#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xtg n PHE 3 N 0.00 1.68 -3.71 6.00 -0.00 -1.26 -4.65 117.46 115.51 1xtg n PHE 3 Ca 0.00 0.59 -0.38 0.00 -0.00 0.00 0.00 57.45 57.66 1xtg n PHE 3 Cb 0.00 -2.35 -0.11 0.00 -0.00 0.00 0.00 39.48 37.02 1xtg n PHE 3 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.76 176.84 1xtg s VAL 4 N -0.43 3.72 -0.39 -2.13 1.01 -1.26 -4.79 120.40 116.13 1xtg s VAL 4 Ca 0.66 -1.57 -0.02 0.00 0.00 0.00 0.00 61.98 61.06 1xtg s VAL 4 Cb -0.72 -3.32 0.20 0.00 0.00 0.00 0.00 36.38 32.53 1xtg s VAL 4 CO 0.54 -0.47 2.22 0.59 0.00 0.00 0.00 175.10 177.98 1xtg n ASN 5 N 4.77 6.60 -3.83 3.32 3.02 -1.26 -4.86 115.26 123.02 1xtg n ASN 5 Ca -0.08 -3.17 -0.12 0.00 -0.03 0.00 0.00 54.58 51.17 1xtg n ASN 5 Cb 0.43 -1.10 -0.12 0.00 -0.61 0.00 0.00 39.78 38.38 1xtg n ASN 5 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1xtg s LYS 6 N -1.99 0.22 -0.98 3.52 2.47 -1.26 -5.08 119.74 116.64 1xtg s LYS 6 Ca 0.42 0.12 -0.15 0.00 -1.56 0.00 0.00 55.97 54.80 1xtg s LYS 6 Cb 0.31 0.10 0.19 0.00 -1.46 0.00 0.00 37.83 36.97 1xtg s LYS 6 CO -0.07 -0.03 1.06 -0.65 0.16 0.00 0.00 175.35 175.82 1xtg s GLN 7 N -0.14 3.80 -0.03 4.03 -0.21 -1.26 -5.03 119.66 120.82 1xtg s GLN 7 Ca -0.02 -2.41 -0.21 0.00 0.02 0.00 0.00 55.36 52.74 1xtg s GLN 7 Cb -0.02 -4.71 -0.05 0.00 1.00 0.00 0.00 33.01 29.23 1xtg s GLN 7 CO 0.00 -1.51 0.61 -0.06 -2.12 0.00 0.00 175.29 172.21 1xtg s PHE 8 N 0.91 3.63 -0.05 0.91 0.08 -1.26 -5.06 117.98 117.14 1xtg s PHE 8 Ca 0.29 1.18 0.05 0.00 0.12 0.00 0.00 56.93 58.57 1xtg s PHE 8 Cb -0.07 -2.66 -0.00 0.00 -0.57 0.00 0.00 43.02 39.72 1xtg s PHE 8 CO -0.07 0.26 -0.20 -0.80 -0.10 0.00 0.00 175.22 174.30 1xtg s ASN 9 N 0.18 2.54 0.30 1.36 0.01 -1.26 -4.87 114.94 113.21 1xtg s ASN 9 Ca 0.32 -0.42 0.06 0.00 -0.71 0.00 0.00 52.86 52.11 1xtg s ASN 9 Cb -0.18 -0.77 0.77 0.00 0.41 0.00 0.00 41.25 41.48 1xtg s ASN 9 CO 0.17 0.18 1.76 0.22 -1.51 0.00 0.00 177.10 177.92 1xtg h TYR 10 N 6.26 1.03 0.00 2.20 3.20 -1.89 -0.31 116.97 127.46 1xtg h TYR 10 Ca -0.31 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.59 1xtg h TYR 10 Cb 1.18 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 39.15 1xtg h TYR 10 CO 0.44 0.18 0.00 0.36 -1.64 0.00 0.00 178.16 177.50 1xtg n LYS 11 N -4.81 0.20 -1.66 1.82 -0.00 -1.26 -4.86 118.16 107.59 1xtg n LYS 11 Ca 0.24 0.12 -0.46 0.00 -0.00 0.00 0.00 58.31 58.21 1xtg n LYS 11 Cb 0.61 -1.50 -0.04 0.00 -0.00 0.00 0.00 35.03 34.11 1xtg n LYS 11 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1xtg n ASP 12 N -1.35 2.72 -4.75 -5.58 9.92 -0.13 -4.90 116.55 112.48 1xtg n ASP 12 Ca 0.08 1.11 -0.38 0.00 -0.53 0.00 0.00 54.79 55.07 1xtg n ASP 12 Cb 0.18 -1.39 0.04 0.00 -0.64 0.00 0.00 41.12 39.30 1xtg n ASP 12 CO 0.00 0.00 0.00 -2.84 0.13 0.00 0.00 177.20 174.49 1xtg s PRO 13 N 0.30 3.23 0.59 -0.24 0.02 -1.26 -4.96 135.00 132.68 1xtg s PRO 13 Ca 0.75 2.24 -0.18 0.00 0.02 0.00 0.00 61.00 63.83 1xtg s PRO 13 Cb -0.71 -2.31 -0.03 0.00 0.02 0.00 0.00 34.50 31.47 1xtg s PRO 13 CO 0.44 -1.12 1.18 0.14 -0.33 0.00 0.00 177.00 177.31 1xtg s VAL 14 N -1.30 2.81 0.00 3.83 -7.23 -1.26 -4.90 120.40 112.35 1xtg s VAL 14 Ca 0.70 0.49 0.00 0.00 -1.81 0.00 0.00 61.98 61.36 1xtg s VAL 14 Cb -0.40 -3.16 0.00 0.00 0.56 0.00 0.00 36.38 33.37 1xtg s VAL 14 CO 0.48 -0.13 0.40 -0.46 -0.31 0.00 0.00 175.10 175.08 1xtg n ASN 15 N -1.64 0.44 0.00 4.85 0.23 0.10 -4.89 115.26 114.35 1xtg n ASN 15 Ca 0.13 -1.15 0.00 0.00 -0.53 0.00 0.00 54.58 53.03 1xtg n ASN 15 Cb 0.50 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.20 1xtg n ASN 15 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1xtg n GLY 16 N -0.07 0.35 0.61 4.83 0.00 -0.98 -4.78 105.19 105.14 1xtg n GLY 16 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 1xtg n GLY 16 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1xtg n VAL 17 N -2.12 0.00 0.03 1.61 0.31 -1.26 -4.87 118.33 112.03 1xtg n VAL 17 Ca 0.00 0.20 0.01 0.00 -0.01 0.00 0.00 64.34 64.53 1xtg n VAL 17 Cb 0.09 -1.20 0.01 0.00 -0.91 0.00 0.00 33.84 31.83 1xtg n VAL 17 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1xtg n ASP 18 N -2.50 1.35 -3.62 4.52 5.75 -1.26 -4.87 116.55 115.92 1xtg n ASP 18 Ca -0.00 -1.30 -0.24 0.00 -0.01 0.00 0.00 54.79 53.24 1xtg n ASP 18 Cb 0.00 -0.01 -0.17 0.00 -1.03 0.00 0.00 41.12 39.92 1xtg n ASP 18 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1xtg s ILE 19 N -0.33 -0.11 0.15 2.12 1.01 -1.26 -0.71 121.20 122.08 1xtg s ILE 19 Ca 0.01 -0.05 -0.24 0.00 0.00 0.00 0.00 60.65 60.38 1xtg s ILE 19 Cb 0.01 -0.50 0.06 0.00 0.01 0.00 0.00 42.46 42.04 1xtg s ILE 19 CO 0.01 -0.19 0.78 0.00 0.00 0.00 0.00 174.94 175.54 1xtg s ALA 20 N 2.16 -1.56 0.01 9.38 0.00 -0.80 0.03 121.76 130.97 1xtg s ALA 20 Ca 0.03 0.31 -0.23 0.00 0.00 0.00 0.00 51.96 52.07 1xtg s ALA 20 Cb -0.15 0.72 -0.05 0.00 0.00 0.00 0.00 23.12 23.63 1xtg s ALA 20 CO -0.08 -0.89 0.68 0.71 0.00 0.00 0.00 175.76 176.18 1xtg s TYR 21 N -3.55 3.70 0.24 0.00 2.02 -1.26 0.51 117.35 119.02 1xtg s TYR 21 Ca 0.07 1.32 0.03 0.00 -0.37 0.00 0.00 57.07 58.12 1xtg s TYR 21 Cb -0.02 -2.71 -0.05 0.00 -0.40 0.00 0.00 41.96 38.77 1xtg s TYR 21 CO -0.03 0.30 0.03 0.96 -1.57 0.00 0.00 175.55 175.24 1xtg s ILE 22 N -0.08 0.84 0.01 2.71 -4.36 0.37 -1.46 121.20 119.23 1xtg s ILE 22 Ca 0.35 -2.01 0.01 0.00 -0.26 0.00 0.00 60.65 58.74 1xtg s ILE 22 Cb -0.19 -2.44 -0.01 0.00 1.25 0.00 0.00 42.46 41.07 1xtg s ILE 22 CO 0.20 -0.22 -0.05 -0.54 0.24 0.00 0.00 174.94 174.56 1xtg s LYS 23 N -3.93 0.39 -0.60 0.37 1.02 -0.61 -1.99 119.74 114.39 1xtg s LYS 23 Ca 0.31 -0.37 -0.11 0.00 0.02 0.00 0.00 55.97 55.82 1xtg s LYS 23 Cb 0.07 -0.28 0.15 0.00 -0.52 0.00 0.00 37.83 37.25 1xtg s LYS 23 CO 0.10 0.07 0.50 0.96 -0.92 0.00 0.00 175.35 176.06 1xtg s ILE 24 N -0.60 4.68 0.44 2.17 -4.36 -1.26 -0.83 121.20 121.43 1xtg s ILE 24 Ca -0.03 -2.11 0.36 0.00 -0.26 0.00 0.00 60.65 58.61 1xtg s ILE 24 Cb -0.05 -4.00 0.55 0.00 1.25 0.00 0.00 42.46 40.20 1xtg s ILE 24 CO -0.00 -0.88 1.40 -2.65 0.24 0.00 0.00 174.94 173.05 1xtg n PRO 25 N 4.49 -0.02 0.14 0.37 -0.02 -1.26 0.03 135.00 138.73 1xtg n PRO 25 Ca -0.01 1.06 -0.13 0.00 -2.02 0.00 0.00 63.50 62.40 1xtg n PRO 25 Cb 0.42 -2.23 -0.08 0.00 -0.02 0.00 0.00 33.50 31.58 1xtg n PRO 25 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1xtg h ASN 26 N 0.00 -0.31 -0.57 2.55 2.35 -1.89 -3.37 115.58 114.34 1xtg h ASN 26 Ca 0.82 -0.18 -0.52 0.00 -0.55 0.00 0.00 56.30 55.87 1xtg h ASN 26 Cb 2.93 0.08 -0.05 0.00 0.05 0.00 0.00 38.32 41.33 1xtg h ASN 26 CO -0.24 0.03 1.73 0.00 -1.65 0.00 0.00 177.43 177.30 1xtg n ALA 27 N -2.43 2.82 0.00 -0.83 0.00 0.10 -4.93 120.51 115.26 