#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ad9 s ILE 2 N 0.00 5.33 -0.11 5.18 1.01 -1.26 -5.06 121.20 126.29 1ad9 s ILE 2 Ca 0.00 0.47 -0.19 0.00 0.00 0.00 0.00 60.65 60.94 1ad9 s ILE 2 Cb 0.00 -3.60 -0.04 0.00 0.01 0.00 0.00 42.46 38.83 1ad9 s ILE 2 CO 0.00 0.40 0.50 -1.10 0.00 0.00 0.00 174.94 174.73 1ad9 s GLN 3 N 0.46 4.34 -0.19 2.79 1.11 -1.26 -4.76 119.66 122.15 1ad9 s GLN 3 Ca 0.15 0.49 -0.02 0.00 0.01 0.00 0.00 55.36 55.99 1ad9 s GLN 3 Cb -0.13 -3.43 -0.00 0.00 -1.01 0.00 0.00 33.01 28.44 1ad9 s GLN 3 CO 0.03 0.17 -0.11 -1.64 0.01 0.00 0.00 175.29 173.74 1ad9 s MET 4 N 0.58 3.26 -0.04 2.91 -1.94 -1.26 -1.13 119.30 121.69 1ad9 s MET 4 Ca 0.27 -0.70 0.06 0.00 -1.71 0.00 0.00 55.69 53.61 1ad9 s MET 4 Cb -0.15 -2.79 -0.01 0.00 2.01 0.00 0.00 34.83 33.88 1ad9 s MET 4 CO 0.11 -0.11 -0.22 0.95 -0.01 0.00 0.00 175.02 175.74 1ad9 s THR 5 N 1.17 1.80 0.02 2.05 -4.23 -0.17 -4.28 115.64 112.00 1ad9 s THR 5 Ca 0.02 -0.95 0.06 0.00 -1.18 0.00 0.00 61.69 59.64 1ad9 s THR 5 Cb -0.14 -1.52 -0.03 0.00 1.34 0.00 0.00 72.50 72.15 1ad9 s THR 5 CO -0.04 0.51 -0.15 -1.10 -0.54 0.00 0.00 174.62 173.29 1ad9 s GLN 6 N -0.27 2.23 -0.08 3.99 -0.21 -1.26 -0.74 119.66 123.32 1ad9 s GLN 6 Ca 0.01 -0.89 -0.06 0.00 0.02 0.00 0.00 55.36 54.45 1ad9 s GLN 6 Cb -0.11 -2.27 0.03 0.00 1.00 0.00 0.00 33.01 31.65 1ad9 s GLN 6 CO 0.01 0.57 0.20 -1.12 -2.12 0.00 0.00 175.29 172.82 1ad9 s SER 7 N -1.30 -0.20 0.79 5.90 0.01 -1.07 -4.43 113.70 113.39 1ad9 s SER 7 Ca 0.15 0.40 -0.08 0.00 1.31 0.00 0.00 55.95 57.73 1ad9 s SER 7 Cb -0.11 0.36 0.12 0.00 0.21 0.00 0.00 66.02 66.61 1ad9 s SER 7 CO 0.05 -0.10 1.10 -2.16 0.41 0.00 0.00 173.24 172.54 1ad9 s PRO 8 N 0.48 1.56 0.10 12.44 0.04 -1.26 -3.23 135.00 145.13 1ad9 s PRO 8 Ca -0.03 -0.58 -0.16 0.00 0.04 0.00 0.00 61.00 60.28 1ad9 s PRO 8 Cb -0.05 -2.12 -0.07 0.00 0.04 0.00 0.00 34.50 32.30 1ad9 s PRO 8 CO -0.02 -1.66 1.47 0.66 0.04 0.00 0.00 177.00 177.49 1ad9 h SER 9 N -0.89 0.67 -4.28 6.66 4.64 -1.84 -3.42 113.55 115.09 1ad9 h SER 9 Ca -0.42 -0.41 -0.51 0.00 -0.47 0.00 0.00 61.79 59.98 1ad9 h SER 9 Cb 1.28 -0.19 -0.28 0.00 -0.31 0.00 0.00 62.40 62.90 1ad9 h SER 9 CO 0.47 0.93 -0.82 -0.89 -0.87 0.00 0.00 176.83 175.65 1ad9 s THR 10 N -4.60 1.27 -0.10 2.95 2.01 -1.26 -1.64 115.64 114.26 1ad9 s THR 10 Ca -0.13 -0.80 -0.02 0.00 0.31 0.00 0.00 61.69 61.05 1ad9 s THR 10 Cb 0.09 -1.08 0.04 0.00 0.01 0.00 0.00 72.50 71.55 1ad9 s THR 10 CO 0.80 0.27 0.01 -0.22 -0.69 0.00 0.00 174.62 174.79 1ad9 s LEU 11 N -0.62 0.71 -0.30 4.42 2.96 0.71 -4.93 118.68 121.63 1ad9 s LEU 11 Ca 0.05 -0.27 -0.21 0.00 -0.22 0.00 0.00 54.13 53.48 1ad9 s LEU 11 Cb -0.07 -0.47 -0.01 0.00 0.50 0.00 0.00 46.19 46.15 1ad9 s LEU 11 CO 0.00 -0.23 0.67 -0.44 -1.32 0.00 0.00 176.35 175.04 1ad9 s SER 12 N 1.95 6.56 0.04 3.68 0.01 -1.26 -1.50 113.70 123.17 1ad9 s SER 12 Ca 0.04 0.54 -0.05 0.00 1.31 0.00 0.00 55.95 57.79 1ad9 s SER 12 Cb -0.13 -2.35 -0.01 0.00 0.21 0.00 0.00 66.02 63.73 1ad9 s SER 12 CO -0.06 -0.50 0.07 0.00 0.41 0.00 0.00 173.24 173.17 1ad9 s ALA 13 N 2.68 -0.00 0.09 1.44 0.00 -0.68 -4.85 121.76 120.44 1ad9 s ALA 13 Ca 0.27 -0.61 0.05 0.00 0.00 0.00 0.00 51.96 51.68 1ad9 s ALA 13 Cb -0.15 0.24 -0.04 0.00 0.00 0.00 0.00 23.12 23.17 1ad9 s ALA 13 CO 0.11 -0.31 0.00 -1.54 0.00 0.00 0.00 175.76 174.03 1ad9 s SER 14 N -2.12 5.04 -0.00 0.00 1.04 -1.26 -1.99 113.70 114.41 1ad9 s SER 14 Ca -0.05 -0.18 -0.37 0.00 0.48 0.00 0.00 55.95 55.83 1ad9 s SER 14 Cb -0.01 -1.20 -0.16 0.00 0.10 0.00 0.00 66.02 64.75 1ad9 s SER 14 CO -0.05 0.17 1.51 0.52 0.98 0.00 0.00 173.24 176.37 1ad9 n VAL 15 N 0.53 0.12 0.00 5.02 0.31 -1.26 -1.39 118.33 121.66 1ad9 n VAL 15 Ca -0.11 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.20 1ad9 n VAL 15 Cb 0.52 -1.09 0.00 0.00 -0.91 0.00 0.00 33.84 32.36 1ad9 n VAL 15 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ad9 n GLY 16 N 3.18 0.11 3.84 2.92 0.00 0.62 -4.94 105.19 110.93 1ad9 n GLY 16 Ca 0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 1ad9 n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ad9 s ASP 17 N -1.99 4.23 -0.44 1.61 1.01 -0.48 -4.38 116.67 116.22 1ad9 s ASP 17 Ca 0.00 0.96 -0.08 0.00 0.71 0.00 0.00 52.55 54.14 1ad9 s ASP 17 Cb 0.00 -1.56 0.10 0.00 1.01 0.00 0.00 42.92 42.48 1ad9 s ASP 17 CO 0.00 -2.10 0.29 -0.60 0.21 0.00 0.00 175.17 172.98 1ad9 s ARG 18 N -5.38 2.49 -0.09 8.23 3.52 -1.20 -0.92 118.95 125.59 1ad9 s ARG 18 Ca 0.62 -1.64 -0.12 0.00 -0.13 0.00 0.00 55.73 54.46 1ad9 s ARG 18 Cb -0.13 -3.82 -0.05 0.00 -1.56 0.00 0.00 34.95 29.39 1ad9 s ARG 18 CO 0.52 -1.08 0.30 0.08 -0.81 0.00 0.00 175.30 174.31 1ad9 s VAL 19 N 1.37 5.26 -0.08 7.11 1.01 -0.37 -4.93 120.40 129.77 1ad9 s VAL 19 Ca 0.05 0.57 0.02 0.00 0.00 0.00 0.00 61.98 62.62 1ad9 s VAL 19 Cb -0.24 -3.60 0.01 0.00 0.00 0.00 0.00 36.38 32.55 1ad9 s VAL 19 CO 0.00 0.52 -0.12 0.42 0.00 0.00 0.00 175.10 175.92 1ad9 s THR 20 N -0.50 1.19 -0.10 3.92 -4.23 -1.26 -0.09 115.64 114.57 1ad9 s THR 20 Ca 0.19 -0.49 -0.02 0.00 -1.18 0.00 0.00 61.69 60.19 1ad9 s THR 20 Cb -0.14 -1.10 -0.03 0.00 1.34 0.00 0.00 72.50 72.57 1ad9 s THR 20 CO 0.07 0.37 -0.02 -0.63 -0.54 0.00 0.00 174.62 173.88 1ad9 s ILE 21 N 0.82 4.14 0.02 2.99 1.01 0.10 -4.94 121.20 125.34 1ad9 s ILE 21 Ca -0.11 -0.30 0.04 0.00 0.00 0.00 0.00 60.65 60.28 1ad9 s ILE 21 Cb -0.15 -2.75 -0.03 0.00 0.01 0.00 0.00 42.46 39.53 1ad9 s ILE 21 CO 0.02 0.57 -0.08 0.42 0.00 0.00 0.00 174.94 175.87 1ad9 s THR 22 N -0.55 3.52 0.03 2.92 -4.23 -1.20 -0.48 115.64 115.65 1ad9 s THR 22 Ca 0.09 -0.87 0.04 0.00 -1.18 0.00 0.00 61.69 59.77 1ad9 s THR 22 Cb -0.12 -2.54 -0.02 0.00 1.34 0.00 0.00 72.50 71.16 1ad9 s THR 22 CO 0.02 0.36 -0.12 0.00 -0.54 0.00 0.00 174.62 174.33 1ad9 s ARG 24 N -1.03 0.34 -0.02 0.00 3.52 0.08 -0.97 118.95 120.86 1ad9 s ARG 24 Ca 0.01 0.13 -0.03 0.00 -0.13 0.00 0.00 55.73 55.71 1ad9 s ARG 24 Cb -0.07 -0.63 -0.04 0.00 -1.56 0.00 0.00 34.95 32.65 1ad9 s ARG 24 CO 0.01 -0.21 0.15 -1.54 -0.81 0.00 0.00 175.30 172.90 1ad9 s SER 25 N 1.45 6.20 0.42 -2.12 1.04 -0.25 -1.00 113.70 119.45 1ad9 s SER 25 Ca -0.04 0.31 0.29 0.00 0.48 0.00 0.00 55.95 57.00 1ad9 s SER 25 Cb -0.13 -1.92 1.41 0.00 0.10 0.00 0.00 66.02 65.48 1ad9 s SER 25 CO -0.03 0.28 1.89 0.77 0.98 0.00 0.00 173.24 177.13 1ad9 h SER 26 N 4.02 0.00 -5.04 7.02 4.64 -1.46 -3.44 113.55 119.29 1ad9 h SER 26 Ca -0.50 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.76 1ad9 h SER 26 Cb 1.19 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.12 1ad9 h SER 26 CO 0.66 0.00 -0.06 -1.59 -0.87 0.00 0.00 176.83 174.97 1ad9 s LYS 27 N -3.62 0.98 0.00 4.77 -2.85 -1.26 -4.99 119.74 112.76 1ad9 s LYS 27 Ca -0.00 -0.39 0.00 0.00 -1.00 0.00 0.00 55.97 54.58 1ad9 s LYS 27 Cb 0.09 0.44 0.00 0.00 -2.06 0.00 0.00 37.83 36.30 1ad9 s LYS 27 CO 0.37 -0.35 0.00 0.45 0.10 0.00 0.00 175.35 175.92 1ad9 n SER 27 N 0.34 -1.00 -0.78 0.03 2.88 -1.26 -4.78 113.62 109.05 1ad9 n SER 27 Ca -0.18 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.36 1ad9 n SER 27 Cb 0.61 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.07 1ad9 n SER 27 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 1ad9 n LEU 27 N 0.00 -3.65 -4.98 2.46 7.94 -1.26 -5.03 117.00 112.47 1ad9 n LEU 27 Ca 0.00 1.23 -0.20 0.00 -1.11 