 -1.52 0.00 0.00 175.55 173.75 1oa9 s TRP 9 N -3.02 -1.38 -1.55 -3.49 -0.11 -0.43 -0.72 118.94 108.24 1oa9 s TRP 9 Ca 0.09 0.89 0.14 0.00 1.22 0.00 0.00 56.10 58.44 1oa9 s TRP 9 Cb -0.01 0.27 0.23 0.00 -1.50 0.00 0.00 33.47 32.46 1oa9 s TRP 9 CO -0.05 -0.80 1.11 -0.40 -4.62 0.00 0.00 176.95 172.20 1oa9 n ASP 10 N 5.34 2.61 0.00 5.86 5.68 -1.26 -3.68 116.55 131.10 1oa9 n ASP 10 Ca 0.05 -1.76 0.00 0.00 -0.50 0.00 0.00 54.79 52.58 1oa9 n ASP 10 Cb 0.55 -0.12 0.00 0.00 -1.14 0.00 0.00 41.12 40.40 1oa9 n ASP 10 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1oa9 s LYS 13 N -4.53 4.31 0.48 0.00 2.20 -1.24 -3.06 119.74 117.90 1oa9 s LYS 13 Ca 0.67 2.17 -0.24 0.00 -0.36 0.00 0.00 55.97 58.21 1oa9 s LYS 13 Cb -0.22 -3.18 -0.07 0.00 -1.51 0.00 0.00 37.83 32.84 1oa9 s LYS 13 CO 0.53 -0.41 1.36 -1.25 -0.36 0.00 0.00 175.35 175.22 1oa9 s PRO 14 N 0.44 3.52 0.41 4.03 0.04 -1.26 -4.90 135.00 137.27 1oa9 s PRO 14 Ca 0.62 2.24 0.12 0.00 0.04 0.00 0.00 61.00 64.02 1oa9 s PRO 14 Cb -0.39 -2.49 0.86 0.00 0.04 0.00 0.00 34.50 32.53 1oa9 s PRO 14 CO 0.36 -0.89 1.94 1.03 0.04 0.00 0.00 177.00 179.47 1oa9 h SER 15 N 2.01 0.11 -0.18 6.66 0.87 -1.89 -0.86 113.55 120.27 1oa9 h SER 15 Ca -0.51 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.03 1oa9 h SER 15 Cb 1.27 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.21 1oa9 h SER 15 CO 0.60 0.30 0.00 0.00 -0.53 0.00 0.00 176.83 177.20 1oa9 n GLY 17 N 0.66 -0.23 3.89 0.00 0.00 -0.33 -1.50 105.19 107.69 1oa9 n GLY 17 Ca 0.06 -0.41 -0.31 0.00 0.00 0.00 0.00 46.02 45.36 1oa9 n GLY 17 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1oa9 s TRP 18 N -2.13 3.47 0.56 1.61 0.52 -1.22 -4.60 118.94 117.15 1oa9 s TRP 18 Ca 0.35 0.24 -0.18 0.00 0.02 0.00 0.00 56.10 56.53 1oa9 s TRP 18 Cb 0.21 -1.75 -0.05 0.00 -1.15 0.00 0.00 33.47 30.73 1oa9 s TRP 18 CO 0.38 0.59 1.09 1.03 0.02 0.00 0.00 176.95 180.06 1oa9 s ARG 19 N -2.39 3.36 -0.02 4.98 0.52 -1.26 -3.60 118.95 120.55 1oa9 s ARG 19 Ca 0.33 1.42 0.00 0.00 -0.52 0.00 0.00 55.73 56.96 1oa9 s ARG 19 Cb -0.13 -2.02 0.00 0.00 0.52 0.00 0.00 34.95 33.32 1oa9 s ARG 19 CO 0.25 -0.80 0.00 0.41 0.02 0.00 0.00 175.30 175.18 1oa9 n GLY 20 N -0.30 0.43 0.76 -3.53 0.00 -1.26 -4.91 105.19 96.37 1oa9 n GLY 20 Ca 0.10 -0.73 0.12 0.00 0.00 0.00 0.00 46.02 45.52 1oa9 n GLY 20 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1oa9 n LYS 21 N -2.98 1.92 0.00 1.61 4.76 -1.24 -5.00 118.16 117.23 1oa9 n LYS 21 Ca -0.00 -1.52 0.00 0.00 -2.87 0.00 0.00 58.31 53.92 1oa9 n LYS 21 Cb 0.01 -1.47 0.00 0.00 -1.84 0.00 0.00 35.03 31.73 1oa9 n LYS 21 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1oa9 n GLY 22 N 1.34 0.97 3.57 0.72 0.00 -1.26 -3.52 105.19 107.00 1oa9 n GLY 22 Ca 0.14 -0.87 -0.43 0.00 0.00 0.00 0.00 46.02 44.86 1oa9 n GLY 22 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1oa9 s PRO 23 N -2.00 3.89 0.25 1.61 0.04 -1.26 -4.94 135.00 132.59 1oa9 s PRO 23 Ca 0.00 -1.79 0.05 0.00 0.04 0.00 0.00 61.00 59.31 1oa9 s PRO 23 Cb 0.00 -5.49 -0.05 0.00 0.04 0.00 0.00 34.50 29.00 1oa9 s PRO 23 CO 0.00 -2.24 -0.04 0.14 0.04 0.00 0.00 177.00 174.90 1oa9 s VAL 24 N 4.38 1.40 0.33 -0.36 -7.23 -1.26 -0.60 120.40 117.05 1oa9 s VAL 24 Ca 0.52 -2.09 0.08 0.00 -1.81 0.00 0.00 61.98 58.68 1oa9 s VAL 24 Cb 0.03 -2.37 0.07 0.00 0.56 0.00 0.00 36.38 34.67 1oa9 s VAL 24 CO 0.03 -0.34 1.76 -0.55 -0.31 0.00 0.00 175.10 175.70 1oa9 h ASN 25 N 2.38 0.19 -4.00 4.85 -1.07 -1.84 -3.46 115.58 112.64 1oa9 h ASN 25 Ca -0.39 -0.07 0.15 0.00 0.07 0.00 0.00 56.30 56.06 1oa9 h ASN 25 Cb 1.23 -0.05 -0.22 0.00 -2.07 0.00 0.00 38.32 37.20 1oa9 h ASN 25 CO 0.66 0.54 0.68 0.00 0.07 0.00 0.00 177.43 179.37 1oa9 s GLN 26 N -4.25 0.46 1.01 4.14 -2.07 -1.26 -5.05 119.66 112.63 1oa9 s GLN 26 Ca -0.04 0.01 -0.14 0.00 -1.82 0.00 0.00 55.36 53.36 1oa9 s GLN 26 Cb 0.14 0.21 0.19 0.00 -1.09 0.00 0.00 33.01 32.47 1oa9 s GLN 26 CO 0.75 -0.16 1.15 -1.25 -1.32 0.00 0.00 175.29 174.46 1oa9 s PRO 27 N -1.60 0.33 0.17 9.60 0.04 -1.26 -4.20 135.00 138.08 1oa9 s PRO 27 Ca 0.03 0.15 -0.32 0.00 0.04 0.00 0.00 61.00 60.91 1oa9 s PRO 27 Cb -0.01 -1.76 -0.10 0.00 0.04 0.00 0.00 34.50 32.67 1oa9 s PRO 27 CO -0.03 -2.72 1.58 0.08 0.04 0.00 0.00 177.00 175.95 1oa9 s VAL 28 N -3.23 2.58 0.51 -0.36 1.01 -0.56 -4.42 120.40 115.93 1oa9 s VAL 28 Ca 0.67 0.41 -0.23 0.00 0.00 0.00 0.00 61.98 62.84 1oa9 s VAL 28 Cb -0.13 -3.26 -0.06 0.00 0.00 0.00 0.00 36.38 32.92 1oa9 s VAL 28 CO 0.55 0.03 1.28 -1.22 0.00 0.00 0.00 175.10 175.74 1oa9 n TYR 29 N 4.01 2.08 -3.86 5.22 4.02 -0.78 -4.27 117.16 123.58 1oa9 n TYR 29 Ca 0.14 0.45 -0.22 0.00 -0.01 0.00 0.00 57.90 58.26 1oa9 n TYR 29 Cb 0.38 -2.34 -0.05 0.00 -0.02 0.00 0.00 39.34 37.31 1oa9 n TYR 29 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 1oa9 s SER 30 N -0.82 4.88 0.10 7.72 0.01 -1.26 -4.66 113.70 119.67 1oa9 s SER 30 Ca 0.68 -0.77 0.03 0.00 1.31 0.00 0.00 55.95 57.20 1oa9 s SER 30 Cb -0.45 -0.67 -0.04 0.00 0.21 0.00 0.00 66.02 65.08 1oa9 s SER 30 CO 0.52 -0.48 -0.08 0.00 0.41 0.00 0.00 173.24 173.60 1oa9 s ASP 32 N -2.82 3.16 0.62 0.00 1.47 -0.02 0.10 116.67 119.18 1oa9 s ASP 32 Ca 0.09 0.06 0.31 0.00 1.18 0.00 0.00 52.55 54.20 1oa9 s ASP 32 Cb 0.02 -0.10 1.71 0.00 -0.34 0.00 0.00 42.92 44.21 1oa9 s ASP 32 CO -0.02 -2.69 2.06 0.00 0.68 0.00 0.00 175.17 175.19 1oa9 h ALA 33 N -1.51 1.68 -0.68 2.11 0.00 -1.90 0.03 119.26 118.98 1oa9 h ALA 33 Ca -0.42 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.25 1oa9 h ALA 33 Cb 1.23 0.01 -0.13 0.00 0.00 0.00 0.00 17.79 18.90 1oa9 h ALA 33 CO 0.35 -0.34 0.29 0.09 0.00 0.00 0.00 179.25 179.63 1oa9 n ASN 34 N -3.50 4.36 -2.32 0.00 3.02 -1.26 -4.87 115.26 110.68 1oa9 n ASN 34 Ca 0.01 -3.10 -0.19 0.00 -0.03 0.00 0.00 54.58 51.28 1oa9 n ASN 34 Cb 0.37 -0.73 -0.02 0.00 -0.61 0.00 0.00 39.78 38.79 1oa9 n ASN 34 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1oa9 n PHE 35 N -0.20 -0.98 -4.36 3.10 3.01 -0.00 -4.99 117.46 113.04 1oa9 n PHE 35 Ca 0.38 0.00 -0.34 0.00 1.01 0.00 0.00 57.45 58.50 1oa9 n PHE 35 Cb 1.29 -3.70 -0.11 0.00 -0.01 0.00 0.00 39.48 36.96 1oa9 n PHE 35 CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 1oa9 s GLN 36 N -4.90 3.50 0.29 -1.08 -0.21 -1.26 -4.81 