1xtg n ALA 27 Ca -0.09 -3.43 0.00 0.00 0.00 0.00 0.00 53.44 49.92 1xtg n ALA 27 Cb 0.25 -3.55 0.00 0.00 0.00 0.00 0.00 19.45 16.15 1xtg n ALA 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xtg n GLY 28 N 5.45 0.68 2.71 0.00 0.00 -1.26 -3.46 105.19 109.31 1xtg n GLY 28 Ca 0.47 -0.42 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 1xtg n GLY 28 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1xtg n GLN 29 N 1.29 3.50 -0.28 1.61 1.13 -1.26 -4.67 117.38 118.69 1xtg n GLN 29 Ca 0.00 -4.39 -0.27 0.00 -1.94 0.00 0.00 57.00 50.40 1xtg n GLN 29 Cb 0.00 -2.28 0.25 0.00 0.11 0.00 0.00 30.24 28.32 1xtg n GLN 29 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1xtg n MET 30 N -0.39 -4.36 -2.95 -1.09 0.00 -1.22 -4.98 117.12 102.13 1xtg n MET 30 Ca 0.42 -1.31 -0.38 0.00 0.00 0.00 0.00 57.70 56.42 1xtg n MET 30 Cb 0.45 -1.64 -0.06 0.00 0.00 0.00 0.00 33.22 31.97 1xtg n MET 30 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 175.97 174.83 1xtg s GLN 31 N -4.87 4.55 0.28 3.17 2.00 -1.26 -5.01 119.66 118.52 1xtg s GLN 31 Ca 0.59 1.17 -0.30 0.00 -2.00 0.00 0.00 55.36 54.83 1xtg s GLN 31 Cb -0.10 -3.12 -0.11 0.00 0.80 0.00 0.00 33.01 30.48 1xtg s GLN 31 CO 0.49 0.49 1.49 -1.25 -0.50 0.00 0.00 175.29 176.01 1xtg s PRO 32 N -1.44 4.21 0.02 1.67 0.04 -1.26 -4.95 135.00 133.28 1xtg s PRO 32 Ca 0.40 2.42 0.07 0.00 0.04 0.00 0.00 61.00 63.93 1xtg s PRO 32 Cb -0.22 -3.06 -0.03 0.00 0.04 0.00 0.00 34.50 31.23 1xtg s PRO 32 CO 0.26 -0.49 -0.20 0.14 0.04 0.00 0.00 177.00 176.75 1xtg s VAL 33 N -0.20 2.63 0.05 -0.36 -7.23 -0.84 -4.82 120.40 109.63 1xtg s VAL 33 Ca 0.59 -1.13 -0.31 0.00 -1.81 0.00 0.00 61.98 59.33 1xtg s VAL 33 Cb -0.44 -2.06 -0.06 0.00 0.56 0.00 0.00 36.38 34.38 1xtg s VAL 33 CO 0.48 0.42 1.24 -0.75 -0.31 0.00 0.00 175.10 176.18 1xtg s LYS 34 N -1.17 4.39 0.24 4.82 2.20 -1.26 -0.48 119.74 128.48 1xtg s LYS 34 Ca 0.13 1.82 0.03 0.00 -0.36 0.00 0.00 55.97 57.59 1xtg s LYS 34 Cb -0.10 -3.38 -0.05 0.00 -1.51 0.00 0.00 37.83 32.78 1xtg s LYS 34 CO 0.03 -0.34 0.01 0.00 -0.36 0.00 0.00 175.35 174.70 1xtg s ALA 35 N 1.34 1.82 -0.05 3.13 0.00 0.18 -4.38 121.76 123.80 1xtg s ALA 35 Ca 0.60 -1.79 0.01 0.00 0.00 0.00 0.00 51.96 50.78 1xtg s ALA 35 Cb -0.30 0.56 0.02 0.00 0.00 0.00 0.00 23.12 23.40 1xtg s ALA 35 CO 0.28 -0.28 -0.05 -0.06 0.00 0.00 0.00 175.76 175.66 1xtg s PHE 36 N -3.45 0.81 -0.54 0.00 0.40 -0.20 -1.91 117.98 113.08 1xtg s PHE 36 Ca 0.30 -0.24 -0.21 0.00 -0.60 0.00 0.00 56.93 56.17 1xtg s PHE 36 Cb 0.06 -0.72 0.05 0.00 0.51 0.00 0.00 43.02 42.92 1xtg s PHE 36 CO 0.09 -0.22 0.78 0.21 0.70 0.00 0.00 175.22 176.79 1xtg s LYS 37 N 1.03 3.20 0.01 0.44 2.20 0.11 0.08 119.74 126.82 1xtg s LYS 37 Ca -0.09 -0.65 0.26 0.00 -0.36 0.00 0.00 55.97 55.13 1xtg s LYS 37 Cb -0.14 -4.10 0.67 0.00 -1.51 0.00 0.00 37.83 32.76 1xtg s LYS 37 CO -0.00 -1.39 1.54 0.44 -0.36 0.00 0.00 175.35 175.57 1xtg n ILE 38 N 5.87 0.03 -3.54 5.43 -5.35 -0.84 -4.91 119.36 116.05 1xtg n ILE 38 Ca -0.03 -0.02 -0.07 0.00 -0.27 0.00 0.00 62.75 62.35 1xtg n ILE 38 Cb 0.46 0.04 -0.03 0.00 -1.74 0.00 0.00 39.64 38.37 1xtg n ILE 38 CO 0.00 0.00 0.00 -2.28 -1.76 0.00 0.00 176.55 172.51 1xtg s HIS 39 N -3.01 -0.28 0.21 4.28 5.04 -1.20 -4.39 115.29 115.94 1xtg s HIS 39 Ca 0.11 0.24 -0.32 0.00 -1.54 0.00 0.00 55.06 53.55 1xtg s HIS 39 Cb 0.18 0.52 -0.14 0.00 0.04 0.00 0.00 32.58 33.18 1xtg s HIS 39 CO 0.66 -0.41 1.47 0.09 -2.34 0.00 0.00 174.74 174.21 1xtg n ASN 40 N -0.03 2.87 0.00 9.88 3.02 -1.26 -1.31 115.26 128.42 1xtg n ASN 40 Ca -0.06 1.12 0.00 0.00 -0.03 0.00 0.00 54.58 55.61 1xtg n ASN 40 Cb 0.60 -1.43 0.00 0.00 -0.61 0.00 0.00 39.78 38.34 1xtg n ASN 40 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1xtg n LYS 41 N 2.50 0.00 -3.93 3.52 4.76 -1.26 -4.90 118.16 118.85 1xtg n LYS 41 Ca 0.13 0.00 -0.28 0.00 -2.87 0.00 0.00 58.31 55.30 1xtg n LYS 41 Cb 0.30 -2.96 -0.17 0.00 -1.84 0.00 0.00 35.03 30.37 1xtg n LYS 41 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1xtg s ILE 42 N -3.10 1.15 0.20 -0.18 1.01 -0.43 -0.97 121.20 118.88 1xtg s ILE 42 Ca 0.00 -0.38 0.10 0.00 0.00 0.00 0.00 60.65 60.37 1xtg s ILE 42 Cb 0.00 -1.15 -0.04 0.00 0.01 0.00 0.00 42.46 41.28 1xtg s ILE 42 CO 0.00 0.38 -0.13 0.26 0.00 0.00 0.00 174.94 175.44 1xtg s TRP 43 N 1.66 2.52 -0.09 3.97 0.52 -0.50 -1.98 118.94 125.04 1xtg s TRP 43 Ca 0.05 -0.27 0.02 0.00 0.02 0.00 0.00 56.10 55.92 1xtg s TRP 43 Cb -0.13 -1.22 0.01 0.00 -1.15 0.00 0.00 33.47 30.99 1xtg s TRP 43 CO -0.09 0.53 -0.14 0.08 0.02 0.00 0.00 176.95 177.36 1xtg s VAL 44 N -1.80 1.33 -0.38 4.03 1.01 0.11 -1.27 120.40 123.43 1xtg s VAL 44 Ca 0.25 -0.56 -0.00 0.00 0.00 0.00 0.00 61.98 61.67 1xtg s VAL 44 Cb -0.08 -1.22 0.10 0.00 0.00 0.00 0.00 36.38 35.18 1xtg s VAL 44 CO 0.14 0.40 0.14 -0.63 0.00 0.00 0.00 175.10 175.15 1xtg s ILE 45 N 0.89 2.90 -1.23 2.22 1.01 -0.01 -1.04 121.20 125.95 1xtg s ILE 45 Ca -0.09 -2.14 -0.08 0.00 0.00 0.00 0.00 60.65 58.33 1xtg s ILE 45 Cb -0.15 -3.02 -0.07 0.00 0.01 0.00 0.00 42.46 39.23 1xtg s ILE 45 CO 0.01 -0.64 2.47 -0.81 0.00 0.00 0.00 174.94 175.97 1xtg n PRO 46 N 4.47 2.78 -4.08 2.79 -0.04 -1.26 -3.32 135.00 136.33 1xtg n PRO 46 Ca -0.00 -1.81 -0.11 0.00 -0.04 0.00 0.00 63.50 61.54 1xtg n PRO 46 Cb 0.42 -2.63 -0.11 0.00 -0.04 0.00 0.00 33.50 31.14 1xtg n PRO 46 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1xtg s GLU 47 N 2.92 0.59 0.32 0.54 0.41 -1.26 -4.78 118.70 117.44 1xtg s GLU 47 Ca 0.53 -0.94 -0.29 0.00 -0.41 0.00 0.00 54.97 53.86 1xtg s GLU 47 Cb 0.14 -0.17 -0.10 0.00 -1.78 0.00 0.00 34.13 32.21 1xtg s GLU 47 CO -0.04 0.00 1.36 1.03 -0.49 0.00 0.00 175.26 177.12 1xtg s ARG 48 N -2.42 4.30 -0.75 1.61 1.81 -1.26 -0.58 118.95 121.66 1xtg s ARG 48 Ca -0.03 2.29 -0.26 0.00 -1.72 0.00 0.00 55.73 56.00 1xtg s ARG 48 Cb -0.04 -3.06 0.02 0.00 -0.45 0.00 0.00 34.95 31.42 1xtg s ARG 48 CO -0.02 -0.29 1.41 0.34 -0.68 0.00 0.00 175.30 176.05 1xtg s ASP 49 N -0.24 6.03 -0.09 0.23 2.15 -0.35 -4.66 116.67 119.74 1xtg s ASP 49 Ca 0.52 -0.44 0.13 0.00 0.43 0.00 0.00 52.55 53.20 1xtg s ASP 49 Cb -0.41 -2.56 0.21 0.00 -0.30 0.00 0.00 42.92 39.86 1xtg s ASP 49 CO 0.52 -1.91 1.10 0.35 -0.17 0.00 0.00 175.17 175.06 1xtg n THR 50 N 6.60 1.35 -0.06 1.71 -2.24 -1.26 -4.44 114.28 115.93 1xtg n THR 50 Ca 0.10 -1.62 -0.11 0.00 -2.27 0.00 0.00 64.05 60.14 1xtg n THR 50 Cb 0.50 -0.02 -0.05 0.00 -2.10 0.00 0.00 70.33 68.65 1xtg n THR 50 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1xtg n PHE 51 N -1.03 0.00 0.15 4.78 3.72 -1.26 -4.69 117.46 119.13 1xtg n PHE 51 Ca 0.11 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.57 1xtg n PHE 51 Cb 0.65 -0.46 0.53 0.00 -0.94 0.00 0.00 39.48 39.26 1xtg n PHE 51 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 176.76 178.50 1xtg h THR 52 N -0.24 1.06 -3.07 4.37 1.35 -1.94 -3.39 112.91 111.06 1xtg h THR 52 Ca -0.30 -0.17 -0.48 0.00 -0.55 0.00 0.00 66.41 64.92 1xtg h THR 52 Cb 1.35 0.85 -0.41 0.00 -1.73 0.00 0.00 68.15 68.21 1xtg h THR 52 CO -0.12 0.07 -0.76 0.21 -0.25 0.00 0.00 175.52 174.67 1xtg s ASN 53 N -6.91 2.57 0.54 5.36 3.04 -1.26 -4.88 114.94 113.39 1xtg s ASN 53 Ca -0.06 -0.72 0.25 0.00 0.04 0.00 0.00 52.86 52.36 1xtg s ASN 53 Cb 0.17 -0.32 1.42 0.00 -1.54 0.00 0.00 41.25 40.98 1xtg s ASN 53 CO 0.70 -0.35 2.02 -0.65 -3.04 0.00 0.00 177.10 175.77 1xtg h PRO 54 N 8.38 0.00 0.00 0.43 0.11 -1.84 0.39 132.00 139.48 1xtg h PRO 54 Ca -0.16 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.95 1xtg h PRO 54 Cb 1.13 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 1xtg h PRO 54 CO 0.31 0.00 -0.03 1.49 -0.21 0.00 0.00 178.00 179.56 1xtg h GLU 55 N 0.00 0.00 -2.34 1.05 4.57 -1.95 -3.14 114.58 112.77 1xtg h GLU 55 Ca 0.21 0.00 -0.67 0.00 -1.18 0.00 0.00 59.36 57.72 1xtg h GLU 55 Cb 0.86 0.00 -0.37 0.00 -0.16 0.00 0.00 28.75 29.08 1xtg h GLU 55 CO -0.00 0.03 -0.10 0.39 -1.18 0.00 0.00 179.01 178.15 1xtg n GLU 56 N -3.46 3.65 -0.01 1.92 1.02 0.13 -4.79 120.64 119.10 1xtg n GLU 56 Ca -0.02 -4.73 -0.14 0.00 -0.02 0.00 0.00 57.16 52.25 1xtg n GLU 56 Cb 0.14 -2.33 -0.14 0.00 -0.02 0.00 0.00 31.44 29.09 1xtg n GLU 56 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xtg n GLY 57 N 0.32 -0.82 3.84 0.62 0.00 -1.19 -4.43 105.19 103.54 1xtg n GLY 57 Ca 0.33 -0.14 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 1xtg n GLY 57 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1xtg s ASP 58 N -6.46 6.51 -0.08 1.61 1.47 -1.26 -4.91 116.67 113.55 1xtg s ASP 58 Ca -0.12 1.56 0.11 0.00 1.18 0.00 0.00 52.55 55.28 1xtg s ASP 58 Cb 0.07 -2.50 0.21 0.00 -0.34 0.00 0.00 42.92 40.36 1xtg s ASP 58 CO 0.80 -0.67 1.13 0.18 0.68 0.00 0.00 175.17 177.29 1xtg n LEU 59 N -1.81 2.42 -4.96 2.11 4.77 -1.26 -4.28 117.00 113.98 1xtg n LEU 59 Ca 0.07 -2.58 -0.22 0.00 -0.03 0.00 0.00 56.01 53.24 1xtg n LEU 59 Cb 0.54 -0.26 -0.01 0.00 -2.33 0.00 0.00 43.42 41.35 1xtg n LEU 59 CO 0.48 0.63 0.07 0.20 -1.33 0.00 0.00 177.39 177.44 1xtg s ASN 60 N -1.92 6.22 0.31 -1.43 0.01 -1.26 -3.84 114.94 113.02 1xtg s ASN 60 Ca 0.20 0.16 -0.29 0.00 -0.71 0.00 0.00 52.86 52.22 1xtg s ASN 60 Cb 0.17 -1.79 -0.12 0.00 0.41 0.00 0.00 41.25 39.92 1xtg s ASN 60 CO 0.04 -0.25 1.39 -0.81 -1.51 0.00 0.00 177.10 175.96 1xtg n PRO 61 N -1.62 2.25 -1.21 -0.60 -0.04 -1.26 -4.93 135.00 127.59 1xtg n PRO 61 Ca -0.05 0.79 -0.32 0.00 -0.04 0.00 0.00 63.50 63.88 1xtg n PRO 61 Cb 0.57 -2.44 0.10 0.00 -0.04 0.00 0.00 33.50 31.69 1xtg n PRO 61 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1xtg s PRO 62 N -1.24 2.03 0.23 0.54 0.04 -1.26 -4.94 135.00 130.41 1xtg s PRO 62 Ca 0.60 1.34 -0.06 0.00 0.04 0.00 0.00 61.00 62.93 1xtg s PRO 62 Cb -0.57 -1.86 0.34 0.00 0.04 0.00 0.00 34.50 32.45 1xtg s PRO 62 CO 0.56 -1.84 1.80 -1.35 0.04 0.00 0.00 177.00 176.21 1xtg h PRO 63 N -1.06 0.68 -4.44 0.56 0.11 -2.07 -3.33 132.00 122.44 1xtg h PRO 63 Ca -0.44 -0.04 -0.72 0.00 0.11 0.00 0.00 66.00 64.91 1xtg h PRO 63 Cb 1.25 -0.15 -0.27 0.00 0.11 0.00 0.00 31.00 31.93 1xtg h PRO 63 CO 0.49 0.45 -0.45 -1.21 -0.21 0.00 0.00 178.00 177.07 1xtg s GLU 64 N -6.06 2.66 0.27 1.05 0.41 -1.26 -5.06 118.70 110.72 1xtg s GLU 64 Ca -0.13 -1.42 -0.30 0.00 -0.41 0.00 0.00 54.97 52.71 1xtg s GLU 64 Cb 0.18 -3.82 -0.13 0.00 -1.78 0.00 0.00 34.13 28.58 1xtg s GLU 64 CO 0.77 -0.95 1.35 0.00 -0.49 0.00 0.00 175.26 175.94 1xtg n ALA 65 N 4.96 1.12 -1.82 5.21 0.00 -1.25 -4.91 120.51 123.81 1xtg n ALA 65 Ca -0.10 0.39 -0.41 0.00 0.00 0.00 0.00 53.44 53.32 1xtg n ALA 65 Cb 0.43 -2.26 -0.02 0.00 0.00 0.00 0.00 19.45 17.61 1xtg n ALA 65 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1xtg s LYS 66 N -0.92 4.26 -1.42 0.00 1.02 -1.26 -4.90 119.74 116.52 1xtg s LYS 66 Ca 0.64 2.34 -0.11 0.00 0.02 0.00 0.00 55.97 58.86 1xtg s LYS 66 Cb -0.63 -3.07 0.07 0.00 -0.52 0.00 0.00 37.83 33.68 1xtg s LYS 66 CO 0.54 -0.38 2.26 1.04 -0.92 0.00 0.00 175.35 177.89 1xtg n GLN 67 N 1.57 3.42 -4.31 1.68 1.13 -1.26 -4.36 117.38 115.25 1xtg n GLN 67 Ca 0.04 -2.91 -0.22 0.00 -1.94 0.00 0.00 57.00 51.96 1xtg n GLN 67 Cb 0.40 -3.03 -0.12 0.00 0.11 0.00 0.00 30.24 27.61 1xtg n GLN 67 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 1xtg s VAL 68 N 1.68 1.74 0.26 5.09 -7.23 -1.26 -5.02 120.40 115.66 1xtg s VAL 68 Ca 0.49 -1.76 -0.01 0.00 -1.81 0.00 0.00 61.98 58.90 1xtg s VAL 68 Cb 0.14 -1.71 0.25 0.00 0.56 0.00 0.00 36.38 35.62 1xtg s VAL 68 CO -0.06 -0.23 1.75 -0.65 -0.31 0.00 0.00 175.10 175.60 1xtg h PRO 69 N 3.58 0.55 -3.41 4.82 0.11 -1.91 -3.42 132.00 132.33 1xtg h PRO 69 Ca -0.43 -0.03 -0.22 0.00 0.11 0.00 0.00 66.00 65.42 1xtg h PRO 69 Cb 1.20 -0.12 -0.29 0.00 0.11 0.00 0.00 31.00 31.89 1xtg h PRO 69 CO 0.47 0.36 -0.60 0.08 -0.21 0.00 0.00 178.00 178.10 1xtg s VAL 70 N -5.96 -0.02 0.05 3.15 1.01 -1.26 -4.71 120.40 112.65 1xtg s VAL 70 Ca -0.12 0.07 -0.11 0.00 0.00 0.00 0.00 61.98 61.82 1xtg s VAL 70 Cb 0.22 -0.18 0.01 0.00 0.00 0.00 0.00 36.38 36.43 1xtg s VAL 70 CO 0.78 0.03 0.24 -0.94 0.00 0.00 0.00 175.10 175.20 1xtg s SER 71 N 0.48 -0.01 -0.13 3.32 1.04 -1.26 -4.95 113.70 112.19 1xtg s SER 71 Ca -0.03 -0.37 -0.09 0.00 0.48 0.00 0.00 55.95 55.94 1xtg s SER 71 Cb -0.05 0.33 0.04 0.00 0.10 0.00 0.00 66.02 66.44 1xtg s SER 71 CO -0.02 -0.62 0.32 -0.47 0.98 0.00 0.00 173.24 173.43 1xtg s TYR 72 N -2.87 -0.40 0.07 5.02 5.04 -1.26 -1.37 117.35 121.57 1xtg s TYR 72 Ca -0.03 0.94 0.05 0.00 -2.44 0.00 0.00 57.07 55.59 1xtg s TYR 72 Cb 0.00 0.14 -0.03 0.00 0.35 0.00 0.00 41.96 42.42 1xtg s TYR 72 CO -0.05 -0.22 -0.15 0.71 -1.34 0.00 0.00 175.55 174.49 1xtg s TYR 73 N 0.72 1.28 -0.31 4.97 1.51 -1.26 -0.43 117.35 123.83 1xtg s TYR 73 Ca -0.04 -0.43 -0.12 0.00 -1.01 0.00 0.00 57.07 55.46 1xtg s TYR 73 Cb -0.06 -0.73 0.19 0.00 -0.11 0.00 0.00 41.96 41.25 1xtg s TYR 73 CO -0.05 0.07 1.09 0.34 -1.11 0.00 0.00 175.55 175.89 1xtg s ASP 74 N -1.60 -0.25 0.32 2.29 2.15 -1.26 -5.02 116.67 113.29 1xtg s ASP 74 Ca -0.00 -0.03 0.21 0.00 0.43 0.00 0.00 52.55 53.15 1xtg s ASP 74 Cb -0.09 0.84 1.12 0.00 -0.30 0.00 0.00 42.92 44.49 1xtg s ASP 74 CO 0.02 -0.04 1.62 -1.54 -0.17 0.00 0.00 175.17 175.06 1xtg n SER 75 N 4.53 0.53 0.05 -0.34 3.41 -1.25 -2.02 113.62 118.54 1xtg n SER 75 Ca 0.08 0.74 0.12 0.00 -0.26 0.00 0.00 58.87 59.55 1xtg n SER 75 Cb 0.60 -0.80 0.07 0.00 -0.26 0.00 0.00 64.21 63.82 1xtg n SER 75 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1xtg