0.00 0.00 56.01 55.94 1ad9 n LEU 27 Cb 0.00 -0.82 0.02 0.00 0.53 0.00 0.00 43.42 43.15 1ad9 n LEU 27 CO 0.00 -0.33 0.25 -2.28 -1.11 0.00 0.00 177.39 173.92 1ad9 s HIS 27 N -1.14 2.92 0.40 1.96 5.65 0.59 -4.98 115.29 120.69 1ad9 s HIS 27 Ca 0.00 -0.13 0.07 0.00 0.25 0.00 0.00 55.06 55.25 1ad9 s HIS 27 Cb 0.00 -2.49 0.82 0.00 -1.18 0.00 0.00 32.58 29.73 1ad9 s HIS 27 CO 0.00 -0.56 2.02 0.77 -0.65 0.00 0.00 174.74 176.32 1ad9 h SER 27 N 0.39 0.46 0.00 9.88 0.02 -2.04 -1.55 113.55 120.71 1ad9 h SER 27 Ca -0.42 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 1ad9 h SER 27 Cb 1.28 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.71 1ad9 h SER 27 CO 0.51 0.38 0.00 -0.46 -1.14 0.00 0.00 176.83 176.11 1ad9 n ASN 28 N -4.43 0.00 0.00 3.07 2.04 -1.26 -4.84 115.26 109.83 1ad9 n ASN 28 Ca 0.03 -0.79 0.00 0.00 -0.44 0.00 0.00 54.58 53.37 1ad9 n ASN 28 Cb 0.10 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.35 1ad9 n ASN 28 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1ad9 n GLY 29 N 0.24 2.34 3.85 4.83 0.00 -0.58 -5.05 105.19 110.83 1ad9 n GLY 29 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 1ad9 n GLY 29 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ad9 s ASP 30 N -1.83 6.70 -0.30 1.61 1.01 -1.26 -4.75 116.67 117.85 1ad9 s ASP 30 Ca 0.00 1.28 -0.11 0.00 0.71 0.00 0.00 52.55 54.43 1ad9 s ASP 30 Cb 0.00 -2.38 -0.03 0.00 1.01 0.00 0.00 42.92 41.52 1ad9 s ASP 30 CO 0.00 -0.30 0.19 -0.89 0.21 0.00 0.00 175.17 174.38 1ad9 s THR 31 N -2.15 5.09 -1.29 -1.27 2.01 -1.26 -0.30 115.64 116.47 1ad9 s THR 31 Ca 0.54 -0.08 -0.18 0.00 0.31 0.00 0.00 61.69 62.28 1ad9 s THR 31 Cb -0.10 -3.51 0.06 0.00 0.01 0.00 0.00 72.50 68.96 1ad9 s THR 31 CO 0.22 0.15 1.75 -0.36 -0.69 0.00 0.00 174.62 175.69 1ad9 s PHE 32 N 1.71 2.72 0.00 4.92 0.40 -1.26 -3.43 117.98 123.04 1ad9 s PHE 32 Ca 0.06 -1.47 0.00 0.00 -0.60 0.00 0.00 56.93 54.93 1ad9 s PHE 32 Cb -0.17 -4.70 -0.01 0.00 0.51 0.00 0.00 43.02 38.66 1ad9 s PHE 32 CO 0.09 -1.76 -0.02 -1.17 0.70 0.00 0.00 175.22 173.06 1ad9 s LEU 33 N 4.75 2.05 0.07 -0.37 2.96 -1.26 -2.36 118.68 124.53 1ad9 s LEU 33 Ca 0.55 -0.13 0.09 0.00 -0.22 0.00 0.00 54.13 54.43 1ad9 s LEU 33 Cb 0.04 -0.03 -0.03 0.00 0.50 0.00 0.00 46.19 46.66 1ad9 s LEU 33 CO 0.08 -0.05 -0.23 -0.31 -1.32 0.00 0.00 176.35 174.52 1ad9 s TYR 34 N -0.33 2.41 -0.14 5.38 2.02 0.17 -1.15 117.35 125.72 1ad9 s TYR 34 Ca -0.03 -0.34 0.02 0.00 -0.37 0.00 0.00 57.07 56.35 1ad9 s TYR 34 Cb -0.02 -1.37 0.01 0.00 -0.40 0.00 0.00 41.96 40.18 1ad9 s TYR 34 CO -0.00 0.25 -0.20 -1.58 -1.57 0.00 0.00 175.55 172.45 1ad9 s TRP 35 N -0.95 2.47 0.08 2.71 0.52 -0.62 -0.33 118.94 122.82 1ad9 s TRP 35 Ca 0.14 -1.26 0.10 0.00 0.02 0.00 0.00 56.10 55.10 1ad9 s TRP 35 Cb -0.10 -1.71 -0.03 0.00 -1.15 0.00 0.00 33.47 30.47 1ad9 s TRP 35 CO 0.05 -0.60 -0.26 -0.06 0.02 0.00 0.00 176.95 176.10 1ad9 s PHE 36 N 0.95 2.28 -0.07 -1.98 0.08 0.18 -0.41 117.98 119.01 1ad9 s PHE 36 Ca -0.05 -0.40 0.03 0.00 0.12 0.00 0.00 56.93 56.63 1ad9 s PHE 36 Cb -0.15 -1.31 -0.02 0.00 -0.57 0.00 0.00 43.02 40.97 1ad9 s PHE 36 CO -0.04 0.21 -0.15 -1.14 -0.10 0.00 0.00 175.22 174.01 1ad9 s GLN 37 N -1.59 2.72 -0.04 0.44 0.74 0.10 -0.77 119.66 121.26 1ad9 s GLN 37 Ca 0.12 -0.71 -0.01 0.00 0.05 0.00 0.00 55.36 54.81 1ad9 s GLN 37 Cb -0.10 -2.42 0.03 0.00 1.10 0.00 0.00 33.01 31.63 1ad9 s GLN 37 CO 0.04 0.50 0.07 -1.14 -0.55 0.00 0.00 175.29 174.21 1ad9 s GLN 38 N -0.41 -0.02 0.08 1.67 0.74 0.97 -0.22 119.66 122.47 1ad9 s GLN 38 Ca 0.05 0.31 -0.03 0.00 0.05 0.00 0.00 55.36 55.73 1ad9 s GLN 38 Cb -0.12 -0.30 -0.05 0.00 1.10 0.00 0.00 33.01 33.65 1ad9 s GLN 38 CO 0.02 -0.22 0.28 0.15 -0.55 0.00 0.00 175.29 174.97 1ad9 s LYS 39 N 1.46 3.53 0.16 1.67 1.02 -1.26 -1.33 119.74 124.99 1ad9 s LYS 39 Ca -0.05 -0.23 -0.34 0.00 0.02 0.00 0.00 55.97 55.38 1ad9 s LYS 39 Cb -0.12 -2.98 -0.15 0.00 -0.52 0.00 0.00 37.83 34.06 1ad9 s LYS 39 CO -0.04 0.57 1.34 -0.35 -0.92 0.00 0.00 175.35 175.95 1ad9 n PRO 40 N 0.41 1.51 -1.00 -1.68 -0.04 -1.26 -1.46 135.00 131.49 1ad9 n PRO 40 Ca -0.06 0.54 0.00 0.00 -0.04 0.00 0.00 63.50 63.95 1ad9 n PRO 40 Cb 0.52 -2.16 0.00 0.00 -0.04 0.00 0.00 33.50 31.81 1ad9 n PRO 40 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ad9 n GLY 41 N 2.44 0.33 3.50 0.55 0.00 -1.26 -5.00 105.19 105.74 1ad9 n GLY 41 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.93 1ad9 n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ad9 s LYS 42 N -0.71 1.72 0.35 1.61 -0.14 -0.53 -5.14 119.74 116.90 1ad9 s LYS 42 Ca 0.00 -1.84 -0.18 0.00 -1.36 0.00 0.00 55.97 52.59 1ad9 s LYS 42 Cb 0.00 -1.68 -0.10 0.00 -1.68 0.00 0.00 37.83 34.38 1ad9 s LYS 42 CO 0.00 0.22 0.82 0.00 -0.76 0.00 0.00 175.35 175.63 1ad9 s ALA 43 N -2.60 3.23 0.54 5.17 0.00 -1.26 -4.64 121.76 122.20 1ad9 s ALA 43 Ca 0.31 0.21 -0.22 0.00 0.00 0.00 0.00 51.96 52.26 1ad9 s ALA 43 Cb -0.01 -2.93 -0.05 0.00 0.00 0.00 0.00 23.12 20.12 1ad9 s ALA 43 CO 0.15 0.25 1.33 -2.30 0.00 0.00 0.00 175.76 175.20 1ad9 n PRO 44 N -0.28 1.68 -5.15 0.00 -0.02 -1.26 -4.71 135.00 125.26 1ad9 n PRO 44 Ca 0.04 0.62 -0.32 0.00 -2.02 0.00 0.00 63.50 61.82 1ad9 n PRO 44 Cb 0.53 -2.54 -0.15 0.00 -0.02 0.00 0.00 33.50 31.32 1ad9 n PRO 44 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1ad9 s LYS 45 N -2.82 2.47 0.04 -0.52 2.20 0.69 -4.95 119.74 116.85 1ad9 s LYS 45 Ca 0.71 -0.84 -0.30 0.00 -0.36 0.00 0.00 55.97 55.17 1ad9 s LYS 45 Cb -0.42 -2.21 -0.04 0.00 -1.51 0.00 0.00 37.83 33.64 1ad9 s LYS 45 CO 0.50 0.49 1.02 -1.17 -0.36 0.00 0.00 175.35 175.82 1ad9 s LEU 46 N -0.41 4.40 -0.05 5.43 2.96 -1.26 -0.73 118.68 129.03 1ad9 s LEU 46 Ca 0.04 1.76 -0.09 0.00 -0.22 0.00 0.00 54.13 55.62 1ad9 s LEU 46 Cb -0.12 -3.58 -0.03 0.00 0.50 0.00 0.00 46.19 42.96 1ad9 s LEU 46 CO 0.02 -0.26 -0.18 0.18 -1.32 0.00 0.00 176.35 174.79 1ad9 n LEU 47 N 3.62 1.47 -4.28 -0.68 4.77 0.45 -4.75 117.00 117.61 1ad9 n LEU 47 Ca 0.06 0.23 -0.32 0.00 -0.03 0.00 0.00 56.01 55.94 1ad9 n LEU 47 Cb 0.50 -0.54 -0.16 0.00 -2.33 0.00 0.00 43.42 40.88 1ad9 n LEU 47 CO 0.52 -0.49 -0.52 -0.04 -1.33 0.00 0.00 177.39 175.53 1ad9 s MET 48 N -2.41 3.13 -0.06 3.23 -1.94 -1.10 0.34 119.30 120.49 1ad9 s MET 48 Ca -0.15 -0.81 0.02 0.00 -1.71 0.00 0.00 55.69 53.03 1ad9 s MET 48 Cb 0.02 -2.40 -0.03 0.00 2.01 0.00 0.00 34.83 34.43 1ad9 s MET 48 CO 0.22 0.21 -0.08 1.52 -0.01 0.00 0.00 175.02 176.88 1ad9 s TYR 49 N 0.30 2.89 -1.19 -0.03 -0.85 0.92 -1.59 117.35 117.81 1ad9 s TYR 49 Ca -0.15 -0.01 -0.16 0.00 -0.52 0.00 0.00 57.07 56.23 1ad9 s TYR 49 Cb -0.17 -1.68 -0.01 0.00 0.38 0.00 0.00 41.96 40.48 1ad9 s TYR 49 CO 0.08 0.31 0.74 2.89 -1.52 0.00 0.00 175.55 178.05 1ad9 n ARG 50 N 2.15 -1.86 0.00 -3.49 1.85 -0.30 -1.85 116.66 113.16 1ad9 n ARG 50 Ca -0.17 0.48 0.00 0.00 -1.00 0.00 0.00 57.85 57.15 1ad9 n ARG 50 Cb 0.53 -4.32 0.00 0.00 -1.05 0.00 0.00 32.46 27.61 1ad9 n ARG 50 CO 0.00 0.00 0.00 -0.12 -0.01 0.00 0.00 177.63 177.50 1ad9 n MET 51 N -4.19 0.00 0.00 2.89 0.00 -0.44 -3.66 117.12 111.72 1ad9 n MET 51 Ca -0.14 0.00 0.04 0.00 -0.00 0.00 0.00 57.70 57.60 1ad9 n MET 51 Cb 0.61 0.00 -0.04 0.00 0.00 0.00 0.00 33.22 33.79 1ad9 n MET 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 1ad9 n SER 52 N 0.30 0.54 -4.62 6.12 3.41 -1.25 -4.27 113.62 113.84 