#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rka s GLY 5 N 0.00 1.59 0.25 0.00 0.00 -1.07 -4.86 107.32 103.23 1rka s GLY 5 Ca 0.00 -0.05 -0.24 0.00 0.00 0.00 0.00 44.72 44.43 1rka s GLY 5 CO 0.00 0.54 0.83 -1.35 0.00 0.00 0.00 173.10 173.12 1rka s SER 6 N -3.00 7.28 -0.06 1.64 1.04 -1.26 -4.53 113.70 114.81 1rka s SER 6 Ca 0.66 1.66 0.02 0.00 0.48 0.00 0.00 55.95 58.77 1rka s SER 6 Cb -0.21 -2.51 -0.03 0.00 0.10 0.00 0.00 66.02 63.37 1rka s SER 6 CO 0.60 0.04 -0.11 -0.22 0.98 0.00 0.00 173.24 174.54 1rka s LEU 7 N -1.77 2.95 -0.19 2.42 2.96 0.79 -0.09 118.68 125.75 1rka s LEU 7 Ca 0.44 -0.12 0.01 0.00 -0.22 0.00 0.00 54.13 54.24 1rka s LEU 7 Cb -0.19 -1.62 0.04 0.00 0.50 0.00 0.00 46.19 44.91 1rka s LEU 7 CO 0.24 0.34 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.79 1rka s VAL 8 N -0.71 1.79 -0.17 1.68 1.01 -0.22 -0.98 120.40 122.80 1rka s VAL 8 Ca 0.11 -1.00 -0.08 0.00 0.00 0.00 0.00 61.98 61.01 1rka s VAL 8 Cb -0.11 -1.77 -0.04 0.00 0.00 0.00 0.00 36.38 34.45 1rka s VAL 8 CO 0.01 0.29 0.11 -0.69 0.00 0.00 0.00 175.10 174.81 1rka s VAL 9 N 1.35 5.20 -0.15 2.92 1.01 -0.63 -0.66 120.40 129.45 1rka s VAL 9 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.09 1rka s VAL 9 Cb -0.15 -3.33 0.03 0.00 0.00 0.00 0.00 36.38 32.93 1rka s VAL 9 CO -0.09 0.50 -0.09 -0.22 0.00 0.00 0.00 175.10 175.19 1rka s LEU 10 N -0.08 1.64 0.00 3.92 0.20 -0.69 -0.46 118.68 123.21 1rka s LEU 10 Ca 0.09 -0.56 0.00 0.00 0.69 0.00 0.00 54.13 54.35 1rka s LEU 10 Cb -0.12 -1.03 0.00 0.00 -0.43 0.00 0.00 46.19 44.61 1rka s LEU 10 CO 0.00 -0.12 0.00 0.61 -0.29 0.00 0.00 176.35 176.55 1rka n GLY 11 N 4.83 -1.22 3.84 7.98 0.00 -1.02 -4.04 105.19 115.55 1rka n GLY 11 Ca -0.14 -0.85 -0.31 0.00 0.00 0.00 0.00 46.02 44.71 1rka n GLY 11 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1rka s SER 12 N -3.19 5.71 -0.07 1.61 1.04 -1.26 -4.49 113.70 113.06 1rka s SER 12 Ca 0.00 1.55 -0.00 0.00 0.48 0.00 0.00 55.95 57.97 1rka s SER 12 Cb 0.00 -2.49 0.02 0.00 0.10 0.00 0.00 66.02 63.66 1rka s SER 12 CO 0.00 -1.22 -0.04 -0.63 0.98 0.00 0.00 173.24 172.33 1rka s ILE 13 N -3.08 0.61 0.16 -1.02 1.01 -1.26 -0.41 121.20 117.20 1rka s ILE 13 Ca 0.57 -0.07 0.07 0.00 0.00 0.00 0.00 60.65 61.22 1rka s ILE 13 Cb -0.13 -0.68 -0.04 0.00 0.01 0.00 0.00 42.46 41.62 1rka s ILE 13 CO 0.54 0.28 -0.15 0.20 0.00 0.00 0.00 174.94 175.81 1rka s ASN 14 N 1.52 2.31 -0.30 3.58 0.02 -0.66 -3.48 114.94 117.93 1rka s ASN 14 Ca -0.01 -0.92 -0.06 0.00 -1.02 0.00 0.00 52.86 50.86 1rka s ASN 14 Cb -0.13 -0.10 0.02 0.00 0.02 0.00 0.00 41.25 41.06 1rka s ASN 14 CO -0.04 -0.15 0.06 0.00 0.02 0.00 0.00 177.10 176.99 1rka s ALA 15 N -2.55 2.99 -0.20 0.60 0.00 -0.50 0.02 121.76 122.13 1rka s ALA 15 Ca 0.16 -1.53 -0.20 0.00 0.00 0.00 0.00 51.96 50.38 1rka s ALA 15 Cb -0.03 -2.10 -0.03 0.00 0.00 0.00 0.00 23.12 20.97 1rka s ALA 15 CO 0.05 -1.02 0.60 -0.51 0.00 0.00 0.00 175.76 174.88 1rka s ASP 16 N 1.44 6.65 -0.34 0.00 1.01 0.13 -1.61 116.67 123.95 1rka s ASP 16 Ca 0.01 0.78 -0.08 0.00 0.71 0.00 0.00 52.55 53.97 1rka s ASP 16 Cb -0.18 -2.33 0.03 0.00 1.01 0.00 0.00 42.92 41.45 1rka s ASP 16 CO 0.01 -0.25 0.13 -1.00 0.21 0.00 0.00 175.17 174.27 1rka s HIS 17 N 1.87 3.23 -0.16 4.23 3.76 0.27 -0.90 115.29 127.58 1rka s HIS 17 Ca 0.27 -1.18 -0.01 0.00 -0.15 0.00 0.00 55.06 53.99 1rka s HIS 17 Cb -0.16 -2.31 -0.01 0.00 1.11 0.00 0.00 32.58 31.21 1rka s HIS 17 CO 0.10 -0.67 -0.12 0.42 -0.85 0.00 0.00 174.74 173.62 1rka s ILE 18 N 1.47 2.91 -0.15 0.60 1.01 0.10 -0.25 121.20 126.88 1rka s ILE 18 Ca 0.00 -0.69 0.01 0.00 0.00 0.00 0.00 60.65 59.98 1rka s ILE 18 Cb -0.19 -2.25 0.02 0.00 0.01 0.00 0.00 42.46 40.05 1rka s ILE 18 CO 0.04 0.50 -0.16 -0.22 0.00 0.00 0.00 174.94 175.10 1rka s LEU 19 N 0.83 1.80 0.01 2.97 2.96 0.22 -1.25 118.68 126.22 1rka s LEU 19 Ca -0.04 -0.52 -0.21 0.00 -0.22 0.00 0.00 54.13 53.15 1rka s LEU 19 Cb -0.15 -1.24 -0.06 0.00 0.50 0.00 0.00 46.19 45.24 1rka s LEU 19 CO 0.00 -0.02 0.60 0.20 -1.32 0.00 0.00 176.35 175.81 1rka s ASN 20 N 1.32 7.01 0.17 3.68 0.01 -0.18 -1.72 114.94 125.23 1rka s ASN 20 Ca 0.02 1.20 -0.09 0.00 -0.71 0.00 0.00 52.86 53.28 1rka s ASN 20 Cb -0.13 -2.37 -0.01 0.00 0.41 0.00 0.00 41.25 39.14 1rka s ASN 20 CO -0.09 0.12 0.28 -1.48 -1.51 0.00 0.00 177.10 174.42 1rka s LEU 21 N -0.32 0.96 0.06 0.60 0.05 0.08 -0.76 118.68 119.36 1rka s LEU 21 Ca 0.31 -0.90 -0.37 0.00 0.05 0.00 0.00 54.13 53.23 1rka s LEU 21 Cb -0.19 1.17 -0.20 0.00 -2.05 0.00 0.00 46.19 44.92 1rka s LEU 21 CO 0.18 -0.90 1.58 -0.61 -0.55 0.00 0.00 176.35 176.05 1rka h GLN 22 N 2.54 -1.23 -3.59 1.48 4.15 -1.84 -2.07 115.11 114.54 1rka h GLN 22 Ca -0.32 0.08 -0.14 0.00 0.77 0.00 0.00 58.65 59.05 1rka h GLN 22 Cb 1.23 0.28 -0.20 0.00 0.21 0.00 0.00 27.48 29.00 1rka h GLN 22 CO 0.48 -0.82 -0.50 -1.54 -1.93 0.00 0.00 178.83 174.53 1rka s SER 23 N -4.08 0.07 0.05 -0.69 1.04 -1.26 -0.77 113.70 108.06 1rka s SER 23 Ca -0.19 -0.30 -0.32 0.00 0.48 0.00 0.00 55.95 55.61 1rka s SER 23 Cb 0.02 0.21 -0.11 0.00 0.10 0.00 0.00 66.02 66.25 1rka s SER 23 CO 0.60 -0.41 1.87 0.49 0.98 0.00 0.00 173.24 176.77 1rka n PHE 24 N 1.25 2.49 -1.72 5.02 3.72 -1.26 -4.90 117.46 122.05 1rka n PHE 24 Ca -0.22 -0.14 -0.42 0.00 -0.05 0.00 0.00 57.45 56.62 1rka n PHE 24 Cb 0.56 -2.72 -0.01 0.00 -0.94 0.00 0.00 39.48 36.38 1rka n PHE 24 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1rka n PRO 25 N 6.25 2.36 -2.21 -1.08 -0.04 -1.26 -4.99 135.00 134.04 1rka n PRO 25 Ca 0.20 0.83 -0.28 0.00 -0.04 0.00 0.00 63.50 64.21 1rka n PRO 25 Cb 0.36 -2.49 0.03 0.00 -0.04 0.00 0.00 33.50 31.36 1rka n PRO 25 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1rka s THR 26 N -0.84 3.78 -0.01 0.52 -4.23 -1.26 -4.89 115.64 108.70 1rka s THR 26 Ca 0.57 0.24 -0.37 0.00 -1.18 0.00 0.00 61.69 60.95 1rka s THR 26 Cb -0.54 -3.53 -0.16 0.00 1.34 0.00 0.00 72.50 69.61 1rka s THR 26 CO 0.60 -0.60 1.48 -2.65 -0.54 0.00 0.00 174.62 172.90 1rka n PRO 27 N -2.71 1.24 -0.56 3.99 -0.02 -1.26 -0.37 135.00 135.31 1rka n PRO 27 Ca 0.05 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 1rka n PRO 27 Cb 0.57 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 1rka n PRO 27 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rka n GLY 28 N 3.08 1.27 3.93 -1.23 0.00 -1.26 -5.03 105.19 105.95 1rka n GLY 28 Ca 0.21 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.96 1rka n GLY 28 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1rka s GLU 29 N -0.23 3.52 -0.06 1.61 2.12 0.50 -5.11 118.70 121.05 1rka s GLU 29 Ca 0.00 -0.34 0.04 0.00 0.36 0.00 0.00 54.97 55.04 1rka s GLU 29 Cb 0.00 -2.81 -0.00 0.00 0.26 0.00 0.00 34.13 31.58 1rka s GLU 29 CO 0.00 0.36 -0.20 0.99 -0.54 0.00 0.00 175.26 175.87 1rka s THR 30 N -1.95 1.71 0.04 -1.70 2.01 -1.26 -4.73 115.64 109.76 1rka s THR 30 Ca 0.39 -0.85 0.05 0.00 0.31 0.00 0.00 61.69 61.58 1rka s THR 30 Cb -0.11 -1.47 -0.02 0.00 0.01 0.00 0.00 72.50 70.91 1rka s THR 30 CO 0.30 0.48 -0.13 0.68 -0.69 0.00 0.00 174.62 175.26 1rka s VAL 31 N 0.15 1.04 -0.23 3.82 -7.23 -1.26 -5.06 120.40 111.63 1rka s VAL 31 Ca -0.09 -0.98 -0.11 0.00 -1.81 0.00 0.00 61.98 59.00 1rka s VAL 31 Cb -0.14 -0.95 -0.05 0.00 0.56 0.00 0.00 36.38 35.80 1rka s VAL 31 CO 0.05 -0.02 0.17 -0.89 -0.31 0.00 0.00 175.10 174.09 1rka s THR 32 N -0.86 5.36 0.92 5.32 2.01 -1.26 -5.08 115.64 122.05 1rka s THR 32 Ca 0.01 0.22 -0.14 0.00 0.31 0.00 0.00 61.69 62.08 1rka s THR 32 Cb -0.08 -3.51 0.18 0.00 0.01 0.00 0.00 72.50 69.10 1rka s THR 32 CO 0.01 0.36 1.28 -0.83 -0.69 0.00 0.00 174.62 174.75 1rka s GLY 33 N 0.93 1.76 -0.00 4.40 0.00 -1.26 -4.64 107.32 108.50 1rka s GLY 33 Ca 0.08 -1.17 0.04 0.00 0.00 0.00 0.00 44.72 43.67 1rka s GLY 33 CO 0.04 -0.45 0.11 1.16 0.00 0.00 0.00 173.10 173.96 1rka n ASN 34 N -3.64 2.50 -3.71 1.64 0.23 0.06 -4.97 115.26 107.38 1rka n ASN 34 Ca 0.14 -0.24 -0.13 0.00 -0.53 0.00 0.00 54.58 53.82 1rka n ASN 34 Cb 0.60 1.10 -0.09 0.00 -2.08 0.00 0.00 39.78 39.30 1rka n ASN 34 CO 0.00 0.00 0.00 -2.28 -0.93 0.00 0.00 177.26 174.05 1rka s HIS 35 N -1.88 -0.53 -0.02 -2.53 5.04 -1.23 -5.00 115.29 109.15 1rka s HIS 35 Ca -0.00 1.28 0.04 0.00 -1.54 0.00 0.00 55.06 54.83 1rka s HIS 35 Cb 0.03 0.18 -0.01 0.00 0.04 0.00 0.00 32.58 32.82 1rka s HIS 35 CO 0.15 -0.25 -0.13 -0.47 -2.34 0.00 0.00 174.74 171.70 1rka s TYR 36 N 0.28 1.18 -0.11 3.88 5.04 -1.26 -1.01 117.35 125.35 1rka s TYR 36 Ca -0.00 -0.26 -0.06 0.00 -2.44 0.00 0.00 57.07 54.31 1rka s TYR 36 Cb -0.03 -0.78 0.04 0.00 0.35 0.00 0.00 41.96 41.54 1rka s TYR 36 CO 0.00 -0.06 0.25 -1.14 -1.34 0.00 0.00 175.55 173.27 1rka s GLN 37 N -0.15 0.22 -0.24 4.97 0.74 -0.38 -5.01 119.66 119.81 1rka s GLN 37 Ca 0.02 0.53 -0.07 0.00 0.05 0.00 0.00 55.36 55.89 1rka s GLN 37 Cb -0.07 -0.09 -0.03 0.00 1.10 0.00 0.00 33.01 33.93 1rka s GLN 37 CO 0.00 -0.15 0.05 0.08 -0.55 0.00 0.00 175.29 174.72 1rka s VAL 38 N 1.16 4.19 0.01 1.34 1.01 -1.26 -0.72 120.40 126.12 1rka s VAL 38 Ca -0.08 -0.22 0.01 0.00 0.00 0.00 0.00 61.98 61.69 1rka s VAL 38 Cb -0.09 -2.95 -0.01 0.00 0.00 0.00 0.00 36.38 33.33 1rka s VAL 38 CO -0.08 0.35 -0.03 0.00 0.00 0.00 0.00 175.10 175.34 1rka s ALA 39 N 1.57 0.23 0.15 5.51 0.00 -0.08 -4.98 121.76 124.16 1rka s ALA 39 Ca 0.06 -0.25 -0.31 0.00 0.00 0.00 0.00 51.96 51.46 1rka s ALA 39 Cb -0.15 -0.01 -0.08 0.00 0.00 0.00 0.00 23.12 22.87 1rka s ALA 39 CO 0.03 0.01 1.39 -0.06 0.00 0.00 0.00 175.76 177.13 1rka s PHE 40 N -0.41 3.22 0.00 0.00 0.08 -1.26 0.19 117.98 119.80 1rka s PHE 40 Ca -0.03 0.99 0.00 0.00 0.12 0.00 0.00 56.93 58.01 1rka s PHE 40 Cb -0.03 -3.69 0.00 0.00 -0.57 0.00 0.00 43.02 38.72 1rka s PHE 40 CO -0.00 -2.38 0.00 0.41 -0.10 0.00 0.00 175.22 173.15 1rka n GLY 41 N 3.17 5.43 0.03 4.36 0.00 0.10 -2.46 105.19 115.83 1rka n GLY 41 Ca 0.10 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 44.92 1rka n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rka n GLY 42 N 0.68 -0.05 0.30 -0.02 0.00 -1.26 -1.65 105.19 103.19 1rka n GLY 42 Ca 0.00 -1.21 0.04 0.00 0.00 0.00 0.00 46.02 44.85 1rka n GLY 42 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rka h LYS 43 N 0.00 0.70 0.23 1.61 1.57 -1.98 0.34 116.57 119.03 1rka h LYS 43 Ca 0.00 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1rka h LYS 43 Cb 0.00 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.14 1rka h LYS 43 CO 0.00 0.46 -0.19 0.78 -0.57 0.00 0.00 179.45 179.94 1rka h GLY 44 N 0.72 -0.43 1.04 