n THR 76 N -2.23 0.30 -1.77 6.66 -2.24 -1.26 -4.93 114.28 108.81 1xtg n THR 76 Ca -0.01 -0.31 -0.42 0.00 -2.27 0.00 0.00 64.05 61.04 1xtg n THR 76 Cb 0.06 -0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.27 1xtg n THR 76 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1xtg s TYR 77 N -3.22 2.85 -0.58 4.78 5.04 -0.85 -2.88 117.35 122.49 1xtg s TYR 77 Ca 0.04 0.57 -0.02 0.00 -2.44 0.00 0.00 57.07 55.22 1xtg s TYR 77 Cb 0.13 -4.09 0.00 0.00 0.35 0.00 0.00 41.96 38.36 1xtg s TYR 77 CO 0.77 -3.90 0.20 1.28 -1.34 0.00 0.00 175.55 172.57 1xtg n LEU 78 N 3.16 -1.90 -0.07 6.97 4.77 -1.26 -4.86 117.00 123.81 1xtg n LEU 78 Ca 0.12 -0.10 0.05 0.00 -0.03 0.00 0.00 56.01 56.06 1xtg n LEU 78 Cb 0.36 -1.41 -0.04 0.00 -2.33 0.00 0.00 43.42 40.00 1xtg n LEU 78 CO 0.64 0.07 0.04 -1.54 -1.33 0.00 0.00 177.39 175.27 1xtg n SER 79 N 0.21 0.70 -4.70 -1.43 3.41 -1.14 -4.56 113.62 106.11 1xtg n SER 79 Ca -0.05 -0.85 -0.24 0.00 -0.26 0.00 0.00 58.87 57.47 1xtg n SER 79 Cb 0.55 0.86 -0.07 0.00 -0.26 0.00 0.00 64.21 65.29 1xtg n SER 79 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1xtg s THR 80 N -1.86 3.85 0.29 6.66 -4.23 -1.26 -5.03 115.64 114.07 1xtg s THR 80 Ca 0.05 -1.56 -0.02 0.00 -1.18 0.00 0.00 61.69 58.99 1xtg s THR 80 Cb 0.08 -3.02 0.20 0.00 1.34 0.00 0.00 72.50 71.11 1xtg s THR 80 CO 0.39 -0.25 1.88 0.44 -0.54 0.00 0.00 174.62 176.54 1xtg h ASP 81 N 2.13 0.86 -0.48 3.99 3.32 -1.98 -1.25 116.42 123.01 1xtg h ASP 81 Ca -0.46 -0.10 -0.07 0.00 0.02 0.00 0.00 57.03 56.42 1xtg h ASP 81 Cb 1.23 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 40.53 1xtg h ASP 81 CO 0.60 0.74 0.05 0.78 -1.72 0.00 0.00 179.24 179.69 1xtg h ASN 82 N 0.95 0.83 -0.21 6.45 2.35 -1.98 0.13 115.58 124.10 1xtg h ASN 82 Ca 0.23 -0.19 -0.07 0.00 -0.55 0.00 0.00 56.30 55.72 1xtg h ASN 82 Cb 0.11 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.26 1xtg h ASN 82 CO -0.03 0.86 -0.13 -0.33 -1.65 0.00 0.00 177.43 176.15 1xtg h GLU 83 N 0.82 0.46 -0.40 0.81 5.08 -1.86 -0.74 114.58 118.75 1xtg h GLU 83 Ca 0.16 -0.21 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1xtg h GLU 83 Cb 0.42 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 1xtg h GLU 83 CO 0.01 0.76 0.18 0.87 -1.00 0.00 0.00 179.01 179.83 1xtg h LYS 84 N 0.15 0.56 -0.28 2.33 1.57 -0.98 0.28 116.57 120.19 1xtg h LYS 84 Ca 0.04 -0.07 -0.13 0.00 -1.87 0.00 0.00 60.65 58.63 1xtg h LYS 84 Cb 0.64 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.84 1xtg h LYS 84 CO 0.04 0.45 -0.33 0.22 -0.57 0.00 0.00 179.45 179.26 1xtg h ASP 85 N 0.56 0.78 0.14 0.86 3.58 -0.53 -1.35 116.42 120.46 1xtg h ASP 85 Ca 0.14 -0.49 -0.09 0.00 0.42 0.00 0.00 57.03 57.01 1xtg h ASP 85 Cb 0.09 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 40.91 1xtg h ASP 85 CO -0.02 1.11 -0.33 -1.13 -2.88 0.00 0.00 179.24 175.99 1xtg h ASN 86 N 0.47 0.28 -0.12 2.28 -0.73 -0.38 -2.03 115.58 115.34 1xtg h ASN 86 Ca 0.04 -0.10 -0.02 0.00 1.87 0.00 0.00 56.30 58.09 1xtg h ASN 86 Cb 0.90 -0.08 -0.00 0.00 0.27 0.00 0.00 38.32 39.41 1xtg h ASN 86 CO 0.08 0.60 -0.01 0.22 -0.37 0.00 0.00 177.43 177.95 1xtg h TYR 87 N 0.24 0.25 -0.64 0.67 5.03 -0.34 -0.25 116.97 121.93 1xtg h TYR 87 Ca 0.03 -0.05 0.04 0.00 2.58 0.00 0.00 58.73 61.33 1xtg h TYR 87 Cb 0.70 -0.06 -0.04 0.00 1.55 0.00 0.00 36.73 38.87 1xtg h TYR 87 CO 0.01 0.48 0.39 1.25 -1.32 0.00 0.00 178.16 178.97 1xtg h LEU 88 N -0.06 0.62 -0.89 2.82 5.85 -1.07 0.44 115.31 123.02 1xtg h LEU 88 Ca 0.03 0.01 -0.11 0.00 0.84 0.00 0.00 57.88 58.65 1xtg h LEU 88 Cb 0.39 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 1xtg h LEU 88 CO 0.01 0.42 -0.40 0.11 -0.34 0.00 0.00 178.44 178.24 1xtg h LYS 89 N 0.75 0.32 -0.10 1.25 1.57 -1.30 -1.78 116.57 117.26 1xtg h LYS 89 Ca 0.27 -0.15 -0.06 0.00 -1.87 0.00 0.00 60.65 58.84 1xtg h LYS 89 Cb 0.06 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.37 1xtg h LYS 89 CO -0.12 0.67 -0.16 0.78 -0.57 0.00 0.00 179.45 180.05 1xtg h GLY 90 N 1.17 0.31 1.22 3.86 0.00 -0.22 -1.67 103.07 107.75 1xtg h GLY 90 Ca 0.03 -0.35 -0.03 0.00 0.00 0.00 0.00 47.33 46.98 1xtg h GLY 90 CO 0.07 0.32 0.33 -2.08 0.00 0.00 0.00 176.54 175.18 1xtg h VAL 91 N -0.15 1.23 -0.42 4.60 2.07 -0.92 -1.91 116.25 120.75 1xtg h VAL 91 Ca 0.01 -0.65 -0.03 0.00 0.82 0.00 0.00 66.70 66.85 1xtg h VAL 91 Cb 0.72 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 1xtg h VAL 91 CO 0.04 0.27 0.13 0.74 0.02 0.00 0.00 177.57 178.77 1xtg h THR 92 N 1.01 1.22 -0.68 2.57 2.02 -1.27 -1.89 112.91 115.89 1xtg h THR 92 Ca 0.25 -0.72 -0.03 0.00 0.77 0.00 0.00 66.41 66.67 1xtg h THR 92 Cb 0.11 0.90 -0.03 0.00 -1.74 0.00 0.00 68.15 67.39 1xtg h THR 92 CO -0.03 0.26 0.30 0.50 0.37 0.00 0.00 175.52 176.91 1xtg h LYS 93 N 0.53 0.98 -0.25 6.66 3.64 -0.99 -1.61 116.57 125.52 1xtg h LYS 93 Ca 0.13 -0.15 -0.15 0.00 -1.27 0.00 0.00 60.65 59.22 1xtg h LYS 93 Cb 0.27 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 1xtg h LYS 93 CO -0.00 0.78 -0.45 -0.07 -2.27 0.00 0.00 179.45 177.43 1xtg h LEU 94 N 0.97 0.70 -0.85 5.20 3.38 -1.15 -0.13 115.31 123.43 1xtg h LEU 94 Ca 0.23 -0.33 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 1xtg h LEU 94 Cb 0.14 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.66 1xtg h LEU 94 CO -0.03 1.05 0.38 -0.26 0.09 0.00 0.00 178.44 179.67 1xtg h PHE 95 N 0.52 1.22 -0.55 1.13 0.04 -0.94 -0.03 116.94 118.34 1xtg h PHE 95 Ca 0.03 -0.07 -0.10 0.00 2.80 0.00 0.00 57.97 60.63 1xtg h PHE 95 Cb 0.99 -0.38 -0.02 0.00 2.20 0.00 0.00 35.95 38.74 1xtg h PHE 95 CO 0.05 0.90 -0.07 0.93 -0.60 0.00 0.00 178.31 179.51 1xtg h GLU 96 N 1.20 1.00 -0.67 1.51 4.39 -0.93 0.92 114.58 122.00 1xtg h GLU 96 Ca 0.28 -0.34 -0.03 0.00 0.34 0.00 0.00 59.36 59.62 1xtg h GLU 96 Cb 0.15 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 28.69 1xtg h GLU 96 CO -0.03 1.02 0.31 -0.09 -1.16 0.00 0.00 179.01 179.06 1xtg h ARG 97 N 0.90 0.97 -0.61 2.33 2.43 -0.47 -0.31 114.38 119.61 1xtg h ARG 97 Ca 0.15 -0.15 -0.04 0.00 -0.81 0.00 0.00 59.98 59.13 1xtg h ARG 97 Cb 0.62 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 29.97 1xtg h ARG 97 CO 0.04 0.78 0.23 0.82 -1.51 0.00 0.00 179.97 180.32 1xtg h ILE 98 N 0.93 1.24 0.00 1.20 2.04 -0.70 -2.08 117.51 120.13 1xtg h ILE 98 Ca 0.23 -0.76 0.00 0.00 1.00 0.00 0.00 64.86 65.33 1xtg h ILE 98 Cb 0.14 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 36.80 1xtg h ILE 98 CO -0.03 0.29 0.00 0.00 0.00 0.00 0.00 178.15 178.42 1xtg n TYR 99 N -4.43 0.06 1.21 1.37 9.36 0.29 -3.16 117.16 121.87 1xtg n TYR 99 Ca 0.04 0.03 0.12 0.00 3.32 0.00 0.00 57.90 61.41 1xtg n TYR 99 Cb 0.18 -0.54 0.64 0.00 -0.63 0.00 0.00 39.34 