1ad9 n SER 52 Ca 0.00 -0.77 -0.43 0.00 -0.26 0.00 0.00 58.87 57.41 1ad9 n SER 52 Cb 0.00 0.91 -0.02 0.00 -0.26 0.00 0.00 64.21 64.84 1ad9 n SER 52 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1ad9 s ASN 53 N -1.73 6.76 0.12 4.04 -0.87 -0.77 -4.45 114.94 118.03 1ad9 s ASN 53 Ca 0.04 0.87 -0.31 0.00 -1.57 0.00 0.00 52.86 51.89 1ad9 s ASN 53 Cb 0.07 -2.54 -0.09 0.00 -0.02 0.00 0.00 41.25 38.66 1ad9 s ASN 53 CO 0.33 -1.07 1.54 -0.22 -2.57 0.00 0.00 177.10 175.12 1ad9 s LEU 54 N 4.14 4.36 0.59 0.60 2.96 -1.26 -0.06 118.68 130.02 1ad9 s LEU 54 Ca 0.49 2.48 -0.17 0.00 -0.22 0.00 0.00 54.13 56.71 1ad9 s LEU 54 Cb -0.11 -3.58 -0.03 0.00 0.50 0.00 0.00 46.19 42.96 1ad9 s LEU 54 CO 0.23 -0.80 1.10 0.00 -1.32 0.00 0.00 176.35 175.56 1ad9 s ALA 55 N 1.65 2.63 0.16 5.97 0.00 0.15 -4.86 121.76 127.47 1ad9 s ALA 55 Ca 0.70 0.60 -0.31 0.00 0.00 0.00 0.00 51.96 52.94 1ad9 s ALA 55 Cb -0.40 -3.31 -0.10 0.00 0.00 0.00 0.00 23.12 19.31 1ad9 s ALA 55 CO 0.31 -0.94 1.58 0.45 0.00 0.00 0.00 175.76 177.16 1ad9 s SER 56 N -2.33 6.58 0.00 0.00 0.15 -1.26 -2.35 113.70 114.49 1ad9 s SER 56 Ca 0.68 2.61 0.00 0.00 0.70 0.00 0.00 55.95 59.94 1ad9 s SER 56 Cb -0.20 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.52 1ad9 s SER 56 CO 0.34 -0.83 0.00 0.61 1.20 0.00 0.00 173.24 174.56 1ad9 n GLY 57 N 3.78 2.98 3.73 9.45 0.00 -1.26 -5.05 105.19 118.83 1ad9 n GLY 57 Ca 0.14 -0.28 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 1ad9 n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ad9 s VAL 58 N -2.31 2.62 0.36 1.61 1.01 -0.99 -4.95 120.40 117.74 1ad9 s VAL 58 Ca 0.00 0.47 -0.28 0.00 0.00 0.00 0.00 61.98 62.17 1ad9 s VAL 58 Cb 0.00 -3.30 -0.12 0.00 0.00 0.00 0.00 36.38 32.97 1ad9 s VAL 58 CO 0.00 0.05 1.36 -2.65 0.00 0.00 0.00 175.10 173.86 1ad9 n PRO 59 N 3.45 2.33 0.00 2.72 -0.02 -1.26 -4.88 135.00 137.33 1ad9 n PRO 59 Ca 0.12 0.82 0.03 0.00 -2.02 0.00 0.00 63.50 62.44 1ad9 n PRO 59 Cb 0.39 -2.46 0.17 0.00 -0.02 0.00 0.00 33.50 31.58 1ad9 n PRO 59 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1ad9 n SER 60 N 0.62 0.00 0.09 2.55 3.41 -1.26 -1.92 113.62 117.11 1ad9 n SER 60 Ca 0.03 -0.03 0.13 0.00 -0.26 0.00 0.00 58.87 58.74 1ad9 n SER 60 Cb 0.37 -0.11 0.45 0.00 -0.26 0.00 0.00 64.21 64.66 1ad9 n SER 60 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1ad9 n ARG 61 N -1.11 0.20 -3.23 4.33 1.85 -1.26 -4.75 116.66 112.69 1ad9 n ARG 61 Ca 0.04 0.22 -0.39 0.00 -1.00 0.00 0.00 57.85 56.72 1ad9 n ARG 61 Cb 0.03 -1.76 -0.06 0.00 -1.05 0.00 0.00 32.46 29.62 1ad9 n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1ad9 s PHE 62 N -3.12 3.75 0.09 2.89 0.08 -0.81 -1.53 117.98 119.34 1ad9 s PHE 62 Ca 0.10 1.25 -0.17 0.00 0.12 0.00 0.00 56.93 58.22 1ad9 s PHE 62 Cb 0.13 -2.56 0.04 0.00 -0.57 0.00 0.00 43.02 40.06 1ad9 s PHE 62 CO 0.54 0.47 0.42 -1.54 -0.10 0.00 0.00 175.22 175.02 1ad9 s SER 63 N -0.67 -0.28 0.04 1.36 1.04 -0.40 -4.97 113.70 109.82 1ad9 s SER 63 Ca 0.30 -0.16 -0.07 0.00 0.48 0.00 0.00 55.95 56.50 1ad9 s SER 63 Cb -0.19 0.46 -0.01 0.00 0.10 0.00 0.00 66.02 66.39 1ad9 s SER 63 CO 0.18 -0.78 0.13 -0.83 0.98 0.00 0.00 173.24 172.92 1ad9 s GLY 64 N -2.47 0.13 0.27 7.32 0.00 -1.26 -0.37 107.32 110.94 1ad9 s GLY 64 Ca -0.01 -0.48 -0.10 0.00 0.00 0.00 0.00 44.72 44.13 1ad9 s GLY 64 CO -0.08 -0.64 0.52 -1.14 0.00 0.00 0.00 173.10 171.77 1ad9 n SER 65 N 0.67 -1.52 0.00 1.64 3.41 -0.84 -4.45 113.62 112.53 1ad9 n SER 65 Ca -0.19 -2.09 0.00 0.00 -0.26 0.00 0.00 58.87 56.34 1ad9 n SER 65 Cb 0.59 2.54 0.00 0.00 -0.26 0.00 0.00 64.21 67.08 1ad9 n SER 65 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ad9 n GLY 66 N -0.36 3.75 2.69 5.00 0.00 -1.26 -0.76 105.19 114.24 1ad9 n GLY 66 Ca -0.06 -1.34 -0.20 0.00 0.00 0.00 0.00 46.02 44.42 1ad9 n GLY 66 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ad9 s SER 67 N 0.00 1.19 0.00 1.61 0.01 -0.53 -4.96 113.70 111.02 1ad9 s SER 67 Ca 0.00 0.05 0.00 0.00 1.31 0.00 0.00 55.95 57.31 1ad9 s SER 67 Cb 0.00 -0.19 0.00 0.00 0.21 0.00 0.00 66.02 66.04 1ad9 s SER 67 CO 0.00 -0.24 0.00 0.61 0.41 0.00 0.00 173.24 174.02 1ad9 n GLY 68 N 5.24 0.72 0.02 3.44 0.00 -1.26 -2.88 105.19 110.46 1ad9 n GLY 68 Ca -0.04 0.59 0.03 0.00 0.00 0.00 0.00 46.02 46.60 1ad9 n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ad9 n THR 69 N 0.00 0.22 -3.88 2.61 -2.24 -1.26 -4.36 114.28 105.38 1ad9 n THR 69 Ca 0.00 -0.35 -0.36 0.00 -2.27 0.00 0.00 64.05 61.07 1ad9 n THR 69 Cb 0.00 -0.04 -0.13 0.00 -2.10 0.00 0.00 70.33 68.06 1ad9 n THR 69 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1ad9 s GLU 70 N -2.73 3.57 0.30 -0.78 0.41 -1.14 -1.09 118.70 117.25 1ad9 s GLU 70 Ca -0.05 -0.53 0.11 0.00 -0.41 0.00 0.00 54.97 54.09 1ad9 s GLU 70 Cb 0.07 -3.18 -0.05 0.00 -1.78 0.00 0.00 34.13 29.19 1ad9 s GLU 70 CO 0.52 -0.14 -0.14 -0.06 -0.49 0.00 0.00 175.26 174.96 1ad9 s PHE 71 N 1.42 2.38 -0.21 1.61 0.08 -0.14 -1.45 117.98 121.66 1ad9 s PHE 71 Ca 0.05 -0.37 -0.11 0.00 0.12 0.00 0.00 56.93 56.61 1ad9 s PHE 71 Cb -0.15 -1.16 0.07 0.00 -0.57 0.00 0.00 43.02 41.22 1ad9 s PHE 71 CO 0.01 0.65 0.51 -0.08 -0.10 0.00 0.00 175.22 176.21 1ad9 s THR 72 N -2.52 -0.09 -0.10 0.64 -1.32 0.06 -1.49 115.64 110.82 1ad9 s THR 72 Ca 0.31 0.07 -0.10 0.00 -1.21 0.00 0.00 61.69 60.76 1ad9 s THR 72 Cb -0.03 -0.75 -0.05 0.00 -1.51 0.00 0.00 72.50 70.17 1ad9 s THR 72 CO 0.16 0.03 0.22 -0.22 -2.21 0.00 0.00 174.62 172.60 1ad9 s LEU 73 N 1.60 4.39 -0.04 9.08 2.96 0.36 -1.99 118.68 135.05 1ad9 s LEU 73 Ca -0.09 0.59 0.03 0.00 -0.22 0.00 0.00 54.13 54.44 1ad9 s LEU 73 Cb -0.08 -2.24 0.00 0.00 0.50 0.00 0.00 46.19 44.38 1ad9 s LEU 73 CO -0.15 0.34 -0.13 -0.89 -1.32 0.00 0.00 176.35 174.20 1ad9 s THR 74 N -0.80 1.10 -0.31 3.68 2.01 0.50 0.02 115.64 121.85 1ad9 s THR 74 Ca 0.17 -0.53 0.03 0.00 0.31 0.00 0.00 61.69 61.67 1ad9 s THR 74 Cb -0.13 -0.96 0.08 0.00 0.01 0.00 0.00 72.50 71.49 1ad9 s THR 74 CO 0.06 0.33 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.68 1ad9 s ILE 75 N 0.17 2.36 0.08 1.82 1.01 0.87 -1.28 121.20 126.24 1ad9 s ILE 75 Ca -0.04 -1.93 -0.32 0.00 0.00 0.00 0.00 60.65 58.35 1ad9 s ILE 75 Cb -0.11 -2.55 -0.16 0.00 0.01 0.00 0.00 42.46 39.66 1ad9 s ILE 75 CO 0.01 -0.31 1.50 0.77 0.00 0.00 0.00 174.94 176.91 1ad9 h SER 76 N 7.74 -1.27 -3.97 3.58 4.64 -1.54 -0.97 113.55 121.77 1ad9 h SER 76 Ca -0.13 0.10 -0.63 0.00 -0.47 0.00 0.00 61.79 60.67 1ad9 h SER 76 Cb 1.03 0.42 -0.41 0.00 -0.31 0.00 0.00 62.40 63.14 1ad9 h SER 76 CO 0.51 -0.60 -0.66 -0.44 -0.87 0.00 0.00 176.83 174.76 1ad9 s SER 77 N -4.16 4.10 -0.02 4.97 0.01 -1.25 -3.22 113.70 114.14 1ad9 s SER 77 Ca -0.16 -2.96 -0.38 0.00 1.31 0.00 0.00 55.95 53.76 1ad9 s SER 77 Cb 0.04 -1.43 -0.16 0.00 0.21 0.00 0.00 66.02 64.67 1ad9 s SER 77 CO 0.54 -0.23 1.45 -0.11 0.41 0.00 0.00 173.24 175.30 1ad9 n LEU 78 N 3.15 1.83 -4.86 2.44 7.94 -0.10 -4.67 117.00 122.73 1ad9 n LEU 78 Ca 0.08 1.11 -0.21 0.00 -1.11 0.00 0.00 56.01 55.87 1ad9 n LEU 78 Cb 0.33 -1.17 -0.03 0.00 0.53 0.00 0.00 43.42 43.08 1ad9 n LEU 78 CO 0.30 -0.88 -0.09 -1.10 -1.11 0.00 0.00 177.39 174.51 1ad9 s GLN 79 N 1.35 2.85 0.57 1.96 -1.52 -1.26 -0.27 119.66 123.34 1ad9 s GLN 79 Ca 0.89 -1.17 0.31 0.00 -1.95 0.00 0.00 55.36 53.43 1ad9 s GLN 79 Cb -0.99 -2.55 1.72 0.00 -0.22 0.00 0.00 33.01 