119.66 111.19 1oa9 s GLN 36 Ca 0.00 -0.47 -0.28 0.00 0.02 0.00 0.00 55.36 54.63 1oa9 s GLN 36 Cb 0.00 -2.90 -0.14 0.00 1.00 0.00 0.00 33.01 30.96 1oa9 s GLN 36 CO 0.00 0.38 0.96 0.54 -2.12 0.00 0.00 175.29 175.05 1oa9 n ARG 37 N 3.12 1.21 -4.18 2.91 1.74 -1.26 -0.84 116.66 119.37 1oa9 n ARG 37 Ca -0.18 0.43 -0.35 0.00 -0.77 0.00 0.00 57.85 56.98 1oa9 n ARG 37 Cb 0.53 -1.76 -0.09 0.00 -1.02 0.00 0.00 32.46 30.12 1oa9 n ARG 37 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1oa9 s ILE 38 N -1.07 4.70 0.18 0.55 1.01 0.09 -4.77 121.20 121.89 1oa9 s ILE 38 Ca 0.59 -0.09 0.00 0.00 0.00 0.00 0.00 60.65 61.15 1oa9 s ILE 38 Cb -0.72 -3.02 -0.11 0.00 0.01 0.00 0.00 42.46 38.62 1oa9 s ILE 38 CO 0.60 0.58 1.43 0.45 0.00 0.00 0.00 174.94 178.00 1oa9 h HIS 39 N 5.42 0.46 -3.60 3.97 3.86 -1.94 -3.41 115.15 119.91 1oa9 h HIS 39 Ca -0.49 -0.21 -0.62 0.00 -1.16 0.00 0.00 60.37 57.89 1oa9 h HIS 39 Cb 1.20 -0.07 -0.12 0.00 1.06 0.00 0.00 27.41 29.48 1oa9 h HIS 39 CO 0.65 0.97 0.36 0.34 0.86 0.00 0.00 177.93 181.11 1oa9 s ASP 40 N -6.96 6.45 0.02 2.45 2.15 -1.26 -4.91 116.67 114.60 1oa9 s ASP 40 Ca -0.05 0.02 0.27 0.00 0.43 0.00 0.00 52.55 53.22 1oa9 s ASP 40 Cb 0.10 -2.39 1.14 0.00 -0.30 0.00 0.00 42.92 41.48 1oa9 s ASP 40 CO 0.83 -0.86 1.87 0.49 -0.17 0.00 0.00 175.17 177.33 1oa9 n PHE 41 N 6.64 0.08 1.19 -5.34 3.01 -1.26 -2.74 117.46 119.04 1oa9 n PHE 41 Ca 0.02 0.02 0.13 0.00 1.01 0.00 0.00 57.45 58.64 1oa9 n PHE 41 Cb 0.48 -0.54 0.34 0.00 -0.01 0.00 0.00 39.48 39.75 1oa9 n PHE 41 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1oa9 n ASP 42 N -1.57 0.96 -4.55 4.37 9.92 -1.26 -4.52 116.55 119.90 1oa9 n ASP 42 Ca 0.07 -0.80 -0.41 0.00 -0.53 0.00 0.00 54.79 53.12 1oa9 n ASP 42 Cb 0.33 0.17 0.01 0.00 -0.64 0.00 0.00 41.12 41.00 1oa9 n ASP 42 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1oa9 n ALA 43 N -0.79 -0.48 -2.10 2.24 0.00 -1.11 -4.93 120.51 113.34 1oa9 n ALA 43 Ca 0.11 0.18 -0.41 0.00 0.00 0.00 0.00 53.44 53.32 1oa9 n ALA 43 Cb 0.35 -1.96 -0.04 0.00 0.00 0.00 0.00 19.45 17.79 1oa9 n ALA 43 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1oa9 s VAL 44 N -1.38 4.05 0.38 0.00 1.01 -1.26 -4.81 120.40 118.39 1oa9 s VAL 44 Ca 0.65 1.76 -0.28 0.00 0.00 0.00 0.00 61.98 64.11 1oa9 s VAL 44 Cb -0.56 -4.13 -0.10 0.00 0.00 0.00 0.00 36.38 31.59 1oa9 s VAL 44 CO 0.56 0.30 1.46 -0.55 0.00 0.00 0.00 175.10 176.87 1oa9 s SER 45 N -0.13 6.31 0.44 3.32 0.15 -1.26 -0.73 113.70 121.80 1oa9 s SER 45 Ca 0.48 3.00 0.31 0.00 0.70 0.00 0.00 55.95 60.44 1oa9 s SER 45 Cb -0.28 -2.66 1.47 0.00 -1.71 0.00 0.00 66.02 62.84 1oa9 s SER 45 CO 0.33 -0.89 1.92 1.23 1.20 0.00 0.00 173.24 177.03 1oa9 h GLY 46 N 2.93 0.00 -0.41 9.45 0.00 -0.33 0.44 103.07 115.15 1oa9 h GLY 46 Ca -0.51 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.82 1oa9 h GLY 46 CO 0.64 0.00 0.00 0.00 0.00 0.00 0.00 176.54 177.18 1oa9 n GLU 48 N 0.05 2.79 -0.36 0.00 4.07 0.12 -4.96 120.64 122.36 1oa9 n GLU 48 Ca 0.17 -1.44 0.00 0.00 -0.06 0.00 0.00 57.16 55.83 1oa9 n GLU 48 Cb 0.29 -0.97 0.00 0.00 -0.06 0.00 0.00 31.44 30.70 1oa9 n GLU 48 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1oa9 n GLY 49 N -0.47 0.80 0.00 8.31 0.00 -0.98 -4.90 105.19 107.95 1oa9 n GLY 49 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1oa9 n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oa9 n GLY 50 N -2.00 -0.16 0.91 -0.02 0.00 0.71 -4.92 105.19 99.71 1oa9 n GLY 50 Ca 0.00 -1.82 0.12 0.00 0.00 0.00 0.00 46.02 44.32 1oa9 n GLY 50 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1oa9 n PRO 51 N -1.00 2.19 -3.08 1.61 -0.04 -0.86 -3.63 135.00 130.18 1oa9 n PRO 51 Ca 0.00 -1.84 -0.43 0.00 -0.04 0.00 0.00 63.50 61.19 1oa9 n PRO 51 Cb 0.00 -1.45 -0.06 0.00 -0.04 0.00 0.00 33.50 31.95 1oa9 n PRO 51 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1oa9 s ALA 52 N -1.98 3.35 0.43 0.55 0.00 0.09 -4.18 121.76 120.01 1oa9 s ALA 52 Ca 0.27 -1.13 0.07 0.00 0.00 0.00 0.00 51.96 51.17 1oa9 s ALA 52 Cb 0.19 -3.32 -0.05 0.00 0.00 0.00 0.00 23.12 19.94 1oa9 s ALA 52 CO 0.31 -1.76 0.14 -0.06 0.00 0.00 0.00 175.76 174.39 1oa9 s PHE 53 N 2.90 2.45 0.17 0.00 0.40 0.12 0.19 117.98 124.20 1oa9 s PHE 53 Ca 0.24 -0.66 -0.30 0.00 -0.60 0.00 0.00 56.93 55.61 1oa9 s PHE 53 Cb -0.14 -1.88 -0.07 0.00 0.51 0.00 0.00 43.02 41.44 1oa9 s PHE 53 CO 0.19 0.20 1.06 0.45 0.70 0.00 0.00 175.22 177.83 1oa9 s SER 54 N -3.88 7.34 0.13 1.36 0.15 0.50 -0.51 113.70 118.78 1oa9 s SER 54 Ca 0.36 2.02 -0.30 0.00 0.70 0.00 0.00 55.95 58.73 1oa9 s SER 54 Cb 0.05 -2.60 -0.07 0.00 -1.71 0.00 0.00 66.02 61.69 1oa9 s SER 54 CO 0.20 -0.17 1.13 0.00 1.20 0.00 0.00 173.24 175.60 1oa9 h ALA 56 N 5.71 1.22 0.00 0.00 0.00 -1.89 -1.19 119.26 123.11 1oa9 h ALA 56 Ca -0.43 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1oa9 h ALA 56 Cb 1.21 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1oa9 h ALA 56 CO 0.75 0.09 0.00 -0.40 0.00 0.00 0.00 179.25 179.69 1oa9 n ASP 57 N -3.48 0.03 -2.55 0.00 5.68 -1.26 -3.29 116.55 111.67 1oa9 n ASP 57 Ca -0.02 0.50 -0.25 0.00 -0.50 0.00 0.00 54.79 54.52 1oa9 n ASP 57 Cb 0.20 -0.51 -0.08 0.00 -1.14 0.00 0.00 41.12 39.59 1oa9 n ASP 57 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 1oa9 n HIS 58 N -1.53 1.32 -4.26 2.11 8.25 -0.45 -4.87 115.22 115.80 1oa9 n HIS 58 Ca 0.05 -2.03 -0.28 0.00 -0.26 0.00 0.00 57.72 55.21 1oa9 n HIS 58 Cb 0.26 -1.61 -0.09 0.00 1.12 0.00 0.00 29.99 29.68 1oa9 n HIS 58 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 1oa9 s SER 59 N 1.01 4.35 0.47 0.41 0.01 -1.21 -4.70 113.70 114.04 1oa9 s SER 59 Ca 0.62 -0.50 -0.21 0.00 1.31 0.00 0.00 55.95 57.17 1oa9 s SER 59 Cb 0.32 -0.79 -0.08 0.00 0.21 0.00 0.00 66.02 65.68 1oa9 s SER 59 CO -0.12 0.12 1.05 -2.16 0.41 0.00 0.00 173.24 172.54 1oa9 s PRO 60 N -2.65 3.83 0.00 12.44 0.04 -1.26 -4.75 135.00 142.66 1oa9 s PRO 60 Ca 0.24 1.42 -0.21 0.00 0.04 0.00 0.00 61.00 62.49 1oa9 s PRO 60 Cb -0.10 -2.18 0.04 0.00 0.04 0.00 0.00 34.50 32.31 1oa9 s PRO 60 CO 0.15 -0.42 0.47 1.67 0.04 0.00 0.00 177.00 178.91 1oa9 s TRP 61 N -1.89 -0.37 0.07 0.56 -2.14 -0.62 -4.56 118.94 109.99 1oa9 s TRP 61 Ca 0.66 0.51 -0.26 0.00 2.66 0.00 0.00 56.10 59.66 1oa9 s TRP 61 Cb -0.18 0.25 -0.06 0.00 -3.10 0.00 0.00 33.47 30.38 1oa9 s TRP 61 CO 0.22 -0.54 0.82 0.00 -2.66 0.00 0.00 176.95 174.80 1oa9 s ALA 62 N -1.80 3.34 -0.20 2.67 0.00 -1.26 -1.29 121.76 123.22 1oa9 s ALA 62 Ca -0.09 0.37 -0.19 0.00 0.00 0.00 0.00 51.96 52.05 1oa9 s ALA 62 Cb -0.02 -3.08 -0.16 0.00 0.00 0.00 0.00 23.12 19.86 1oa9 s ALA 62 CO 0.03 0.05 0.14 0.82 0.00 0.00 0.00 175.76 176.80 1oa9 h ILE 63 N 4.05 0.75 -2.96 0.00 1.08 -0.66 -3.48 117.51 116.29 1oa9 h ILE 63 Ca -0.44 -1.97 -0.12 0.00 -0.39 0.00 0.00 64.86 61.94 1oa9 h ILE 63 Cb 1.21 1.82 -0.03 0.00 -3.07 0.00 0.00 36.82 36.75 1oa9 h ILE 63 CO 0.71 0.25 -0.04 -0.46 -0.69 0.00 0.00 178.15 177.92 1oa9 n ASN 64 N -4.47 -0.79 0.30 1.72 0.23 -0.90 -4.99 115.26 106.36 1oa9 n ASN 64 Ca -0.28 -1.96 0.20 0.00 -0.53 0.00 0.00 54.58 52.01 1oa9 n ASN 64 Cb 0.61 1.44 1.02 0.00 -2.08 0.00 0.00 39.78 40.77 1oa9 n ASN 64 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1oa9 h ASP 65 N 1.03 0.00 -0.00 0.53 3.32 -2.02 -2.70 116.42 116.59 1oa9 h ASP 65 Ca -0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.90 1oa9 h ASP 65 Cb 0.62 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.17 1oa9 h ASP 65 CO 0.20 0.00 -0.40 0.59 -1.72 0.00 0.00 179.24 177.90 1oa9 n ASN 66 N -2.94 0.95 -3.84 6.45 3.02 -1.26 -4.99 115.26 112.64 1oa9 n ASN 66 Ca -0.02 -0.97 -0.12 0.00 -0.03 0.00 0.00 54.58 53.43 1oa9 n ASN 66 Cb 0.11 0.74 -0.14 0.00 -0.61 0.00 0.00 39.78 39.89 1oa9 n ASN 66 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1oa9 s LEU 67 N -2.17 1.72 0.12 3.41 2.96 -1.02 -0.72 118.68 122.99 1oa9 s LEU 67 Ca 0.07 0.10 0.03 0.00 -0.22 0.00 0.00 54.13 54.12 1oa9 s LEU 67 Cb 0.09 0.16 -0.04 0.00 0.50 0.00 0.00 46.19 46.90 1oa9 s LEU 67 CO 0.39 -0.03 -0.09 -0.44 -1.32 0.00 0.00 176.35 174.87 1oa9 s SER 68 N 0.14 1.46 0.16 3.68 0.01 -0.79 0.12 113.70 118.48 1oa9 s SER 68 Ca -0.01 -0.97 0.08 0.00 1.31 0.00 0.00 55.95 56.36 1oa9 s SER 68 Cb -0.02 0.04 -0.04 0.00 0.21 0.00 0.00 66.02 66.21 1oa9 s SER 68 CO -0.00 -0.37 -0.09 -0.31 0.41 0.00 0.00 173.24 172.88 1oa9 s TYR 69 N -3.29 2.68 0.00 2.43 2.02 -0.41 -1.49 117.35 119.29 1oa9 s TYR 69 Ca 0.13 -0.20 0.00 0.00 -0.37 0.00 0.00 57.07 56.63 1oa9 s TYR 69 Cb 0.03 -1.33 0.00 0.00 -0.40 0.00 0.00 41.96 40.26 1oa9 s TYR 69 CO -0.02 0.49 0.00 0.41 -1.57 0.00 0.00 175.55 174.87 1oa9 n GLY 70 N 0.16 1.79 3.11 0.71 0.00 -0.20 -1.59 105.19 109.17 1oa9 n GLY 70 Ca -0.11 -0.75 -0.08 0.00 0.00 0.00 0.00 46.02 45.08 1oa9 n GLY 70 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1oa9 s PHE 71 N -3.52 0.52 -0.01 1.61 0.40 -1.26 -1.66 117.98 114.06 1oa9 s PHE 71 Ca 0.00 -1.03 -0.28 0.00 -0.60 0.00 0.00 56.93 55.01 1oa9 s PHE 71 Cb 0.00 -0.36 0.10 0.00 0.51 0.00 0.00 43.02 43.26 1oa9 s PHE 71 CO 0.00 -0.42 0.82 0.00 0.70 0.00 0.00 175.22 176.32 1oa9 s ALA 72 N -3.93 -1.79 -0.14 5.36 0.00 -1.10 -0.88 121.76 119.28 1oa9 s ALA 72 Ca 0.09 1.06 -0.19 0.00 0.00 0.00 0.00 51.96 52.92 1oa9 s ALA 72 Cb 0.08 0.23 -0.04 0.00 0.00 0.00 0.00 23.12 23.39 1oa9 s ALA 72 CO -0.09 -0.58 0.53 0.00 0.00 0.00 0.00 175.76 175.62 1oa9 s ALA 73 N -2.58 3.48 0.20 0.00 0.00 0.14 -2.25 121.76 120.75 1oa9 s ALA 73 Ca 0.01 -0.20 0.10 0.00 0.00 0.00 0.00 51.96 51.86 1oa9 s ALA 73 Cb -0.01 -2.75 -0.04 0.00 0.00 0.00 0.00 23.12 20.32 1oa9 s ALA 73 CO -0.05 -0.16 -0.16 0.95 0.00 0.00 0.00 175.76 176.35 1oa9 s THR 74 N 0.97 2.80 -0.20 0.00 -4.23 0.26 -0.98 115.64 114.26 1oa9 s THR 74 Ca 0.27 -1.90 -0.04 0.00 -1.18 0.00 0.00 61.69 58.84 1oa9 s THR 74 Cb -0.16 -2.38 0.10 0.00 1.34 0.00 0.00 72.50 71.40 1oa9 s THR 74 CO 0.11 -0.16 0.28 0.00 -0.54 0.00 0.00 174.62 174.31 1oa9 s ALA 75 N -1.81 -0.58 -0.08 3.99 0.00 -0.72 -1.16 121.76 121.41 1oa9 s ALA 75 Ca 0.24 0.63 0.02 0.00 0.00 0.00 0.00 51.96 52.86 1oa9 s ALA 75 Cb -0.08 -1.34 -0.02 0.00 0.00 0.00 0.00 23.12 21.68 1oa9 s ALA 75 CO 0.13 -1.07 -0.14 -0.51 0.00 0.00 0.00 175.76 174.17 1oa9 s LEU 76 N 2.42 2.72 -0.26 0.00 1.43 -1.25 -0.56 118.68 123.17 1oa9 s LEU 76 Ca 0.07 -0.24 -0.41 0.00 -1.03 0.00 0.00 54.13 52.51 1oa9 s LEU 76 Cb -0.15 -1.57 -0.17 0.00 0.03 0.00 0.00 46.19 44.33 1oa9 s LEU 76 CO -0.12 0.29 1.61 -1.20 0.23 0.00 0.00 176.35 177.16 1oa9 n SER 77 N 2.70 1.88 -0.33 2.29 7.64 -0.95 -1.20 113.62 125.64 1oa9 n SER 77 Ca -0.17 1.11 -0.04 0.00 1.01 0.00 0.00 58.87 60.77 1oa9 n SER 77 Cb 0.52 -1.08 -0.02 0.00 -1.01 0.00 0.00 64.21 62.63 1oa9 n SER 77 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1oa9 n GLY 78 N 3.75 0.40 3.91 0.23 0.00 -1.26 -4.96 105.19 107.26 1oa9 n GLY 78 Ca 0.26 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.07 1oa9 n GLY 78 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1oa9 s GLN 79 N -2.26 2.51 0.45 1.61 -0.21 -0.34 -5.14 119.66 116.27 1oa9 s GLN 79 Ca 0.00 -1.57 0.05 0.00 0.02 0.00 0.00 55.36 53.85 1oa9 s GLN 79 Cb 0.00 -2.42 -0.05 0.00 1.00 0.00 0.00 33.01 31.54 1oa9 s GLN 79 CO 0.00 -0.33 0.01 0.95 -2.12 0.00 0.00 175.29 173.80 1oa9 s THR 80 N -2.52 1.63 0.41 -0.19 -4.23 -1.26 -4.78 115.64 104.70 1oa9 s THR 80 Ca 0.48 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 59.09 1oa9 s THR 80 Cb -0.04 -2.65 0.29 0.00 1.34 0.00 0.00 72.50 71.44 1oa9 s THR 80 CO 0.29 0.00 2.02 -0.08 -0.54 0.00 0.00 174.62 176.30 1oa9 h GLU 81 N 1.61 0.53 0.00 3.99 4.81 -1.97 -2.40 114.58 121.15 1oa9 h GLU 81 Ca -0.44 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 58.75 1oa9 h GLU 81 Cb 1.27 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 30.53 1oa9 h GLU 81 CO 0.78 0.35 -0.03 0.93 -0.73 0.00 0.00 179.01 180.30 1oa9 h GLU 82 N 0.54 0.00 0.00 1.92 5.08 -1.95 -2.00 114.58 118.18 1oa9 h GLU 82 Ca 0.22 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 1oa9 h GLU 82 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1oa9 h GLU 82 CO -0.06 0.03 -0.67 -1.13 -1.00 0.00 0.00 179.01 176.18 1oa9 n SER 83 N -3.63 0.61 0.00 1.42 3.41 -0.90 -4.49 113.62 110.03 1oa9 n SER 83 Ca -0.03 -0.32 0.00 0.00 -0.26 0.00 0.00 58.87 58.27 1oa9 n SER 83 Cb 0.13 0.44 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 1oa9 n SER 83 CO 0.00 0.00 0.00 -2.67 -0.16 0.00 0.00 175.04 172.21 1oa9 n TRP 84 N -1.64 0.00 -1.68 7.33 2.14 -1.00 -4.86 117.44 117.74 1oa9 n TRP 84 Ca 0.04 0.00 -0.43 0.00 