38.99 1xtg n TYR 99 CO 0.00 0.00 0.00 -1.13 0.22 0.00 0.00 176.86 175.95 1xtg n SER 100 N -1.56 0.00 -4.28 2.98 3.41 -0.21 -4.48 113.62 109.48 1xtg n SER 100 Ca 0.02 -0.12 -0.16 0.00 -0.26 0.00 0.00 58.87 58.36 1xtg n SER 100 Cb 0.13 -0.27 -0.10 0.00 -0.26 0.00 0.00 64.21 63.71 1xtg n SER 100 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1xtg s THR 101 N -2.54 1.37 0.29 6.66 -4.23 -1.19 -5.04 115.64 110.96 1xtg s THR 101 Ca 0.25 -2.11 -0.03 0.00 -1.18 0.00 0.00 61.69 58.62 1xtg s THR 101 Cb 0.17 -1.91 0.25 0.00 1.34 0.00 0.00 72.50 72.34 1xtg s THR 101 CO 0.38 -0.69 1.95 0.44 -0.54 0.00 0.00 174.62 176.15 1xtg h ASP 102 N 2.71 0.97 -0.13 3.99 3.32 -1.88 -0.97 116.42 124.42 1xtg h ASP 102 Ca -0.37 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.64 1xtg h ASP 102 Cb 1.20 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.50 1xtg h ASP 102 CO 0.63 0.72 0.09 0.25 -1.72 0.00 0.00 179.24 179.21 1xtg h LEU 103 N 1.13 0.15 -0.46 1.55 5.85 -1.96 -0.86 115.31 120.71 1xtg h LEU 103 Ca 0.30 -0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.94 1xtg h LEU 103 Cb -0.09 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 40.89 1xtg h LEU 103 CO -0.06 0.11 -0.02 1.23 -0.34 0.00 0.00 178.44 179.36 1xtg h GLY 104 N 0.18 0.89 1.01 3.75 0.00 -1.57 -1.51 103.07 105.82 1xtg h GLY 104 Ca 0.05 -0.67 0.00 0.00 0.00 0.00 0.00 47.33 46.72 1xtg h GLY 104 CO -0.01 0.61 0.59 3.21 0.00 0.00 0.00 176.54 180.94 1xtg h ARG 105 N 0.67 1.25 -0.30 4.80 3.08 -1.01 -0.99 114.38 121.89 1xtg h ARG 105 Ca 0.13 -0.09 -0.07 0.00 0.07 0.00 0.00 59.98 60.02 1xtg h ARG 105 Cb 0.53 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 1xtg h ARG 105 CO 0.03 0.85 -0.08 1.98 -1.07 0.00 0.00 179.97 181.67 1xtg h MET 106 N 1.28 0.58 -0.27 0.04 4.05 -1.01 -2.22 114.93 117.38 1xtg h MET 106 Ca 0.34 -0.23 0.00 0.00 -0.28 0.00 0.00 59.70 59.53 1xtg h MET 106 Cb -0.10 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 30.65 1xtg h MET 106 CO -0.07 0.78 0.17 1.25 0.23 0.00 0.00 176.91 179.28 1xtg h LEU 107 N 0.34 0.30 -1.04 3.39 5.85 -0.92 -0.36 115.31 122.87 1xtg h LEU 107 Ca 0.07 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 1xtg h LEU 107 Cb 0.58 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.50 1xtg h LEU 107 CO 0.03 0.22 0.27 -0.07 -0.34 0.00 0.00 178.44 178.55 1xtg h LEU 108 N 0.36 0.87 -0.61 2.25 3.38 -1.17 -0.67 115.31 119.71 1xtg h LEU 108 Ca 0.10 -0.11 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 1xtg h LEU 108 Cb -0.04 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 1xtg h LEU 108 CO -0.02 0.77 -0.25 0.74 0.09 0.00 0.00 178.44 179.76 1xtg h THR 109 N 0.94 1.27 -0.80 0.22 2.02 -1.08 -0.70 112.91 114.78 1xtg h THR 109 Ca 0.22 -1.39 -0.05 0.00 0.77 0.00 0.00 66.41 65.96 1xtg h THR 109 Cb 0.16 1.24 -0.04 0.00 -1.74 0.00 0.00 68.15 67.77 1xtg h THR 109 CO -0.02 0.47 0.32 0.28 0.37 0.00 0.00 175.52 176.93 1xtg h SER 110 N 0.71 1.10 -0.41 4.18 0.02 -0.51 -0.31 113.55 118.33 1xtg h SER 110 Ca 0.09 -0.17 -0.05 0.00 -0.84 0.00 0.00 61.79 60.81 1xtg h SER 110 Cb 0.79 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 63.03 1xtg h SER 110 CO 0.07 0.98 0.05 0.40 -1.14 0.00 0.00 176.83 177.19 1xtg h ILE 111 N 1.17 1.25 -0.00 3.27 2.04 -0.83 -0.28 117.51 124.12 1xtg h ILE 111 Ca 0.27 -0.91 -0.07 0.00 1.00 0.00 0.00 64.86 65.15 1xtg h ILE 111 Cb 0.22 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 1xtg h ILE 111 CO -0.02 0.31 -0.33 0.58 0.00 0.00 0.00 178.15 178.69 1xtg h VAL 112 N 0.54 1.24 0.00 1.67 2.07 -0.84 -2.17 116.25 118.76 1xtg h VAL 112 Ca 0.12 -1.12 -0.01 0.00 0.82 0.00 0.00 66.70 66.51 1xtg h VAL 112 Cb 0.40 1.60 -0.00 0.00 -1.52 0.00 0.00 31.29 31.77 1xtg h VAL 112 CO 0.01 0.32 -0.05 0.03 0.02 0.00 0.00 177.57 177.90 1xtg h ARG 113 N 0.00 0.00 -2.38 1.57 3.08 -0.72 -3.39 114.38 112.54 1xtg h ARG 113 Ca -0.00 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.92 1xtg h ARG 113 Cb 0.58 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.59 1xtg h ARG 113 CO 0.04 0.05 0.00 0.41 -1.07 0.00 0.00 179.97 179.41 1xtg n GLY 114 N 1.04 2.32 3.70 0.04 0.00 -0.15 -4.75 105.19 107.39 1xtg n GLY 114 Ca 0.04 -0.79 -0.42 0.00 0.00 0.00 0.00 46.02 44.85 1xtg n GLY 114 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xtg s ILE 115 N 1.75 2.69 0.23 -0.61 1.01 -1.26 -4.75 121.20 120.25 1xtg s ILE 115 Ca 0.43 0.25 -0.32 0.00 0.00 0.00 0.00 60.65 61.02 1xtg s ILE 115 Cb 0.20 -3.16 -0.13 0.00 0.01 0.00 0.00 42.46 39.38 1xtg s ILE 115 CO -0.00 0.00 1.49 -2.65 0.00 0.00 0.00 174.94 173.78 1xtg n PRO 116 N 5.35 2.19 -1.70 2.79 -0.02 -1.26 -4.91 135.00 137.44 1xtg n PRO 116 Ca 0.16 0.78 -0.38 0.00 -2.02 0.00 0.00 63.50 62.04 1xtg n PRO 116 Cb 0.39 -2.49 0.05 0.00 -0.02 0.00 0.00 33.50 31.42 1xtg n PRO 116 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1xtg n PHE 117 N 2.38 1.80 -2.76 6.00 7.35 -0.14 -4.91 117.46 127.17 1xtg n PHE 117 Ca 0.13 0.44 -0.44 0.00 -0.76 0.00 0.00 57.45 56.82 1xtg n PHE 117 Cb 0.32 -2.28 0.00 0.00 0.35 0.00 0.00 39.48 37.87 1xtg n PHE 117 CO 0.00 0.00 0.00 0.91 -0.76 0.00 0.00 176.76 176.91 1xtg n TRP 118 N -1.34 4.40 -2.46 -5.13 7.02 -1.26 -4.61 117.44 114.06 1xtg n TRP 118 Ca 0.12 -3.19 -0.15 0.00 -1.02 0.00 0.00 57.50 53.27 1xtg n TRP 118 Cb 0.46 -2.14 0.03 0.00 -2.42 0.00 0.00 31.31 27.23 1xtg n TRP 118 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1xtg n GLY 119 N 3.77 4.13 1.78 6.99 0.00 -0.94 -3.26 105.19 117.65 1xtg n GLY 119 Ca 0.38 -1.97 0.08 0.00 0.00 0.00 0.00 46.02 44.51 1xtg n GLY 119 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xtg n GLY 120 N -0.54 2.92 3.91 -0.02 0.00 -0.00 -4.96 105.19 106.50 1xtg n GLY 120 Ca 0.26 -0.90 -0.31 0.00 0.00 0.00 0.00 46.02 45.07 1xtg n GLY 120 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1xtg s SER 121 N -0.85 6.43 0.10 1.61 0.15 -1.26 -4.91 113.70 114.97 1xtg s SER 121 Ca 0.54 0.45 0.26 0.00 0.70 0.00 0.00 55.95 57.90 1xtg s SER 121 Cb 0.38 -2.03 0.72 0.00 -1.71 0.00 0.00 66.02 63.39 1xtg s SER 121 CO 0.20 0.09 1.62 0.35 1.20 0.00 0.00 173.24 176.70 1xtg n THR 122 N 0.11 0.29 -3.27 6.45 -2.24 -1.26 -4.61 114.28 109.76 1xtg n THR 122 Ca -0.04 -0.17 -0.44 0.00 -2.27 0.00 0.00 64.05 61.13 1xtg n THR 122 Cb 0.52 -0.30 -0.06 0.00 -2.10 0.00 0.00 70.33 68.38 1xtg n THR 122 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1xtg s ILE 123 N -3.08 5.06 0.62 2.28 1.01 -1.26 -4.94 121.20 120.89 1xtg s ILE 123 Ca 0.10 -0.92 0.24 0.00 0.00 0.00 0.00 60.65 60.07 1xtg s ILE 123 Cb 0.15 -4.26 0.32 0.00 0.01 0.00 0.00 42.46 38.68 1xtg s ILE 123 CO 0.63 -0.76 1.57 -2.24 0.00 0.00 0.00 174.94 174.15 1xtg h ASP 124 N 8.91 