30.96 1ad9 s GLN 79 CO 0.52 0.19 2.18 -1.00 -0.25 0.00 0.00 175.29 176.94 1ad9 h PRO 80 N 1.28 0.00 0.00 2.91 0.13 -1.99 -0.70 132.00 133.62 1ad9 h PRO 80 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1ad9 h PRO 80 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1ad9 h PRO 80 CO 0.59 0.05 0.00 -3.47 -0.23 0.00 0.00 178.00 174.94 1ad9 n ASP 81 N -3.63 0.00 -0.37 1.44 2.03 -1.26 -3.39 116.55 111.38 1ad9 n ASP 81 Ca -0.02 0.31 0.14 0.00 0.52 0.00 0.00 54.79 55.74 1ad9 n ASP 81 Cb 0.16 -0.43 0.52 0.00 -0.72 0.00 0.00 41.12 40.65 1ad9 n ASP 81 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1ad9 n ASP 82 N -1.43 1.21 -4.60 1.67 8.00 -0.27 -4.78 116.55 116.36 1ad9 n ASP 82 Ca 0.08 -1.26 -0.43 0.00 0.71 0.00 0.00 54.79 53.89 1ad9 n ASP 82 Cb 0.25 0.03 -0.02 0.00 -0.02 0.00 0.00 41.12 41.35 1ad9 n ASP 82 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1ad9 s PHE 83 N -2.15 2.67 0.00 1.24 0.08 -1.22 -4.87 117.98 113.72 1ad9 s PHE 83 Ca 0.35 0.66 0.00 0.00 0.12 0.00 0.00 56.93 58.06 1ad9 s PHE 83 Cb 0.21 -4.42 0.00 0.00 -0.57 0.00 0.00 43.02 38.23 1ad9 s PHE 83 CO 0.39 -1.51 0.00 0.00 -0.10 0.00 0.00 175.22 174.00 1ad9 n ALA 84 N 8.23 0.00 -2.91 5.36 0.00 -1.22 -4.96 120.51 125.01 1ad9 n ALA 84 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.24 1ad9 n ALA 84 Cb 0.49 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.80 1ad9 n ALA 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1ad9 s THR 85 N -2.72 3.11 -0.17 0.00 2.01 -0.44 -0.43 115.64 117.00 1ad9 s THR 85 Ca 0.00 -0.66 -0.01 0.00 0.31 0.00 0.00 61.69 61.34 1ad9 s THR 85 Cb 0.00 -2.29 -0.00 0.00 0.01 0.00 0.00 72.50 70.22 1ad9 s THR 85 CO 0.00 0.54 -0.12 -0.31 -0.69 0.00 0.00 174.62 174.04 1ad9 s TYR 86 N 0.05 2.84 0.03 4.92 1.51 -0.01 -0.02 117.35 126.67 1ad9 s TYR 86 Ca -0.05 -0.97 0.07 0.00 -1.01 0.00 0.00 57.07 55.11 1ad9 s TYR 86 Cb -0.14 -1.94 -0.03 0.00 -0.11 0.00 0.00 41.96 39.74 1ad9 s TYR 86 CO 0.04 -0.46 -0.18 0.71 -1.11 0.00 0.00 175.55 174.55 1ad9 s TYR 87 N 0.91 2.55 -0.02 2.71 1.51 0.05 -1.48 117.35 123.59 1ad9 s TYR 87 Ca -0.03 -0.26 0.04 0.00 -1.01 0.00 0.00 57.07 55.81 1ad9 s TYR 87 Cb -0.15 -1.47 -0.03 0.00 -0.11 0.00 0.00 41.96 40.20 1ad9 s TYR 87 CO -0.01 0.23 -0.12 0.00 -1.11 0.00 0.00 175.55 174.55 1ad9 s MET 89 N -1.05 0.63 -0.18 0.00 1.75 0.55 -1.15 119.30 119.85 1ad9 s MET 89 Ca 0.14 -0.62 -0.07 0.00 -1.25 0.00 0.00 55.69 53.88 1ad9 s MET 89 Cb -0.11 -0.53 -0.04 0.00 2.84 0.00 0.00 34.83 37.00 1ad9 s MET 89 CO 0.03 0.12 0.05 -1.14 -0.65 0.00 0.00 175.02 173.44 1ad9 s GLN 90 N -1.10 3.94 -0.22 4.11 -0.44 -0.72 0.46 119.66 125.69 1ad9 s GLN 90 Ca -0.03 -0.36 0.11 0.00 -2.50 0.00 0.00 55.36 52.57 1ad9 s GLN 90 Cb -0.07 -3.18 0.42 0.00 -1.64 0.00 0.00 33.01 28.54 1ad9 s GLN 90 CO 0.01 0.26 1.22 -2.39 0.50 0.00 0.00 175.29 174.89 1ad9 n HIS 91 N 3.55 0.16 -0.07 1.67 1.44 -0.99 -3.35 115.22 117.62 1ad9 n HIS 91 Ca -0.17 -1.54 -0.11 0.00 -2.01 0.00 0.00 57.72 53.90 1ad9 n HIS 91 Cb 0.52 -0.26 -0.08 0.00 0.12 0.00 0.00 29.99 30.29 1ad9 n HIS 91 CO 0.00 0.00 0.00 1.25 -2.81 0.00 0.00 176.34 174.78 1ad9 h LEU 92 N 1.06 0.00 -9.58 2.39 5.85 -1.95 -3.49 115.31 109.59 1ad9 h LEU 92 Ca 0.02 -0.54 -0.61 0.00 0.84 0.00 0.00 57.88 57.59 1ad9 h LEU 92 Cb 1.04 0.00 -0.12 0.00 0.37 0.00 0.00 40.66 41.95 1ad9 h LEU 92 CO 0.05 0.94 -0.63 -1.61 -0.34 0.00 0.00 178.44 176.85 1ad9 s GLU 93 N -2.08 1.95 -0.11 1.25 2.02 -1.26 -5.14 118.70 115.33 1ad9 s GLU 93 Ca -0.16 -1.96 -0.06 0.00 0.02 0.00 0.00 54.97 52.82 1ad9 s GLU 93 Cb 0.00 -1.74 -0.04 0.00 0.10 0.00 0.00 34.13 32.45 1ad9 s GLU 93 CO 0.45 0.05 0.12 0.71 0.02 0.00 0.00 175.26 176.61 1ad9 s TYR 94 N -2.63 3.53 0.51 1.61 2.02 -1.26 -3.63 117.35 117.51 1ad9 s TYR 94 Ca 0.34 0.47 -0.07 0.00 -0.37 0.00 0.00 57.07 57.44 1ad9 s TYR 94 Cb 0.05 -1.91 -0.04 0.00 -0.40 0.00 0.00 41.96 39.66 1ad9 s TYR 94 CO 0.18 0.70 0.84 -1.25 -1.57 0.00 0.00 175.55 174.45 1ad9 s PRO 95 N -1.09 3.58 0.38 -1.71 0.04 -1.26 -4.48 135.00 130.46 1ad9 s PRO 95 Ca 0.16 0.36 -0.27 0.00 0.04 0.00 0.00 61.00 61.28 1ad9 s PRO 95 Cb -0.12 -2.31 -0.10 0.00 0.04 0.00 0.00 34.50 32.02 1ad9 s PRO 95 CO 0.05 -0.27 1.37 -0.06 0.04 0.00 0.00 177.00 178.13 1ad9 s PHE 96 N -2.81 2.79 0.02 0.56 0.08 -1.24 -4.71 117.98 112.67 1ad9 s PHE 96 Ca 0.50 1.33 0.03 0.00 0.12 0.00 0.00 56.93 58.90 1ad9 s PHE 96 Cb -0.10 -3.80 -0.01 0.00 -0.57 0.00 0.00 43.02 38.53 1ad9 s PHE 96 CO 0.46 -2.36 -0.10 0.95 -0.10 0.00 0.00 175.22 174.07 1ad9 s THR 97 N -1.17 0.74 0.51 0.64 -4.23 -1.21 -5.01 115.64 105.91 1ad9 s THR 97 Ca 0.53 -0.66 0.08 0.00 -1.18 0.00 0.00 61.69 60.46 1ad9 s THR 97 Cb -0.42 -0.67 0.04 0.00 1.34 0.00 0.00 72.50 72.79 1ad9 s THR 97 CO 0.55 0.02 0.54 -0.36 -0.54 0.00 0.00 174.62 174.84 1ad9 s PHE 98 N -0.59 1.92 0.43 3.99 0.40 -1.26 -1.76 117.98 121.11 1ad9 s PHE 98 Ca 0.00 -0.68 0.06 0.00 -0.60 0.00 0.00 56.93 55.71 1ad9 s PHE 98 Cb -0.06 -2.12 0.01 0.00 0.51 0.00 0.00 43.02 41.37 1ad9 s PHE 98 CO 0.00 -0.61 0.59 0.20 0.70 0.00 0.00 175.22 176.10 1ad9 s GLY 99 N -4.38 1.84 0.59 4.36 0.00 -0.30 -4.43 107.32 105.00 1ad9 s GLY 99 Ca 0.49 -1.53 0.29 0.00 0.00 0.00 0.00 44.72 43.96 1ad9 s GLY 99 CO 0.30 -1.35 2.08 0.06 0.00 0.00 0.00 173.10 174.18 1ad9 h GLN 100 N 0.57 0.00 0.00 2.90 -0.00 -1.89 -3.45 115.11 113.25 1ad9 h GLN 100 Ca -0.42 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.23 1ad9 h GLN 100 Cb 1.28 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.76 1ad9 h GLN 100 CO 0.48 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.72 1ad9 n GLY 101 N -1.41 0.55 2.88 0.06 0.00 -1.26 -5.04 105.19 100.97 1ad9 n GLY 101 Ca 0.02 -1.62 -0.23 0.00 0.00 0.00 0.00 46.02 44.19 1ad9 n GLY 101 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1ad9 s THR 102 N -2.72 0.68 -0.13 2.61 -1.32 -0.55 -4.71 115.64 109.51 1ad9 s THR 102 Ca 0.00 -0.14 -0.20 0.00 -1.21 0.00 0.00 61.69 60.14 1ad9 s THR 102 Cb 0.00 -0.73 -0.04 0.00 -1.51 0.00 0.00 72.50 70.23 1ad9 s THR 102 CO 0.00 0.28 0.57 -0.75 -2.21 0.00 0.00 174.62 172.52 1ad9 s LYS 103 N 1.36 4.33 -0.50 7.08 2.20 -0.65 -0.83 119.74 132.73 1ad9 s LYS 103 Ca -0.03 0.60 -0.13 0.00 -0.36 0.00 0.00 55.97 56.05 1ad9 s LYS 103 Cb -0.14 -3.48 0.12 0.00 -1.51 0.00 0.00 37.83 32.82 1ad9 s LYS 103 CO -0.03 0.03 0.41 0.08 -0.36 0.00 0.00 175.35 175.48 1ad9 s VAL 104 N 1.01 4.73 0.18 4.02 1.01 0.43 -0.20 120.40 131.56 1ad9 s VAL 104 Ca 0.30 -1.57 0.04 0.00 0.00 0.00 0.00 61.98 60.74 1ad9 s VAL 104 Cb -0.16 -4.03 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 1ad9 s VAL 104 CO 0.12 -0.78 0.26 -1.83 0.00 0.00 0.00 175.10 172.88 1ad9 s GLU 105 N 1.49 3.29 0.03 2.72 4.04 -0.56 -3.44 118.70 126.26 1ad9 s GLU 105 Ca 0.04 -0.72 -0.30 0.00 0.04 0.00 0.00 54.97 54.03 1ad9 s GLU 105 Cb -0.27 -2.85 -0.06 0.00 0.02 0.00 0.00 34.13 30.96 1ad9 s GLU 105 CO 0.02 0.49 1.47 0.08 -1.84 0.00 0.00 175.26 175.47 1ad9 s VAL 106 N -1.82 3.51 0.23 1.83 1.01 -1.26 -1.69 120.40 122.21 1ad9 s VAL 106 Ca 0.34 0.92 -0.22 0.00 0.00 0.00 0.00 61.98 63.02 1ad9 s VAL 106 Cb -0.10 -3.59 -0.09 0.00 0.00 0.00 0.00 36.38 32.60 1ad9 s VAL 106 CO 0.27 0.00 0.78 -0.75 0.00 0.00 0.00 175.10 175.41 1ad9 s LYS 106 N 2.38 4.39 0.39 2.72 2.47 -0.84 -4.81 119.74 126.43 1ad9 s LYS 106 Ca 0.66 1.03 -0.12 