2.07 0.00 0.00 57.50 59.19 1oa9 n TRP 84 Cb 0.36 0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 30.83 1oa9 n TRP 84 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1oa9 s ALA 87 N -2.17 3.11 0.07 0.00 0.00 -0.40 -4.48 121.76 117.89 1oa9 s ALA 87 Ca 0.00 0.25 0.05 0.00 0.00 0.00 0.00 51.96 52.26 1oa9 s ALA 87 Cb 0.00 -3.06 -0.04 0.00 0.00 0.00 0.00 23.12 20.03 1oa9 s ALA 87 CO 0.00 0.06 -0.05 0.00 0.00 0.00 0.00 175.76 175.78 1oa9 s TYR 89 N -1.19 0.48 -0.28 0.00 1.51 0.52 -0.99 117.35 117.39 1oa9 s TYR 89 Ca 0.22 -0.09 -0.21 0.00 -1.01 0.00 0.00 57.07 55.99 1oa9 s TYR 89 Cb -0.11 -0.44 -0.01 0.00 -0.11 0.00 0.00 41.96 41.28 1oa9 s TYR 89 CO 0.14 -0.11 0.65 0.00 -1.11 0.00 0.00 175.55 175.11 1oa9 s ALA 90 N 0.64 3.56 -0.10 3.71 0.00 -0.41 -1.16 121.76 128.01 1oa9 s ALA 90 Ca -0.07 -0.54 -0.03 0.00 0.00 0.00 0.00 51.96 51.32 1oa9 s ALA 90 Cb -0.10 -3.09 -0.04 0.00 0.00 0.00 0.00 23.12 19.89 1oa9 s ALA 90 CO -0.01 -0.98 0.04 -0.51 0.00 0.00 0.00 175.76 174.30 1oa9 s LEU 91 N 2.60 3.78 -0.24 0.00 1.43 -0.51 -2.79 118.68 122.95 1oa9 s LEU 91 Ca 0.26 0.21 0.01 0.00 -1.03 0.00 0.00 54.13 53.59 1oa9 s LEU 91 Cb -0.15 -1.89 0.06 0.00 0.03 0.00 0.00 46.19 44.24 1oa9 s LEU 91 CO 0.10 0.37 -0.07 -0.89 0.23 0.00 0.00 176.35 176.09 1oa9 s THR 92 N -0.80 1.73 0.29 5.49 2.01 -0.08 -0.88 115.64 123.39 1oa9 s THR 92 Ca 0.13 -1.34 -0.30 0.00 0.31 0.00 0.00 61.69 60.49 1oa9 s THR 92 Cb -0.12 -1.94 -0.11 0.00 0.01 0.00 0.00 72.50 70.35 1oa9 s THR 92 CO 0.03 -0.07 1.46 -0.36 -0.69 0.00 0.00 174.62 174.99 1oa9 s PHE 93 N 1.31 2.90 -0.71 4.92 0.40 -0.91 -1.13 117.98 124.77 1oa9 s PHE 93 Ca -0.07 1.04 0.07 0.00 -0.60 0.00 0.00 56.93 57.38 1oa9 s PHE 93 Cb -0.19 -3.89 0.16 0.00 0.51 0.00 0.00 43.02 39.61 1oa9 s PHE 93 CO -0.06 -2.82 1.03 0.25 0.70 0.00 0.00 175.22 174.32 1oa9 n THR 94 N 1.83 0.68 -3.62 0.64 -2.24 -0.31 -0.81 114.28 110.45 1oa9 n THR 94 Ca 0.05 -0.84 -0.10 0.00 -2.27 0.00 0.00 64.05 60.89 1oa9 n THR 94 Cb 0.40 0.71 -0.03 0.00 -2.10 0.00 0.00 70.33 69.30 1oa9 n THR 94 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1oa9 s SER 95 N -0.88 -0.35 0.00 3.42 1.04 -1.25 -4.90 113.70 110.78 1oa9 s SER 95 Ca 0.13 -0.30 0.00 0.00 0.48 0.00 0.00 55.95 56.26 1oa9 s SER 95 Cb 0.07 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.76 1oa9 s SER 95 CO 0.10 -1.00 0.00 0.61 0.98 0.00 0.00 173.24 173.93 1oa9 n GLY 96 N -0.33 -3.07 0.15 7.32 0.00 -1.26 -3.81 105.19 104.19 1oa9 n GLY 96 Ca -0.13 -1.77 0.12 0.00 0.00 0.00 0.00 46.02 44.24 1oa9 n GLY 96 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1oa9 h PRO 97 N 0.00 0.00 -0.44 1.61 0.13 -1.90 -2.76 132.00 128.64 1oa9 h PRO 97 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1oa9 h PRO 97 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1oa9 h PRO 97 CO 0.00 0.00 0.00 1.33 -0.23 0.00 0.00 178.00 179.10 1oa9 n VAL 98 N -2.30 0.70 -1.58 1.56 0.24 -1.26 -5.01 118.33 110.68 1oa9 n VAL 98 Ca 0.01 -0.85 -0.53 0.00 -2.04 0.00 0.00 64.34 60.93 1oa9 n VAL 98 Cb 0.15 0.78 -0.06 0.00 -1.47 0.00 0.00 33.84 33.24 1oa9 n VAL 98 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1oa9 n ALA 99 N 1.27 -1.36 0.00 2.33 0.00 -1.04 -0.29 120.51 121.41 1oa9 n ALA 99 Ca 0.18 0.53 0.00 0.00 0.00 0.00 0.00 53.44 54.15 1oa9 n ALA 99 Cb 0.55 -2.03 0.00 0.00 0.00 0.00 0.00 19.45 17.97 1oa9 n ALA 99 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oa9 n GLY 100 N 2.35 3.41 3.85 0.00 0.00 0.01 -4.99 105.19 109.82 1oa9 n GLY 100 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 1oa9 n GLY 100 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oa9 s LYS 101 N -0.83 3.86 0.11 1.61 1.02 0.60 -4.84 119.74 121.27 1oa9 s LYS 101 Ca 0.00 0.90 0.11 0.00 0.02 0.00 0.00 55.97 57.00 1oa9 s LYS 101 Cb 0.00 -2.12 -0.04 0.00 -0.52 0.00 0.00 37.83 35.15 1oa9 s LYS 101 CO 0.00 -0.35 -0.27 0.99 -0.92 0.00 0.00 175.35 174.81 1oa9 s THR 102 N -2.77 2.23 -0.16 2.17 2.01 0.10 -2.13 115.64 117.09 1oa9 s THR 102 Ca 0.58 -1.65 -0.04 0.00 0.31 0.00 0.00 61.69 60.88 1oa9 s THR 102 Cb -0.10 -1.96 0.08 0.00 0.01 0.00 0.00 72.50 70.53 1oa9 s THR 102 CO 0.37 0.17 0.20 -0.32 -0.69 0.00 0.00 174.62 174.35 1oa9 s MET 103 N -1.83 0.14 -0.33 4.92 1.75 -0.06 -1.89 119.30 122.00 1oa9 s MET 103 Ca 0.13 0.33 -0.24 0.00 -1.25 0.00 0.00 55.69 54.67 1oa9 s MET 103 Cb -0.10 -0.89 0.01 0.00 2.84 0.00 0.00 34.83 36.68 1oa9 s MET 103 CO 0.05 -0.53 0.82 0.08 -0.65 0.00 0.00 175.02 174.79 1oa9 s VAL 104 N 2.32 4.74 0.14 10.11 1.01 -0.56 -1.42 120.40 136.73 1oa9 s VAL 104 Ca 0.05 1.16 0.09 0.00 0.00 0.00 0.00 61.98 63.28 1oa9 s VAL 104 Cb -0.14 -4.20 -0.04 0.00 0.00 0.00 0.00 36.38 31.99 1oa9 s VAL 104 CO -0.10 -0.34 -0.15 0.68 0.00 0.00 0.00 175.10 175.19 1oa9 s VAL 105 N 3.09 2.99 -0.14 2.92 -7.23 -0.30 -1.03 120.40 120.70 1oa9 s VAL 105 Ca 0.34 -1.55 -0.02 0.00 -1.81 0.00 0.00 61.98 58.94 1oa9 s VAL 105 Cb -0.14 -2.41 -0.02 0.00 0.56 0.00 0.00 36.38 34.37 1oa9 s VAL 105 CO 0.14 0.02 -0.09 -1.58 -0.31 0.00 0.00 175.10 173.29 1oa9 s GLN 106 N -2.39 3.48 -0.21 4.82 0.74 -0.66 -0.35 119.66 125.08 1oa9 s GLN 106 Ca 0.21 -0.60 -0.29 0.00 0.05 0.00 0.00 55.36 54.72 1oa9 s GLN 106 Cb -0.10 -2.76 -0.01 0.00 1.10 0.00 0.00 33.01 31.25 1oa9 s GLN 106 CO 0.12 0.25 1.29 -1.12 -0.55 0.00 0.00 175.29 175.29 1oa9 s SER 107 N 0.29 6.83 -0.00 6.67 0.01 -0.22 -2.70 113.70 124.56 1oa9 s SER 107 Ca -0.07 1.52 0.07 0.00 1.31 0.00 0.00 55.95 58.79 1oa9 s SER 107 Cb -0.15 -2.54 -0.09 0.00 0.21 0.00 0.00 66.02 63.46 1oa9 s SER 107 CO 0.04 -0.89 0.25 0.35 0.41 0.00 0.00 173.24 173.40 1oa9 n THR 108 N 5.71 0.00 -4.11 1.44 -2.24 -0.95 0.46 114.28 114.58 1oa9 n THR 108 Ca 0.14 -0.28 -0.15 0.00 -2.27 0.00 0.00 64.05 61.50 1oa9 n THR 108 Cb 0.45 0.77 -0.05 0.00 -2.10 0.00 0.00 70.33 69.41 1oa9 n THR 108 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1oa9 s SER 109 N -2.05 0.93 -0.13 3.42 0.15 -1.23 -0.48 113.70 114.31 1oa9 s SER 109 Ca 0.01 -1.49 0.02 0.00 0.70 0.00 0.00 55.95 55.19 1oa9 s SER 109 Cb 0.05 0.64 -0.00 0.00 -1.71 0.00 0.00 66.02 65.00 1oa9 s SER 109 CO 0.29 -1.25 -0.19 -0.89 1.20 0.00 0.00 173.24 172.40 1oa9 s THR 110 N -3.18 2.48 0.43 6.45 2.01 -1.26 -0.58 115.64 122.00 1oa9 s THR 110 Ca 0.32 -0.85 -0.13 0.00 0.31 0.00 0.00 61.69 61.33 1oa9 s THR 110 Cb 0.00 -2.01 -0.07 0.00 0.01 0.00 0.00 72.50 70.43 1oa9 s THR 110 CO 0.20 0.54 0.83 -0.83 -0.69 0.00 0.00 174.62 174.67 1oa9 s GLY 111 N 0.53 2.02 -0.82 4.40 0.00 -0.31 -4.74 107.32 108.39 1oa9 s GLY 111 Ca -0.12 -0.06 -0.04 0.00 0.00 0.00 0.00 44.72 44.50 1oa9 s GLY 111 CO 0.04 0.15 2.46 0.61 0.00 0.00 0.00 173.10 176.37 1oa9 n GLY 112 N -1.28 4.95 3.10 0.20 0.00 -1.26 -4.67 105.19 106.22 1oa9 n GLY 112 Ca 0.04 -2.09 -0.26 0.00 0.00 0.00 0.00 46.02 43.70 1oa9 n GLY 112 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1oa9 s ASP 113 N -0.02 2.12 0.22 1.61 -1.08 -1.26 -5.14 116.67 113.12 1oa9 s ASP 113 Ca 0.55 -0.36 0.10 0.00 -0.52 0.00 0.00 52.55 52.32 1oa9 s ASP 113 Cb 0.31 -0.81 -0.04 0.00 -1.46 0.00 0.00 42.92 40.92 1oa9 s ASP 113 CO -0.20 0.10 -0.11 -0.76 0.52 0.00 0.00 175.17 174.72 1oa9 s LEU 114 N 0.35 2.88 -1.62 -1.34 1.43 -1.26 -4.69 118.68 114.43 1oa9 s LEU 114 Ca -0.11 -0.71 -0.02 0.00 -1.03 0.00 0.00 54.13 52.26 1oa9 s LEU 114 Cb -0.14 -1.51 0.00 0.00 0.03 0.00 0.00 46.19 44.57 1oa9 s LEU 114 CO 0.04 0.07 0.23 0.61 0.23 0.00 0.00 176.35 177.53 1oa9 n GLY 115 N -0.26 -0.46 3.44 -3.19 0.00 -1.26 -4.97 105.19 98.48 1oa9 n GLY 115 Ca -0.09 0.01 -0.11 0.00 0.00 0.00 0.00 46.02 45.83 1oa9 n GLY 115 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1oa9 s SER 116 N -2.35 -0.43 -0.52 1.61 0.15 -1.26 -4.92 113.70 105.99 1oa9 s SER 116 Ca 0.12 -0.18 -0.13 0.00 0.70 0.00 0.00 55.95 56.45 1oa9 s SER 116 Cb -0.05 0.58 0.13 0.00 -1.71 0.00 0.00 66.02 64.96 1oa9 s SER 116 CO 0.14 -0.98 0.44 0.20 1.20 0.00 0.00 173.24 174.25 1oa9 s ASN 117 N -2.79 6.00 -0.08 5.45 0.01 -1.26 -2.24 114.94 120.03 1oa9 s ASN 117 Ca 0.03 -1.88 0.03 0.00 -0.71 0.00 0.00 52.86 50.34 1oa9 s ASN 117 Cb -0.01 -2.13 0.01 0.00 0.41 0.00 0.00 41.25 39.53 1oa9 s ASN 117 CO -0.10 -0.78 -0.17 -2.28 -1.51 0.00 0.00 177.10 172.26 1oa9 s HIS 118 N 1.45 1.92 -0.24 2.20 2.46 0.27 -1.73 115.29 121.62 1oa9 s HIS 118 Ca 0.05 -0.74 0.03 0.00 0.47 0.00 0.00 55.06 54.86 1oa9 s HIS 118 Cb -0.28 -1.34 0.05 0.00 -0.13 0.00 0.00 32.58 30.89 1oa9 s HIS 118 CO 0.01 -0.33 -0.13 -0.06 -2.47 0.00 0.00 174.74 171.76 1oa9 s PHE 119 N 0.50 3.16 -0.63 3.88 0.40 -0.83 -1.75 117.98 122.71 1oa9 s PHE 119 Ca -0.16 -2.19 -0.19 0.00 -0.60 0.00 0.00 56.93 53.80 1oa9 s PHE 119 Cb -0.16 -1.93 0.11 0.00 0.51 0.00 0.00 43.02 41.55 1oa9 s PHE 119 CO 0.06 -0.86 0.74 0.34 0.70 0.00 0.00 175.22 176.19 1oa9 s ASP 120 N 1.14 6.25 0.24 1.36 3.68 -0.16 -2.20 116.67 126.99 1oa9 s ASP 120 Ca -0.06 -1.56 -0.30 0.00 2.13 0.00 0.00 52.55 52.76 1oa9 s ASP 120 Cb -0.19 -2.30 -0.10 0.00 -1.45 0.00 0.00 42.92 38.88 1oa9 s ASP 120 CO -0.07 -1.08 1.51 -0.76 0.13 0.00 0.00 175.17 174.90 1oa9 s LEU 121 N 2.53 4.37 -0.28 -1.34 1.43 -0.53 -0.69 118.68 124.17 1oa9 s LEU 121 Ca 0.13 2.73 -0.29 0.00 -1.03 0.00 0.00 54.13 55.68 1oa9 s LEU 121 Cb -0.22 -3.62 -0.01 0.00 0.03 0.00 0.00 46.19 42.37 1oa9 s LEU 121 CO 0.04 -0.78 1.42 0.20 0.23 0.00 0.00 176.35 177.46 1oa9 s ASN 122 N 0.55 6.54 -0.17 2.29 0.02 -0.06 -1.37 114.94 122.74 1oa9 s ASN 122 Ca 0.62 1.31 -0.05 0.00 -1.02 0.00 0.00 52.86 53.73 1oa9 s ASN 122 Cb -0.44 -2.54 0.06 0.00 0.02 0.00 0.00 41.25 38.36 1oa9 s ASN 122 CO 0.42 -1.17 0.11 -0.63 0.02 0.00 0.00 177.10 175.84 1oa9 s ILE 123 N 4.76 -0.12 -0.14 0.60 1.01 0.10 -4.26 121.20 123.14 1oa9 s ILE 123 Ca 0.62 -0.13 -0.35 0.00 0.00 0.00 0.00 60.65 60.79 1oa9 s ILE 123 Cb -0.19 -0.57 -0.12 0.00 0.01 0.00 0.00 42.46 41.59 1oa9 s ILE 123 CO 0.26 -0.25 1.88 -2.65 0.00 0.00 0.00 174.94 174.18 1oa9 n PRO 124 N 5.29 1.96 -0.42 2.79 -0.02 -1.26 -0.00 135.00 143.34 1oa9 n PRO 124 Ca -0.07 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 1oa9 n PRO 124 Cb 0.49 -2.56 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 1oa9 n PRO 124 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1oa9 n GLY 125 N 4.48 0.75 0.04 -1.23 0.00 -1.26 -3.69 105.19 104.28 1oa9 n GLY 125 Ca 0.24 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.41 1oa9 n GLY 125 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oa9 n GLY 126 N -2.20 -1.17 0.00 -0.02 0.00 1.00 -1.34 105.19 101.46 1oa9 n GLY 126 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1oa9 n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oa9 n GLY 127 N 1.30 3.74 0.34 -0.02 0.00 -1.26 -1.95 105.19 107.33 1oa9 n GLY 127 Ca 0.14 -1.14 -0.02 0.00 0.00 0.00 0.00 46.02 45.00 1oa9 n GLY 127 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1oa9 h VAL 128 N 0.00 1.22 0.00 1.61 3.04 -1.47 -1.14 116.25 119.51 1oa9 h VAL 128 Ca 0.00 -0.59 0.00 0.00 -1.01 0.00 0.00 66.70 65.10 1oa9 h VAL 128 Cb 0.00 0.29 0.00 0.00 -2.01 0.00 0.00 31.29 29.57 1oa9 h VAL 128 CO 0.00 0.25 0.00 0.61 -1.01 0.00 0.00 177.57 177.42 1oa9 n GLY 129 N -1.15 0.27 0.05 3.17 0.00 0.52 -4.07 105.19 103.99 1oa9 n GLY 129 Ca 0.07 -1.05 -0.12 0.00 0.00 0.00 0.00 46.02 44.92 1oa9 n GLY 129 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1oa9 h LEU 130 N 0.00 -0.02-10.06 0.99 6.46 -1.93 -3.44 115.31 107.31 1oa9 h LEU 130 Ca 0.00 0.00 -0.49 0.00 -0.12 0.00 0.00 57.88 57.27 1oa9 h LEU 130 Cb 0.00 0.01 -0.04 0.00 -0.73 0.00 0.00 40.66 39.90 1oa9 h LEU 130 CO 0.00 -0.01 -0.44 -0.36 -0.62 0.00 0.00 178.44 177.01 1oa9 s PHE 131 N -6.19 2.92 -0.33 1.25 0.40 -1.26 -5.10 117.98 109.66 1oa9 s PHE 131 Ca -0.13 -0.30 -0.00 0.00 -0.60 0.00 0.00 56.93 55.90 1oa9 s PHE 131 Cb 0.06 -1.81 0.13 0.00 0.51 0.00 0.00 43.02 41.92 1oa9 s PHE 131 CO 0.66 0.18 0.24 0.34 0.70 0.00 0.00 175.22 177.33 1oa9 s ASP 132 N -4.00 2.58 0.00 1.36 2.15 -1.26 -4.75 116.67 112.74 1oa9 s ASP 132 Ca 0.41 -1.69 0.23 0.00 0.43 0.00 0.00 52.55 51.93 1oa9 s ASP 132 Cb -0.06 -0.09 0.20 0.00 -0.30 0.00 0.00 42.92 42.68 1oa9 s ASP 132 CO 0.27 -0.34 1.20 0.61 -0.17 0.00 0.00 175.17 176.74 1oa9 n GLY 133 N 4.51 -1.08 0.20 2.66 0.00 0.11 -4.20 105.19 107.38 1oa9 n GLY 133 Ca 0.06 -0.46 -0.03 0.00 0.00 0.00 0.00 46.02 45.59 1oa9 n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oa9 h THR 135 N 0.25 1.13 -0.61 0.00 2.02 -1.83 0.21 112.91 114.09 1oa9 h THR 135 Ca 0.02 -0.39 -0.09 0.00 0.77 0.00 0.00 66.41 66.73 1oa9 h THR 135 Cb 0.82 