3.86 0.00 -1.77 -0.94 103.07 105.54 1rka h GLY 44 Ca 0.41 0.21 -0.12 0.00 0.00 0.00 0.00 47.33 47.83 1rka h GLY 44 CO -0.28 -0.18 -0.21 0.00 0.00 0.00 0.00 176.54 175.87 1rka h ALA 45 N 0.31 0.57 -0.60 3.60 0.00 -0.28 -0.37 119.26 122.48 1rka h ALA 45 Ca -0.01 -0.38 0.06 0.00 0.00 0.00 0.00 54.91 54.58 1rka h ALA 45 Cb 0.38 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.98 1rka h ALA 45 CO -0.02 0.53 0.31 -0.91 0.00 0.00 0.00 179.25 179.16 1rka h ASN 46 N 0.66 0.43 -0.04 0.00 2.35 -0.24 0.25 115.58 119.00 1rka h ASN 46 Ca 0.09 0.04 -0.16 0.00 -0.55 0.00 0.00 56.30 55.72 1rka h ASN 46 Cb 0.77 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 39.09 1rka h ASN 46 CO 0.06 0.28 -0.51 1.56 -1.65 0.00 0.00 177.43 177.18 1rka h GLN 47 N 0.57 0.61 -0.72 0.81 4.20 -1.05 0.28 115.11 119.81 1rka h GLN 47 Ca 0.27 -0.36 -0.06 0.00 0.06 0.00 0.00 58.65 58.56 1rka h GLN 47 Cb 0.20 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 27.98 1rka h GLN 47 CO -0.19 0.97 0.21 0.00 -0.67 0.00 0.00 178.83 179.15 1rka h ALA 48 N 0.96 1.01 -0.16 3.87 0.00 -0.36 -1.20 119.26 123.38 1rka h ALA 48 Ca 0.02 -0.23 -0.18 0.00 0.00 0.00 0.00 54.91 54.52 1rka h ALA 48 Cb 1.05 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 18.57 1rka h ALA 48 CO 0.10 0.66 -0.59 0.28 0.00 0.00 0.00 179.25 179.70 1rka h VAL 49 N 1.08 1.31 -0.65 0.00 2.07 -0.41 -0.57 116.25 119.08 1rka h VAL 49 Ca 0.23 -1.83 0.01 0.00 0.82 0.00 0.00 66.70 65.93 1rka h VAL 49 Cb 0.32 1.98 -0.03 0.00 -1.52 0.00 0.00 31.29 32.04 1rka h VAL 49 CO -0.01 0.57 0.43 0.00 0.02 0.00 0.00 177.57 178.59 1rka h ALA 50 N 0.55 1.54 -0.00 1.67 0.00 -0.71 0.47 119.26 122.78 1rka h ALA 50 Ca -0.03 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 1rka h ALA 50 Cb 1.22 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 18.75 1rka h ALA 50 CO 0.12 0.42 -0.28 0.00 0.00 0.00 0.00 179.25 179.51 1rka h ALA 51 N 1.60 0.04 0.00 0.00 0.00 -1.16 -2.35 119.26 117.39 1rka h ALA 51 Ca 0.24 -0.48 0.01 0.00 0.00 0.00 0.00 54.91 54.68 1rka h ALA 51 Cb -0.09 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1rka h ALA 51 CO -0.05 0.11 -0.05 0.78 0.00 0.00 0.00 179.25 180.04 1rka h GLY 52 N -0.47 -0.05 1.28 0.00 0.00 -0.85 -0.94 103.07 102.03 1rka h GLY 52 Ca -0.04 0.06 -0.04 0.00 0.00 0.00 0.00 47.33 47.32 1rka h GLY 52 CO 0.06 -0.06 0.25 3.21 0.00 0.00 0.00 176.54 180.00 1rka h ARG 53 N -0.09 0.92 0.00 4.80 3.08 -0.95 -1.60 114.38 120.55 1rka h ARG 53 Ca 0.02 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 59.92 1rka h ARG 53 Cb 0.11 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.01 1rka h ARG 53 CO -0.05 0.76 0.00 -1.13 -1.07 0.00 0.00 179.97 178.48 1rka n SER 54 N -4.31 0.00 0.00 7.04 3.41 -0.88 -1.02 113.62 117.85 1rka n SER 54 Ca 0.05 -0.27 0.00 0.00 -0.26 0.00 0.00 58.87 58.39 1rka n SER 54 Cb 0.17 -0.16 0.00 0.00 -0.26 0.00 0.00 64.21 63.97 1rka n SER 54 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rka n GLY 55 N 0.27 1.20 3.88 5.00 0.00 -0.60 -4.54 105.19 110.41 1rka n GLY 55 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 1rka n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rka s ALA 56 N -2.00 2.98 -0.89 4.61 0.00 -0.40 -4.99 121.76 121.07 1rka s ALA 56 Ca 0.00 -0.26 -0.12 0.00 0.00 0.00 0.00 51.96 51.58 1rka s ALA 56 Cb 0.00 -3.03 0.23 0.00 0.00 0.00 0.00 23.12 20.32 1rka s ALA 56 CO 0.00 -0.97 0.83 1.21 0.00 0.00 0.00 175.76 176.83 1rka s ASN 57 N -4.30 6.80 -0.01 0.00 2.47 -1.26 -4.66 114.94 113.99 1rka s ASN 57 Ca 0.57 -2.93 0.08 0.00 0.42 0.00 0.00 52.86 51.00 1rka s ASN 57 Cb -0.11 -2.19 -0.02 0.00 -1.45 0.00 0.00 41.25 37.48 1rka s ASN 57 CO 0.52 -0.49 -0.25 -0.51 -3.72 0.00 0.00 177.10 172.65 1rka s ILE 58 N -0.21 1.98 0.04 -5.21 -1.16 -1.26 -0.15 121.20 115.23 1rka s ILE 58 Ca 0.21 -1.09 0.06 0.00 -0.51 0.00 0.00 60.65 59.32 1rka s ILE 58 Cb -0.10 -1.64 -0.03 0.00 0.61 0.00 0.00 42.46 41.29 1rka s ILE 58 CO -0.09 0.54 -0.13 0.00 -2.81 0.00 0.00 174.94 172.46 1rka s ALA 59 N -0.60 2.80 -0.21 1.50 0.00 -0.15 -1.47 121.76 123.63 1rka s ALA 59 Ca 0.10 -1.14 0.02 0.00 0.00 0.00 0.00 51.96 50.93 1rka s ALA 59 Cb -0.10 -0.90 0.04 0.00 0.00 0.00 0.00 23.12 22.16 1rka s ALA 59 CO -0.01 0.60 -0.15 0.12 0.00 0.00 0.00 175.76 176.32 1rka s PHE 60 N -1.00 2.91 -0.31 0.00 5.36 -0.64 -1.60 117.98 122.70 1rka s PHE 60 Ca 0.17 -1.89 -0.19 0.00 -0.96 0.00 0.00 56.93 54.05 1rka s PHE 60 Cb -0.11 -1.88 -0.01 0.00 -0.34 0.00 0.00 43.02 40.68 1rka s PHE 60 CO 0.08 -0.83 0.58 0.42 -1.46 0.00 0.00 175.22 174.01 1rka s ILE 61 N 1.24 4.98 0.28 3.12 1.01 0.39 -3.01 121.20 129.20 1rka s ILE 61 Ca -0.01 0.73 -0.20 0.00 0.00 0.00 0.00 60.65 61.18 1rka s ILE 61 Cb -0.16 -3.95 0.06 0.00 0.01 0.00 0.00 42.46 38.41 1rka s ILE 61 CO -0.09 -0.11 0.87 0.00 0.00 0.00 0.00 174.94 175.61 1rka s ALA 62 N 2.50 -1.19 -0.03 9.38 0.00 -1.18 -2.44 121.76 128.79 1rka s ALA 62 Ca 0.23 -0.43 0.02 0.00 0.00 0.00 0.00 51.96 51.77 1rka s ALA 62 Cb -0.15 0.72 0.01 0.00 0.00 0.00 0.00 23.12 23.70 1rka s ALA 62 CO 0.12 -1.03 -0.06 0.00 0.00 0.00 0.00 175.76 174.79 1rka s THR 64 N 0.54 1.97 0.14 0.00 -4.23 -0.53 -4.15 115.64 109.38 1rka s THR 64 Ca -0.07 -1.93 -0.00 0.00 -1.18 0.00 0.00 61.69 58.51 1rka s THR 64 Cb -0.11 -2.89 0.03 0.00 1.34 0.00 0.00 72.50 70.86 1rka s THR 64 CO 0.00 0.00 0.19 0.61 -0.54 0.00 0.00 174.62 174.88 1rka n GLY 65 N -1.07 0.55 2.23 3.99 0.00 -1.26 -1.47 105.19 108.15 1rka n GLY 65 Ca -0.06 -1.94 -0.26 0.00 0.00 0.00 0.00 46.02 43.76 1rka n GLY 65 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1rka n ASP 66 N -3.00 4.61 -5.02 1.61 5.68 -0.88 -4.48 116.55 115.07 1rka n ASP 66 Ca 0.03 -3.62 -0.18 0.00 -0.50 0.00 0.00 54.79 50.52 1rka n ASP 66 Cb 0.11 -0.87 0.03 0.00 -1.14 0.00 0.00 41.12 39.25 1rka n ASP 66 CO 0.00 0.00 0.00 1.51 -1.33 0.00 0.00 177.20 177.38 1rka s ASP 67 N -1.36 5.41 0.16 -1.12 1.47 -1.26 -5.00 116.67 114.97 1rka s ASP 67 Ca 0.58 -0.60 -0.15 0.00 1.18 0.00 0.00 52.55 53.56 1rka s ASP 67 Cb 0.48 -0.24 0.03 0.00 -0.34 0.00 0.00 42.92 42.85 1rka s ASP 67 CO 0.08 -1.02 1.76 0.28 0.68 0.00 0.00 175.17 176.95 1rka h SER 68 N 0.43 0.60 -0.81 2.11 0.02 -2.00 -2.66 113.55 111.24 1rka h SER 68 Ca -0.36 -0.10 0.05 0.00 -0.84 0.00 0.00 61.79 60.54 1rka h SER 68 Cb 1.28 -0.15 -0.06 0.00 0.14 0.00 0.00 62.40 63.61 1rka h SER 68 CO 0.43 0.53 0.51 -0.29 -1.14 0.00 0.00 176.83 176.87 1rka h ILE 69 N 0.63 1.07 -0.93 3.27 6.09 -1.97 -1.19 117.51 124.49 1rka h ILE 69 Ca 0.17 -0.33 0.07 0.00 -1.37 0.00 0.00 64.86 63.40 1rka h ILE 69 Cb 0.07 0.03 -0.07 0.00 0.47 0.00 0.00 36.82 37.33 1rka h ILE 69 CO -0.03 0.17 0.59 1.23 -3.07 0.00 0.00 178.15 177.05 1rka h GLY 70 N 0.95 1.42 1.09 8.18 0.00 -1.76 -1.49 103.07 111.47 1rka h GLY 70 Ca 0.34 -0.43 -0.12 0.00 0.00 0.00 0.00 47.33 47.13 1rka h GLY 70 CO -0.15 0.29 -0.12 -2.09 0.00 0.00 0.00 176.54 174.47 1rka h GLU 71 N 1.07 1.02 -0.09 4.80 4.81 -1.01 -2.50 114.58 122.68 1rka h GLU 71 Ca 0.41 -0.39 -0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1rka h GLU 71 Cb 0.18 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.50 1rka h GLU 71 CO -0.18 1.08 0.04 0.77 -0.73 0.00 0.00 179.01 179.98 1rka h SER 72 N 0.89 0.12 -0.97 1.04 0.02 -0.53 0.32 113.55 114.43 1rka h SER 72 Ca 0.14 -0.15 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1rka h SER 72 Cb 0.69 -0.03 -0.05 0.00 0.14 0.00 0.00 62.40 63.16 1rka h SER 72 CO 0.05 0.23 0.62 1.62 -1.14 0.00 0.00 176.83 178.21 1rka h VAL 73 N -0.01 1.26 -0.47 2.27 3.04 -1.32 0.12 116.25 121.14 1rka h VAL 73 Ca 0.03 -0.51 -0.02 0.00 -1.01 0.00 0.00 66.70 65.20 1rka h VAL 73 Cb 0.15 -0.15 -0.02 0.00 -2.01 0.00 0.00 31.29 29.25 1rka h VAL 73 CO -0.00 0.26 0.23 -0.09 -1.01 0.00 0.00 177.57 176.95 1rka h ARG 74 N 1.33 0.67 -0.77 4.17 2.43 -1.21 0.22 114.38 121.22 1rka h ARG 74 Ca 0.35 -0.10 0.03 0.00 -0.81 0.00 0.00 59.98 59.46 1rka h ARG 74 Cb -0.11 -0.12 -0.05 0.00 -0.42 0.00 0.00 29.97 29.27 1rka h ARG 74 CO -0.07 0.56 0.49 1.96 -1.51 0.00 0.00 179.97 181.40 1rka h GLN 75 N 0.61 0.92 0.16 0.20 7.50 0.12 -2.73 115.11 121.89 1rka h GLN 75 Ca 0.16 -0.06 -0.01 0.00 0.50 0.00 0.00 58.65 59.25 1rka h GLN 75 Cb 0.11 -0.21 0.00 0.00 0.05 0.00 0.00 27.48 27.44 1rka h GLN 75 CO -0.02 0.61 -0.08 0.37 -1.50 0.00 0.00 178.83 178.21 1rka h GLN 76 N 0.95 -0.21 -0.41 1.46 5.75 0.03 -3.20 115.11 119.48 1rka h GLN 76 Ca 0.31 0.01 0.10 0.00 -0.15 0.00 0.00 58.65 58.93 1rka h GLN 76 Cb 0.02 0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.60 1rka h GLN 76 CO -0.11 0.12 0.29 -0.07 -2.65 0.00 0.00 178.83 176.41 1rka h LEU 77 N -0.56 0.08 -1.80 -2.39 3.38 -0.52 0.12 115.31 113.61 1rka h LEU 77 Ca -0.02 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 1rka h LEU 77 Cb 0.43 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 1rka h LEU 77 CO 0.04 0.05 -0.15 0.00 0.09 0.00 0.00 178.44 178.46 1rka h ALA 78 N 1.79 1.39 -0.01 1.53 0.00 -1.48 -1.89 119.26 120.60 1rka h ALA 78 Ca 0.19 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1rka h ALA 78 Cb 0.65 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1rka h ALA 78 CO -0.02 0.19 -0.29 0.25 0.00 0.00 0.00 179.25 179.38 1rka n THR 79 N -3.84 0.00 -0.13 0.00 -2.24 0.02 -4.00 114.28 104.08 1rka n THR 79 Ca -0.02 -0.18 -0.01 0.00 -2.27 0.00 0.00 64.05 61.57 1rka n THR 79 Cb 0.25 0.65 0.19 0.00 -2.10 0.00 0.00 70.33 69.32 1rka n THR 79 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1rka n ASP 80 N -0.40 3.61 -3.23 3.42 8.00 -0.71 -4.88 116.55 122.37 1rka n ASP 80 Ca 0.12 -2.64 -0.16 0.00 0.71 0.00 0.00 54.79 52.81 1rka n ASP 80 Cb 0.38 -0.63 0.08 0.00 -0.02 0.00 0.00 41.12 40.93 1rka n ASP 80 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1rka n ASN 81 N 0.12 -2.36 -4.05 -2.24 5.15 -1.26 -3.53 115.26 107.09 1rka n ASN 81 Ca 0.21 -0.56 -0.20 0.00 -0.60 0.00 0.00 54.58 53.43 1rka n ASN 81 Cb 0.90 -4.72 -0.15 0.00 -0.53 0.00 0.00 39.78 35.28 1rka n ASN 81 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1rka s ILE 82 N -3.33 0.87 -0.54 -1.44 1.01 -1.24 -4.53 121.20 112.01 1rka s ILE 82 Ca 0.04 -0.46 -0.24 0.00 0.00 0.00 0.00 60.65 59.99 1rka s ILE 82 Cb -0.02 -0.74 0.04 0.00 0.01 0.00 0.00 42.46 41.75 1rka s ILE 82 CO 0.67 0.25 0.93 -0.62 0.00 0.00 0.00 174.94 176.17 1rka s ASP 83 N -0.18 6.35 -0.08 3.58 2.15 -0.54 -4.55 116.67 123.40 1rka s ASP 83 Ca 0.03 -0.31 0.10 0.00 0.43 0.00 0.00 52.55 52.80 1rka s ASP 83 Cb -0.05 -2.43 0.42 0.00 -0.30 0.00 0.00 42.92 40.56 1rka s ASP 83 CO -0.00 -1.20 1.24 2.30 -0.17 0.00 0.00 175.17 177.34 1rka n ILE 84 N 6.21 1.18 -0.17 4.11 -5.35 -1.26 -1.62 119.36 122.45 1rka n ILE 84 Ca 0.02 -0.70 0.04 0.00 -0.27 0.00 0.00 62.75 61.84 1rka n ILE 84 Cb 0.48 -0.13 0.32 0.00 -1.74 0.00 0.00 39.64 38.56 1rka n ILE 84 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1rka h THR 85 N 2.30 1.11 -0.06 7.28 2.02 -1.90 -2.07 112.91 121.59 1rka h THR 85 Ca 0.00 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 66.89 1rka h THR 85 Cb 1.04 0.19 0.00 0.00 -1.74 0.00 0.00 68.15 67.64 1rka h THR 85 CO 0.17 0.15 0.00 -2.65 0.37 0.00 0.00 175.52 173.57 1rka n PRO 86 N -4.46 1.20 -2.99 6.66 -0.02 -1.25 -4.77 135.00 129.36 1rka n PRO 86 Ca 0.09 -0.30 -0.43 0.00 -2.02 0.00 0.00 63.50 60.84 1rka n PRO 86 Cb 0.12 -1.24 -0.06 0.00 -0.02 0.00 0.00 33.50 32.30 1rka n PRO 86 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1rka s VAL 87 N -1.92 4.69 0.43 -1.45 1.01 -0.78 -3.08 120.40 119.30 1rka s VAL 87 Ca 0.22 0.42 -0.11 0.00 0.00 0.00 0.00 61.98 62.51 1rka s VAL 87 Cb 0.11 -4.28 -0.06 0.00 0.00 0.00 0.00 36.38 32.14 1rka s VAL 87 CO 0.17 -0.66 0.81 -0.44 0.00 0.00 0.00 175.10 174.98 1rka s SER 88 N 2.08 6.50 -0.19 3.32 0.01 0.91 -4.93 113.70 121.40 1rka s SER 88 Ca 0.29 1.19 -0.03 0.00 1.31 0.00 0.00 55.95 58.71 1rka s SER 88 Cb -0.13 -2.35 -0.01 0.00 0.21 0.00 0.00 66.02 63.74 1rka s SER 88 CO 0.21 -0.46 -0.07 -0.69 0.41 0.00 0.00 173.24 172.65 1rka s VAL 89 N -2.47 3.36 -0.34 3.43 1.01 -1.26 -1.45 120.40 122.68 1rka s VAL 89 Ca 0.52 -0.52 -0.13 0.00 0.00 0.00 0.00 61.98 61.86 1rka s VAL 89 Cb -0.10 -2.49 -0.02 0.00 0.00 0.00 0.00 36.38 33.77 1rka s VAL 89 CO 0.33 0.46 0.23 -0.63 0.00 0.00 0.00 175.10 175.50 1rka s ILE 90 N 1.00 5.24 0.34 2.22 -1.09 -0.54 -4.96 121.20 123.40 1rka s ILE 90 Ca -0.00 -0.22 -0.29 0.00 -2.23 0.00 0.00 60.65 57.91 1rka s ILE 90 Cb -0.15 -3.68 -0.10 0.00 -1.58 0.00 0.00 42.46 36.95 1rka s ILE 90 CO -0.00 0.00 1.33 -0.75 -1.23 0.00 0.00 174.94 174.29 1rka s LYS 91 N 1.72 4.32 0.00 2.79 2.20 -1.26 -2.82 119.74 126.68 1rka s LYS 91 Ca 0.06 2.27 0.00 0.00 -0.36 0.00 0.00 55.97 57.94 1rka s LYS 91 Cb -0.17 -3.06 0.00 0.00 -1.51 0.00 0.00 37.83 33.09 1rka s LYS 91 CO 0.10 -0.24 0.00 0.41 -0.36 0.00 0.00 175.35 175.26 1rka n GLY 92 N 0.75 0.48 3.35 5.54 0.00 -1.26 -4.97 105.19 109.08 1rka n GLY 92 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1rka n GLY 92 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1rka s GLU 93 N -0.39 1.31 0.24 1.61 2.56 -1.13 -5.03 118.70 117.87 1rka s GLU 93 Ca 0.00 -1.41 -0.11 0.00 0.00 0.00 0.00 54.97 53.45 1rka s GLU 93 Cb 0.00 -1.44 -0.08 0.00 2.00 0.00 0.00 34.13 34.61 1rka s GLU 93 CO 0.00 0.30 0.59 -1.12 -0.56 0.00 0.00 175.26 174.47 1rka s SER 94 N -2.60 6.68 0.39 -1.70 0.01 -1.26 -2.06 113.70 113.15 1rka s SER 94 Ca 0.16 1.01 -0.25 0.00 1.31 0.00 0.00 55.95 58.18 1rka s SER 94 Cb -0.07 -2.26 -0.09 0.00 0.21 0.00 0.00 66.02 63.82 1rka s SER 94 CO 0.07 -0.09 1.12 -0.89 0.41 0.00 0.00 173.24 173.86 1rka s THR 95 N -1.82 3.40 0.56 1.44 2.01 -1.26 0.49 115.64 120.45 1rka s THR 95 Ca 0.48 1.14 -0.20 0.00 0.31 0.00 0.00 61.69 63.42 1rka s THR 95 Cb -0.11 -3.63 -0.06 0.00 0.01 0.00 0.00 72.50 68.71 1rka s THR 95 CO 0.20 0.08 0.98 0.61 -0.69 0.00 0.00 174.62 175.80 1rka n GLY 96 N 0.56 -0.26 3.03 4.40 0.00 -1.23 -4.70 105.19 107.00 1rka n GLY 96 Ca 0.04 -0.06 -0.08 0.00 0.00 0.00 0.00 46.02 45.92 1rka n GLY 96 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rka s VAL 97 N -1.46 0.16 -0.08 1.61 1.01 -0.87 -1.41 120.40 119.36 1rka s VAL 97 Ca 0.72 -1.32 -0.01 0.00 0.00 0.00 0.00 61.98 61.38 1rka s VAL 97 Cb -0.45 -0.84 0.03 0.00 0.00 0.00 0.00 36.38 35.12 1rka s VAL 97 CO 0.50 -0.73 -0.01 0.00 0.00 0.00 0.00 175.10 174.86 1rka s ALA 98 N -2.60 0.79 -0.26 5.51 0.00 -0.63 -0.84 121.76 123.74 1rka s ALA 98 Ca -0.05 -0.18 -0.10 0.00 0.00 0.00 0.00 51.96 51.62 1rka s ALA 98 Cb -0.02 -0.74 -0.05 0.00 0.00 0.00 0.00 23.12 22.31 1rka s ALA 98 CO -0.05 -0.42 0.16 -0.51 0.00 0.00 0.00 175.76 174.94 1rka s LEU 99 N 1.85 3.99 -0.06 0.00 1.43 0.56 -0.57 118.68 125.89 1rka s LEU 99 Ca 0.04 0.02 0.03 0.00 -1.03 0.00 0.00 54.13 53.19 1rka s LEU 99 Cb -0.12 -2.09 0.00 0.00 0.03 0.00 0.00 46.19 44.01 1rka s LEU 99 CO -0.05 0.01 -0.16 -0.63 0.23 0.00 0.00 176.35 175.74 1rka s ILE 100 N 1.41 1.39 -0.05 -0.59 1.01 0.65 -0.88 121.20 124.14 1rka s ILE 100 Ca 0.07 -0.66 0.02 0.00 0.00 0.00 0.00 60.65 60.08 1rka s ILE 100 Cb -0.15 -1.22 -0.03 0.00 0.01 0.00 0.00 42.46 41.07 1rka s ILE 100 CO 0.07 0.41 -0.09 -0.36 0.00 0.00 0.00 174.94 174.97 1rka s PHE 101 N 0.36 2.86 -0.12 3.97 0.08 -0.87 -0.61 117.98 123.65 1rka s PHE 101 Ca -0.11 -0.04 -0.01 0.00 0.12 0.00 0.00 56.93 56.89 1rka s PHE 101 Cb -0.14 -1.67 0.04 0.00 -0.57 0.00 0.00 43.02 40.67 1rka s PHE 101 CO 0.04 0.30 -0.02 0.08 -0.10 0.00 0.00 175.22 175.52 1rka s VAL 102 N -0.82 0.66 0.88 -0.44 1.01 -0.70 -1.74 120.40 119.25 1rka s VAL 102 Ca 0.13 -0.21 -0.11 0.00 0.00 0.00 0.00 61.98 61.79 1rka s VAL 102 Cb -0.11 -0.85 0.17 0.00 0.00 0.00 0.00 36.38 35.59 1rka s VAL 102 CO 0.02 0.18 1.21 0.54 0.00 0.00 0.00 175.10 177.05 1rka s ASN 103 N 1.84 3.54 0.00 3.32 2.20 -0.64 -0.74 114.94 124.47 1rka s ASN 103 Ca 0.03 0.07 0.13 0.00 -0.94 0.00 0.00 52.86 52.15 1rka s ASN 103 Cb -0.14 -0.23 0.60 0.00 -2.00 0.00 0.00 41.25 39.48 1rka s ASN 103 CO -0.07 -2.43 1.35 0.61 -2.94 0.00 0.00 177.10 173.62 1rka n GLY 104 N -3.45 -0.79 0.91 0.45 0.00 0.05 -1.75 105.19 100.62 1rka n GLY 104 Ca 0.15 -0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.24 1rka n GLY 104 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1rka n GLU 105 N -1.36 2.24 -0.28 1.61 1.02 -1.26 -4.95 120.64 117.65 1rka n GLU 105 Ca 0.05 -1.82 0.00 0.00 -0.02 0.00 0.00 57.16 55.36 1rka n GLU 105 Cb 0.12 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.06 1rka n GLU 105 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1rka n GLY 106 N 1.35 1.33 3.85 0.62 0.00 -0.72 -5.05 105.19 106.58 1rka n GLY 106 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 1rka n GLY 106 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rka s GLU 107 N -0.40 2.67 0.08 1.61 2.02 -1.26 -4.83 118.70 118.60 1rka s GLU 107 Ca 0.00 0.56 -0.08 0.00 0.02 0.00 0.00 54.97 55.47 1rka s GLU 107 Cb 0.00 -1.99 -0.00 0.00 0.10 0.00 0.00 34.13 32.23 1rka s GLU 107 CO 0.00 -1.19 0.17 0.54 0.02 0.00 0.00 175.26 174.80 1rka s ASN 108 N -4.18 0.15 0.01 -0.19 2.20 -1.26 -1.62 114.94 110.05 1rka s ASN 108 Ca 0.59 -0.68 0.01 0.00 -0.94 0.00 0.00 52.86 51.84 1rka s ASN 108 Cb -0.12 0.33 -0.01 0.00 -2.00 0.00 0.00 41.25 39.45 1rka s ASN 108 CO 0.53 -0.72 -0.04 0.68 -2.94 0.00 0.00 177.10 174.61 1rka s VAL 109 N -3.85 0.30 -0.05 3.54 -7.23 -0.71 -5.00 120.40 107.40 1rka s VAL 109 Ca 0.05 -0.35 0.04 0.00 -1.81 0.00 0.00 61.98 59.91 1rka s VAL 109 Cb 0.05 -0.30 -0.00 0.00 0.56 0.00 0.00 36.38 36.69 1rka s VAL 109 CO -0.11 -0.04 -0.16 -0.63 -0.31 0.00 0.00 175.10 173.86 1rka s ILE 110 N -0.39 1.33 -0.14 -0.62 1.01 -1.26 -2.04 121.20 119.09 1rka s ILE 110 Ca -0.02 -0.65 0.02 0.00 0.00 0.00 0.00 60.65 60.00 1rka s ILE 110 Cb -0.03 -1.16 0.00 0.00 0.01 0.00 0.00 42.46 41.28 1rka s ILE 110 CO -0.00 0.39 -0.19 -0.83 0.00 0.00 0.00 174.94 174.31 1rka s GLY 111 N 0.15 1.42 -0.02 6.18 0.00 -0.06 -4.98 107.32 110.02 1rka s GLY 111 Ca -0.06 -1.03 0.06 0.00 0.00 0.00 0.00 44.72 43.69 1rka s GLY 111 CO 0.02 -0.08 -0.20 -0.42 0.00 0.00 0.00 173.10 172.43 1rka s ILE 112 N 0.68 2.61 -0.25 0.90 1.01 -1.26 -0.32 121.20 124.56 1rka s ILE 112 Ca -0.09 -0.97 -0.03 0.00 0.00 0.00 0.00 60.65 59.57 1rka s ILE 112 Cb -0.16 -2.00 0.02 0.00 0.01 0.00 0.00 42.46 40.33 1rka s ILE 112 CO 0.02 0.54 -0.04 -2.28 0.00 0.00 0.00 174.94 173.17 1rka s HIS 113 N -0.72 3.06 0.19 3.97 5.65 -0.02 -5.01 115.29 122.41 1rka s HIS 113 Ca 0.11 -1.42 -0.12 0.00 0.25 0.00 0.00 55.06 53.89 1rka s HIS 113 Cb -0.10 -2.09 0.13 0.00 -1.18 0.00 0.00 32.58 29.34 1rka s HIS 113 CO 0.01 -0.69 1.84 0.00 -0.65 0.00 0.00 174.74 175.24 1rka h ALA 114 N 8.05 0.79 -0.62 1.58 0.00 -1.96 -2.32 119.26 124.78 1rka h ALA 114 Ca -0.33 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1rka h ALA 114 Cb 1.12 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1rka h ALA 114 CO 0.58 0.15 0.00 0.41 0.00 0.00 0.00 179.25 180.39 1rka n GLY 115 N -1.27 2.56 0.35 0.00 0.00 -1.26 -1.70 105.19 103.86 1rka n GLY 115 Ca 0.05 -0.26 0.18 0.00 0.00 0.00 0.00 46.02 45.99 1rka n GLY 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rka h ALA 116 N -0.62 1.85 -0.26 4.61 0.00 -0.24 -2.20 119.26 122.40 1rka h ALA 116 Ca 0.00 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.95 1rka h ALA 116 Cb 0.00 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1rka h ALA 116 CO 0.00 -0.39 0.18 -0.91 0.00 0.00 0.00 179.25 178.13 1rka h ASN 117 N 0.00 0.12 0.47 0.00 2.35 -1.49 0.28 115.58 117.31 1rka h ASN 117 Ca 0.11 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.86 1rka h ASN 117 Cb 0.64 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.99 1rka h ASN 117 CO -0.00 0.08 0.00 0.00 -1.65 0.00 0.00 177.43 175.86 1rka n ALA 118 N -2.55 2.09 1.27 -0.83 0.00 -0.83 -2.82 120.51 116.84 1rka n ALA 118 Ca 0.02 -0.10 0.13 0.00 0.00 0.00 0.00 53.44 53.50 1rka n ALA 118 Cb 0.23 -1.35 0.33 0.00 0.00 0.00 0.00 19.45 18.67 1rka n ALA 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rka n ALA 119 N -1.33 2.79 -2.31 0.00 0.00 0.09 -4.76 120.51 115.00 1rka n ALA 119 Ca 0.09 -0.51 -0.36 0.00 0.00 0.00 0.00 53.44 52.66 1rka n ALA 119 Cb 0.19 -1.03 -0.04 0.00 0.00 0.00 0.00 19.45 18.57 1rka n ALA 119 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1rka s LEU 120 N -2.17 3.30 0.50 0.00 0.20 -1.13 -4.94 118.68 114.44 1rka s LEU 120 Ca 0.30 -0.76 0.05 0.00 0.69 0.00 0.00 54.13 54.41 1rka s LEU 120 Cb 0.20 -2.56 0.03 0.00 -0.43 0.00 0.00 46.19 43.44 1rka s LEU 120 CO 0.40 -2.11 0.69 -0.94 -0.29 0.00 0.00 176.35 174.10 1rka s SER 121 N 6.29 5.38 0.35 3.68 1.04 -1.26 -4.47 113.70 124.71 1rka s SER 121 Ca 0.56 -0.34 0.02 0.00 0.48 0.00 0.00 55.95 56.67 1rka s SER 121 Cb -0.05 -0.57 0.63 0.00 0.10 0.00 0.00 66.02 66.12 1rka s SER 121 CO 0.02 -1.02 1.99 -0.65 0.98 0.00 0.00 173.24 174.55 1rka h PRO 122 N 0.33 0.80 -0.82 4.02 0.11 -1.91 -1.01 132.00 133.52 1rka h PRO 122 Ca -0.39 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 