0.00 -1.56 0.00 0.00 55.97 55.98 1ad9 s LYS 106 Cb -0.34 -2.94 0.05 0.00 -1.46 0.00 0.00 37.83 33.13 1ad9 s LYS 106 CO 0.28 0.41 0.73 -0.98 0.16 0.00 0.00 175.35 175.95 1ad9 s ARG 107 N -1.81 2.21 0.65 4.03 1.70 -1.26 -4.81 118.95 119.65 1ad9 s ARG 107 Ca 0.43 -1.54 -0.16 0.00 -0.47 0.00 0.00 55.73 53.99 1ad9 s ARG 107 Cb -0.18 0.59 -0.01 0.00 -0.57 0.00 0.00 34.95 34.78 1ad9 s ARG 107 CO 0.23 -1.01 1.13 0.95 -1.08 0.00 0.00 175.30 175.52 1ad9 s THR 108 N -2.35 3.06 0.18 4.99 -4.23 -1.26 -4.95 115.64 111.08 1ad9 s THR 108 Ca 0.19 0.53 -0.31 0.00 -1.18 0.00 0.00 61.69 60.92 1ad9 s THR 108 Cb -0.04 -3.07 -0.09 0.00 1.34 0.00 0.00 72.50 70.63 1ad9 s THR 108 CO 0.14 -0.27 1.42 -0.69 -0.54 0.00 0.00 174.62 174.68 1ad9 s VAL 109 N -2.16 2.96 -0.15 2.29 1.01 -1.26 -4.75 120.40 118.33 1ad9 s VAL 109 Ca 0.69 0.74 -0.02 0.00 0.00 0.00 0.00 61.98 63.39 1ad9 s VAL 109 Cb -0.23 -3.47 0.05 0.00 0.00 0.00 0.00 36.38 32.73 1ad9 s VAL 109 CO 0.39 0.09 0.00 0.00 0.00 0.00 0.00 175.10 175.58 1ad9 s ALA 110 N 0.60 1.05 0.46 5.51 0.00 -0.41 -4.94 121.76 124.02 1ad9 s ALA 110 Ca 0.63 -0.57 -0.24 0.00 0.00 0.00 0.00 51.96 51.77 1ad9 s ALA 110 Cb -0.40 -1.04 -0.07 0.00 0.00 0.00 0.00 23.12 21.61 1ad9 s ALA 110 CO 0.36 -0.85 1.32 0.00 0.00 0.00 0.00 175.76 176.58 1ad9 s ALA 111 N 1.83 3.09 0.05 0.00 0.00 -1.26 -1.51 121.76 123.95 1ad9 s ALA 111 Ca 0.01 1.26 -0.30 0.00 0.00 0.00 0.00 51.96 52.93 1ad9 s ALA 111 Cb -0.15 -3.51 -0.04 0.00 0.00 0.00 0.00 23.12 19.41 1ad9 s ALA 111 CO -0.07 -1.02 0.97 -1.25 0.00 0.00 0.00 175.76 174.39 1ad9 s PRO 112 N -2.53 4.62 -0.27 0.00 0.04 -1.26 -4.68 135.00 130.91 1ad9 s PRO 112 Ca 0.63 1.43 -0.29 0.00 0.04 0.00 0.00 61.00 62.81 1ad9 s PRO 112 Cb -0.38 -3.42 0.01 0.00 0.04 0.00 0.00 34.50 30.74 1ad9 s PRO 112 CO 0.48 0.07 1.18 -1.12 0.04 0.00 0.00 177.00 177.65 1ad9 s SER 113 N 0.53 6.87 0.01 6.66 0.01 -0.71 -4.79 113.70 122.28 1ad9 s SER 113 Ca 0.50 1.27 -0.09 0.00 1.31 0.00 0.00 55.95 58.94 1ad9 s SER 113 Cb -0.22 -2.54 -0.05 0.00 0.21 0.00 0.00 66.02 63.42 1ad9 s SER 113 CO 0.29 -0.90 0.30 -0.69 0.41 0.00 0.00 173.24 172.65 1ad9 s VAL 114 N 3.80 5.24 -0.05 3.43 1.01 -1.26 -0.80 120.40 131.77 1ad9 s VAL 114 Ca 0.51 0.33 -0.04 0.00 0.00 0.00 0.00 61.98 62.78 1ad9 s VAL 114 Cb -0.16 -3.59 0.02 0.00 0.00 0.00 0.00 36.38 32.65 1ad9 s VAL 114 CO 0.17 0.41 0.14 -0.36 0.00 0.00 0.00 175.10 175.45 1ad9 s PHE 115 N -1.26 -0.15 -0.12 5.22 0.08 -0.63 -4.98 117.98 116.13 1ad9 s PHE 115 Ca 0.27 0.39 0.01 0.00 0.12 0.00 0.00 56.93 57.72 1ad9 s PHE 115 Cb -0.14 0.03 0.02 0.00 -0.57 0.00 0.00 43.02 42.36 1ad9 s PHE 115 CO 0.15 -0.09 -0.15 -1.50 -0.10 0.00 0.00 175.22 173.53 1ad9 s ILE 116 N 0.24 1.51 -0.15 0.64 2.07 -1.26 0.58 121.20 124.83 1ad9 s ILE 116 Ca -0.01 -0.63 -0.03 0.00 -1.41 0.00 0.00 60.65 58.56 1ad9 s ILE 116 Cb -0.03 -1.40 -0.03 0.00 0.13 0.00 0.00 42.46 41.14 1ad9 s ILE 116 CO -0.01 0.45 -0.03 -0.36 -1.91 0.00 0.00 174.94 173.07 1ad9 s PHE 117 N 1.19 3.04 0.51 3.50 0.08 0.10 -4.98 117.98 121.42 1ad9 s PHE 117 Ca -0.02 -0.22 -0.09 0.00 0.12 0.00 0.00 56.93 56.72 1ad9 s PHE 117 Cb -0.14 -1.93 -0.05 0.00 -0.57 0.00 0.00 43.02 40.33 1ad9 s PHE 117 CO -0.05 0.03 0.87 -1.25 -0.10 0.00 0.00 175.22 174.73 1ad9 s PRO 118 N 0.20 3.64 0.37 0.24 0.04 -1.26 -1.89 135.00 136.33 1ad9 s PRO 118 Ca -0.02 0.48 -0.28 0.00 0.04 0.00 0.00 61.00 61.22 1ad9 s PRO 118 Cb -0.14 -2.27 -0.10 0.00 0.04 0.00 0.00 34.50 32.03 1ad9 s PRO 118 CO 0.03 -0.29 1.36 -1.25 0.04 0.00 0.00 177.00 176.89 1ad9 s PRO 119 N -4.66 4.16 0.83 0.56 0.04 -1.25 -4.87 135.00 129.82 1ad9 s PRO 119 Ca 0.51 2.30 -0.11 0.00 0.04 0.00 0.00 61.00 63.75 1ad9 s PRO 119 Cb -0.10 -2.95 0.09 0.00 0.04 0.00 0.00 34.50 31.58 1ad9 s PRO 119 CO 0.44 -0.38 1.09 -1.54 0.04 0.00 0.00 177.00 176.65 1ad9 s SER 120 N -0.46 3.96 0.17 6.66 1.04 -1.26 -4.92 113.70 118.89 1ad9 s SER 120 Ca 0.52 1.72 -0.13 0.00 0.48 0.00 0.00 55.95 58.55 1ad9 s SER 120 Cb -0.41 -2.39 0.08 0.00 0.10 0.00 0.00 66.02 63.39 1ad9 s SER 120 CO 0.55 -2.37 1.79 0.44 0.98 0.00 0.00 173.24 174.63 1ad9 h ASP 121 N -1.36 0.71 -0.85 7.02 5.19 -1.99 -2.81 116.42 122.33 1ad9 h ASP 121 Ca -0.46 -0.09 0.08 0.00 -0.62 0.00 0.00 57.03 55.95 1ad9 h ASP 121 Cb 1.25 -0.18 -0.07 0.00 0.18 0.00 0.00 39.33 40.51 1ad9 h ASP 121 CO 0.52 0.59 0.51 -0.33 -3.12 0.00 0.00 179.24 177.41 1ad9 h GLU 122 N 0.77 0.85 -0.29 3.56 5.08 -1.97 -1.11 114.58 121.48 1ad9 h GLU 122 Ca 0.20 -0.05 -0.15 0.00 -1.00 0.00 0.00 59.36 58.37 1ad9 h GLU 122 Cb 0.03 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.08 1ad9 h GLU 122 CO -0.03 0.56 -0.41 0.37 -1.00 0.00 0.00 179.01 178.50 1ad9 h GLN 123 N 0.88 0.71 0.00 2.33 4.15 -1.82 -2.39 115.11 118.96 1ad9 h GLN 123 Ca 0.40 -0.37 -0.06 0.00 0.77 0.00 0.00 58.65 59.39 1ad9 h GLN 123 Cb 0.30 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.00 1ad9 h GLN 123 CO -0.22 0.99 -0.28 -0.07 -1.93 0.00 0.00 178.83 177.31 1ad9 h LEU 124 N 0.58 0.00 0.00 -2.39 3.38 -1.18 -0.56 115.31 115.14 1ad9 h LEU 124 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1ad9 h LEU 124 Cb 0.95 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.70 1ad9 h LEU 124 CO 0.09 0.28 0.00 1.17 0.09 0.00 0.00 178.44 180.07 1ad9 n LYS 125 N -3.71 0.90 0.00 1.13 4.81 -0.47 -2.96 118.16 117.86 1ad9 n LYS 125 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.43 1ad9 n LYS 125 Cb 0.39 -1.24 0.00 0.00 0.02 0.00 0.00 35.03 34.20 1ad9 n LYS 125 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 1ad9 n SER 126 N -0.74 1.37 0.00 3.14 3.41 -0.22 -5.04 113.62 115.54 1ad9 n SER 126 Ca 0.10 -1.63 0.00 0.00 -0.26 0.00 0.00 58.87 57.08 1ad9 n SER 126 Cb 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 1ad9 n SER 126 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ad9 n GLY 127 N -0.32 3.08 3.77 5.00 0.00 -1.16 -5.04 105.19 110.52 1ad9 n GLY 127 Ca 0.00 -0.57 -0.22 0.00 0.00 0.00 0.00 46.02 45.23 1ad9 n GLY 127 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ad9 s THR 128 N -1.71 4.15 -0.02 2.61 -4.23 -1.23 -1.10 115.64 114.11 1ad9 s THR 128 Ca 0.00 -1.53 -0.00 0.00 -1.18 0.00 0.00 61.69 58.97 1ad9 s THR 128 Cb 0.00 -3.23 0.03 0.00 1.34 0.00 0.00 72.50 70.64 1ad9 s THR 128 CO 0.00 -0.34 0.03 0.00 -0.54 0.00 0.00 174.62 173.76 1ad9 s ALA 129 N -2.16 0.16 -0.08 3.99 0.00 0.03 -3.67 121.76 120.01 1ad9 s ALA 129 Ca 0.32 0.26 0.01 0.00 0.00 0.00 0.00 51.96 52.55 1ad9 s ALA 129 Cb -0.08 -0.31 0.02 0.00 0.00 0.00 0.00 23.12 22.76 1ad9 s ALA 129 CO 0.23 -0.14 -0.08 -1.54 0.00 0.00 0.00 175.76 174.23 1ad9 s SER 130 N 1.19 1.77 -0.18 0.00 1.04 -1.26 -0.55 113.70 115.71 1ad9 s SER 130 Ca -0.08 -0.25 -0.10 0.00 0.48 0.00 0.00 55.95 56.00 1ad9 s SER 130 Cb -0.13 -0.73 -0.05 0.00 0.10 0.00 0.00 66.02 65.21 1ad9 s SER 130 CO -0.03 -0.06 0.16 -0.69 0.98 0.00 0.00 173.24 173.60 1ad9 s VAL 131 N 1.22 5.40 -0.12 5.02 1.01 0.62 -3.74 120.40 129.82 1ad9 s VAL 131 Ca -0.05 0.26 -0.01 0.00 0.00 0.00 0.00 61.98 62.19 1ad9 s VAL 131 Cb -0.14 -3.49 -0.02 0.00 0.00 0.00 0.00 36.38 32.73 1ad9 s VAL 131 CO -0.02 0.46 -0.09 -0.69 0.00 0.00 0.00 175.10 174.76 1ad9 s VAL 132 N 0.13 3.43 -0.15 2.92 1.01 -0.79 0.16 120.40 127.11 1ad9 s VAL 132 Ca 0.11 -0.54 0.02 0.00 0.00 0.00 0.00 61.98 61.56 1ad9 s VAL 132 Cb -0.12 -2.44 0.01 0.00 0.00 0.00 0.00 36.38 33.83 1ad9 s VAL 132 CO 0.00 0.54 -0.20 0.00 0.00 0.00 0.00 175.10 175.44 1ad9 s LEU 134 N 0.88 3.99 -0.35 0.00 2.96 0.20 -1.40 118.68 124.96 1ad9 s LEU 134 Ca -0.05 0.28 0.03 0.00 -0.22 0.00 0.00 54.13 54.17 1ad9 s LEU 134 Cb -0.15 -1.96 0.10 0.00 0.50 0.00 0.00 46.19 44.68 1ad9 s LEU 134 CO -0.03 0.36 0.07 -0.76 -1.32 0.00 0.00 176.35 174.67 1ad9 s LEU 135 N -0.72 4.35 -0.01 -0.68 1.43 0.24 -1.61 118.68 121.68 1ad9 s LEU 135 Ca 0.12 -2.15 -0.15 0.00 -1.03 0.00 0.00 54.13 50.92 1ad9 s LEU 135 Cb -0.12 -1.51 -0.06 0.00 0.03 0.00 0.00 46.19 44.53 1ad9 s LEU 135 CO 0.03 -0.37 0.41 0.21 0.23 0.00 0.00 176.35 176.86 1ad9 s ASN 136 N 0.91 6.80 -0.03 2.29 2.47 0.02 -0.76 114.94 126.64 1ad9 s ASN 136 Ca 0.11 0.95 -0.03 0.00 0.42 0.00 0.00 52.86 54.32 1ad9 s ASN 136 Cb -0.19 -2.26 0.00 0.00 -1.45 0.00 0.00 41.25 37.36 1ad9 s ASN 136 CO -0.10 0.30 0.04 0.59 -3.72 0.00 0.00 177.10 174.21 1ad9 n ASN 137 N 1.99 -4.51 -4.16 -4.21 3.02 -0.99 -1.74 115.26 104.66 1ad9 n ASN 137 Ca -0.13 0.24 -0.10 0.00 -0.03 0.00 0.00 54.58 54.56 1ad9 n ASN 137 Cb 0.52 -1.10 -0.10 0.00 -0.61 0.00 0.00 39.78 38.49 1ad9 n ASN 137 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 1ad9 s PHE 138 N -0.73 0.91 -0.24 3.10 -0.12 0.90 -4.46 117.98 117.33 1ad9 s PHE 138 Ca 0.03 -1.17 -0.19 0.00 -0.05 0.00 0.00 56.93 55.54 1ad9 s PHE 138 Cb -0.00 -0.52 0.07 0.00 -0.63 0.00 0.00 43.02 41.94 1ad9 s PHE 138 CO 0.06 -0.44 0.63 -0.47 -0.05 0.00 0.00 175.22 174.94 1ad9 s TYR 139 N -3.95 -0.80 0.95 3.49 6.14 -0.57 -0.63 117.35 121.98 1ad9 s TYR 139 Ca 0.23 1.78 -0.15 0.00 0.64 0.00 0.00 57.07 59.57 1ad9 s TYR 139 Cb 0.07 0.36 0.17 0.00 0.42 0.00 0.00 41.96 42.98 1ad9 s TYR 139 CO 0.01 -0.39 1.24 -1.25 0.64 0.00 0.00 175.55 175.80 1ad9 s PRO 140 N 0.83 0.81 0.33 4.97 0.04 -1.26 -1.29 135.00 139.43 1ad9 s PRO 140 Ca -0.04 -0.16 0.09 0.00 0.04 0.00 0.00 61.00 60.93 1ad9 s PRO 140 Cb -0.05 -1.84 0.84 0.00 0.04 0.00 0.00 34.50 33.48 1ad9 s PRO 140 CO -0.07 -2.34 1.79 -0.09 0.04 0.00 0.00 177.00 176.33 1ad9 h ARG 141 N -1.59 0.65 -6.25 4.56 1.12 -1.98 -3.43 114.38 107.46 1ad9 h ARG 141 Ca -0.46 -0.04 -0.64 0.00 -1.11 0.00 0.00 59.98 57.73 1ad9 h ARG 141 Cb 1.28 -0.15 0.02 0.00 -0.01 0.00 0.00 29.97 31.11 1ad9 h ARG 141 CO 0.47 0.43 1.06 0.39 -3.11 0.00 0.00 179.97 179.21 1ad9 n GLU 142 N -4.72 1.95 -3.63 0.20 4.71 -1.26 -4.96 120.64 112.93 1ad9 n GLU 142 Ca 0.23 0.71 -0.14 0.00 -0.01 0.00 0.00 57.16 57.95 1ad9 n GLU 142 Cb 0.63 -2.52 -0.07 0.00 -1.01 0.00 0.00 31.44 28.47 1ad9 n GLU 142 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1ad9 s ALA 143 N 3.95 -1.75 -0.19 0.62 0.00 -1.26 -4.67 121.76 118.46 1ad9 s ALA 143 Ca 0.94 1.94 -0.02 0.00 0.00 0.00 0.00 51.96 54.82 1ad9 s ALA 143 Cb -0.78 -1.07 -0.00 0.00 0.00 0.00 0.00 23.12 21.27 1ad9 s ALA 143 CO 0.55 -0.34 -0.10 0.21 0.00 0.00 0.00 175.76 176.08 1ad9 s LYS 144 N 0.25 3.29 -0.26 0.00 2.20 -0.86 -5.00 119.74 119.36 1ad9 s LYS 144 Ca -0.01 -0.69 -0.06 0.00 -0.36 0.00 0.00 55.97 54.85 1ad9 s LYS 144 Cb -0.05 -2.80 -0.01 0.00 -1.51 0.00 0.00 37.83 33.46 1ad9 s LYS 144 CO 0.02 -0.08 0.05 0.08 -0.36 0.00 0.00 175.35 175.06 1ad9 s VAL 145 N 1.11 3.96 -0.25 4.02 1.01 -1.26 -0.98 120.40 128.01 1ad9 s VAL 145 Ca 0.01 -0.46 -0.02 0.00 0.00 0.00 0.00 61.98 61.50 1ad9 s VAL 145 Cb -0.14 -2.92 0.02 0.00 0.00 0.00 0.00 36.38 33.33 1ad9 s VAL 145 CO -0.03 0.25 -0.04 -1.58 0.00 0.00 0.00 175.10 173.70 1ad9 s GLN 146 N 1.54 2.90 0.06 2.72 2.00 -0.07 -4.97 119.66 123.84 1ad9 s GLN 146 Ca 0.05 -0.94 -0.20 0.00 -2.00 0.00 0.00 55.36 52.27 1ad9 s GLN 146 Cb -0.16 -3.04 -0.06 0.00 0.80 0.00 0.00 33.01 30.55 1ad9 s GLN 146 CO 0.02 -0.39 0.59 -1.58 -0.50 0.00 0.00 175.29 173.42 1ad9 s TRP 147 N 1.36 3.79 -0.10 1.67 0.52 -1.26 -0.12 118.94 124.79 1ad9 s TRP 147 Ca 0.01 1.28 -0.02 0.00 0.02 0.00 0.00 56.10 57.40 1ad9 s TRP 147 Cb -0.17 -2.54 0.03 0.00 -1.15 0.00 0.00 33.47 29.65 1ad9 s TRP 147 CO -0.03 0.53 0.00 0.15 0.02 0.00 0.00 176.95 177.62 1ad9 s LYS 148 N -0.90 0.68 -0.32 4.98 1.02 -0.95 -1.25 119.74 123.01 1ad9 s LYS 148 Ca 0.30 -0.03 -0.10 0.00 0.02 0.00 0.00 55.97 56.16 1ad9 s LYS 148 Cb -0.19 -1.26 0.00 0.00 -0.52 0.00 0.00 37.83 35.85 1ad9 s LYS 148 CO 0.19 -0.37 0.16 0.08 -0.92 0.00 0.00 175.35 174.48 1ad9 s VAL 149 N 1.93 4.53 -1.37 3.17 1.01 -0.72 -0.96 120.40 127.99 1ad9 s VAL 149 Ca 0.04 -0.53 -0.04 0.00 0.00 0.00 0.00 61.98 61.44 1ad9 s VAL 149 Cb -0.13 -3.36 0.03 0.00 0.00 0.00 0.00 36.38 32.92 1ad9 s VAL 149 CO -0.06 0.01 0.80 0.47 0.00 0.00 0.00 175.10 176.32 1ad9 n ASP 150 N 4.97 -2.41 -3.83 3.32 8.00 0.65 -2.04 116.55 125.22 1ad9 n ASP 150 Ca -0.13 -0.79 -0.26 0.00 0.71 0.00 0.00 54.79 54.31 1ad9 n ASP 150 Cb 0.48 -4.06 0.03 0.00 -0.02 0.00 0.00 41.12 37.55 1ad9 n ASP 150 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1ad9 n ASN 151 N -2.99 -3.15 -3.81 -2.24 5.15 -1.26 -4.99 115.26 101.96 1ad9 n ASN 151 Ca -0.19 -0.80 -0.24 0.00 -0.60 0.00 0.00 54.58 52.74 1ad9 n ASN 151 Cb 0.63 -3.93 -0.17 0.00 -0.53 0.00 0.00 39.78 35.78 1ad9 n ASN 151 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ad9 s ALA 152 N -3.48 0.92 0.28 5.20 0.00 -0.87 -5.10 121.76 118.71 1ad9 s ALA 152 Ca 0.37 -0.30 -0.30 0.00 0.00 0.00 0.00 51.96 51.72 1ad9 s ALA 152 Cb -0.18 -0.83 -0.12 0.00 0.00 0.00 0.00 23.12 21.99 1ad9 s ALA 152 CO 0.82 -0.50 1.57 1.28 0.00 0.00 0.00 175.76 178.94 1ad9 n LEU 153 N 5.08 4.15 -4.81 0.00 4.32 -1.26 -1.76 117.00 122.71 1ad9 n LEU 153 Ca -0.09 1.14 -0.28 0.00 -0.02 0.00 0.00 56.01 56.77 1ad9 n LEU 153 Cb 0.50 -1.57 -0.06 0.00 -1.62 0.00 0.00 43.42 40.68 1ad9 n LEU 153 CO 0.12 0.05 -0.22 -1.10 -1.22 0.00 0.00 177.39 175.03 1ad9 s GLN 154 N -0.42 2.96 -0.29 3.23 -1.52 -0.38 -4.93 119.66 118.31 1ad9 s GLN 154 Ca 0.65 -0.77 -0.14 0.00 -1.95 0.00 0.00 55.36 53.15 1ad9 s GLN 154 Cb -0.52 -2.72 0.12 0.00 -0.22 0.00 0.00 33.01 29.68 1ad9 s GLN 154 CO 0.48 0.52 0.78 -1.54 -0.25 0.00 0.00 175.29 175.28 1ad9 s SER 155 N -2.86 -0.87 0.00 5.90 1.04 -1.26 -4.62 113.70 111.03 1ad9 s SER 155 Ca 0.31 1.28 0.00 0.00 0.48 0.00 0.00 55.95 58.02 1ad9 s SER 155 Cb -0.11 1.72 0.00 0.00 0.10 0.00 0.00 66.02 67.73 1ad9 s SER 155 CO 0.24 -0.19 0.00 0.61 0.98 0.00 0.00 173.24 174.88 1ad9 n GLY 156 N 4.71 0.77 0.94 7.32 0.00 -1.26 -4.95 105.19 112.72 1ad9 n GLY 156 Ca -0.15 -0.61 0.02 0.00 0.00 0.00 0.00 46.02 45.27 1ad9 n GLY 156 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ad9 n ASN 157 N 1.20 0.40 -3.81 1.61 6.94 -1.26 -5.09 115.26 115.25 1ad9 n ASN 157 Ca 0.00 -1.97 -0.12 0.00 -0.02 0.00 0.00 54.58 52.47 1ad9 n ASN 157 Cb 0.10 -0.23 -0.09 0.00 -2.36 0.00 0.00 39.78 37.21 1ad9 n ASN 157 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 1ad9 s SER 158 N -1.40 -0.08 -0.05 0.53 1.04 -1.26 -0.66 113.70 111.83 1ad9 s SER 158 Ca 0.15 -0.10 0.02 0.00 0.48 0.00 0.00 55.95 56.49 1ad9 s SER 158 Cb 0.17 0.28 0.02 0.00 0.10 0.00 0.00 66.02 66.58 1ad9 s SER 158 CO -0.07 -0.46 -0.08 -1.10 0.98 0.00 0.00 173.24 172.51 1ad9 s GLN 159 N -1.65 1.17 0.34 4.02 -0.21 -0.95 -4.92 119.66 117.46 1ad9 s GLN 159 Ca -0.12 -0.25 0.02 0.00 0.02 0.00 0.00 55.36 55.03 1ad9 s GLN 159 Cb -0.05 -1.05 -0.02 0.00 1.00 0.00 0.00 33.01 32.88 1ad9 s GLN 159 CO 0.02 -0.01 0.52 -1.21 -2.12 