1.38 -0.02 0.00 -1.74 0.00 0.00 68.15 68.59 1oa9 h THR 135 CO 0.07 0.10 0.04 -0.65 0.37 0.00 0.00 175.52 175.45 1oa9 h PRO 136 N -0.15 1.03 -0.19 6.66 0.11 -1.76 0.40 132.00 138.11 1oa9 h PRO 136 Ca 0.00 -0.30 -0.01 0.00 0.11 0.00 0.00 66.00 65.81 1oa9 h PRO 136 Cb 0.16 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.16 1oa9 h PRO 136 CO -0.00 0.98 0.09 0.37 -0.21 0.00 0.00 178.00 179.23 1oa9 h GLN 137 N 0.95 0.27 0.00 1.05 4.15 -0.84 -3.40 115.11 117.29 1oa9 h GLN 137 Ca 0.18 -0.04 -0.06 0.00 0.77 0.00 0.00 58.65 59.50 1oa9 h GLN 137 Cb 0.50 -0.05 -0.09 0.00 0.21 0.00 0.00 27.48 28.04 1oa9 h GLN 137 CO 0.02 0.30 -0.33 1.97 -1.93 0.00 0.00 178.83 178.86 1oa9 n PHE 138 N -4.87 0.00 0.00 3.99 1.16 -0.65 -4.88 117.46 112.20 1oa9 n PHE 138 Ca -0.04 -0.21 0.00 0.00 -1.87 0.00 0.00 57.45 55.33 1oa9 n PHE 138 Cb 0.10 0.21 0.00 0.00 -1.61 0.00 0.00 39.48 38.17 1oa9 n PHE 138 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1oa9 n GLY 139 N 0.07 0.27 0.00 4.97 0.00 0.14 -4.99 105.19 105.66 1oa9 n GLY 139 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1oa9 n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oa9 n GLY 140 N -1.94 0.89 3.54 -0.02 0.00 0.65 -4.66 105.19 103.66 1oa9 n GLY 140 Ca 0.00 -1.86 -0.30 0.00 0.00 0.00 0.00 46.02 43.86 1oa9 n GLY 140 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1oa9 s LEU 141 N -0.95 2.92 0.92 0.99 1.43 -1.26 -4.84 118.68 117.89 1oa9 s LEU 141 Ca 0.00 -0.42 -0.14 0.00 -1.03 0.00 0.00 54.13 52.55 1oa9 s LEU 141 Cb 0.00 -1.73 0.15 0.00 0.03 0.00 0.00 46.19 44.64 1oa9 s LEU 141 CO 0.00 0.19 1.20 -2.16 0.23 0.00 0.00 176.35 175.81 1oa9 s PRO 142 N -2.06 1.05 0.00 1.29 0.04 -1.26 -4.99 135.00 129.06 1oa9 s PRO 142 Ca 0.20 0.00 0.00 0.00 0.04 0.00 0.00 61.00 61.24 1oa9 s PRO 142 Cb -0.11 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.58 1oa9 s PRO 142 CO 0.12 -2.20 0.00 0.41 0.04 0.00 0.00 177.00 175.36 1oa9 n GLY 143 N -2.89 2.42 3.75 0.56 0.00 -1.26 -4.18 105.19 103.59 1oa9 n GLY 143 Ca 0.10 -1.97 -0.34 0.00 0.00 0.00 0.00 46.02 43.80 1oa9 n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oa9 s ALA 144 N -2.69 2.42 0.19 4.61 0.00 -0.67 -4.79 121.76 120.83 1oa9 s ALA 144 Ca 0.00 0.80 -0.13 0.00 0.00 0.00 0.00 51.96 52.63 1oa9 s ALA 144 Cb 0.00 -3.40 0.20 0.00 0.00 0.00 0.00 23.12 19.92 1oa9 s ALA 144 CO 0.00 -1.35 1.69 -0.09 0.00 0.00 0.00 175.76 176.02 1oa9 h ARG 145 N 0.33 0.15 -5.02 0.00 2.43 -1.94 -1.74 114.38 108.59 1oa9 h ARG 145 Ca -0.48 -0.01 -0.65 0.00 -0.81 0.00 0.00 59.98 58.03 1oa9 h ARG 145 Cb 1.28 -0.03 -0.25 0.00 -0.42 0.00 0.00 29.97 30.55 1oa9 h ARG 145 CO 0.53 0.10 -0.67 0.71 -1.51 0.00 0.00 179.97 179.13 1oa9 s TYR 146 N -6.16 3.02 0.00 2.20 1.51 -1.26 -0.36 117.35 116.31 1oa9 s TYR 146 Ca -0.13 -0.63 0.00 0.00 -1.01 0.00 0.00 57.07 55.29 1oa9 s TYR 146 Cb 0.16 -2.14 0.00 0.00 -0.11 0.00 0.00 41.96 39.87 1oa9 s TYR 146 CO 0.72 -0.40 0.00 0.41 -1.11 0.00 0.00 175.55 175.18 1oa9 n GLY 147 N 4.67 2.45 7.00 0.71 0.00 -0.93 -4.96 105.19 114.12 1oa9 n GLY 147 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1oa9 n GLY 147 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oa9 n GLY 148 N -0.33 0.87 3.71 -0.02 0.00 -0.65 -4.23 105.19 104.54 1oa9 n GLY 148 Ca 0.00 -0.73 -0.30 0.00 0.00 0.00 0.00 46.02 44.99 1oa9 n GLY 148 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1oa9 s ILE 149 N 0.00 2.66 -0.23 -0.61 -4.36 -0.45 -1.66 121.20 116.55 1oa9 s ILE 149 Ca 0.00 0.21 0.05 0.00 -0.26 0.00 0.00 60.65 60.65 1oa9 s ILE 149 Cb 0.00 -2.66 -0.05 0.00 1.25 0.00 0.00 42.46 41.00 1oa9 s ILE 149 CO 0.00 -0.28 0.21 -1.54 0.24 0.00 0.00 174.94 173.57 1oa9 n SER 150 N -3.91 0.37 -4.06 4.36 3.41 -1.26 -4.92 113.62 107.61 1oa9 n SER 150 Ca 0.07 -0.59 -0.16 0.00 -0.26 0.00 0.00 58.87 57.93 1oa9 n SER 150 Cb 0.55 1.01 -0.13 0.00 -0.26 0.00 0.00 64.21 65.38 1oa9 n SER 150 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1oa9 s SER 151 N -1.51 1.07 0.35 4.04 0.01 -1.26 -5.03 113.70 111.36 1oa9 s SER 151 Ca 0.02 -0.39 0.03 0.00 1.31 0.00 0.00 55.95 56.92 1oa9 s SER 151 Cb 0.04 -0.04 0.66 0.00 0.21 0.00 0.00 66.02 66.88 1oa9 s SER 151 CO 0.20 -0.04 1.98 -0.09 0.41 0.00 0.00 173.24 175.70 1oa9 h ARG 152 N 5.09 0.83 -0.79 12.44 2.43 -1.96 -1.61 114.38 130.80 1oa9 h ARG 152 Ca -0.34 -0.05 0.13 0.00 -0.81 0.00 0.00 59.98 58.91 1oa9 h ARG 152 Cb 1.19 -0.19 -0.06 0.00 -0.42 0.00 0.00 29.97 30.50 1oa9 h ARG 152 CO 0.45 0.55 0.52 0.37 -1.51 0.00 0.00 179.97 180.34 1oa9 h GLN 153 N 0.85 0.56 -0.02 0.20 -0.00 -2.00 -0.47 115.11 114.23 1oa9 h GLN 153 Ca 0.29 -0.03 0.01 0.00 -0.00 0.00 0.00 58.65 58.91 1oa9 h GLN 153 Cb 0.09 -0.13 -0.00 0.00 0.00 0.00 0.00 27.48 27.44 1oa9 h GLN 153 CO -0.08 0.37 0.05 0.93 0.00 0.00 0.00 178.83 180.10 1oa9 h GLU 154 N 0.58 0.00 0.00 1.69 5.08 -1.71 -1.53 114.58 118.69 1oa9 h GLU 154 Ca 0.39 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.71 1oa9 h GLU 154 Cb 0.68 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 1oa9 h GLU 154 CO -0.15 0.00 -0.18 0.00 -1.00 0.00 0.00 179.01 177.68 1oa9 h ASP 156 N 0.00 0.00 0.12 0.00 3.32 -1.43 0.01 116.42 118.44 1oa9 h ASP 156 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1oa9 h ASP 156 Cb 0.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1oa9 h ASP 156 CO 0.02 0.00 -0.44 -1.54 -1.72 0.00 0.00 179.24 175.57 1oa9 n SER 157 N -3.35 1.42 -4.77 6.45 3.41 -1.20 -4.96 113.62 110.63 1oa9 n SER 157 Ca 0.06 -1.13 -0.32 0.00 -0.26 0.00 0.00 58.87 57.23 1oa9 n SER 157 Cb 0.69 0.37 0.07 0.00 -0.26 0.00 0.00 64.21 65.08 1oa9 n SER 157 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1oa9 s PHE 158 N -2.57 2.60 0.33 7.33 0.40 -0.01 -4.96 117.98 121.10 1oa9 s PHE 158 Ca 0.19 1.55 -0.29 0.00 -0.60 0.00 0.00 56.93 57.79 1oa9 s PHE 158 Cb 0.18 -3.09 -0.10 0.00 0.51 0.00 0.00 43.02 40.52 1oa9 s PHE 158 CO 0.59 -1.75 1.36 -1.25 0.70 0.00 0.00 175.22 174.87 1oa9 s PRO 159 N -4.61 4.29 0.23 0.24 0.04 -1.26 -4.80 135.00 129.13 1oa9 s PRO 159 Ca 0.63 2.30 -0.15 0.00 0.04 0.00 0.00 61.00 63.83 1oa9 s PRO 159 Cb -0.18 -3.05 0.27 0.00 0.04 0.00 0.00 34.50 31.57 1oa9 s PRO 159 CO 0.51 -0.29 1.47 -1.91 0.04 0.00 0.00 177.00 176.81 1oa9 n GLU 160 N 0.92 -0.19 