1rka h PRO 122 Cb 1.29 -0.17 -0.04 0.00 0.11 0.00 0.00 31.00 32.18 1rka h PRO 122 CO 0.46 0.56 0.45 0.00 -0.21 0.00 0.00 178.00 179.27 1rka h ALA 123 N 1.58 1.26 -0.13 -0.75 0.00 -1.97 0.12 119.26 119.38 1rka h ALA 123 Ca 0.22 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.88 1rka h ALA 123 Cb -0.04 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 1rka h ALA 123 CO -0.04 0.60 -0.50 -0.07 0.00 0.00 0.00 179.25 179.24 1rka h LEU 124 N 1.14 0.37 -0.18 0.00 3.38 -1.60 -2.26 115.31 116.15 1rka h LEU 124 Ca 0.29 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 1rka h LEU 124 Cb 0.01 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1rka h LEU 124 CO -0.05 0.81 -0.05 0.58 0.09 0.00 0.00 178.44 179.82 1rka h VAL 125 N 0.27 1.29 -0.86 1.22 2.07 -0.44 -2.94 116.25 116.86 1rka h VAL 125 Ca 0.01 -1.04 0.07 0.00 0.82 0.00 0.00 66.70 66.57 1rka h VAL 125 Cb 0.98 1.62 -0.06 0.00 -1.52 0.00 0.00 31.29 32.31 1rka h VAL 125 CO 0.08 0.31 0.56 -0.08 0.02 0.00 0.00 177.57 178.46 1rka h GLU 126 N 0.05 0.90 0.00 1.57 4.57 -0.73 0.59 114.58 121.53 1rka h GLU 126 Ca 0.04 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1rka h GLU 126 Cb 0.50 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 28.88 1rka h GLU 126 CO 0.02 0.60 0.00 0.00 -1.18 0.00 0.00 179.01 178.45 1rka h ALA 127 N 1.54 1.00 -0.35 2.92 0.00 -1.24 -0.17 119.26 122.96 1rka h ALA 127 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1rka h ALA 127 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1rka h ALA 127 CO -0.14 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.15 1rka n GLN 128 N -2.56 3.21 -0.15 0.00 1.13 0.20 -4.73 117.38 114.48 1rka n GLN 128 Ca -0.01 -2.71 -0.04 0.00 -1.94 0.00 0.00 57.00 52.30 1rka n GLN 128 Cb 0.12 -1.77 0.02 0.00 0.11 0.00 0.00 30.24 28.72 1rka n GLN 128 CO 0.00 0.00 0.00 -0.09 -1.44 0.00 0.00 177.06 175.53 1rka h ARG 129 N 2.33 -0.08 -0.17 -1.09 2.43 -0.56 -0.96 114.38 116.28 1rka h ARG 129 Ca 0.00 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.17 1rka h ARG 129 Cb 1.35 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.91 1rka h ARG 129 CO 0.21 -0.05 0.08 1.49 -1.51 0.00 0.00 179.97 180.18 1rka h GLU 130 N -0.08 0.25 -0.79 0.20 4.81 -1.85 0.12 114.58 117.24 1rka h GLU 130 Ca 0.23 -0.04 0.07 0.00 -0.13 0.00 0.00 59.36 59.49 1rka h GLU 130 Cb 0.43 -0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.70 1rka h GLU 130 CO -0.53 0.30 0.47 -0.09 -0.73 0.00 0.00 179.01 178.42 1rka h ARG 131 N 0.14 0.80 -0.41 1.92 2.43 -1.80 0.14 114.38 117.60 1rka h ARG 131 Ca 0.06 -0.05 -0.15 0.00 -0.81 0.00 0.00 59.98 59.03 1rka h ARG 131 Cb 0.13 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 1rka h ARG 131 CO -0.01 0.53 -0.31 0.82 -1.51 0.00 0.00 179.97 179.49 1rka h ILE 132 N 0.83 1.27 -0.52 1.20 2.04 -0.99 -2.78 117.51 118.56 1rka h ILE 132 Ca 0.36 -1.48 -0.00 0.00 1.00 0.00 0.00 64.86 64.74 1rka h ILE 132 Cb 0.24 1.30 -0.03 0.00 -0.74 0.00 0.00 36.82 37.59 1rka h ILE 132 CO -0.20 0.50 0.31 0.00 0.00 0.00 0.00 178.15 178.76 1rka h ALA 133 N 0.80 0.67 0.00 1.87 0.00 0.30 -3.04 119.26 119.86 1rka h ALA 133 Ca 0.08 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1rka h ALA 133 Cb 0.90 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1rka h ALA 133 CO 0.08 0.16 -0.01 0.09 0.00 0.00 0.00 179.25 179.57 1rka n ASN 134 N -4.67 0.24 -4.79 0.00 3.02 0.40 -4.80 115.26 104.67 1rka n ASN 134 Ca 0.03 0.51 -0.30 0.00 -0.03 0.00 0.00 54.58 54.79 1rka n ASN 134 Cb 0.06 -0.57 0.11 0.00 -0.61 0.00 0.00 39.78 38.76 1rka n ASN 134 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1rka s ALA 135 N -3.03 2.03 -0.08 5.41 0.00 -1.05 -4.84 121.76 120.19 1rka s ALA 135 Ca 0.13 -0.27 0.11 0.00 0.00 0.00 0.00 51.96 51.92 1rka s ALA 135 Cb 0.17 -3.10 -0.24 0.00 0.00 0.00 0.00 23.12 19.96 1rka s ALA 135 CO 0.55 -1.95 0.51 0.43 0.00 0.00 0.00 175.76 175.30 1rka n SER 136 N -3.58 0.94 -3.72 0.00 7.64 0.88 -4.66 113.62 111.12 1rka n SER 136 Ca 0.07 0.31 -0.12 0.00 1.01 0.00 0.00 58.87 60.14 1rka n SER 136 Cb 0.57 -0.02 -0.07 0.00 -1.01 0.00 0.00 64.21 63.68 1rka n SER 136 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1rka s ALA 137 N -2.57 -0.83 -0.12 -0.43 0.00 -1.09 -1.01 121.76 115.72 1rka s ALA 137 Ca -0.09 0.17 0.03 0.00 0.00 0.00 0.00 51.96 52.07 1rka s ALA 137 Cb 0.08 0.31 0.01 0.00 0.00 0.00 0.00 23.12 23.51 1rka s ALA 137 CO 0.81 -0.42 -0.20 -1.17 0.00 0.00 0.00 175.76 174.78 1rka s LEU 138 N -1.97 1.96 -0.20 0.00 2.96 0.19 -1.06 118.68 120.56 1rka s LEU 138 Ca -0.06 -0.52 -0.03 0.00 -0.22 0.00 0.00 54.13 53.30 1rka s LEU 138 Cb -0.01 -1.29 -0.01 0.00 0.50 0.00 0.00 46.19 45.38 1rka s LEU 138 CO -0.02 0.08 -0.07 -0.22 -1.32 0.00 0.00 176.35 174.80 1rka s LEU 139 N 0.73 2.81 0.18 -0.68 2.96 0.17 -0.11 118.68 124.74 1rka s LEU 139 Ca -0.11 -0.39 0.02 0.00 -0.22 0.00 0.00 54.13 53.44 1rka s LEU 139 Cb -0.16 -1.69 -0.05 0.00 0.50 0.00 0.00 46.19 44.79 1rka s LEU 139 CO 0.01 0.03 0.00 -0.04 -1.32 0.00 0.00 176.35 175.04 1rka s MET 140 N 1.19 1.15 0.00 1.98 -1.94 -0.27 -1.70 119.30 119.70 1rka s MET 140 Ca 0.02 -1.56 0.00 0.00 -1.71 0.00 0.00 55.69 52.44 1rka s MET 140 Cb -0.14 -0.31 0.00 0.00 2.01 0.00 0.00 34.83 36.38 1rka s MET 140 CO -0.02 -0.13 0.00 1.04 -0.01 0.00 0.00 175.02 175.90 1rka n GLN 141 N -0.27 2.22 -1.03 2.03 3.00 -1.26 -0.74 117.38 121.32 1rka n GLN 141 Ca -0.06 0.00 -0.01 0.00 -0.01 0.00 0.00 57.00 56.92 1rka n GLN 141 Cb 0.63 0.00 0.15 0.00 0.00 0.00 0.00 30.24 31.02 1rka n GLN 141 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1rka n LEU 142 N 0.00 2.99 -1.32 1.08 4.77 -0.11 -4.64 117.00 119.77 1rka n LEU 142 Ca 0.00 -3.89 0.08 0.00 -0.03 0.00 0.00 56.01 52.17 1rka n LEU 142 Cb 0.00 -0.42 0.32 0.00 -2.33 0.00 0.00 43.42 40.99 1rka n LEU 142 CO 0.00 1.47 0.78 -0.62 -1.33 0.00 0.00 177.39 177.69 1rka n GLU 143 N -0.88 3.76 -4.29 3.23 1.02 -1.26 -4.43 120.64 117.78 1rka n GLU 143 Ca 0.23 -2.97 -0.21 0.00 -0.02 0.00 0.00 57.16 54.19 1rka n GLU 143 Cb 0.79 -2.01 -0.11 0.00 -0.02 0.00 0.00 31.44 30.09 1rka n GLU 143 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1rka s SER 144 N -1.43 2.41 0.13 1.62 0.01 -1.26 -4.56 113.70 110.62 1rka s SER 144 Ca 0.47 -0.82 -0.35 0.00 1.31 0.00 0.00 55.95 56.56 1rka s SER 144 Cb 0.37 -0.12 -0.16 0.00 0.21 0.00 0.00 66.02 66.32 1rka s SER 144 CO 0.12 -0.07 1.28 -2.65 0.41 0.00 0.00 173.24 172.33 1rka n PRO 145 N 0.47 1.22 -0.00 12.44 -0.02 -1.26 -4.82 135.00 143.02 1rka n PRO 145 Ca -0.15 0.44 0.08 0.00 -2.02 0.00 0.00 63.50 61.85 1rka n PRO 145 Cb 0.57 -2.02 0.48 0.00 -0.02 0.00 0.00 33.50 32.50 1rka n PRO 145 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1rka h LEU 146 N 4.11 0.38 -1.39 2.45 5.85 -1.95 -1.54 115.31 123.21 1rka h LEU 146 Ca -0.46 -0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.20 1rka h LEU 146 Cb 1.33 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.27 1rka h LEU 146 CO 0.75 0.26 -0.23 1.05 -0.34 0.00 0.00 178.44 179.93 1rka h GLU 147 N 0.43 0.11 0.11 1.25 9.09 -1.96 0.13 114.58 123.74 1rka h GLU 147 Ca 0.18 -0.03 -0.28 0.00 0.05 0.00 0.00 59.36 59.29 1rka h GLU 147 Cb 0.19 -0.01 0.02 0.00 -1.65 0.00 0.00 28.75 27.29 1rka h GLU 147 CO -0.05 0.34 -1.19 0.77 0.05 0.00 0.00 179.01 178.94 1rka h SER 148 N 0.11 0.65 -0.46 3.06 0.02 -1.57 -1.49 113.55 113.86 1rka h SER 148 Ca 0.02 -0.62 -0.07 0.00 -0.84 0.00 0.00 61.79 60.28 1rka h SER 148 Cb 0.47 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.78 1rka h SER 148 CO 0.03 1.45 0.00 0.58 -1.14 0.00 0.00 176.83 177.75 1rka h VAL 149 N 0.19 1.26 0.16 2.27 2.07 -1.13 -1.00 116.25 120.08 1rka h VAL 149 Ca -0.15 -1.05 0.00 0.00 0.82 0.00 0.00 66.70 66.32 1rka h VAL 149 Cb 1.87 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 32.65 1rka h VAL 149 CO 0.21 0.36 -0.15 -0.03 0.02 0.00 0.00 177.57 177.98 1rka h MET 150 N 0.67 -0.33 -0.35 1.57 -1.53 -0.75 -1.02 114.93 113.18 1rka h MET 150 Ca 0.13 0.02 -0.05 0.00 -3.44 0.00 0.00 59.70 56.37 1rka h MET 150 Cb 0.50 0.07 -0.02 0.00 -0.55 0.00 0.00 31.60 31.60 1rka h MET 150 CO 0.02 -0.22 0.02 0.00 0.14 0.00 0.00 176.91 176.87 1rka h ALA 151 N 0.47 1.38 -0.16 0.39 0.00 -1.21 -2.19 119.26 117.94 1rka h ALA 151 Ca 0.00 -0.19 -0.15 0.00 0.00 0.00 0.00 54.91 54.57 1rka h ALA 151 Cb 0.32 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1rka h ALA 151 CO -0.03 0.43 -0.52 0.00 0.00 0.00 0.00 179.25 179.13 1rka h ALA 152 N 1.51 0.81 -0.34 0.00 0.00 -0.88 -2.89 119.26 117.47 1rka h ALA 152 Ca 0.11 -0.49 -0.12 0.00 0.00 0.00 0.00 54.91 54.40 1rka h ALA 152 Cb 0.31 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1rka h ALA 152 CO 0.01 0.68 -0.29 0.00 0.00 0.00 0.00 179.25 179.64 1rka h ALA 153 N 1.09 0.84 0.09 0.00 0.00 -0.73 -2.34 119.26 118.22 1rka h ALA 153 Ca 0.01 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 1rka h ALA 153 Cb 1.03 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1rka h ALA 153 CO 0.09 0.64 -0.04 0.87 0.00 0.00 0.00 179.25 180.81 1rka h LYS 154 N 0.62 -0.12 -0.76 0.00 1.57 -1.34 0.97 116.57 117.51 1rka h LYS 154 Ca 0.07 0.01 0.11 0.00 -1.87 0.00 0.00 60.65 58.97 1rka h LYS 154 Cb 0.81 0.03 -0.08 0.00 0.08 0.00 0.00 32.23 33.07 1rka h LYS 154 CO 0.07 0.06 0.38 0.82 -0.57 0.00 0.00 179.45 180.21 1rka h ILE 155 N -0.28 0.81 -0.26 1.86 2.04 -1.45 -0.48 117.51 119.74 1rka h ILE 155 Ca -0.01 -0.21 -0.02 0.00 1.00 0.00 0.00 64.86 65.62 1rka h ILE 155 Cb 0.23 0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 36.44 1rka h ILE 155 CO 0.02 0.11 0.09 0.00 0.00 0.00 0.00 178.15 178.37 1rka h ALA 156 N 1.47 0.34 -0.60 1.87 0.00 -1.13 -2.43 119.26 118.78 1rka h ALA 156 Ca 0.39 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.21 1rka h ALA 156 Cb 0.45 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1rka h ALA 156 CO -0.30 -0.04 0.40 1.25 0.00 0.00 0.00 179.25 180.56 1rka h HIS 157 N 0.27 0.64 0.00 0.00 -0.00 0.08 -1.40 115.15 114.74 1rka h HIS 157 Ca 0.09 0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 60.46 1rka h HIS 157 Cb 0.22 -0.21 -0.00 0.00 -0.00 0.00 0.00 27.41 27.41 1rka h HIS 157 CO -0.00 0.36 -0.06 1.96 -0.00 0.00 0.00 177.93 180.19 1rka h GLN 158 N 0.65 0.00 -0.39 5.26 4.20 -0.79 -3.35 115.11 120.69 1rka h GLN 158 Ca 0.25 0.00 -0.29 0.00 0.06 0.00 0.00 58.65 58.67 1rka h GLN 158 Cb 0.18 0.00 -0.27 0.00 0.30 0.00 0.00 27.48 27.69 1rka h GLN 158 CO -0.07 0.06 -0.76 0.09 -0.67 0.00 0.00 