0.00 0.00 175.29 172.48 1ad9 s GLU 160 N 0.71 3.36 -0.22 2.91 2.02 -1.26 -1.55 118.70 124.68 1ad9 s GLU 160 Ca -0.12 -0.53 -0.12 0.00 0.02 0.00 0.00 54.97 54.22 1ad9 s GLU 160 Cb -0.14 -2.71 0.07 0.00 0.10 0.00 0.00 34.13 31.44 1ad9 s GLU 160 CO 0.02 0.13 0.54 0.45 0.02 0.00 0.00 175.26 176.41 1ad9 s SER 161 N -4.07 -0.71 -0.04 -0.19 0.15 -0.89 -4.96 113.70 102.99 1ad9 s SER 161 Ca 0.41 1.18 0.07 0.00 0.70 0.00 0.00 55.95 58.30 1ad9 s SER 161 Cb -0.10 1.05 -0.01 0.00 -1.71 0.00 0.00 66.02 65.25 1ad9 s SER 161 CO 0.34 -0.21 -0.24 -0.69 1.20 0.00 0.00 173.24 173.64 1ad9 s VAL 162 N 1.48 1.95 0.63 4.45 1.01 -1.26 -0.62 120.40 128.04 1ad9 s VAL 162 Ca -0.10 -1.03 -0.13 0.00 0.00 0.00 0.00 61.98 60.73 1ad9 s VAL 162 Cb -0.07 -1.64 -0.03 0.00 0.00 0.00 0.00 36.38 34.65 1ad9 s VAL 162 CO -0.16 0.55 1.04 0.42 0.00 0.00 0.00 175.10 176.95 1ad9 s THR 163 N -0.32 4.17 0.56 3.92 -4.23 -0.84 -5.01 115.64 113.89 1ad9 s THR 163 Ca 0.02 0.83 -0.18 0.00 -1.18 0.00 0.00 61.69 61.19 1ad9 s THR 163 Cb -0.12 -3.53 -0.05 0.00 1.34 0.00 0.00 72.50 70.14 1ad9 s THR 163 CO 0.02 -0.80 1.07 -0.70 -0.54 0.00 0.00 174.62 173.67 1ad9 s GLU 164 N -4.67 3.42 0.13 3.99 2.56 -1.26 -4.60 118.70 118.26 1ad9 s GLU 164 Ca 0.59 1.35 -0.35 0.00 0.00 0.00 0.00 54.97 56.56 1ad9 s GLU 164 Cb -0.13 -2.04 -0.16 0.00 2.00 0.00 0.00 34.13 33.80 1ad9 s GLU 164 CO 0.47 -0.75 1.38 0.94 -0.56 0.00 0.00 175.26 176.74 1ad9 n GLN 165 N -1.60 1.46 -1.88 4.30 7.27 -1.26 -4.88 117.38 120.78 1ad9 n GLN 165 Ca 0.10 0.53 -0.42 0.00 0.07 0.00 0.00 57.00 57.28 1ad9 n GLN 165 Cb 0.52 -2.18 -0.02 0.00 2.41 0.00 0.00 30.24 30.97 1ad9 n GLN 165 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1ad9 s ASP 166 N 0.50 6.50 0.00 1.69 2.15 -0.57 -4.91 116.67 122.03 1ad9 s ASP 166 Ca 0.80 2.81 0.25 0.00 0.43 0.00 0.00 52.55 56.84 1ad9 s ASP 166 Cb -0.85 -2.62 1.26 0.00 -0.30 0.00 0.00 42.92 40.40 1ad9 s ASP 166 CO 0.46 -0.83 1.85 -1.54 -0.17 0.00 0.00 175.17 174.94 1ad9 n SER 167 N 2.48 0.00 -0.04 -0.34 3.41 -1.26 -1.86 113.62 116.00 1ad9 n SER 167 Ca 0.08 -0.01 -0.10 0.00 -0.26 0.00 0.00 58.87 58.59 1ad9 n SER 167 Cb 0.38 -0.31 -0.03 0.00 -0.26 0.00 0.00 64.21 63.99 1ad9 n SER 167 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ad9 n LYS 168 N -1.31 0.21 -0.05 4.33 5.02 -1.26 -4.79 118.16 120.31 1ad9 n LYS 168 Ca 0.11 0.09 0.08 0.00 -2.02 0.00 0.00 58.31 56.57 1ad9 n LYS 168 Cb 0.21 -0.85 0.10 0.00 -0.02 0.00 0.00 35.03 34.47 1ad9 n LYS 168 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1ad9 n ASP 169 N -3.48 2.55 -1.83 4.39 5.68 -1.26 -5.00 116.55 117.60 1ad9 n ASP 169 Ca -0.18 -1.74 -0.17 0.00 -0.50 0.00 0.00 54.79 52.20 1ad9 n ASP 169 Cb 0.59 -0.07 -0.05 0.00 -1.14 0.00 0.00 41.12 40.45 1ad9 n ASP 169 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1ad9 n SER 170 N 0.92 -4.70 -4.93 -1.12 7.64 -0.78 -4.97 113.62 105.68 1ad9 n SER 170 Ca 0.11 0.30 -0.21 0.00 1.01 0.00 0.00 58.87 60.08 1ad9 n SER 170 Cb 0.42 -4.13 0.08 0.00 -1.01 0.00 0.00 64.21 59.58 1ad9 n SER 170 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1ad9 s THR 171 N -2.60 2.07 0.20 0.44 -4.23 -1.26 -4.59 115.64 105.68 1ad9 s THR 171 Ca 0.00 -0.90 0.06 0.00 -1.18 0.00 0.00 61.69 59.67 1ad9 s THR 171 Cb 0.00 -2.18 -0.05 0.00 1.34 0.00 0.00 72.50 71.61 1ad9 s THR 171 CO 0.00 0.00 -0.10 -0.31 -0.54 0.00 0.00 174.62 173.67 1ad9 s TYR 172 N -2.82 1.58 0.00 3.99 2.02 0.20 -1.51 117.35 120.82 1ad9 s TYR 172 Ca 0.64 -0.70 0.00 0.00 -0.37 0.00 0.00 57.07 56.64 1ad9 s TYR 172 Cb -0.05 -0.81 -0.00 0.00 -0.40 0.00 0.00 41.96 40.69 1ad9 s TYR 172 CO 0.41 0.20 -0.01 -1.12 -1.57 0.00 0.00 175.55 173.45 1ad9 s SER 173 N -3.29 0.15 0.04 2.29 0.01 -1.26 -0.07 113.70 111.56 1ad9 s SER 173 Ca 0.23 -0.10 0.06 0.00 1.31 0.00 0.00 55.95 57.44 1ad9 s SER 173 Cb 0.02 0.01 -0.02 0.00 0.21 0.00 0.00 66.02 66.23 1ad9 s SER 173 CO 0.06 -0.04 -0.16 -0.22 0.41 0.00 0.00 173.24 173.29 1ad9 s LEU 174 N -0.28 2.16 -0.29 2.44 0.20 0.06 -1.98 118.68 120.99 1ad9 s LEU 174 Ca -0.02 -0.46 0.02 0.00 0.69 0.00 0.00 54.13 54.35 1ad9 s LEU 174 Cb -0.02 -0.72 0.08 0.00 -0.43 0.00 0.00 46.19 45.10 1ad9 s LEU 174 CO -0.00 0.08 0.01 -0.55 -0.29 0.00 0.00 176.35 175.60 1ad9 s SER 175 N -1.09 4.23 -0.17 3.68 0.15 0.21 -0.59 113.70 120.14 1ad9 s SER 175 Ca 0.04 -1.62 -0.13 0.00 0.70 0.00 0.00 55.95 54.94 1ad9 s SER 175 Cb -0.08 -1.28 -0.05 0.00 -1.71 0.00 0.00 66.02 62.90 1ad9 s SER 175 CO 0.01 -0.32 0.27 -0.55 1.20 0.00 0.00 173.24 173.85 1ad9 s SER 176 N 1.26 6.40 -0.26 5.45 0.15 -0.49 -2.09 113.70 124.12 1ad9 s SER 176 Ca 0.03 0.47 0.02 0.00 0.70 0.00 0.00 55.95 57.17 1ad9 s SER 176 Cb -0.19 -2.17 0.07 0.00 -1.71 0.00 0.00 66.02 62.02 1ad9 s SER 176 CO -0.11 0.11 -0.06 -0.89 1.20 0.00 0.00 173.24 173.49 1ad9 s THR 177 N 0.45 1.95 -0.15 6.45 2.01 -0.59 -0.54 115.64 125.20 1ad9 s THR 177 Ca 0.15 -1.60 -0.24 0.00 0.31 0.00 0.00 61.69 60.31 1ad9 s THR 177 Cb -0.13 -2.17 -0.02 0.00 0.01 0.00 0.00 72.50 70.20 1ad9 s THR 177 CO 0.03 -0.15 0.78 -0.22 -0.69 0.00 0.00 174.62 174.37 1ad9 s LEU 178 N 1.18 4.20 -0.18 4.42 2.96 0.12 -2.25 118.68 129.13 1ad9 s LEU 178 Ca -0.05 1.13 -0.03 0.00 -0.22 0.00 0.00 54.13 54.96 1ad9 s LEU 178 Cb -0.19 -3.16 -0.02 0.00 0.50 0.00 0.00 46.19 43.31 1ad9 s LEU 178 CO -0.06 -0.33 -0.05 -0.89 -1.32 0.00 0.00 176.35 173.70 1ad9 s THR 179 N 1.88 3.60 0.18 3.68 2.01 0.17 -0.28 115.64 126.88 1ad9 s THR 179 Ca 0.37 -0.44 0.01 0.00 0.31 0.00 0.00 61.69 61.94 1ad9 s THR 179 Cb -0.17 -2.60 -0.05 0.00 0.01 0.00 0.00 72.50 69.70 1ad9 s THR 179 CO 0.13 0.46 0.02 -0.76 -0.69 0.00 0.00 174.62 173.79 1ad9 s LEU 180 N 0.84 2.01 0.28 4.42 1.43 0.29 -4.87 118.68 123.08 1ad9 s LEU 180 Ca -0.01 -1.21 -0.14 0.00 -1.03 0.00 0.00 54.13 51.74 1ad9 s LEU 180 Cb -0.15 -0.01 -0.08 0.00 0.03 0.00 0.00 46.19 45.98 1ad9 s LEU 180 CO 0.01 -0.61 0.68 -0.94 0.23 0.00 0.00 176.35 175.73 1ad9 s SER 181 N -3.18 6.78 0.34 2.29 1.04 -1.26 -0.79 113.70 118.92 1ad9 s SER 181 Ca 0.26 1.21 0.11 0.00 0.48 0.00 0.00 55.95 58.00 1ad9 s SER 181 Cb 0.06 -2.34 0.88 0.00 0.10 0.00 0.00 66.02 64.72 1ad9 s SER 181 CO 0.05 -0.13 1.79 0.50 0.98 0.00 0.00 173.24 176.43 1ad9 h LYS 182 N 2.52 0.61 -0.30 4.02 3.64 -1.38 -0.16 116.57 125.52 1ad9 h LYS 182 Ca -0.48 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 58.85 1ad9 h LYS 182 Cb 1.18 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.85 1ad9 h LYS 182 CO 0.66 0.40 0.13 0.00 -2.27 0.00 0.00 179.45 178.37 1ad9 h ALA 183 N 1.63 0.38 -0.58 5.00 0.00 -1.93 0.07 119.26 123.84 1ad9 h ALA 183 Ca 0.56 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 55.26 1ad9 h ALA 183 Cb 1.06 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 1ad9 h ALA 183 CO -0.32 -0.04 -0.01 -0.44 0.00 0.00 0.00 179.25 178.45 1ad9 h ASP 184 N 0.33 0.99 0.03 0.00 5.19 -1.51 -2.66 116.42 118.78 1ad9 h ASP 184 Ca 0.10 -0.28 -0.00 0.00 -0.62 0.00 0.00 57.03 56.23 1ad9 h ASP 184 Cb 0.16 -0.27 0.00 0.00 0.18 0.00 0.00 39.33 39.40 1ad9 h ASP 184 CO -0.01 1.05 -0.01 0.22 -3.12 0.00 0.00 179.24 177.37 1ad9 h TYR 185 N 0.93 -0.03 -0.39 4.55 3.20 -0.92 -2.87 116.97 121.42 1ad9 h TYR 185 Ca 0.17 -0.00 0.11 0.00 3.14 0.00 0.00 58.73 62.15 1ad9 h TYR 185 Cb 0.55 0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.81 1ad9 h