0.00 -0.39 3.58 2.03 -1.99 0.49 116.42 129.04 1xtg h ASP 124 Ca -0.28 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.02 1xtg h ASP 124 Cb 1.10 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.60 1xtg h ASP 124 CO 0.96 0.00 0.00 0.35 -1.03 0.00 0.00 179.24 179.52 1xtg n THR 125 N -3.25 0.51 -4.57 1.15 -2.24 -1.26 -4.67 114.28 99.95 1xtg n THR 125 Ca 0.11 -0.70 -0.33 0.00 -2.27 0.00 0.00 64.05 60.85 1xtg n THR 125 Cb 0.97 0.81 -0.15 0.00 -2.10 0.00 0.00 70.33 69.86 1xtg n THR 125 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1xtg s GLU 126 N -1.49 3.31 -0.12 -0.78 2.12 0.17 -0.34 118.70 121.57 1xtg s GLU 126 Ca 0.38 -0.71 -0.24 0.00 0.36 0.00 0.00 54.97 54.77 1xtg s GLU 126 Cb 0.22 -2.67 -0.03 0.00 0.26 0.00 0.00 34.13 31.91 1xtg s GLU 126 CO 0.31 0.08 0.75 -0.51 -0.54 0.00 0.00 175.26 175.34 1xtg s LEU 127 N 0.68 4.24 -0.03 2.70 1.43 -0.18 -4.49 118.68 123.03 1xtg s LEU 127 Ca -0.06 1.15 -0.05 0.00 -1.03 0.00 0.00 54.13 54.13 1xtg s LEU 127 Cb -0.15 -3.13 0.01 0.00 0.03 0.00 0.00 46.19 42.95 1xtg s LEU 127 CO 0.02 -0.24 0.13 -0.75 0.23 0.00 0.00 176.35 175.73 1xtg s LYS 128 N 1.45 0.27 0.77 1.70 2.20 -1.20 -2.30 119.74 122.63 1xtg s LYS 128 Ca 0.37 -0.03 -0.11 0.00 -0.36 0.00 0.00 55.97 55.84 1xtg s LYS 128 Cb -0.17 0.12 0.06 0.00 -1.51 0.00 0.00 37.83 36.32 1xtg s LYS 128 CO 0.15 -0.05 1.09 0.54 -0.36 0.00 0.00 175.35 176.73 1xtg s VAL 129 N -0.46 3.31 -0.31 4.02 0.11 -1.26 -0.82 120.40 124.98 1xtg s VAL 129 Ca -0.05 0.43 -0.07 0.00 -2.93 0.00 0.00 61.98 59.36 1xtg s VAL 129 Cb -0.04 -2.91 0.02 0.00 -1.53 0.00 0.00 36.38 31.93 1xtg s VAL 129 CO 0.01 -0.55 0.10 -0.63 -3.33 0.00 0.00 175.10 170.69 1xtg s ILE 130 N -2.88 3.93 0.57 7.04 1.01 -1.26 -4.21 121.20 125.40 1xtg s ILE 130 Ca 0.61 -0.86 0.35 0.00 0.00 0.00 0.00 60.65 60.75 1xtg s ILE 130 Cb -0.17 -3.11 0.51 0.00 0.01 0.00 0.00 42.46 39.70 1xtg s ILE 130 CO 0.56 -0.03 1.70 0.44 0.00 0.00 0.00 174.94 177.61 1xtg h ASP 131 N 8.24 0.00 0.37 3.58 5.19 -1.97 0.15 116.42 131.98 1xtg h ASP 131 Ca -0.28 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.13 1xtg h ASP 131 Cb 1.11 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.62 1xtg h ASP 131 CO 0.61 0.00 0.00 1.07 -3.12 0.00 0.00 179.24 177.80 1xtg n THR 132 N -3.86 0.79 -1.13 0.35 5.66 -1.26 -2.47 114.28 112.36 1xtg n THR 132 Ca 0.23 0.20 0.02 0.00 -3.05 0.00 0.00 64.05 61.46 1xtg n THR 132 Cb 1.26 -0.96 0.25 0.00 -1.55 0.00 0.00 70.33 69.34 1xtg n THR 132 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 1xtg n ASN 133 N -1.38 3.64 -4.05 1.09 5.03 0.53 -4.52 115.26 115.58 1xtg n ASN 133 Ca 0.05 -3.27 -0.17 0.00 0.87 0.00 0.00 54.58 52.07 1xtg n ASN 133 Cb 0.14 -0.60 -0.09 0.00 -1.02 0.00 0.00 39.78 38.20 1xtg n ASN 133 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1xtg s ILE 135 N -3.73 0.22 -0.22 0.00 -4.36 -0.56 -4.61 121.20 107.94 1xtg s ILE 135 Ca 0.37 -1.76 -0.08 0.00 -0.26 0.00 0.00 60.65 58.92 1xtg s ILE 135 Cb 0.06 -1.45 -0.04 0.00 1.25 0.00 0.00 42.46 42.28 1xtg s ILE 135 CO 0.16 -0.97 0.09 0.20 0.24 0.00 0.00 174.94 174.66 1xtg s ASN 136 N -2.84 5.55 -0.33 4.36 0.01 -0.01 -1.42 114.94 120.27 1xtg s ASN 136 Ca 0.06 -0.02 -0.11 0.00 -0.71 0.00 0.00 52.86 52.07 1xtg s ASN 136 Cb 0.07 -1.98 -0.01 0.00 0.41 0.00 0.00 41.25 39.74 1xtg s ASN 136 CO -0.09 0.07 0.19 -0.69 -1.51 0.00 0.00 177.10 175.07 1xtg s VAL 137 N 1.01 4.88 0.22 1.60 1.01 0.40 -1.57 120.40 127.95 1xtg s VAL 137 Ca 0.05 -0.38 -0.30 0.00 0.00 0.00 0.00 61.98 61.35 1xtg s VAL 137 Cb -0.14 -3.52 -0.08 0.00 0.00 0.00 0.00 36.38 32.64 1xtg s VAL 137 CO 0.03 0.01 1.06 -0.63 0.00 0.00 0.00 175.10 175.57 1xtg s ILE 138 N 1.65 3.82 0.33 2.22 1.01 -0.54 -1.71 121.20 127.98 1xtg s ILE 138 Ca 0.05 1.70 0.04 0.00 0.00 0.00 0.00 60.65 62.44 1xtg s ILE 138 Cb -0.17 -4.08 -0.02 0.00 0.01 0.00 0.00 42.46 38.20 1xtg s ILE 138 CO 0.08 0.35 0.49 -1.10 0.00 0.00 0.00 174.94 174.77 1xtg s GLN 139 N -0.88 3.26 0.51 2.79 -1.52 0.10 -4.36 119.66 119.55 1xtg s GLN 139 Ca 0.46 -0.71 0.21 0.00 -1.95 0.00 0.00 55.36 53.36 1xtg s GLN 139 Cb -0.29 -2.76 1.32 0.00 -0.22 0.00 0.00 33.01 31.06 1xtg s GLN 139 CO 0.36 0.11 2.09 -1.35 -0.25 0.00 0.00 175.29 176.25 1xtg h PRO 140 N 0.84 0.00 0.00 2.91 0.11 -1.86 -1.41 132.00 132.59 1xtg h PRO 140 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1xtg h PRO 140 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1xtg h PRO 140 CO 0.57 0.11 0.00 -0.40 -0.21 0.00 0.00 178.00 178.07 1xtg n ASP 141 N -4.07 0.00 0.00 -2.05 5.68 -1.26 -4.90 116.55 109.95 1xtg n ASP 141 Ca -0.02 -0.09 0.00 0.00 -0.50 0.00 0.00 54.79 54.17 1xtg n ASP 141 Cb 0.19 -0.29 0.00 0.00 -1.14 0.00 0.00 41.12 39.88 1xtg n ASP 141 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1xtg n GLY 142 N 1.07 2.88 1.91 6.12 0.00 -0.53 -5.07 105.19 111.56 1xtg n GLY 142 Ca 0.13 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.00 1xtg n GLY 142 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xtg n SER 143 N 0.00 -0.51 -3.70 1.61 3.41 -1.26 -4.68 113.62 108.49 1xtg n SER 143 Ca 0.00 -1.10 -0.10 0.00 -0.26 0.00 0.00 58.87 57.41 1xtg n SER 143 Cb 0.00 -0.52 -0.04 0.00 -0.26 0.00 0.00 64.21 63.39 1xtg n SER 143 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1xtg s TYR 144 N -2.32 -0.12 0.03 7.33 1.13 -1.26 0.01 117.35 122.14 1xtg s TYR 144 Ca 0.38 -0.21 0.01 0.00 -1.41 0.00 0.00 57.07 55.84 1xtg s TYR 144 Cb -0.02 0.30 -0.02 0.00 -1.10 0.00 0.00 41.96 41.12 1xtg s TYR 144 CO 0.27 -0.81 -0.05 -0.98 -2.51 0.00 0.00 175.55 171.47 1xtg s ARG 145 N -3.85 0.42 0.22 -3.49 1.70 -0.70 -4.96 118.95 108.29 1xtg s ARG 145 Ca 0.07 -0.65 -0.08 0.00 -0.47 0.00 0.00 55.73 54.60 1xtg s ARG 145 Cb 0.01 -0.12 -0.07 0.00 -0.57 0.00 0.00 34.95 34.20 1xtg s ARG 145 CO -0.07 0.01 0.51 -1.12 -1.08 0.00 0.00 175.30 173.55 1xtg s SER 146 N -1.43 6.58 -0.09 -2.89 0.01 -1.26 -0.46 113.70 114.16 1xtg s SER 146 Ca -0.12 0.83 -0.08 0.00 1.31 0.00 0.00 55.95 57.89 1xtg s SER 146 Cb -0.09 -2.19 0.03 0.00 0.21 0.00 0.00 66.02 63.97 1xtg s SER 146 CO -0.00 -0.06 0.24 -0.70 0.41 0.00 0.00 173.24 173.13 1xtg s GLU 147 N -2.86 0.27 0.37 12.44 2.12 -0.50 -4.94 118.70 125.60 1xtg s GLU 147 Ca 0.46 0.36 -0.19 0.00 0.36 0.00 0.00 54.97 55.96 1xtg s GLU 147 Cb -0.11 0.10 -0.10 0.00 0.26 0.00 0.00 34.13 34.28 1xtg s GLU 147 CO 0.23 -0.05 0.85 -1.21 -0.54 0.00 0.00 175.26 174.54 1xtg s GLU 148 N 0.29 4.16 0.14 4.30 2.02 -1.26 -1.49 118.70 126.86 1xtg s GLU 148 Ca -0.01 0.94 -0.17 0.00 0.02 0.00 0.00 54.97 55.75 1xtg s GLU 148 Cb -0.03 -2.34 0.04 0.00 0.10 0.00 0.00 34.13 31.89 1xtg s GLU 148 CO -0.01 0.08 0.44 -0.48 0.02 0.00 0.00 175.26 175.31 1xtg s LEU 