178.83 177.48 1rka n ASN 159 N -3.14 3.12 -3.88 1.46 3.02 -0.62 -4.98 115.26 110.24 1rka n ASN 159 Ca 0.02 -3.48 -0.28 0.00 -0.03 0.00 0.00 54.58 50.81 1rka n ASN 159 Cb 0.43 -0.42 0.02 0.00 -0.61 0.00 0.00 39.78 39.21 1rka n ASN 159 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1rka n LYS 160 N -0.75 -5.19 -3.83 3.52 5.02 -1.15 -4.88 118.16 110.90 1rka n LYS 160 Ca 0.28 0.59 -0.36 0.00 -2.02 0.00 0.00 58.31 56.80 1rka n LYS 160 Cb 0.87 -5.35 -0.13 0.00 -0.02 0.00 0.00 35.03 30.39 1rka n LYS 160 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1rka s THR 161 N -3.43 3.78 0.24 -0.18 2.01 -0.63 -4.86 115.64 112.56 1rka s THR 161 Ca 0.47 -0.41 -0.31 0.00 0.31 0.00 0.00 61.69 61.76 1rka s THR 161 Cb -0.24 -2.77 -0.11 0.00 0.01 0.00 0.00 72.50 69.40 1rka s THR 161 CO 0.83 0.35 1.56 -0.63 -0.69 0.00 0.00 174.62 176.04 1rka s ILE 162 N 1.53 2.36 -0.31 1.82 1.01 -0.18 -4.33 121.20 123.10 1rka s ILE 162 Ca 0.06 0.29 -0.09 0.00 0.00 0.00 0.00 60.65 60.90 1rka s ILE 162 Cb -0.15 -3.18 -0.00 0.00 0.01 0.00 0.00 42.46 39.14 1rka s ILE 162 CO -0.00 0.04 0.14 -0.69 0.00 0.00 0.00 174.94 174.42 1rka s VAL 163 N 0.39 4.45 -0.17 2.92 1.01 -1.26 0.55 120.40 128.30 1rka s VAL 163 Ca 0.65 -0.51 -0.02 0.00 0.00 0.00 0.00 61.98 62.10 1rka s VAL 163 Cb -0.45 -3.29 -0.02 0.00 0.00 0.00 0.00 36.38 32.62 1rka s VAL 163 CO 0.41 0.05 -0.08 0.00 0.00 0.00 0.00 175.10 175.48 1rka s ALA 164 N 1.58 2.78 -0.11 5.51 0.00 0.84 -0.70 121.76 131.65 1rka s ALA 164 Ca 0.04 -0.97 0.01 0.00 0.00 0.00 0.00 51.96 51.04 1rka s ALA 164 Cb -0.17 -1.46 0.02 0.00 0.00 0.00 0.00 23.12 21.50 1rka s ALA 164 CO 0.05 0.01 -0.13 -1.17 0.00 0.00 0.00 175.76 174.52 1rka s LEU 165 N 0.74 1.62 -0.65 0.00 2.96 0.15 -1.12 118.68 122.38 1rka s LEU 165 Ca -0.03 -0.41 -0.16 0.00 -0.22 0.00 0.00 54.13 53.31 1rka s LEU 165 Cb -0.15 -1.04 0.16 0.00 0.50 0.00 0.00 46.19 45.66 1rka s LEU 165 CO 0.02 -0.02 0.61 0.21 -1.32 0.00 0.00 176.35 175.85 1rka s ASN 166 N 1.17 6.39 -0.53 3.68 3.04 0.08 -1.53 114.94 127.25 1rka s ASN 166 Ca -0.03 -2.08 -0.04 0.00 0.04 0.00 0.00 52.86 50.75 1rka s ASN 166 Cb -0.14 -2.22 -0.04 0.00 -1.54 0.00 0.00 41.25 37.31 1rka s ASN 166 CO -0.04 -0.78 1.74 -0.81 -3.04 0.00 0.00 177.10 174.17 1rka n PRO 167 N 4.89 1.31 -4.43 0.43 -0.04 -1.26 -3.84 135.00 132.05 1rka n PRO 167 Ca -0.04 -1.03 -0.20 0.00 -0.04 0.00 0.00 63.50 62.19 1rka n PRO 167 Cb 0.43 -2.21 -0.14 0.00 -0.04 0.00 0.00 33.50 31.53 1rka n PRO 167 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1rka s ALA 168 N 3.68 0.97 0.69 0.55 0.00 -1.26 -3.96 121.76 122.42 1rka s ALA 168 Ca 0.26 -0.58 -0.13 0.00 0.00 0.00 0.00 51.96 51.52 1rka s ALA 168 Cb 0.08 -0.21 0.01 0.00 0.00 0.00 0.00 23.12 23.00 1rka s ALA 168 CO -0.02 0.21 1.08 -1.25 0.00 0.00 0.00 175.76 175.79 1rka s PRO 169 N -0.54 2.78 0.21 0.00 0.04 -1.26 -0.94 135.00 135.29 1rka s PRO 169 Ca 0.03 1.19 -0.31 0.00 0.04 0.00 0.00 61.00 61.95 1rka s PRO 169 Cb -0.05 -1.96 -0.15 0.00 0.04 0.00 0.00 34.50 32.37 1rka s PRO 169 CO 0.00 -1.24 1.04 0.00 0.04 0.00 0.00 177.00 176.84 1rka n ALA 170 N -2.83 -0.84 0.00 8.56 0.00 -1.25 -4.88 120.51 119.27 1rka n ALA 170 Ca 0.09 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.97 1rka n ALA 170 Cb 0.53 -1.98 0.00 0.00 0.00 0.00 0.00 19.45 18.00 1rka n ALA 170 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1rka n ARG 171 N 1.30 0.00 -2.31 0.00 1.85 -1.26 -5.09 116.66 111.15 1rka n ARG 171 Ca 0.13 0.00 -0.34 0.00 -1.00 0.00 0.00 57.85 56.64 1rka n ARG 171 Cb 0.27 0.00 -0.01 0.00 -1.05 0.00 0.00 32.46 31.67 1rka n ARG 171 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 1rka s GLU 172 N -2.00 3.51 0.06 2.89 2.02 -1.26 -4.64 118.70 119.27 1rka s GLU 172 Ca 0.00 1.40 0.04 0.00 0.02 0.00 0.00 54.97 56.43 1rka s GLU 172 Cb 0.00 -2.05 -0.03 0.00 0.10 0.00 0.00 34.13 32.16 1rka s GLU 172 CO 0.00 -0.68 -0.13 -0.51 0.02 0.00 0.00 175.26 173.96 1rka s LEU 173 N -3.87 2.24 0.52 1.80 1.43 -1.26 -5.08 118.68 114.45 1rka s LEU 173 Ca 0.68 -0.55 -0.21 0.00 -1.03 0.00 0.00 54.13 53.03 1rka s LEU 173 Cb -0.19 -0.47 -0.06 0.00 0.03 0.00 0.00 46.19 45.50 1rka s LEU 173 CO 0.27 -0.06 1.17 -2.16 0.23 0.00 0.00 176.35 175.79 1rka s PRO 174 N -1.50 3.42 0.60 1.29 0.04 -1.26 -4.90 135.00 132.69 1rka s PRO 174 Ca -0.02 1.74 0.34 0.00 0.04 0.00 0.00 61.00 63.10 1rka s PRO 174 Cb -0.09 -2.15 1.93 0.00 0.04 0.00 0.00 34.50 34.23 1rka s PRO 174 CO 0.02 -0.82 2.25 -0.44 0.04 0.00 0.00 177.00 178.05 1rka h ASP 175 N 1.47 0.00 -0.49 6.66 3.32 -2.00 -1.88 116.42 123.48 1rka h ASP 175 Ca -0.50 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.52 1rka h ASP 175 Cb 1.26 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.79 1rka h ASP 175 CO 0.58 0.02 0.20 -0.08 -1.72 0.00 0.00 179.24 178.24 1rka h GLU 176 N 0.00 0.79 0.16 3.56 4.81 -1.97 0.94 114.58 122.86 1rka h GLU 176 Ca -0.00 -0.13 -0.21 0.00 -0.13 0.00 0.00 59.36 58.89 1rka h GLU 176 Cb 0.08 -0.14 0.02 0.00 0.63 0.00 0.00 28.75 29.35 1rka h GLU 176 CO 0.00 0.66 -0.93 1.25 -0.73 0.00 0.00 179.01 179.27 1rka h LEU 177 N 0.78 0.55 -1.46 1.64 5.85 -1.72 -3.31 115.31 117.64 1rka h LEU 177 Ca 0.18 -0.94 0.02 0.00 0.84 0.00 0.00 57.88 57.98 1rka h LEU 177 Cb 0.18 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.00 1rka h LEU 177 CO -0.01 1.45 0.38 -0.07 -0.34 0.00 0.00 178.44 179.84 1rka h LEU 178 N -0.26 0.63 0.00 2.25 3.38 -1.32 0.13 115.31 120.11 1rka h LEU 178 Ca -0.16 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1rka h LEU 178 Cb 1.73 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.33 1rka h LEU 178 CO 0.17 0.44 0.00 0.00 0.09 0.00 0.00 178.44 179.15 1rka n ALA 179 N -2.45 2.15 -0.01 1.53 0.00 0.31 -1.81 120.51 120.22 1rka n ALA 179 Ca 0.06 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1rka n ALA 179 Cb 0.08 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.41 1rka n ALA 179 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1rka n LEU 180 N -0.70 0.97 -4.81 0.00 4.77 0.02 -4.98 117.00 112.26 1rka n LEU 180 Ca 0.06 -0.98 -0.38 0.00 -0.03 0.00 0.00 56.01 54.68 1rka n LEU 180 Cb 0.03 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.06 1rka n LEU 180 CO 0.04 0.24 0.08 -0.69 -1.33 0.00 0.00 177.39 175.74 1rka s VAL 181 N -0.03 5.12 -0.24 4.08 1.01 -0.75 -4.66 120.40 124.93 1rka s VAL 181 Ca 0.00 0.78 0.04 0.00 0.00 0.00 0.00 61.98 62.80 1rka s VAL 181 Cb 0.00 -3.69 -0.17 0.00 0.00 0.00 0.00 36.38 32.51 1rka s VAL 181 CO 0.00 0.52 -0.18 0.47 0.00 0.00 0.00 175.10 175.92 1rka n ASP 182 N 2.30 1.80 -3.81 3.32 8.00 0.12 -4.10 116.55 124.18 1rka n ASP 182 Ca -0.13 -0.11 -0.23 0.00 0.71 0.00 0.00 54.79 55.02 1rka n ASP 182 Cb 0.52 -0.19 -0.17 0.00 -0.02 0.00 0.00 41.12 41.26 1rka n ASP 182 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1rka s ILE 183 N -2.49 0.51 -0.05 0.53 1.01 -0.66 -1.83 121.20 118.23 1rka s ILE 183 Ca -0.30 0.01 0.05 0.00 0.00 0.00 0.00 60.65 60.42 1rka s ILE 183 Cb 0.08 -0.63 -0.01 0.00 0.01 0.00 0.00 42.46 41.92 1rka s ILE 183 CO 0.61 0.27 -0.21 -0.51 0.00 0.00 0.00 174.94 175.10 1rka s ILE 184 N 1.76 1.73 -0.53 2.92 2.07 -0.91 0.30 121.20 128.55 1rka s ILE 184 Ca 0.02 -0.89 0.06 0.00 -1.41 0.00 0.00 60.65 58.44 1rka s ILE 184 Cb -0.13 -1.48 0.35 0.00 0.13 0.00 0.00 42.46 41.34 1rka s ILE 184 CO -0.05 0.49 0.94 0.35 -1.91 0.00 0.00 174.94 174.76 1rka n THR 185 N 3.03 2.52 -2.18 4.00 -2.24 -0.58 -1.50 114.28 117.32 1rka n THR 185 Ca -0.18 -5.32 -0.33 0.00 -2.27 0.00 0.00 64.05 55.96 1rka n THR 185 Cb 0.52 -1.19 -0.00 0.00 -2.10 0.00 0.00 70.33 67.56 1rka n THR 185 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1rka s PRO 186 N -3.34 3.51 0.29 -0.78 0.04 -1.16 -4.58 135.00 128.98 1rka s PRO 186 Ca 0.47 1.18 -0.00 0.00 0.04 0.00 0.00 61.00 62.69 1rka s PRO 186 Cb 0.31 -2.06 0.06 0.00 0.04 0.00 0.00 34.50 32.85 1rka s PRO 186 CO -0.13 -0.66 0.40 0.27 0.04 0.00 0.00 177.00 176.92 1rka n ASN 187 N -1.79 0.52 -0.15 6.66 0.23 -1.26 -1.12 115.26 118.36 1rka n ASN 187 Ca 0.08 -1.45 -0.08 0.00 -0.53 0.00 0.00 54.58 52.61 1rka n ASN 187 Cb 0.53 -0.26 0.01 0.00 -2.08 0.00 0.00 39.78 37.98 1rka n ASN 187 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1rka h GLU 188 N 0.00 0.60 -0.62 -3.83 5.08 -1.83 -0.06 114.58 113.93 1rka h GLU 188 Ca -0.13 -0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.18 1rka h GLU 188 Cb 0.48 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.58 1rka h GLU 188 CO 0.14 0.46 0.41 1.15 -1.00 0.00 0.00 179.01 180.17 1rka h THR 189 N 0.58 1.14 -0.26 1.13 2.02 -1.91 -1.98 112.91 113.63 1rka h THR 189 Ca 0.16 -0.28 -0.14 0.00 0.77 0.00 0.00 66.41 66.92 1rka h THR 189 Cb 0.02 0.25 -0.01 0.00 -1.74 0.00 0.00 68.15 66.67 1rka h THR 189 CO -0.03 0.15 -0.40 -0.33 0.37 0.00 0.00 175.52 175.29 1rka h GLU 190 N 0.83 0.62 -0.61 6.66 5.08 -1.85 -1.51 114.58 123.79 1rka h GLU 190 Ca 0.23 -0.31 -0.03 0.00 -1.00 0.00 0.00 59.36 58.25 1rka h GLU 190 Cb -0.07 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 1rka h GLU 190 CO -0.06 0.91 0.27 0.00 -1.00 0.00 0.00 179.01 179.13 1rka h ALA 191 N 1.05 0.79 -0.28 3.43 0.00 -0.65 0.18 119.26 123.78 1rka h ALA 191 Ca 0.04 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 1rka h ALA 191 Cb 0.91 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1rka h ALA 191 CO 0.08 0.38 -0.02 1.49 0.00 0.00 0.00 179.25 181.19 1rka h GLU 192 N 0.85 0.51 -0.51 0.00 4.81 -1.27 -0.26 114.58 118.71 1rka h GLU 192 Ca 0.21 -0.17 0.01 0.00 -0.13 0.00 0.00 59.36 59.28 1rka h GLU 192 Cb 0.16 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.47 1rka h GLU 192 CO -0.02 0.68 0.34 -0.22 -0.73 0.00 0.00 179.01 179.05 1rka h LYS 193 N 0.29 0.65 0.02 1.92 1.63 -0.96 0.82 116.57 120.93 1rka h LYS 193 Ca 0.08 -0.04 -0.24 0.00 -0.85 0.00 0.00 60.65 59.60 1rka h LYS 193 Cb 0.46 -0.15 -0.03 0.00 -0.60 0.00 0.00 32.23 31.91 1rka h LYS 193 CO 0.02 0.43 -1.20 -0.07 -3.45 0.00 0.00 179.45 175.18 1rka h LEU 194 N 0.67 0.05 0.00 5.20 3.38 -0.71 -3.40 115.31 120.50 1rka h LEU 194 Ca 0.19 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 58.05 1rka h LEU 194 Cb -0.04 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1rka h LEU 194 CO -0.04 1.05 -1.49 0.35 0.09 0.00 0.00 178.44 178.39 1rka n THR 195 N -3.30 0.18 -0.46 0.22 -2.24 -0.13 -4.90 114.28 103.65 1rka n THR 195 Ca -0.05 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 1rka n THR 195 Cb 0.97 -0.03 0.00 0.00 -2.10 0.00 0.00 