0.09 4.56 4.07 -1.26 -0.71 120.64 128.13 1oa9 n GLU 160 Ca 0.01 1.46 0.20 0.00 -0.06 0.00 0.00 57.16 58.77 1oa9 n GLU 160 Cb 0.41 -2.17 0.75 0.00 -0.06 0.00 0.00 31.44 30.38 1oa9 n GLU 160 CO 0.00 0.00 0.00 -1.35 -0.06 0.00 0.00 177.13 175.72 1oa9 h PRO 161 N 0.00 0.00 0.00 5.31 0.11 -1.98 -1.53 132.00 133.91 1oa9 h PRO 161 Ca 0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.46 1oa9 h PRO 161 Cb 0.59 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.70 1oa9 h PRO 161 CO -0.94 0.00 -0.68 1.28 -0.21 0.00 0.00 178.00 177.45 1oa9 n LEU 162 N -3.87 0.66 -0.17 2.35 4.77 0.11 -4.50 117.00 116.35 1oa9 n LEU 162 Ca 0.07 -0.16 -0.08 0.00 -0.03 0.00 0.00 56.01 55.81 1oa9 n LEU 162 Cb 0.56 -0.16 0.01 0.00 -2.33 0.00 0.00 43.42 41.49 1oa9 n LEU 162 CO 0.29 0.16 0.99 0.11 -1.33 0.00 0.00 177.39 177.62 1oa9 h LYS 163 N 0.00 0.72 -0.82 3.23 1.57 -1.17 -2.51 116.57 117.59 1oa9 h LYS 163 Ca 0.00 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.64 1oa9 h LYS 163 Cb 0.51 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.65 1oa9 h LYS 163 CO 0.00 0.60 0.39 -1.00 -0.57 0.00 0.00 179.45 178.87 1oa9 h PRO 164 N 0.67 1.18 -0.56 3.15 0.13 -1.79 0.61 132.00 135.38 1oa9 h PRO 164 Ca 0.17 -0.17 -0.10 0.00 -0.87 0.00 0.00 66.00 65.03 1oa9 h PRO 164 Cb 0.11 -0.21 -0.02 0.00 0.13 0.00 0.00 31.00 31.01 1oa9 h PRO 164 CO -0.02 0.91 -0.04 0.78 -0.23 0.00 0.00 178.00 179.39 1oa9 h GLY 165 N 1.18 1.10 1.03 1.56 0.00 -1.79 -0.12 103.07 106.03 1oa9 h GLY 165 Ca 0.28 -0.83 -0.03 0.00 0.00 0.00 0.00 47.33 46.75 1oa9 h GLY 165 CO -0.03 0.76 0.36 0.00 0.00 0.00 0.00 176.54 177.62 1oa9 h GLN 167 N 1.09 0.28 -0.98 0.00 4.20 -0.64 -3.15 115.11 115.91 1oa9 h GLN 167 Ca 0.26 -0.27 0.20 0.00 0.06 0.00 0.00 58.65 58.91 1oa9 h GLN 167 Cb 0.14 0.07 -0.11 0.00 0.30 0.00 0.00 27.48 27.87 1oa9 h GLN 167 CO -0.03 0.95 0.57 2.35 -0.67 0.00 0.00 178.83 182.00 1oa9 h TRP 168 N 0.18 1.00 -0.98 2.96 7.01 -0.82 -0.34 115.95 124.95 1oa9 h TRP 168 Ca -0.04 0.04 0.17 0.00 2.11 0.00 0.00 58.89 61.17 1oa9 h TRP 168 Cb 1.40 -0.29 -0.09 0.00 -2.10 0.00 0.00 29.16 28.07 1oa9 h TRP 168 CO 0.04 0.17 0.61 -0.09 -2.79 0.00 0.00 178.44 176.38 1oa9 h ARG 169 N 0.68 0.75 -0.02 2.65 2.43 -1.52 -1.27 114.38 118.07 1oa9 h ARG 169 Ca 0.58 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.71 1oa9 h ARG 169 Cb 0.97 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.35 1oa9 h ARG 169 CO -0.41 0.49 -0.00 1.19 -1.51 0.00 0.00 179.97 179.73 1oa9 n PHE 170 N -4.67 0.00 0.00 2.20 3.01 -0.18 0.15 117.46 117.98 1oa9 n PHE 170 Ca 0.21 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.67 1oa9 n PHE 170 Cb 0.52 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.99 1oa9 n PHE 170 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1oa9 n ASP 171 N 0.82 0.00 -0.36 4.37 8.00 -0.51 -4.24 116.55 124.63 1oa9 n ASP 171 Ca 0.16 0.00 0.09 0.00 0.71 0.00 0.00 54.79 55.75 1oa9 n ASP 171 Cb 0.49 0.00 0.27 0.00 -0.02 0.00 0.00 41.12 41.86 1oa9 n ASP 171 CO 0.00 0.00 0.00 -0.25 -0.39 0.00 0.00 177.20 176.56 1oa9 h TRP 172 N 0.00 1.11 0.00 1.24 7.01 -1.79 -0.28 115.95 123.24 1oa9 h TRP 172 Ca 0.00 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.03 1oa9 h TRP 172 Cb 0.00 -0.35 0.00 0.00 -2.10 0.00 0.00 29.16 26.71 1oa9 h TRP 172 CO 0.00 0.38 -0.04 0.35 -2.79 0.00 0.00 178.44 176.34 1oa9 h PHE 173 N 0.92 0.00 -6.42 2.65 3.57 -1.62 -3.48 116.94 112.55 1oa9 h PHE 173 Ca 0.52 0.00 -0.50 0.00 3.53 0.00 0.00 57.97 61.52 1oa9 h PHE 173 Cb 0.62 0.00 -0.15 0.00 2.79 0.00 0.00 35.95 39.22 1oa9 h PHE 173 CO -0.00 0.00 -0.76 1.04 -2.23 0.00 0.00 178.31 176.35 1oa9 n GLN 174 N -2.30 -3.76 -3.50 1.11 1.13 -0.12 -1.78 117.38 108.15 1oa9 n GLN 174 Ca 0.05 0.44 -0.26 0.00 -1.94 0.00 0.00 57.00 55.30 1oa9 n GLN 174 Cb 0.44 -5.21 0.01 0.00 0.11 0.00 0.00 30.24 25.58 1oa9 n GLN 174 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 1oa9 n ASN 175 N -2.63 -4.26 -4.72 1.08 5.15 0.12 -4.88 115.26 105.14 1oa9 n ASN 175 Ca 0.06 -0.51 -0.42 0.00 -0.60 0.00 0.00 54.58 53.11 1oa9 n ASN 175 Cb 0.50 -3.47 -0.03 0.00 -0.53 0.00 0.00 39.78 36.25 1oa9 n ASN 175 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1oa9 s ALA 176 N -3.07 3.86 -0.55 5.20 0.00 -0.73 -4.96 121.76 121.51 1oa9 s ALA 176 Ca 0.47 1.49 -0.19 0.00 0.00 0.00 0.00 51.96 53.73 1oa9 s ALA 176 Cb -0.24 -3.68 0.08 0.00 0.00 0.00 0.00 23.12 19.28 1oa9 s ALA 176 CO 0.58 -0.91 0.68 0.34 0.00 0.00 0.00 175.76 176.46 1oa9 s ASP 177 N 1.35 6.21 -1.31 0.00 2.15 -1.26 -4.60 116.67 119.20 1oa9 s ASP 177 Ca 0.74 -1.13 -0.07 0.00 0.43 0.00 0.00 52.55 52.52 1oa9 s ASP 177 Cb -0.47 -2.30 -0.00 0.00 -0.30 0.00 0.00 42.92 39.84 1oa9 s ASP 177 CO 0.32 -1.02 0.57 0.59 -0.17 0.00 0.00 175.17 175.46 1oa9 n ASN 178 N 6.35 -1.99 -4.77 -0.34 3.02 -1.26 -4.93 115.26 111.33 1oa9 n ASN 178 Ca -0.08 -0.99 -0.37 0.00 -0.03 0.00 0.00 54.58 53.12 1oa9 n ASN 178 Cb 0.44 -3.25 0.00 0.00 -0.61 0.00 0.00 39.78 36.36 1oa9 n ASN 178 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1oa9 s PRO 179 N -6.32 3.55 0.81 3.52 0.04 -1.26 -4.44 135.00 130.89 1oa9 s PRO 179 Ca 0.15 1.78 -0.04 0.00 0.04 0.00 0.00 61.00 62.93 1oa9 s PRO 179 Cb -0.06 -2.26 0.17 0.00 0.04 0.00 0.00 34.50 32.39 1oa9 s PRO 179 CO 0.87 -0.73 1.11 -1.54 0.04 0.00 0.00 177.00 176.75 1oa9 s SER 180 N -1.43 3.84 -0.10 6.66 1.04 -1.26 -3.18 113.70 119.25 1oa9 s SER 180 Ca 0.67 -0.34 -0.33 0.00 0.48 0.00 0.00 55.95 56.44 1oa9 s SER 180 Cb -0.29 0.15 0.13 0.00 0.10 0.00 0.00 66.02 66.11 1oa9 s SER 180 CO 0.34 -2.22 1.20 0.72 0.98 0.00 0.00 173.24 174.26 1oa9 s PHE 181 N -3.38 -0.12 0.13 5.02 -0.12 -0.78 -1.16 117.98 117.57 1oa9 s PHE 181 Ca 0.70 0.03 0.04 0.00 -0.05 0.00 0.00 56.93 57.65 1oa9 s PHE 181 Cb -0.04 0.53 -0.04 0.00 -0.63 0.00 0.00 43.02 42.85 1oa9 s PHE 181 CO 0.47 -0.28 0.14 0.95 -0.05 0.00 0.00 175.22 176.45 1oa9 s THR 182 N -2.51 4.65 0.02 -4.49 -4.23 -0.28 -1.18 115.64 107.62 1oa9 s THR 182 Ca 0.11 -0.89 -0.22 0.00 -1.18 0.00 0.00 61.69 59.51 1oa9 s THR 182 Cb 0.01 -3.32 0.05 0.00 1.34 0.00 0.00 72.50 70.57 1oa9 s THR 182 CO -0.04 -0.01 0.49 0.72 -0.54 0.00 0.00 174.62 175.24 1oa9 s PHE 183 N -1.61 -0.39 0.01 3.99 -0.12 0.81 -0.90 117.98 119.76 1oa9 s PHE 183 Ca 