149 N -2.99 0.27 -0.17 1.80 2.34 -1.14 -4.80 118.68 113.99 1xtg s LEU 149 Ca 0.57 -0.34 0.09 0.00 0.06 0.00 0.00 54.13 54.51 1xtg s LEU 149 Cb -0.10 1.95 -0.17 0.00 -0.56 0.00 0.00 46.19 47.31 1xtg s LEU 149 CO 0.16 -0.90 -0.04 0.59 -1.06 0.00 0.00 176.35 175.09 1xtg n ASN 150 N -0.26 1.70 -3.86 1.48 4.13 -0.14 -4.55 115.26 113.75 1xtg n ASN 150 Ca -0.15 -0.04 -0.12 0.00 1.68 0.00 0.00 54.58 55.95 1xtg n ASN 150 Cb 0.64 0.40 -0.13 0.00 -1.54 0.00 0.00 39.78 39.15 1xtg n ASN 150 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1xtg s LEU 151 N -5.55 1.76 -0.06 3.41 2.96 -0.62 -0.98 118.68 119.60 1xtg s LEU 151 Ca -0.15 0.04 0.01 0.00 -0.22 0.00 0.00 54.13 53.81 1xtg s LEU 151 Cb 0.05 0.28 0.02 0.00 0.50 0.00 0.00 46.19 47.04 1xtg s LEU 151 CO 0.56 -0.09 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.74 1xtg s VAL 152 N -0.27 0.81 -0.23 1.68 1.01 0.24 -1.41 120.40 122.24 1xtg s VAL 152 Ca -0.03 -0.26 -0.09 0.00 0.00 0.00 0.00 61.98 61.60 1xtg s VAL 152 Cb -0.02 -0.80 -0.04 0.00 0.00 0.00 0.00 36.38 35.52 1xtg s VAL 152 CO 0.00 0.29 0.11 -0.63 0.00 0.00 0.00 175.10 174.88 1xtg s ILE 153 N 0.96 4.93 0.15 2.22 -1.09 -0.40 -0.51 121.20 127.47 1xtg s ILE 153 Ca -0.10 0.03 0.05 0.00 -2.23 0.00 0.00 60.65 58.40 1xtg s ILE 153 Cb -0.15 -3.28 -0.04 0.00 -1.58 0.00 0.00 42.46 37.41 1xtg s ILE 153 CO 0.00 0.37 -0.11 -0.51 -1.23 0.00 0.00 174.94 173.46 1xtg s ILE 154 N 1.06 1.28 0.91 2.92 2.07 0.84 -0.83 121.20 129.45 1xtg s ILE 154 Ca 0.06 -2.06 -0.11 0.00 -1.41 0.00 0.00 60.65 57.13 1xtg s ILE 154 Cb -0.14 -1.85 0.14 0.00 0.13 0.00 0.00 42.46 40.74 1xtg s ILE 154 CO 0.04 -0.69 1.10 -0.83 -1.91 0.00 0.00 174.94 172.64 1xtg s GLY 155 N -3.13 1.64 0.96 1.50 0.00 0.25 -0.55 107.32 108.00 1xtg s GLY 155 Ca 0.17 0.18 -0.12 0.00 0.00 0.00 0.00 44.72 44.95 1xtg s GLY 155 CO 0.02 0.65 1.10 2.56 0.00 0.00 0.00 173.10 177.43 1xtg s PRO 156 N -4.78 0.71 0.00 2.90 0.04 -1.25 -2.16 135.00 130.45 1xtg s PRO 156 Ca 0.64 0.54 0.00 0.00 0.04 0.00 0.00 61.00 62.22 1xtg s PRO 156 Cb -0.20 -1.77 0.00 0.00 0.04 0.00 0.00 34.50 32.57 1xtg s PRO 156 CO 0.58 -2.54 0.00 0.45 0.04 0.00 0.00 177.00 175.53 1xtg n SER 157 N -4.05 0.00 -0.09 6.66 2.88 -1.26 -1.21 113.62 116.55 1xtg n SER 157 Ca 0.06 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.48 1xtg n SER 157 Cb 0.57 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.97 1xtg n SER 157 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1xtg h ALA 158 N -1.42 -0.56 -1.55 -1.46 0.00 -1.84 -3.33 119.26 109.11 1xtg h ALA 158 Ca 0.00 0.03 -0.55 0.00 0.00 0.00 0.00 54.91 54.39 1xtg h ALA 158 Cb 0.00 0.92 -0.07 0.00 0.00 0.00 0.00 17.79 18.64 1xtg h ALA 158 CO 0.00 -0.93 1.06 0.34 0.00 0.00 0.00 179.25 179.72 1xtg s ASP 159 N -5.00 6.23 0.47 0.00 -1.08 -1.26 -4.46 116.67 111.57 1xtg s ASP 159 Ca -0.15 0.11 0.21 0.00 -0.52 0.00 0.00 52.55 52.20 1xtg s ASP 159 Cb 0.10 -2.55 1.23 0.00 -1.46 0.00 0.00 42.92 40.24 1xtg s ASP 159 CO 0.64 -1.66 1.93 0.40 0.52 0.00 0.00 175.17 177.00 1xtg h ILE 160 N 6.25 0.72 -0.59 4.11 2.04 -0.86 -1.91 117.51 127.28 1xtg h ILE 160 Ca -0.26 -0.08 0.00 0.00 1.00 0.00 0.00 64.86 65.52 1xtg h ILE 160 Cb 1.07 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 37.63 1xtg h ILE 160 CO 1.20 0.04 0.00 2.30 0.00 0.00 0.00 178.15 181.69 1xtg n ILE 161 N -4.42 1.70 -2.82 -0.67 -5.35 -1.26 -4.74 119.36 101.81 1xtg n ILE 161 Ca 0.14 -1.22 -0.43 0.00 -0.27 0.00 0.00 62.75 60.98 1xtg n ILE 161 Cb 0.64 0.17 -0.03 0.00 -1.74 0.00 0.00 39.64 38.69 1xtg n ILE 161 CO 0.00 0.00 0.00 -1.58 -1.76 0.00 0.00 176.55 173.21 1xtg s GLN 162 N -1.75 3.48 -0.07 6.28 0.74 -0.72 -4.99 119.66 122.63 1xtg s GLN 162 Ca 0.47 -1.36 -0.12 0.00 0.05 0.00 0.00 55.36 54.40 1xtg s GLN 162 Cb 0.30 -4.84 -0.05 0.00 1.10 0.00 0.00 33.01 29.52 1xtg s GLN 162 CO 0.23 -1.89 0.31 -0.06 -0.55 0.00 0.00 175.29 173.32 1xtg s PHE 163 N 3.61 3.64 0.29 1.67 0.08 -1.26 -4.75 117.98 121.25 1xtg s PHE 163 Ca 0.34 0.78 -0.14 0.00 0.12 0.00 0.00 56.93 58.02 1xtg s PHE 163 Cb -0.06 -2.20 0.01 0.00 -0.57 0.00 0.00 43.02 40.20 1xtg s PHE 163 CO -0.05 0.59 0.59 -1.83 -0.10 0.00 0.00 175.22 174.42 1xtg s GLU 164 N -0.74 1.78 -0.23 0.44 -1.05 -1.10 -4.98 118.70 112.81 1xtg s GLU 164 Ca 0.20 -1.29 -0.00 0.00 -0.15 0.00 0.00 54.97 53.72 1xtg s GLU 164 Cb -0.15 0.53 0.06 0.00 -0.44 0.00 0.00 34.13 34.13 1xtg s GLU 164 CO 0.09 -0.78 -0.02 0.00 0.95 0.00 0.00 175.26 175.50 1xtg s LYS 166 N 1.53 1.81 0.21 0.00 -2.85 0.23 -4.93 119.74 115.73 1xtg s LYS 166 Ca -0.04 -2.02 -0.19 0.00 -1.00 0.00 0.00 55.97 52.72 1xtg s LYS 166 Cb -0.18 -1.23 0.03 0.00 -2.06 0.00 0.00 37.83 34.39 1xtg s LYS 166 CO -0.07 -0.13 0.58 -1.54 0.10 0.00 0.00 175.35 174.29 1xtg s SER 167 N -3.60 -0.32 0.05 0.03 1.04 -1.26 0.15 113.70 109.78 1xtg s SER 167 Ca 0.35 -0.42 -0.26 0.00 0.48 0.00 0.00 55.95 56.10 1xtg s SER 167 Cb 0.09 0.62 -0.05 0.00 0.10 0.00 0.00 66.02 66.78 1xtg s SER 167 CO 0.16 -1.11 0.83 -0.36 0.98 0.00 0.00 173.24 173.74 1xtg s PHE 168 N -3.86 3.74 0.55 5.02 0.08 -1.26 -5.05 117.98 117.20 1xtg s PHE 168 Ca 0.08 1.55 0.01 0.00 0.12 0.00 0.00 56.93 58.70 1xtg s PHE 168 Cb -0.02 -2.90 0.03 0.00 -0.57 0.00 0.00 43.02 39.56 1xtg s PHE 168 CO -0.02 0.22 0.78 0.20 -0.10 0.00 0.00 175.22 176.30 1xtg s GLY 169 N 0.11 1.82 0.17 4.36 0.00 -1.26 -4.93 107.32 107.59 1xtg s GLY 169 Ca 0.42 -1.31 -0.01 0.00 0.00 0.00 0.00 44.72 43.82 1xtg s GLY 169 CO 0.25 -1.03 0.35 -1.58 0.00 0.00 0.00 173.10 171.09 1xtg s HIS 170 N -2.77 3.49 0.46 1.90 2.46 -1.25 -5.00 115.29 114.57 1xtg s HIS 170 Ca 0.57 0.32 0.19 0.00 0.47 0.00 0.00 55.06 56.61 1xtg s HIS 170 Cb -0.10 -1.83 1.21 0.00 -0.13 0.00 0.00 32.58 31.73 1xtg s HIS 170 CO 0.39 0.43 2.05 0.93 -2.47 0.00 0.00 174.74 176.06 1xtg h GLU 171 N 2.24 0.00 0.00 2.88 5.08 -2.06 -3.37 114.58 119.35 1xtg h GLU 171 Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 1xtg h GLU 171 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1xtg h GLU 171 CO 0.69 0.14 -0.82 0.28 -1.00 0.00 0.00 179.01 178.30 1xtg n VAL 172 N -4.11 0.00 -2.40 3.13 0.31 -1.26 -5.08 118.33 108.93 1xtg n VAL 172 Ca -0.02 0.00 -0.35 0.00 -0.01 0.00 0.00 64.34 63.96 1xtg n VAL 172 Cb 0.22 -0.82 -0.02 0.00 -0.91 0.00 0.00 33.84 32.31 1xtg n VAL 172 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1xtg s LEU 173 N -5.17 3.82 -0.99 7.52 1.43 -1.26 -4.98 118.68 119.05 1xtg s LEU 173 Ca 0.00 2.07 -0.04 0.00 -1.03 0.00 0.00 54.13 55.12 1xtg s LEU 173 Cb 0.00 -4.54 0.25 0.00 0.03 0.00 0.00 46.19 41.93 1xtg s LEU 173 CO 0.00 -0.97 0.96 0.59 0.23 0.00 0.00 176.35 177.16 1xtg n ASN 174 N -1.05 4.85 -0.32 2.29 5.03 -1.26 -3.93 115.26 120.87 1xtg n