70.33 69.18 1rka n THR 195 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rka n GLY 196 N 2.10 0.75 3.39 3.38 0.00 0.28 -5.04 105.19 110.05 1rka n GLY 196 Ca -0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.61 1rka n GLY 196 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rka s ILE 197 N -2.39 3.82 0.21 -0.61 1.01 -1.23 -5.03 121.20 116.98 1rka s ILE 197 Ca 0.00 -0.34 -0.30 0.00 0.00 0.00 0.00 60.65 60.00 1rka s ILE 197 Cb 0.00 -2.75 -0.09 0.00 0.01 0.00 0.00 42.46 39.62 1rka s ILE 197 CO 0.00 0.40 1.39 -0.60 0.00 0.00 0.00 174.94 176.12 1rka s ARG 198 N 1.40 4.32 -0.32 2.79 6.06 -1.26 -3.70 118.95 128.25 1rka s ARG 198 Ca 0.05 2.17 0.02 0.00 -2.50 0.00 0.00 55.73 55.47 1rka s ARG 198 Cb -0.15 -3.16 0.08 0.00 0.06 0.00 0.00 34.95 31.78 1rka s ARG 198 CO 0.00 -0.36 0.02 0.08 -2.50 0.00 0.00 175.30 172.54 1rka s VAL 199 N 0.22 2.51 -0.06 7.11 1.01 -1.26 -4.81 120.40 125.12 1rka s VAL 199 Ca 0.59 -1.93 0.01 0.00 0.00 0.00 0.00 61.98 60.65 1rka s VAL 199 Cb -0.39 -2.65 -0.05 0.00 0.00 0.00 0.00 36.38 33.29 1rka s VAL 199 CO 0.39 -0.36 -0.04 -0.62 0.00 0.00 0.00 175.10 174.47 1rka n GLU 200 N 4.42 0.84 -4.65 2.72 1.02 -1.26 -4.88 120.64 118.84 1rka n GLU 200 Ca -0.05 0.03 -0.29 0.00 -0.02 0.00 0.00 57.16 56.82 1rka n GLU 200 Cb 0.42 -1.13 -0.10 0.00 -0.02 0.00 0.00 31.44 30.61 1rka n GLU 200 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1rka s ASN 201 N -4.38 3.90 0.61 1.62 2.20 -1.26 -5.03 114.94 112.59 1rka s ASN 201 Ca -0.07 -1.45 0.37 0.00 -0.94 0.00 0.00 52.86 50.77 1rka s ASN 201 Cb 0.02 -0.13 1.97 0.00 -2.00 0.00 0.00 41.25 41.11 1rka s ASN 201 CO 0.16 -0.57 2.24 0.44 -2.94 0.00 0.00 177.10 176.43 1rka h ASP 202 N 1.66 0.00 -0.09 3.54 5.19 -1.99 -1.41 116.42 123.33 1rka h ASP 202 Ca -0.44 0.00 -0.17 0.00 -0.62 0.00 0.00 57.03 55.80 1rka h ASP 202 Cb 1.26 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.78 1rka h ASP 202 CO 0.79 0.02 -0.60 -0.08 -3.12 0.00 0.00 179.24 176.25 1rka h GLU 203 N 0.00 0.56 -0.47 3.56 4.81 -1.99 -2.31 114.58 118.74 1rka h GLU 203 Ca -0.00 -0.49 -0.04 0.00 -0.13 0.00 0.00 59.36 58.70 1rka h GLU 203 Cb 0.15 0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 1rka h GLU 203 CO 0.00 1.11 0.13 -0.44 -0.73 0.00 0.00 179.01 179.09 1rka h ASP 204 N 0.17 0.70 -0.73 1.04 3.32 -1.66 -2.17 116.42 117.09 1rka h ASP 204 Ca -0.05 -0.22 0.04 0.00 0.02 0.00 0.00 57.03 56.82 1rka h ASP 204 Cb 1.25 -0.18 -0.05 0.00 0.22 0.00 0.00 39.33 40.57 1rka h ASP 204 CO 0.12 0.73 0.45 0.00 -1.72 0.00 0.00 179.24 178.83 1rka h ALA 205 N 0.99 0.97 -0.66 3.45 0.00 -1.30 0.23 119.26 122.93 1rka h ALA 205 Ca 0.15 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1rka h ALA 205 Cb 0.30 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1rka h ALA 205 CO -0.00 0.22 0.24 0.00 0.00 0.00 0.00 179.25 179.71 1rka h ALA 206 N 1.32 0.86 -0.17 0.00 0.00 -1.23 0.26 119.26 120.30 1rka h ALA 206 Ca 0.30 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1rka h ALA 206 Cb 0.05 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1rka h ALA 206 CO -0.13 0.51 0.05 0.87 0.00 0.00 0.00 179.25 180.55 1rka h LYS 207 N 0.95 0.27 -0.83 0.00 1.57 -0.64 0.10 116.57 117.98 1rka h LYS 207 Ca 0.22 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.92 1rka h LYS 207 Cb 0.25 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.48 1rka h LYS 207 CO -0.01 0.39 0.43 0.00 -0.57 0.00 0.00 179.45 179.69 1rka h ALA 208 N 0.87 1.07 -0.45 3.86 0.00 -0.38 -2.17 119.26 122.07 1rka h ALA 208 Ca 0.05 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.84 1rka h ALA 208 Cb 0.23 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1rka h ALA 208 CO -0.00 0.61 0.27 0.00 0.00 0.00 0.00 179.25 180.12 1rka h ALA 209 N 1.23 0.57 -0.85 0.00 0.00 -0.17 -2.16 119.26 117.89 1rka h ALA 209 Ca 0.29 -0.01 0.11 0.00 0.00 0.00 0.00 54.91 55.30 1rka h ALA 209 Cb 0.07 -0.13 -0.08 0.00 0.00 0.00 0.00 17.79 17.65 1rka h ALA 209 CO -0.04 -0.05 0.48 0.37 0.00 0.00 0.00 179.25 180.01 1rka h GLN 210 N 0.54 0.75 -0.74 0.00 5.75 -0.38 0.55 115.11 121.57 1rka h GLN 210 Ca 0.18 -0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 58.63 1rka h GLN 210 Cb 0.01 -0.17 -0.04 0.00 1.07 0.00 0.00 27.48 28.35 1rka h GLN 210 CO -0.08 0.49 0.45 0.28 -2.65 0.00 0.00 178.83 177.33 1rka h VAL 211 N 0.77 1.21 -0.31 2.39 2.07 -0.84 -1.65 116.25 119.89 1rka h VAL 211 Ca 0.42 -0.44 -0.16 0.00 0.82 0.00 0.00 66.70 67.34 1rka h VAL 211 Cb 0.44 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 1rka h VAL 211 CO -0.28 0.21 -0.44 -0.07 0.02 0.00 0.00 177.57 177.02 1rka h LEU 212 N 1.01 0.85 -1.12 2.57 3.38 -0.86 -2.91 115.31 118.23 1rka h LEU 212 Ca 0.27 -0.41 0.01 0.00 0.09 0.00 0.00 57.88 57.84 1rka h LEU 212 Cb -0.05 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.41 1rka h LEU 212 CO -0.05 1.17 0.60 0.45 0.09 0.00 0.00 178.44 180.69 1rka h HIS 213 N 0.64 1.13 0.00 1.13 3.86 -0.57 -0.58 115.15 120.76 1rka h HIS 213 Ca 0.04 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.28 1rka h HIS 213 Cb 1.01 -0.38 -0.00 0.00 1.06 0.00 0.00 27.41 29.09 1rka h HIS 213 CO 0.06 0.71 -0.02 0.93 0.86 0.00 0.00 177.93 180.47 1rka h GLU 214 N 1.22 0.00 0.00 2.45 5.08 -1.13 0.36 114.58 122.57 1rka h GLU 214 Ca 0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 1rka h GLU 214 Cb -0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.11 1rka h GLU 214 CO -0.07 0.02 0.00 1.63 -1.00 0.00 0.00 179.01 179.58 1rka n LYS 215 N -3.13 0.07 0.00 2.33 4.76 -0.25 -4.87 118.16 117.07 1rka n LYS 215 Ca -0.01 0.07 0.00 0.00 -2.87 0.00 0.00 58.31 55.50 1rka n LYS 215 Cb 0.24 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.93 1rka n LYS 215 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1rka n GLY 216 N 1.03 1.00 3.58 0.72 0.00 0.13 -4.01 105.19 107.64 1rka n GLY 216 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 1rka n GLY 216 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rka s ILE 217 N -2.00 4.57 0.08 -0.61 1.01 -1.07 -4.87 121.20 118.31 1rka s ILE 217 Ca 0.00 0.93 -0.22 0.00 0.00 0.00 0.00 60.65 61.36 1rka s ILE 217 Cb 0.00 -4.35 -0.13 0.00 0.01 0.00 0.00 42.46 37.99 1rka s ILE 217 CO 0.00 -0.64 1.65 -0.09 0.00 0.00 0.00 174.94 175.87 1rka h ARG 218 N 8.72 0.11 -5.15 2.79 2.43 -1.76 -3.36 114.38 118.17 1rka h ARG 218 Ca -0.24 -0.02 -0.65 0.00 -0.81 0.00 0.00 59.98 58.26 1rka h ARG 218 Cb 1.08 -0.02 -0.26 0.00 -0.42 0.00 0.00 29.97 30.35 1rka h ARG 218 CO 0.98 0.18 -0.72 0.99 -1.51 0.00 0.00 179.97 179.89 1rka s THR 219 N -5.75 3.38 -0.13 0.20 2.01 -0.76 -0.92 115.64 113.67 1rka s THR 219 Ca -0.14 -0.51 0.00 0.00 0.31 0.00 0.00 61.69 61.35 1rka s THR 219 Cb 0.06 -2.50 0.02 0.00 0.01 0.00 0.00 72.50 70.10 1rka s THR 219 CO 0.68 0.47 -0.11 -0.69 -0.69 0.00 0.00 174.62 174.27 1rka s VAL 220 N 0.94 1.31 -0.26 3.82 1.01 0.24 -2.13 120.40 125.34 1rka s VAL 220 Ca -0.01 -0.48 0.03 0.00 0.00 0.00 0.00 61.98 61.52 1rka s VAL 220 Cb -0.15 -1.26 0.06 0.00 0.00 0.00 0.00 36.38 35.03 1rka s VAL 220 CO 0.00 0.41 -0.10 -0.76 0.00 0.00 0.00 175.10 174.66 1rka s LEU 221 N 1.53 3.27 -0.38 3.92 1.43 -0.56 -0.82 118.68 127.06 1rka s LEU 221 Ca 0.04 -1.36 -0.13 0.00 -1.03 0.00 0.00 54.13 51.64 1rka s LEU 221 Cb -0.13 -1.47 0.01 0.00 0.03 0.00 0.00 46.19 44.64 1rka s LEU 221 CO -0.09 -0.20 0.26 -0.63 0.23 0.00 0.00 176.35 175.92 1rka s ILE 222 N 1.16 5.08 0.15 -0.59 1.01 -0.75 -3.00 121.20 124.28 1rka s ILE 222 Ca -0.08 -0.60 -0.31 0.00 0.00 0.00 0.00 60.65 59.66 1rka s ILE 222 Cb -0.20 -3.77 -0.08 0.00 0.01 0.00 0.00 42.46 38.42 1rka s ILE 222 CO -0.05 -0.21 1.36 0.42 0.00 0.00 0.00 174.94 176.46 1rka s THR 223 N 1.66 3.24 -1.46 2.92 -4.23 -0.28 -0.75 115.64 116.74 1rka s THR 223 Ca 0.05 0.94 0.13 0.00 -1.18 0.00 0.00 61.69 61.63 1rka s THR 223 Cb -0.19 -3.60 0.21 0.00 1.34 0.00 0.00 72.50 70.27 1rka s THR 223 CO 0.09 0.10 1.08 0.18 -0.54 0.00 0.00 174.62 175.54 1rka n LEU 224 N 3.37 2.53 0.00 4.79 4.77 0.74 -2.47 117.00 130.73 1rka n LEU 224 Ca 0.09 -1.41 0.00 0.00 -0.03 0.00 0.00 56.01 54.67 1rka n LEU 224 Cb 0.42 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 1rka n LEU 224 CO 0.58 0.55 0.00 0.61 -1.33 0.00 0.00 177.39 177.80 1rka n GLY 225 N 0.75 0.74 0.39 -0.72 0.00 -1.24 -4.31 105.19 100.80 1rka n GLY 225 Ca 0.10 -1.30 0.17 0.00 0.00 0.00 0.00 46.02 44.99 1rka n GLY 225 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1rka h SER 226 N 4.13 0.55 0.00 1.61 4.64 -2.03 -2.01 113.55 120.43 1rka h SER 226 Ca 0.00 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1rka h SER 226 Cb 0.00 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 1rka h SER 226 CO 0.00 0.20 0.00 -2.11 -0.87 0.00 0.00 176.83 174.05 1rka n ARG 227 N -4.60 0.96 0.00 4.77 1.85 -1.26 -4.74 116.66 113.64 1rka n ARG 227 Ca 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.06 1rka n ARG 227 Cb 0.67 -1.32 0.00 0.00 -1.05 0.00 0.00 32.46 30.76 1rka n ARG 227 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1rka n GLY 228 N 0.75 0.80 3.03 2.89 0.00 -0.76 -4.28 105.19 107.62 1rka n GLY 228 Ca 0.15 -1.68 -0.16 0.00 0.00 0.00 0.00 46.02 44.32 1rka n GLY 228 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rka s VAL 229 N 0.00 0.62 -0.56 1.61 0.11 -0.54 -0.19 120.40 121.46 1rka s VAL 229 Ca 0.00 -0.65 -0.20 0.00 -2.93 0.00 0.00 61.98 58.20 1rka s VAL 229 Cb 0.00 -0.58 0.08 0.00 -1.53 0.00 0.00 36.38 34.34 1rka s VAL 229 CO 0.00 -0.04 0.72 0.86 -3.33 0.00 0.00 175.10 173.30 1rka s TRP 230 N -0.65 2.97 -0.28 1.54 -0.11 0.07 -0.49 118.94 121.99 1rka s TRP 230 Ca -0.02 -0.69 -0.20 0.00 1.22 0.00 0.00 56.10 56.41 1rka s TRP 230 Cb -0.06 -3.86 -0.01 0.00 -1.50 0.00 0.00 33.47 28.04 1rka s TRP 230 CO 0.00 -1.24 0.63 0.00 -4.62 0.00 0.00 176.95 171.73 1rka s ALA 231 N 2.90 3.57 -0.07 5.86 0.00 -0.38 -1.80 121.76 131.85 1rka s ALA 231 Ca 0.15 -0.53 -0.01 0.00 0.00 0.00 0.00 51.96 51.57 1rka s ALA 231 Cb -0.21 -3.07 0.03 0.00 0.00 0.00 0.00 23.12 19.87 1rka s ALA 231 CO 0.10 -0.94 -0.01 0.45 0.00 0.00 0.00 175.76 175.35 1rka s SER 232 N 1.56 1.43 -0.25 0.00 0.15 -0.00 -1.12 113.70 115.47 1rka s SER 232 Ca 0.26 -0.10 -0.02 0.00 0.70 0.00 0.00 55.95 56.79 1rka s SER 232 Cb -0.15 -0.45 0.03 0.00 -1.71 0.00 0.00 66.02 63.73 1rka s SER 232 CO 0.10 -0.16 -0.06 -0.69 1.20 0.00 0.00 173.24 173.64 1rka s VAL 233 N 1.71 2.91 -1.38 4.45 1.01 -0.29 -0.59 120.40 128.23 1rka s VAL 233 Ca 0.01 -1.02 -0.03 0.00 0.00 