0.31 0.49 -0.01 0.00 -0.05 0.00 0.00 56.93 57.67 1oa9 s PHE 183 Cb -0.11 0.29 -0.01 0.00 -0.63 0.00 0.00 43.02 42.56 1oa9 s PHE 183 CO 0.24 -0.59 0.00 -1.21 -0.05 0.00 0.00 175.22 173.61 1oa9 s GLU 184 N -2.10 0.23 0.35 1.99 0.41 -1.12 -1.94 118.70 116.52 1oa9 s GLU 184 Ca -0.07 -0.38 -0.26 0.00 -0.41 0.00 0.00 54.97 53.85 1oa9 s GLU 184 Cb -0.01 0.08 -0.09 0.00 -1.78 0.00 0.00 34.13 32.33 1oa9 s GLU 184 CO 0.01 -0.04 1.05 0.50 -0.49 0.00 0.00 175.26 176.29 1oa9 s ARG 185 N -0.96 4.37 0.18 1.61 3.52 -1.26 -1.29 118.95 125.12 1oa9 s ARG 185 Ca -0.11 1.58 -0.00 0.00 -0.13 0.00 0.00 55.73 57.07 1oa9 s ARG 185 Cb -0.06 -2.78 -0.04 0.00 -1.56 0.00 0.00 34.95 30.50 1oa9 s ARG 185 CO -0.00 0.03 0.08 0.14 -0.81 0.00 0.00 175.30 174.74 1oa9 s VAL 186 N -1.49 0.22 0.27 7.11 -7.23 -0.16 -4.86 120.40 114.25 1oa9 s VAL 186 Ca 0.53 -1.97 -0.30 0.00 -1.81 0.00 0.00 61.98 58.43 1oa9 s VAL 186 Cb -0.25 -2.32 -0.10 0.00 0.56 0.00 0.00 36.38 34.27 1oa9 s VAL 186 CO 0.31 -0.22 1.35 -1.58 -0.31 0.00 0.00 175.10 174.66 1oa9 s GLN 187 N -4.07 4.34 0.03 4.82 0.74 -0.97 -3.93 119.66 120.62 1oa9 s GLN 187 Ca 0.32 2.20 -0.30 0.00 0.05 0.00 0.00 55.36 57.63 1oa9 s GLN 187 Cb 0.07 -3.11 -0.07 0.00 1.10 0.00 0.00 33.01 30.99 1oa9 s GLN 187 CO 0.08 -0.28 1.62 0.00 -0.55 0.00 0.00 175.29 176.16 1oa9 s PRO 189 N 2.95 2.44 0.61 0.00 0.04 -1.26 -4.84 135.00 134.93 1oa9 s PRO 189 Ca 0.73 1.88 0.32 0.00 0.04 0.00 0.00 61.00 63.97 1oa9 s PRO 189 Cb -0.37 -1.85 1.89 0.00 0.04 0.00 0.00 34.50 34.21 1oa9 s PRO 189 CO 0.31 -1.64 2.24 0.93 0.04 0.00 0.00 177.00 178.88 1oa9 h GLU 190 N 0.22 0.00 -0.11 4.56 4.39 -2.00 -2.22 114.58 119.43 1oa9 h GLU 190 Ca -0.49 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.13 1oa9 h GLU 190 Cb 1.31 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.95 1oa9 h GLU 190 CO 0.52 0.00 -0.29 0.93 -1.16 0.00 0.00 179.01 179.00 1oa9 h GLU 191 N 0.00 0.20 0.09 2.33 3.07 -1.99 -0.82 114.58 117.47 1oa9 h GLU 191 Ca 0.02 -0.07 -0.00 0.00 -0.50 0.00 0.00 59.36 58.80 1oa9 h GLU 191 Cb 0.12 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.02 1oa9 h GLU 191 CO -0.00 0.48 -0.04 -0.07 -1.40 0.00 0.00 179.01 177.98 1oa9 h LEU 192 N 0.18 -0.10 -1.94 1.33 3.38 -1.75 -3.01 115.31 113.39 1oa9 h LEU 192 Ca 0.03 -0.43 0.12 0.00 0.09 0.00 0.00 57.88 57.69 1oa9 h LEU 192 Cb 0.62 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 1oa9 h LEU 192 CO 0.04 0.55 0.33 0.58 0.09 0.00 0.00 178.44 180.04 1oa9 h VAL 193 N -0.93 0.79 0.00 1.22 2.07 -1.55 0.28 116.25 118.14 1oa9 h VAL 193 Ca -0.01 -0.02 -0.06 0.00 0.82 0.00 0.00 66.70 67.43 1oa9 h VAL 193 Cb 0.53 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 1oa9 h VAL 193 CO 0.02 0.01 -0.29 0.00 0.02 0.00 0.00 177.57 177.34 1oa9 h ALA 194 N 1.77 1.26 0.18 1.67 0.00 -1.15 1.09 119.26 124.07 1oa9 h ALA 194 Ca 0.22 -0.26 -0.35 0.00 0.00 0.00 0.00 54.91 54.52 1oa9 h ALA 194 Cb 0.80 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.56 1oa9 h ALA 194 CO -0.02 0.36 -1.75 0.00 0.00 0.00 0.00 179.25 177.84 1oa9 h ARG 195 N 0.00 0.38 0.00 0.00 2.47 -0.34 -3.39 114.38 113.50 1oa9 h ARG 195 Ca -0.00 -0.65 -0.05 0.00 -1.26 0.00 0.00 59.98 58.02 1oa9 h ARG 195 Cb 0.61 0.24 -0.01 0.00 -1.65 0.00 0.00 29.97 29.16 1oa9 h ARG 195 CO 0.04 1.31 -1.60 0.25 0.56 0.00 0.00 179.97 180.53 1oa9 n THR 196 N -3.61 0.50 -0.95 2.04 -2.24 -0.70 -4.82 114.28 104.49 1oa9 n THR 196 Ca -0.25 -0.57 0.00 0.00 -2.27 0.00 0.00 64.05 60.95 1oa9 n THR 196 Cb 1.06 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 69.03 1oa9 n THR 196 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1oa9 n GLY 197 N 1.29 0.41 3.26 3.38 0.00 0.38 -1.86 105.19 112.05 1oa9 n GLY 197 Ca -0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.61 1oa9 n GLY 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oa9 s ARG 199 N 1.40 2.01 0.57 0.00 6.06 -1.26 -4.74 118.95 123.00 1oa9 s ARG 199 Ca 0.02 -0.49 -0.17 0.00 -2.50 0.00 0.00 55.73 52.59 1oa9 s ARG 199 Cb -0.17 -1.74 -0.04 0.00 0.06 0.00 0.00 34.95 33.06 1oa9 s ARG 199 CO -0.02 -0.07 1.08 1.03 -2.50 0.00 0.00 175.30 174.82 1oa9 s ARG 200 N 1.01 3.31 0.24 5.12 0.52 -1.26 -2.55 118.95 125.35 1oa9 s ARG 200 Ca -0.07 1.37 -0.01 0.00 -0.52 0.00 0.00 55.73 56.50 1oa9 s ARG 200 Cb -0.15 -2.02 0.29 0.00 0.52 0.00 0.00 34.95 33.59 1oa9 s ARG 200 CO -0.01 -0.84 1.66 0.45 0.02 0.00 0.00 175.30 176.58 1oa9 h HIS 201 N 0.75 0.69 -0.26 -0.53 3.86 -1.23 -3.00 115.15 115.44 1oa9 h HIS 201 Ca -0.48 -0.16 0.00 0.00 -1.16 0.00 0.00 60.37 58.57 1oa9 h HIS 201 Cb 1.24 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 29.54 1oa9 h HIS 201 CO 0.56 0.82 0.00 -0.40 0.86 0.00 0.00 177.93 179.76 1oa9 n ASP 202 N -4.10 1.58 -0.14 2.45 5.75 -1.26 -4.32 116.55 116.51 1oa9 n ASP 202 Ca -0.00 -2.05 -0.11 0.00 -0.01 0.00 0.00 54.79 52.62 1oa9 n ASP 202 Cb 0.44 -0.23 -0.01 0.00 -1.03 0.00 0.00 41.12 40.28 1oa9 n ASP 202 CO 0.00 0.00 0.00 -0.78 -0.11 0.00 0.00 177.20 176.31 1oa9 h ASP 203 N 1.52 0.81 -0.28 -1.12 -0.00 -1.92 -2.93 116.42 112.50 1oa9 h ASP 203 Ca 0.00 -0.36 0.08 0.00 -0.00 0.00 0.00 57.03 56.75 1oa9 h ASP 203 Cb 0.45 -0.22 -0.01 0.00 -0.00 0.00 0.00 39.33 39.54 1oa9 h ASP 203 CO 0.02 0.98 0.34 1.23 -0.00 0.00 0.00 179.24 181.81 1oa9 h GLY 204 N 0.62 0.00 2.00 -0.78 0.00 -1.82 0.24 103.07 103.32 1oa9 h GLY 204 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.43 1oa9 h GLY 204 CO 0.04 0.00 0.00 -1.33 0.00 0.00 0.00 176.54 175.25 1oa9 h GLY 205 N 0.00 0.00 -5.92 4.60 0.00 -1.83 -3.42 103.07 96.49 1oa9 h GLY 205 Ca 0.13 0.00 -0.64 0.00 0.00 0.00 0.00 47.33 46.82 1oa9 h GLY 205 CO -0.00 0.00 -0.50 -1.36 0.00 0.00 0.00 176.54 174.68 1oa9 s PHE 206 N -3.58 3.47 0.00 5.60 0.40 0.07 -5.05 117.98 118.89 1oa9 s PHE 206 Ca 0.02 0.39 0.00 0.00 -0.60 0.00 0.00 56.93 56.74 1oa9 s PHE 206 Cb 0.09 -2.04 0.00 0.00 0.51 0.00 0.00 43.02 41.58 1oa9 s PHE 206 CO 0.51 0.49 0.00 0.00 0.70 0.00 0.00 175.22 176.93 1oa9 n ALA 207 N 2.76 0.00 0.00 5.36 0.00 -1.26 -3.53 120.51 123.83 1oa9 n ALA 207 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1oa9 n ALA 207 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1oa9 n ALA 207 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78