TYR 185 CO 0.04 0.16 0.32 1.49 -1.64 0.00 0.00 178.16 178.53 1ad9 h GLU 186 N -0.23 0.00 -0.60 1.82 4.57 -0.88 -1.96 114.58 117.30 1ad9 h GLU 186 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1ad9 h GLU 186 Cb 0.21 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.80 1ad9 h GLU 186 CO 0.01 0.00 0.00 0.36 -1.18 0.00 0.00 179.01 178.20 1ad9 n LYS 187 N -4.19 2.73 -4.01 1.92 2.85 -1.01 -4.89 118.16 111.55 1ad9 n LYS 187 Ca 0.07 -1.79 -0.11 0.00 -1.05 0.00 0.00 58.31 55.42 1ad9 n LYS 187 Cb 0.50 -1.66 -0.11 0.00 -0.65 0.00 0.00 35.03 33.11 1ad9 n LYS 187 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 177.40 176.34 1ad9 s HIS 188 N -1.74 0.43 0.00 5.58 3.76 -0.74 -5.09 115.29 117.50 1ad9 s HIS 188 Ca 0.32 -0.50 0.00 0.00 -0.15 0.00 0.00 55.06 54.73 1ad9 s HIS 188 Cb 0.21 -0.28 0.00 0.00 1.11 0.00 0.00 32.58 33.62 1ad9 s HIS 188 CO 0.15 -0.14 0.00 1.63 -0.85 0.00 0.00 174.74 175.53 1ad9 n LYS 189 N 1.58 0.00 -2.53 1.40 5.02 -1.26 -4.76 118.16 117.61 1ad9 n LYS 189 Ca -0.23 0.02 -0.42 0.00 -2.02 0.00 0.00 58.31 55.65 1ad9 n LYS 189 Cb 0.55 -0.30 -0.03 0.00 -0.02 0.00 0.00 35.03 35.23 1ad9 n LYS 189 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ad9 s VAL 190 N -0.54 4.39 -0.25 -0.18 1.01 -1.26 -0.19 120.40 123.37 1ad9 s VAL 190 Ca 0.00 1.71 0.02 0.00 0.00 0.00 0.00 61.98 63.71 1ad9 s VAL 190 Cb 0.00 -4.10 0.06 0.00 0.00 0.00 0.00 36.38 32.34 1ad9 s VAL 190 CO 0.00 0.09 -0.08 -0.31 0.00 0.00 0.00 175.10 174.79 1ad9 s TYR 191 N 1.42 2.87 0.30 5.22 2.02 -0.38 -0.25 117.35 128.54 1ad9 s TYR 191 Ca 0.55 -2.07 0.09 0.00 -0.37 0.00 0.00 57.07 55.28 1ad9 s TYR 191 Cb -0.25 -1.77 -0.04 0.00 -0.40 0.00 0.00 41.96 39.50 1ad9 s TYR 191 CO 0.26 -0.83 0.05 0.00 -1.57 0.00 0.00 175.55 173.46 1ad9 s ALA 192 N 1.24 3.29 -0.22 3.71 0.00 -0.13 -2.00 121.76 127.64 1ad9 s ALA 192 Ca -0.08 -1.73 -0.03 0.00 0.00 0.00 0.00 51.96 50.12 1ad9 s ALA 192 Cb -0.19 -0.74 0.07 0.00 0.00 0.00 0.00 23.12 22.26 1ad9 s ALA 192 CO -0.06 0.17 0.08 0.00 0.00 0.00 0.00 175.76 175.96 1ad9 s GLU 194 N 1.96 3.01 -0.24 0.00 2.12 0.82 -2.07 118.70 124.30 1ad9 s GLU 194 Ca 0.04 -1.23 -0.15 0.00 0.36 0.00 0.00 54.97 53.99 1ad9 s GLU 194 Cb -0.17 -4.12 -0.04 0.00 0.26 0.00 0.00 34.13 30.07 1ad9 s GLU 194 CO -0.17 -1.05 0.37 0.08 -0.54 0.00 0.00 175.26 173.95 1ad9 s VAL 195 N 1.86 5.19 -0.27 3.70 1.01 0.02 -0.89 120.40 131.02 1ad9 s VAL 195 Ca 0.07 0.60 -0.07 0.00 0.00 0.00 0.00 61.98 62.58 1ad9 s VAL 195 Cb -0.23 -3.70 -0.01 0.00 0.00 0.00 0.00 36.38 32.44 1ad9 s VAL 195 CO 0.08 0.21 0.06 -0.89 0.00 0.00 0.00 175.10 174.56 1ad9 s THR 196 N 1.71 4.05 0.05 3.92 2.01 -0.15 -2.04 115.64 125.19 1ad9 s THR 196 Ca 0.16 -0.45 -0.06 0.00 0.31 0.00 0.00 61.69 61.64 1ad9 s THR 196 Cb -0.15 -2.98 -0.01 0.00 0.01 0.00 0.00 72.50 69.37 1ad9 s THR 196 CO 0.09 0.23 0.12 -2.28 -0.69 0.00 0.00 174.62 172.08 1ad9 s HIS 197 N 1.55 0.20 0.32 4.92 2.46 -1.26 -2.03 115.29 121.45 1ad9 s HIS 197 Ca 0.05 -0.55 0.03 0.00 0.47 0.00 0.00 55.06 55.05 1ad9 s HIS 197 Cb -0.16 -0.13 0.53 0.00 -0.13 0.00 0.00 32.58 32.69 1ad9 s HIS 197 CO 0.02 -0.42 1.84 0.37 -2.47 0.00 0.00 174.74 174.08 1ad9 h GLN 198 N 3.34 0.60 0.00 2.88 4.15 -1.92 -2.20 115.11 121.95 1ad9 h GLN 198 Ca -0.33 -0.14 0.00 0.00 0.77 0.00 0.00 58.65 58.95 1ad9 h GLN 198 Cb 1.18 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.79 1ad9 h GLN 198 CO 0.53 0.62 0.00 0.41 -1.93 0.00 0.00 178.83 178.46 1ad9 n GLY 199 N -0.81 -1.06 3.40 2.39 0.00 -1.26 -4.51 105.19 103.34 1ad9 n GLY 199 Ca 0.02 -0.01 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 1ad9 n GLY 199 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ad9 s LEU 200 N -3.37 3.49 0.23 0.99 1.43 -0.83 -4.55 118.68 116.07 1ad9 s LEU 200 Ca 0.06 -0.38 -0.08 0.00 -1.03 0.00 0.00 54.13 52.70 1ad9 s LEU 200 Cb 0.09 -1.89 0.21 0.00 0.03 0.00 0.00 46.19 44.64 1ad9 s LEU 200 CO 0.29 -0.08 1.89 0.77 0.23 0.00 0.00 176.35 179.45 1ad9 h SER 201 N 8.22 1.06 -3.90 2.29 4.64 -1.81 -3.42 113.55 120.64 1ad9 h SER 201 Ca -0.37 -0.05 -0.49 0.00 -0.47 0.00 0.00 61.79 60.41 1ad9 h SER 201 Cb 1.16 -0.27 -0.31 0.00 -0.31 0.00 0.00 62.40 62.67 1ad9 h SER 201 CO 0.59 0.80 -0.81 -0.44 -0.87 0.00 0.00 176.83 176.10 1ad9 s SER 202 N -6.09 1.68 -0.07 4.97 0.01 -1.26 -5.09 113.70 107.85 1ad9 s SER 202 Ca -0.13 -0.27 -0.33 0.00 1.31 0.00 0.00 55.95 56.53 1ad9 s SER 202 Cb 0.17 -0.42 -0.11 0.00 0.21 0.00 0.00 66.02 65.86 1ad9 s SER 202 CO 0.81 0.12 1.92 -0.81 0.41 0.00 0.00 173.24 175.69 1ad9 n PRO 203 N 3.16 2.32 -2.60 12.44 -0.04 -1.26 -4.96 135.00 144.06 1ad9 n PRO 203 Ca -0.18 0.84 -0.37 0.00 -0.04 0.00 0.00 63.50 63.75 1ad9 n PRO 203 Cb 0.54 -2.74 -0.05 0.00 -0.04 0.00 0.00 33.50 31.21 1ad9 n PRO 203 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1ad9 s VAL 204 N 4.35 3.81 -0.31 0.52 0.11 -0.86 -4.84 120.40 123.17 1ad9 s VAL 204 Ca 0.92 1.51 -0.01 0.00 -2.93 0.00 0.00 61.98 61.48 1ad9 s VAL 204 Cb -0.63 -3.84 0.10 0.00 -1.53 0.00 0.00 36.38 30.48 1ad9 s VAL 204 CO 0.49 0.13 0.10 -0.89 -3.33 0.00 0.00 175.10 171.60 1ad9 s THR 205 N -1.53 0.95 0.02 5.04 2.01 -1.26 -0.80 115.64 120.06 1ad9 s THR 205 Ca 0.53 -1.47 -0.19 0.00 0.31 0.00 0.00 61.69 60.87 1ad9 s THR 205 Cb -0.23 -1.72 -0.06 0.00 0.01 0.00 0.00 72.50 70.50 1ad9 s THR 205 CO 0.29 -0.68 0.55 -0.54 -0.69 0.00 0.00 174.62 173.55 1ad9 s LYS 206 N 1.56 4.21 0.36 4.92 -0.14 -0.88 -4.88 119.74 124.89 1ad9 s LYS 206 Ca 0.10 0.67 -0.06 0.00 -1.36 0.00 0.00 55.97 55.32 1ad9 s LYS 206 Cb -0.17 -3.29 0.02 0.00 -1.68 0.00 0.00 37.83 32.71 1ad9 s LYS 206 CO -0.24 0.52 0.58 -1.13 -0.76 0.00 0.00 175.35 174.31 1ad9 n SER 207 N 2.22 -1.63 -3.60 2.83 3.41 -1.26 -0.87 113.62 114.71 1ad9 n SER 207 Ca -0.09 -2.75 -0.16 0.00 -0.26 0.00 0.00 58.87 55.61 1ad9 n SER 207 Cb 0.51 2.90 -0.07 0.00 -0.26 0.00 0.00 64.21 67.29 1ad9 n SER 207 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1ad9 s PHE 208 N -2.78 -0.63 -0.18 7.33 -0.71 -0.85 -5.00 117.98 115.16 1ad9 s PHE 208 Ca 0.24 1.28 -0.17 0.00 -1.04 0.00 0.00 56.93 57.25 1ad9 s PHE 208 Cb -0.02 0.31 -0.04 0.00 -1.21 0.00 0.00 43.02 42.05 1ad9 s PHE 208 CO 0.17 -0.47 0.43 1.21 -1.34 0.00 0.00 175.22 175.22 1ad9 s ASN 209 N -0.57 6.51 0.51 1.98 3.04 -1.26 -1.25 114.94 123.90 1ad9 s ASN 209 Ca -0.07 0.61 0.18 0.00 0.04 0.00 0.00 52.86 53.62 1ad9 s ASN 209 Cb -0.02 -2.25 1.26 0.00 -1.54 0.00 0.00 41.25 38.69 1ad9 s ASN 209 CO 0.06 -0.07 2.08 -0.09 -3.04 0.00 0.00 177.10 176.04 1ad9 h ARG 210 N 7.19 0.07 -0.48 0.43 2.43 -0.88 -1.97 114.38 121.19 1ad9 h ARG 210 Ca -0.37 -0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 58.76 1ad9 h ARG 210 Cb 1.16 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.67 1ad9 h ARG 210 CO 0.73 0.05 0.13 0.78 -1.51 0.00 0.00 179.97 180.16 1ad9 h GLY 211 N 0.08 0.76 1.73 2.80 0.00 -1.91 -1.91 103.07 104.61 1ad9 h GLY 211 Ca 0.11 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 47.03 1ad9 h GLY 211 CO -0.01 0.38 -0.04 1.18 0.00 0.00 0.00 176.54 178.05 1ad9 n GLU 212 N -4.31 0.17 0.00 4.80 1.02 -0.75 -5.25 120.64 116.31 1ad9 n GLU 212 Ca 0.03 -0.02 0.13 0.00 -0.02 0.00 0.00 57.16 57.29 1ad9 n GLU 212 Cb 0.20 -1.50 0.31 0.00 -0.02 0.00 0.00 31.44 30.42 1ad9 n GLU 212 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31