0.00 0.00 61.98 60.94 1rka s VAL 233 Cb -0.13 -2.48 0.00 0.00 0.00 0.00 0.00 36.38 33.77 1rka s VAL 233 CO -0.04 0.19 0.44 0.59 0.00 0.00 0.00 175.10 176.28 1rka n ASN 234 N 4.67 -0.87 0.00 3.32 5.03 -0.10 -1.70 115.26 125.62 1rka n ASN 234 Ca -0.16 -1.03 0.00 0.00 0.87 0.00 0.00 54.58 54.25 1rka n ASN 234 Cb 0.47 -2.97 0.00 0.00 -1.02 0.00 0.00 39.78 36.26 1rka n ASN 234 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1rka n GLY 235 N -1.99 2.55 3.37 7.41 0.00 -1.26 -5.00 105.19 110.26 1rka n GLY 235 Ca -0.28 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.33 1rka n GLY 235 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rka s GLU 236 N -0.44 2.80 0.35 1.61 2.02 -0.69 -5.03 118.70 119.32 1rka s GLU 236 Ca 0.00 -1.14 0.04 0.00 0.02 0.00 0.00 54.97 53.89 1rka s GLU 236 Cb 0.00 -3.76 -0.05 0.00 0.10 0.00 0.00 34.13 30.42 1rka s GLU 236 CO 0.00 -0.75 0.08 0.20 0.02 0.00 0.00 175.26 174.81 1rka s GLY 237 N 1.65 2.25 -0.08 -1.39 0.00 -1.26 -1.13 107.32 107.36 1rka s GLY 237 Ca 0.02 -1.76 -0.30 0.00 0.00 0.00 0.00 44.72 42.68 1rka s GLY 237 CO 0.06 -1.83 0.92 -0.86 0.00 0.00 0.00 173.10 171.40 1rka s GLN 238 N -3.85 0.73 -0.09 2.90 -2.07 -0.27 -4.97 119.66 112.05 1rka s GLN 238 Ca 0.32 -0.06 -0.26 0.00 -1.82 0.00 0.00 55.36 53.54 1rka s GLN 238 Cb 0.07 0.34 -0.02 0.00 -1.09 0.00 0.00 33.01 32.30 1rka s GLN 238 CO 0.15 -0.28 0.85 0.50 -1.32 0.00 0.00 175.29 175.18 1rka s ARG 239 N -2.07 4.42 -0.31 9.60 3.52 -1.26 -1.24 118.95 131.60 1rka s ARG 239 Ca 0.01 1.11 -0.03 0.00 -0.13 0.00 0.00 55.73 56.69 1rka s ARG 239 Cb -0.01 -3.50 0.04 0.00 -1.56 0.00 0.00 34.95 29.92 1rka s ARG 239 CO -0.03 -0.14 0.03 0.08 -0.81 0.00 0.00 175.30 174.43 1rka s VAL 240 N 1.45 3.23 0.62 7.11 1.01 0.36 -4.96 120.40 129.22 1rka s VAL 240 Ca 0.42 -1.28 -0.18 0.00 0.00 0.00 0.00 61.98 60.94 1rka s VAL 240 Cb -0.18 -2.84 -0.02 0.00 0.00 0.00 0.00 36.38 33.34 1rka s VAL 240 CO 0.18 -0.11 1.19 -2.84 0.00 0.00 0.00 175.10 173.52 1rka s PRO 241 N 1.30 2.84 0.29 2.72 0.02 -1.26 -1.46 135.00 139.44 1rka s PRO 241 Ca -0.04 1.74 0.05 0.00 0.02 0.00 0.00 61.00 62.77 1rka s PRO 241 Cb -0.20 -1.92 0.05 0.00 0.02 0.00 0.00 34.50 32.45 1rka s PRO 241 CO 0.00 -1.29 0.39 0.41 -0.33 0.00 0.00 177.00 176.18 1rka n GLY 242 N 0.33 2.00 3.86 0.52 0.00 -1.26 -4.89 105.19 105.74 1rka n GLY 242 Ca 0.13 -2.18 -0.31 0.00 0.00 0.00 0.00 46.02 43.66 1rka n GLY 242 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1rka s PHE 243 N -0.82 3.43 -0.15 1.61 0.40 -1.26 -5.00 117.98 116.19 1rka s PHE 243 Ca 0.30 1.11 -0.23 0.00 -0.60 0.00 0.00 56.93 57.51 1rka s PHE 243 Cb -0.02 -2.48 -0.03 0.00 0.51 0.00 0.00 43.02 41.00 1rka s PHE 243 CO 0.19 -0.03 0.70 0.50 0.70 0.00 0.00 175.22 177.28 1rka s ARG 244 N -3.50 4.31 0.09 0.44 3.52 -1.26 -4.99 118.95 117.55 1rka s ARG 244 Ca 0.52 0.80 -0.13 0.00 -0.13 0.00 0.00 55.73 56.79 1rka s ARG 244 Cb -0.10 -3.53 0.02 0.00 -1.56 0.00 0.00 34.95 29.77 1rka s ARG 244 CO 0.26 -0.16 0.29 0.14 -0.81 0.00 0.00 175.30 175.02 1rka s VAL 245 N 1.60 0.10 -0.43 7.11 -7.23 -1.26 -5.12 120.40 115.18 1rka s VAL 245 Ca 0.34 -0.82 -0.20 0.00 -1.81 0.00 0.00 61.98 59.49 1rka s VAL 245 Cb -0.17 -1.15 0.02 0.00 0.56 0.00 0.00 36.38 35.64 1rka s VAL 245 CO 0.13 -0.45 0.58 -1.58 -0.31 0.00 0.00 175.10 173.46 1rka s GLN 246 N -3.42 3.25 0.29 4.82 -0.44 -1.26 -5.04 119.66 117.87 1rka s GLN 246 Ca 0.01 -0.47 -0.29 0.00 -2.50 0.00 0.00 55.36 52.12 1rka s GLN 246 Cb 0.02 -3.95 -0.09 0.00 -1.64 0.00 0.00 33.01 27.35 1rka s GLN 246 CO -0.09 -0.94 1.07 0.00 0.50 0.00 0.00 175.29 175.82 1rka s ALA 247 N 2.60 3.34 -0.02 1.58 0.00 -1.26 -4.56 121.76 123.44 1rka s ALA 247 Ca 0.19 0.82 0.01 0.00 0.00 0.00 0.00 51.96 52.99 1rka s ALA 247 Cb -0.15 -3.30 -0.02 0.00 0.00 0.00 0.00 23.12 19.65 1rka s ALA 247 CO 0.17 -0.11 0.00 1.33 0.00 0.00 0.00 175.76 177.16 1rka n VAL 248 N 1.01 0.12 -3.15 0.00 0.24 0.21 -4.98 118.33 111.79 1rka n VAL 248 Ca -0.00 -0.07 0.04 0.00 -2.04 0.00 0.00 64.34 62.27 1rka n VAL 248 Cb 0.46 -0.92 -0.01 0.00 -1.47 0.00 0.00 33.84 31.90 1rka n VAL 248 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1rka s ASP 249 N -3.30 -1.34 0.01 -1.34 2.15 -0.66 -4.97 116.67 107.22 1rka s ASP 249 Ca -0.01 0.59 0.28 0.00 0.43 0.00 0.00 52.55 53.84 1rka s ASP 249 Cb 0.01 2.03 1.18 0.00 -0.30 0.00 0.00 42.92 45.84 1rka s ASP 249 CO 0.07 -0.25 1.90 0.35 -0.17 0.00 0.00 175.17 177.07 1rka n THR 250 N 5.42 0.08 -1.68 1.71 -2.24 -1.26 -4.21 114.28 112.10 1rka n THR 250 Ca 0.01 -0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.35 1rka n THR 250 Cb 0.52 -0.53 -0.01 0.00 -2.10 0.00 0.00 70.33 68.22 1rka n THR 250 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rka n ILE 251 N -1.55 2.03 -0.85 2.28 3.06 -1.26 -1.09 119.36 121.98 1rka n ILE 251 Ca 0.07 -0.50 0.00 0.00 -2.50 0.00 0.00 62.75 59.82 1rka n ILE 251 Cb 0.34 -1.47 0.00 0.00 0.54 0.00 0.00 39.64 39.05 1rka n ILE 251 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1rka n ALA 252 N 0.28 0.00 -0.02 1.51 0.00 -1.26 -4.70 120.51 116.32 1rka n ALA 252 Ca 0.06 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.39 1rka n ALA 252 Cb 0.36 -0.34 -0.04 0.00 0.00 0.00 0.00 19.45 19.43 1rka n ALA 252 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rka h ALA 253 N 0.00 0.16 -0.44 0.00 0.00 -1.44 0.54 119.26 118.08 1rka h ALA 253 Ca 0.00 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1rka h ALA 253 Cb 0.02 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1rka h ALA 253 CO 0.00 -0.38 -0.03 0.78 0.00 0.00 0.00 179.25 179.62 1rka h GLY 254 N 0.14 0.78 1.37 0.00 0.00 -1.90 -1.80 103.07 101.66 1rka h GLY 254 Ca 0.06 -0.53 -0.13 0.00 0.00 0.00 0.00 47.33 46.73 1rka h GLY 254 CO -0.05 0.49 -0.30 -0.55 0.00 0.00 0.00 176.54 176.13 1rka h ASP 255 N 0.68 0.74 -0.44 0.19 3.32 -1.85 -1.65 116.42 117.42 1rka h ASP 255 Ca 0.13 -0.29 -0.05 0.00 0.02 0.00 0.00 57.03 56.83 1rka h ASP 255 Cb 0.46 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 1rka h ASP 255 CO 0.02 0.99 0.06 0.74 -1.72 0.00 0.00 179.24 179.34 1rka h THR 256 N 0.61 1.25 -0.26 0.35 2.02 -0.69 -0.75 112.91 115.45 1rka h THR 256 Ca 0.07 -0.91 0.05 0.00 0.77 0.00 0.00 66.41 66.39 1rka h THR 256 Cb 0.81 0.98 -0.05 0.00 -1.74 0.00 0.00 68.15 68.16 1rka h THR 256 CO 0.07 0.32 -0.06 0.15 0.37 0.00 0.00 175.52 176.36 1rka h PHE 257 N 0.60 -0.13 -0.25 3.16 3.57 -1.12 0.01 116.94 122.78 1rka h PHE 257 Ca 0.13 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.65 1rka h PHE 257 Cb 0.39 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 1rka h PHE 257 CO 0.03 -0.11 0.13 -0.91 -2.23 0.00 0.00 178.31 175.22 1rka h ASN 258 N 0.00 0.32 -0.49 0.41 4.21 -1.04 -0.20 115.58 118.79 1rka h ASN 258 Ca 0.12 -0.11 -0.04 0.00 1.21 0.00 0.00 56.30 57.48 1rka h ASN 258 Cb 0.19 -0.08 -0.02 0.00 -1.12 0.00 0.00 38.32 37.28 1rka h ASN 258 CO -0.26 0.33 0.13 1.23 -1.29 0.00 0.00 177.43 177.58 1rka h GLY 259 N 0.28 0.84 1.15 2.83 0.00 -0.89 -2.26 103.07 105.01 1rka h GLY 259 Ca 0.09 -0.52 -0.15 0.00 0.00 0.00 0.00 47.33 46.75 1rka h GLY 259 CO -0.01 0.48 -0.35 0.00 0.00 0.00 0.00 176.54 176.66 1rka h ALA 260 N 1.00 0.61 0.19 3.60 0.00 -0.97 -2.71 119.26 120.99 1rka h ALA 260 Ca 0.16 -0.44 0.01 0.00 0.00 0.00 0.00 54.91 54.63 1rka h ALA 260 Cb 0.31 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1rka h ALA 260 CO -0.00 0.68 -0.22 1.25 0.00 0.00 0.00 179.25 180.95 1rka h LEU 261 N 0.77 -0.61 -1.14 0.00 5.85 -0.92 -1.32 115.31 117.94 1rka h LEU 261 Ca 0.07 0.06 0.02 0.00 0.84 0.00 0.00 57.88 58.87 1rka h LEU 261 Cb 0.94 0.22 -0.05 0.00 0.37 0.00 0.00 40.66 42.14 1rka h LEU 261 CO 0.09 -0.33 0.58 0.40 -0.34 0.00 0.00 178.44 178.85 1rka h ILE 262 N -0.46 1.20 -0.17 4.05 1.08 -1.43 -0.37 117.51 121.41 1rka h ILE 262 Ca 0.01 -0.40 0.03 0.00 -0.39 0.00 0.00 64.86 64.11 1rka h ILE 262 Cb 0.45 -0.06 -0.03 0.00 -3.07 0.00 0.00 36.82 34.10 1rka h ILE 262 CO -0.07 0.21 -0.02 0.74 -0.69 0.00 0.00 178.15 178.32 1rka h THR 263 N 1.17 0.86 -0.45 -0.27 2.02 -1.12 0.11 112.91 115.22 1rka h THR 263 Ca 0.33 -0.01 0.02 0.00 0.77 0.00 0.00 66.41 67.52 1rka h THR 263 Cb -0.09 0.83 -0.03 0.00 -1.74 0.00 0.00 68.15 67.12 1rka h THR 263 CO -0.08 0.00 0.27 0.00 0.37 0.00 0.00 175.52 176.09 1rka h ALA 264 N 1.16 0.57 -0.53 6.16 0.00 -0.33 -2.17 119.26 124.12 1rka h ALA 264 Ca 0.08 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 1rka h ALA 264 Cb 0.11 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1rka h ALA 264 CO -0.15 -0.03 0.06 -0.07 0.00 0.00 0.00 179.25 179.05 1rka h LEU 265 N 0.55 0.87 0.00 0.00 3.38 -0.73 -1.60 115.31 117.78 1rka h LEU 265 Ca 0.18 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1rka h LEU 265 Cb -0.01 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.51 1rka h LEU 265 CO -0.07 0.93 0.00 0.18 0.09 0.00 0.00 178.44 179.57 1rka n LEU 266 N -4.34 0.00 -1.13 1.67 4.77 0.34 0.45 117.00 118.75 1rka n LEU 266 Ca 0.02 0.27 0.12 0.00 -0.03 0.00 0.00 56.01 56.38 1rka n LEU 266 Cb 0.29 -0.27 0.21 0.00 -2.33 0.00 0.00 43.42 41.32 1rka n LEU 266 CO 0.42 -0.14 0.70 1.21 -1.33 0.00 0.00 177.39 178.24 1rka n GLU 267 N -1.27 2.48 -2.57 3.23 2.13 -0.65 -2.60 120.64 121.38 1rka n GLU 267 Ca 0.07 -2.27 -0.20 0.00 0.66 0.00 0.00 57.16 55.41 1rka n GLU 267 Cb 0.11 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.32 1rka n GLU 267 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1rka n GLU 268 N 1.46 -2.58 -2.88 5.31 -0.58 0.17 -4.90 120.64 116.64 1rka n GLU 268 Ca 0.19 0.94 -0.34 0.00 -0.42 0.00 0.00 57.16 57.53 1rka n GLU 268 Cb 0.60 -5.61 -0.07 0.00 -0.57 0.00 0.00 31.44 25.79 1rka n GLU 268 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1rka s LYS 269 N -5.20 4.26 0.59 3.49 1.02 -0.88 -5.01 119.74 118.00 1rka s LYS 269 Ca 0.09 1.07 -0.20 0.00 0.02 0.00 0.00 55.97 56.96 1rka s LYS 269 Cb -0.04 -2.37 -0.03 0.00 -0.52 0.00 0.00 37.83 34.87 1rka s LYS 269 CO 0.11 0.08 1.28 -2.14 -0.92 0.00 0.00 175.35 173.76 1rka s PRO 270 N -2.89 2.90 0.22 -1.68 0.02 -1.26 -4.62 135.00 127.70 1rka s PRO 270 Ca 0.58 2.04 -0.14 0.00 0.02 0.00 0.00 61.00 63.50 1rka s PRO 270 Cb -0.11 -2.02 0.26 0.00 0.02 0.00 0.00 34.50 32.65 1rka s PRO 270 CO 0.16 -1.32 1.60 1.25 -0.33 0.00 0.00 177.00 178.37 1rka h LEU 271 N 0.99 -0.79 -0.93 -5.54 5.85 -1.98 0.12 115.31 113.03 1rka h LEU 271 Ca -0.51 0.22 0.15 0.00 0.84 0.00 0.00 57.88 58.58 1rka h LEU 271 Cb 1.31 0.48 -0.09 0.00 0.37 0.00 0.00 40.66 42.73 1rka h LEU 271 CO 0.55 -0.25 0.54 -0.65 -0.34 0.00 0.00 178.44 178.29 1rka h PRO 272 N -0.03 0.75 0.02 5.25 0.11 -1.99 0.16 132.00 136.27 1rka h PRO 272 Ca 0.33 -0.05 -0.24 0.00 0.11 0.00 0.00 66.00 66.15 1rka h PRO 272 Cb 0.54 -0.17 0.01 0.00 0.11 0.00 0.00 31.00 31.49 1rka h PRO 272 CO -0.74 0.50 -1.02 1.49 -0.21 0.00 0.00 178.00 178.02 1rka h GLU 273 N 0.78 0.46 -0.53 1.05 4.81 -1.61 -2.75 114.58 116.79 1rka h GLU 273 Ca 0.50 -0.53 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1rka h GLU 273 Cb 0.65 0.16 -0.03 0.00 0.63 0.00 0.00 28.75 30.16 1rka h GLU 273 CO -0.33 1.18 0.34 0.00 -0.73 0.00 0.00 179.01 179.46 1rka h ALA 274 N 0.63 0.68 -0.22 2.92 0.00 0.17 -0.45 119.26 123.00 1rka h ALA 274 Ca -0.10 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 1rka h ALA 274 Cb 1.67 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 1rka h ALA 274 CO 0.18 0.14 -0.18 0.82 0.00 0.00 0.00 179.25 180.21 1rka h ILE 275 N 0.72 1.23 -0.09 0.00 2.04 -0.75 -1.16 117.51 119.50 1rka h ILE 275 Ca 0.19 -1.05 -0.14 0.00 1.00 0.00 0.00 64.86 64.87 1rka h ILE 275 Cb -0.05 1.26 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 1rka h ILE 275 CO -0.04 0.33 -0.56 -0.09 0.00 0.00 0.00 178.15 177.80 1rka h ARG 276 N 0.35 0.27 -0.07 2.37 2.43 -1.07 -0.88 114.38 117.78 1rka h ARG 276 Ca 0.06 -0.17 -0.02 0.00 -0.81 0.00 0.00 59.98 59.04 1rka h ARG 276 Cb 0.52 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.09 1rka h ARG 276 CO 0.03 0.76 -0.04 0.35 -1.51 0.00 0.00 179.97 179.56 1rka h PHE 277 N 0.21 0.17 -0.82 2.20 3.57 -0.63 -1.69 116.94 119.96 1rka h PHE 277 Ca 0.00 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.43 1rka h PHE 277 Cb 1.04 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 39.71 1rka h PHE 277 CO 0.02 0.53 0.39 0.00 -2.23 0.00 0.00 178.31 177.02 1rka h ALA 278 N 0.62 1.05 -0.69 2.41 0.00 -1.14 -2.05 119.26 119.46 1rka h ALA 278 Ca 0.02 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 1rka h ALA 278 Cb 0.49 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1rka h ALA 278 CO 0.01 0.62 0.23 0.45 0.00 0.00 0.00 179.25 180.56 1rka h HIS 279 N 1.16 1.08 -0.31 0.00 3.86 -1.12 -1.13 115.15 118.69 1rka h HIS 279 Ca 0.28 -0.09 -0.02 0.00 -1.16 0.00 0.00 60.37 59.38 1rka h HIS 279 Cb 0.12 -0.32 -0.01 0.00 1.06 0.00 0.00 27.41 28.26 1rka h HIS 279 CO 0.01 0.85 0.13 0.00 0.86 0.00 0.00 177.93 179.78 1rka h ALA 280 N 1.23 0.40 -0.45 2.45 0.00 -0.89 0.17 119.26 122.16 1rka h ALA 280 Ca 0.23 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1rka h ALA 280 Cb 0.27 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1rka h ALA 280 CO -0.01 -0.00 0.30 0.00 0.00 0.00 0.00 179.25 179.53 1rka h ALA 281 N 0.97 0.58 -0.61 0.00 0.00 -1.14 -2.32 119.26 116.74 1rka h ALA 281 Ca 0.10 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 1rka h ALA 281 Cb 0.18 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1rka h ALA 281 CO -0.01 0.04 0.02 0.00 0.00 0.00 0.00 179.25 179.30 1rka h ALA 282 N 1.16 0.88 -0.97 0.00 0.00 -0.99 -1.55 119.26 117.79 1rka h ALA 282 Ca 0.17 -0.30 0.05 0.00 0.00 0.00 0.00 54.91 54.83 1rka h ALA 282 Cb -0.06 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 17.44 1rka h ALA 282 CO -0.03 0.66 0.63 0.00 0.00 0.00 0.00 179.25 180.50 1rka h ALA 283 N 1.04 1.32 -0.28 0.00 0.00 -0.70 -1.84 119.26 118.81 1rka h ALA 283 Ca 0.18 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 1rka h ALA 283 Cb 0.53 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1rka h ALA 283 CO 0.03 0.45 -0.22 0.82 0.00 0.00 0.00 179.25 180.32 1rka h ILE 284 N 1.16 1.30 -0.91 0.00 2.04 -1.13 -3.25 117.51 116.73 1rka h ILE 284 Ca 0.41 -1.36 0.09 0.00 1.00 0.00 0.00 64.86 65.00 1rka h ILE 284 Cb 0.11 1.57 -0.06 0.00 -0.74 0.00 0.00 36.82 37.69 1rka h ILE 284 CO -0.16 0.43 0.59 0.00 0.00 0.00 0.00 178.15 179.01 1rka h ALA 285 N 0.71 1.59 0.00 1.87 0.00 -0.50 -2.06 119.26 120.88 1rka h ALA 285 Ca 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1rka h ALA 285 Cb 0.77 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1rka h ALA 285 CO 0.06 0.23 0.00 1.33 0.00 0.00 0.00 179.25 180.87 1rka n VAL 286 N -4.53 0.53 0.55 0.00 0.24 -0.83 -2.52 118.33 111.79 1rka n VAL 286 Ca 0.15 0.13 0.10 0.00 -2.04 0.00 0.00 64.34 62.69 1rka n VAL 286 Cb 0.28 -0.79 0.27 0.00 -1.47 0.00 0.00 33.84 32.13 1rka n VAL 286 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1rka n THR 287 N -1.41 0.50 -4.24 3.34 -2.24 -0.77 0.65 114.28 110.11 1rka n THR 287 Ca 0.07 -0.63 -0.16 0.00 -2.27 0.00 0.00 64.05 61.06 1rka n THR 287 Cb 0.20 0.58 -0.11 0.00 -2.10 0.00 0.00 70.33 68.91 1rka n THR 287 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1rka s ARG 288 N -1.50 1.02 0.04 -0.78 0.52 -1.05 -4.80 118.95 112.41 1rka s ARG 288 Ca 0.36 -1.31 -0.12 0.00 -0.52 0.00 0.00 55.73 54.14 1rka s ARG 288 Cb 0.20 -0.76 -0.06 0.00 0.52 0.00 0.00 34.95 34.85 1rka s ARG 288 CO 0.28 0.13 0.41 0.15 0.02 0.00 0.00 175.30 176.28 1rka s LYS 289 N -3.07 3.85 0.00 3.54 1.02 -1.26 -4.26 119.74 119.56 1rka s LYS 289 Ca 0.11 0.31 0.00 0.00 0.02 0.00 0.00 55.97 56.41 1rka s LYS 289 Cb -0.02 -3.10 0.00 0.00 -0.52 0.00 0.00 37.83 34.19 1rka s LYS 289 CO 0.02 0.62 0.00 0.41 -0.92 0.00 0.00 175.35 175.48 1rka n GLY 290 N 1.34 -0.41 0.00 -3.33 0.00 -1.26 -4.19 105.19 97.34 1rka n GLY 290 Ca -0.11 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.27 1rka n GLY 290 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rka n ALA 291 N -0.14 0.00 -0.16 4.61 0.00 -1.26 -3.78 120.51 119.77 1rka n ALA 291 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 1rka n ALA 291 Cb 0.00 0.00 0.31 0.00 0.00 0.00 0.00 19.45 19.76 1rka n ALA 291 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1rka h GLN 292 N 0.00 0.82 0.00 0.00 4.20 -1.84 -2.22 115.11 116.08 1rka h GLN 292 Ca 0.00 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.66 1rka h GLN 292 Cb 0.00 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 27.59 1rka h GLN 292 CO 0.00 0.54 0.01 -1.35 -0.67 0.00 0.00 178.83 177.37 1rka h PRO 293 N 0.85 0.00 -0.00 1.46 0.11 -1.82 -1.76 132.00 130.84 1rka h PRO 293 Ca 0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.37 1rka h PRO 293 Cb 0.01 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.12 1rka h PRO 293 CO -0.07 0.00 -0.79 -1.13 -0.21 0.00 0.00 178.00 175.80 1rka n SER 294 N -2.89 0.95 -4.63 -2.05 3.41 -0.84 -4.92 113.62 102.66 1rka n SER 294 Ca -0.03 -0.83 -0.43 0.00 -0.26 0.00 0.00 58.87 57.32 1rka n SER 294 Cb 0.07 0.72 -0.03 0.00 -0.26 0.00 0.00 64.21 64.72 1rka n SER 294 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1rka s VAL 295 N -2.94 3.64 0.45 -3.33 1.01 -0.66 -4.22 120.40 114.35 1rka s VAL 295 Ca 0.10 0.73 -0.23 0.00 0.00 0.00 0.00 61.98 62.59 1rka s VAL 295 Cb 0.17 -3.64 -0.08 0.00 0.00 0.00 0.00 36.38 32.83 1rka s VAL 295 CO 0.79 -0.24 1.13 -2.16 0.00 0.00 0.00 175.10 174.61 1rka s PRO 296 N 4.65 3.84 0.51 2.72 0.04 -1.26 -5.01 135.00 140.49 1rka s PRO 296 Ca 0.73 1.69 -0.04 0.00 0.04 0.00 0.00 61.00 63.42 1rka s PRO 296 Cb -0.27 -2.41 -0.01 0.00 0.04 0.00 0.00 34.50 31.85 1rka s PRO 296 CO 0.30 -0.46 0.79 -1.58 0.04 0.00 0.00 177.00 176.09 1rka s TRP 297 N -1.60 3.35 0.22 0.56 0.52 -1.26 -4.35 118.94 116.39 1rka s TRP 297 Ca 0.63 0.58 -0.13 0.00 0.02 0.00 0.00 56.10 57.19 1rka s TRP 297 Cb -0.26 -2.46 0.27 0.00 -1.15 0.00 0.00 33.47 29.87 1rka s TRP 297 CO 0.32 -0.49 1.61 -0.09 0.02 0.00 0.00 176.95 178.31 1rka h ARG 298 N 0.14 -0.02 -0.70 4.98 9.65 -1.32 -1.07 114.38 126.04 1rka h ARG 298 Ca -0.46 0.00 0.11 0.00 -1.10 0.00 0.00 59.98 58.53 1rka h ARG 298 Cb 1.24 0.00 -0.08 0.00 -1.39 0.00 0.00 29.97 29.74 1rka h ARG 298 CO 0.60 -0.01 0.31 0.93 2.80 0.00 0.00 179.97 184.60 1rka h GLU 299 N -0.02 0.50 -0.47 0.20 4.39 -1.94 -0.23 114.58 117.01 1rka h GLU 299 Ca 0.33 -0.03 -0.08 0.00 0.34 0.00 0.00 59.36 59.92 1rka h GLU 299 Cb 0.53 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.05 1rka h GLU 299 CO -0.74 0.33 -0.02 0.93 -1.16 0.00 0.00 179.01 178.35 1rka h GLU 300 N 0.51 0.84 0.06 2.33 5.08 -1.60 -1.00 114.58 120.80 1rka h GLU 300 Ca 0.36 -0.28 -0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1rka h GLU 300 Cb 0.45 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1rka h GLU 300 CO -0.32 0.90 -0.03 0.82 -1.00 0.00 0.00 179.01 179.38 1rka h ILE 301 N 0.69 0.97 -0.44 3.13 2.04 -0.58 -0.26 117.51 123.06 1rka h ILE 301 Ca 0.13 -0.09 -0.05 0.00 1.00 0.00 0.00 64.86 65.85 1rka h ILE 301 Cb 0.53 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 37.61 1rka h ILE 301 CO 0.03 0.02 0.06 0.44 0.00 0.00 0.00 178.15 178.70 1rka h ASP 302 N -0.12 0.63 -0.27 1.72 3.32 -1.02 -1.28 116.42 119.39 1rka h ASP 302 Ca -0.01 -0.11 -0.02 0.00 0.02 0.00 0.00 57.03 56.90 1rka h ASP 302 Cb 0.10 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 1rka h ASP 302 CO 0.01 0.66 0.08 0.00 -1.72 0.00 0.00 179.24 178.28 1rka h ALA 303 N 1.42 0.36 -0.40 3.45 0.00 -0.94 0.69 119.26 123.85 1rka h ALA 303 Ca 0.14 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 54.96 1rka h ALA 303 Cb 0.31 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 1rka h ALA 303 CO 0.00 -0.01 0.10 0.35 0.00 0.00 0.00 179.25 179.70 1rka h PHE 304 N 0.28 0.18 -0.39 0.00 3.57 -0.60 -1.46 116.94 118.51 1rka h PHE 304 Ca 0.09 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.60 1rka h PHE 304 Cb 0.25 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 1rka h PHE 304 CO 0.01 0.05 0.21 -0.07 -2.23 0.00 0.00 178.31 176.27 1rka h LEU 305 N 0.24 0.50 -1.25 0.59 3.38 -0.95 -2.56 115.31 115.26 1rka h LEU 305 Ca 0.19 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.07 1rka h LEU 305 Cb 0.20 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 1rka h LEU 305 CO -0.23 0.45 0.50 0.44 0.09 0.00 0.00 178.44 179.70 1rka h ASP 306 N 0.50 0.87 0.65 -0.43 3.32 -0.38 0.47 116.42 121.43 1rka h ASP 306 Ca 0.14 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1rka h ASP 306 Cb 0.07 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.40 1rka h ASP 306 CO -0.02 0.63 0.00 0.54 -1.72 0.00 0.00 179.24 178.67 1rka n ARG 307 N -4.42 0.22 0.00 3.56 1.74 -0.60 -5.10 116.66 112.07 1rka n ARG 307 Ca 0.08 0.05 0.16 0.00 -0.77 0.00 0.00 57.85 57.37 1rka n ARG 307 Cb 0.03 -1.50 0.90 0.00 -1.02 0.00 0.00 32.46 30.87 1rka n ARG 307 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05