ASN 174 Ca 0.10 -3.13 0.15 0.00 0.87 0.00 0.00 54.58 52.57 1xtg n ASN 174 Cb 0.51 -1.17 0.39 0.00 -1.02 0.00 0.00 39.78 38.48 1xtg n ASN 174 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.26 175.36 1xtg h LEU 175 N 6.11 0.66 0.00 3.41 3.38 -1.94 -0.99 115.31 125.95 1xtg h LEU 175 Ca 0.17 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1xtg h LEU 175 Cb 0.81 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.52 1xtg h LEU 175 CO 0.96 0.24 0.00 0.35 0.09 0.00 0.00 178.44 180.07 1xtg n THR 176 N -4.68 0.29 -0.70 0.22 -2.24 -1.26 -1.23 114.28 104.68 1xtg n THR 176 Ca 0.22 0.07 0.01 0.00 -2.27 0.00 0.00 64.05 62.08 1xtg n THR 176 Cb 0.63 -0.67 0.01 0.00 -2.10 0.00 0.00 70.33 68.19 1xtg n THR 176 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1xtg n ARG 177 N -1.38 1.21 -0.21 -0.78 1.74 -0.46 -1.64 116.66 115.14 1xtg n ARG 177 Ca 0.09 -1.04 0.08 0.00 -0.77 0.00 0.00 57.85 56.21 1xtg n ARG 177 Cb 0.23 -0.75 0.17 0.00 -1.02 0.00 0.00 32.46 31.09 1xtg n ARG 177 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 1xtg n ASN 178 N -0.27 2.93 0.00 0.55 6.94 -0.69 -4.82 115.26 119.89 1xtg n ASN 178 Ca 0.01 -2.81 0.00 0.00 -0.02 0.00 0.00 54.58 51.76 1xtg n ASN 178 Cb 0.43 -0.40 0.00 0.00 -2.36 0.00 0.00 39.78 37.45 1xtg n ASN 178 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1xtg n GLY 179 N -0.77 2.86 0.07 4.83 0.00 -0.10 -4.82 105.19 107.26 1xtg n GLY 179 Ca 0.15 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.05 1xtg n GLY 179 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1xtg h TYR 180 N 0.00 -0.05 0.00 1.61 -1.99 -1.78 -3.36 116.97 111.41 1xtg h TYR 180 Ca 0.00 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1xtg h TYR 180 Cb 0.00 0.02 0.00 0.00 2.00 0.00 0.00 36.73 38.75 1xtg h TYR 180 CO 0.00 0.28 0.00 0.41 -0.00 0.00 0.00 178.16 178.85 1xtg n GLY 181 N -0.23 -1.04 3.43 3.88 0.00 -0.36 -0.97 105.19 109.90 1xtg n GLY 181 Ca -0.08 -1.61 -0.14 0.00 0.00 0.00 0.00 46.02 44.19 1xtg n GLY 181 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xtg s SER 182 N -2.89 -0.53 0.17 1.61 1.04 -1.22 -4.25 113.70 107.63 1xtg s SER 182 Ca 0.00 0.21 -0.32 0.00 0.48 0.00 0.00 55.95 56.31 1xtg s SER 182 Cb 0.00 0.54 -0.12 0.00 0.10 0.00 0.00 66.02 66.54 1xtg s SER 182 CO 0.00 -0.79 1.72 0.41 0.98 0.00 0.00 173.24 175.56 1xtg n THR 183 N 0.19 0.10 -3.88 2.02 -1.04 -1.26 -4.49 114.28 105.91 1xtg n THR 183 Ca -0.18 -0.02 -0.37 0.00 -2.04 0.00 0.00 64.05 61.45 1xtg n THR 183 Cb 0.61 -1.92 -0.06 0.00 -1.82 0.00 0.00 70.33 67.14 1xtg n THR 183 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 1xtg s GLN 184 N 1.54 3.51 -0.21 -2.82 -1.52 -0.15 -4.39 119.66 115.63 1xtg s GLN 184 Ca 0.78 -0.15 -0.01 0.00 -1.95 0.00 0.00 55.36 54.03 1xtg s GLN 184 Cb -0.54 -3.20 0.01 0.00 -0.22 0.00 0.00 33.01 29.06 1xtg s GLN 184 CO 0.35 0.72 -0.12 0.71 -0.25 0.00 0.00 175.29 176.70 1xtg s TYR 185 N -0.86 2.90 -0.23 0.91 1.51 0.12 -0.59 117.35 121.12 1xtg s TYR 185 Ca 0.14 -1.39 -0.05 0.00 -1.01 0.00 0.00 57.07 54.76 1xtg s TYR 185 Cb -0.12 -2.01 -0.02 0.00 -0.11 0.00 0.00 41.96 39.70 1xtg s TYR 185 CO 0.03 -0.70 -0.00 0.42 -1.11 0.00 0.00 175.55 174.19 1xtg s ILE 186 N 1.36 3.76 -0.22 2.71 1.01 0.34 -0.60 121.20 129.56 1xtg s ILE 186 Ca 0.04 -0.36 -0.24 0.00 0.00 0.00 0.00 60.65 60.09 1xtg s ILE 186 Cb -0.14 -2.73 -0.01 0.00 0.01 0.00 0.00 42.46 39.59 1xtg s ILE 186 CO -0.08 0.40 0.81 -0.13 0.00 0.00 0.00 174.94 175.94 1xtg s ARG 187 N 1.43 4.21 0.09 2.79 0.52 -0.60 -0.12 118.95 127.28 1xtg s ARG 187 Ca 0.05 0.93 -0.19 0.00 -0.52 0.00 0.00 55.73 56.00 1xtg s ARG 187 Cb -0.15 -3.62 0.04 0.00 0.52 0.00 0.00 34.95 31.75 1xtg s ARG 187 CO -0.00 -0.45 0.46 0.12 0.02 0.00 0.00 175.30 175.45 1xtg s PHE 188 N 2.59 -0.32 -0.09 -0.53 5.36 0.29 -2.71 117.98 122.58 1xtg s PHE 188 Ca 0.35 0.18 -0.04 0.00 -0.96 0.00 0.00 56.93 56.46 1xtg s PHE 188 Cb -0.16 0.31 0.04 0.00 -0.34 0.00 0.00 43.02 42.88 1xtg s PHE 188 CO 0.09 -0.68 0.19 0.45 -1.46 0.00 0.00 175.22 173.82 1xtg s SER 189 N -2.39 -0.16 0.00 6.13 0.15 -1.26 -3.96 113.70 112.21 1xtg s SER 189 Ca -0.01 0.41 0.26 0.00 0.70 0.00 0.00 55.95 57.30 1xtg s SER 189 Cb 0.00 0.30 0.82 0.00 -1.71 0.00 0.00 66.02 65.44 1xtg s SER 189 CO -0.07 -0.16 1.61 -0.81 1.20 0.00 0.00 173.24 175.01 1xtg n PRO 190 N 4.26 1.82 0.00 5.44 -0.04 -1.26 -4.18 135.00 141.04 1xtg n PRO 190 Ca -0.25 -1.21 0.13 0.00 -0.04 0.00 0.00 63.50 62.13 1xtg n PRO 190 Cb 0.52 -1.46 0.37 0.00 -0.04 0.00 0.00 33.50 32.89 1xtg n PRO 190 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1xtg n ASP 191 N 0.45 1.88 -4.08 3.54 8.00 -1.26 -4.63 116.55 120.45 1xtg n ASP 191 Ca 0.18 -1.56 -0.09 0.00 0.71 0.00 0.00 54.79 54.02 1xtg n ASP 191 Cb 0.40 0.04 -0.09 0.00 -0.02 0.00 0.00 41.12 41.45 1xtg n ASP 191 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1xtg s PHE 192 N -2.08 0.65 0.24 1.24 0.40 -1.26 -1.50 117.98 115.66 1xtg s PHE 192 Ca 0.33 -1.06 -0.20 0.00 -0.60 0.00 0.00 56.93 55.40 1xtg s PHE 192 Cb 0.20 -0.35 0.03 0.00 0.51 0.00 0.00 43.02 43.41 1xtg s PHE 192 CO 0.36 -0.53 0.64 -0.08 0.70 0.00 0.00 175.22 176.31 1xtg s THR 193 N -3.99 0.00 0.31 0.64 -1.32 -0.67 -4.89 115.64 105.74 1xtg s THR 193 Ca 0.17 -0.84 -0.02 0.00 -1.21 0.00 0.00 61.69 59.80 1xtg s THR 193 Cb 0.07 -1.78 -0.04 0.00 -1.51 0.00 0.00 72.50 69.24 1xtg s THR 193 CO -0.02 -0.02 0.54 -0.36 -2.21 0.00 0.00 174.62 172.54 1xtg s PHE 194 N -3.89 3.49 -0.07 9.09 0.40 -1.26 -0.90 117.98 124.84 1xtg s PHE 194 Ca 0.10 0.48 0.03 0.00 -0.60 0.00 0.00 56.93 56.94 1xtg s PHE 194 Cb -0.04 -1.98 -0.02 0.00 0.51 0.00 0.00 43.02 41.49 1xtg s PHE 194 CO 0.02 0.16 -0.17 0.20 0.70 0.00 0.00 175.22 176.13 1xtg s GLY 195 N -3.60 1.47 0.18 4.36 0.00 0.15 -1.23 107.32 108.64 1xtg s GLY 195 Ca 0.41 -0.98 -0.03 0.00 0.00 0.00 0.00 44.72 44.12 1xtg s GLY 195 CO 0.33 -0.61 0.16 -0.11 0.00 0.00 0.00 173.10 172.88 1xtg s PHE 196 N -0.33 0.86 0.14 1.90 -0.71 0.42 0.14 117.98 120.40 1xtg s PHE 196 Ca 0.02 -1.17 0.08 0.00 -1.04 0.00 0.00 56.93 54.82 1xtg s PHE 196 Cb -0.13 -0.38 -0.04 0.00 -1.21 0.00 0.00 43.02 41.26 1xtg s PHE 196 CO 0.02 -0.65 -0.11 -1.21 -1.34 0.00 0.00 175.22 171.94 1xtg s GLU 197 N -4.08 2.06 0.49 1.99 0.41 -1.26 -1.64 118.70 116.67 1xtg s GLU 197 Ca 0.29 -1.15 -0.21 0.00 -0.41 0.00 0.00 54.97 53.48 1xtg s GLU 197 Cb 0.06 -2.22 -0.07 0.00 -1.78 0.00 0.00 34.13 30.12 1xtg s GLU 197 CO 0.06 0.47 1.12 -1.21 -0.49 0.00 0.00 175.26 175.21 1xtg s GLU 198 N -2.50 3.66 0.15 1.61 2.02 -1.26 -4.92 118.70 117.46 1xtg s GLU 198 Ca 0.23 1.62 -0.34 0.00 0.02 0.00 0.00 54.97 56.51 1xtg s GLU 198 Cb -0.10 -2.22 -0.17 0.00 0.10 0.00 0.00 34.13 31.74 1xtg s GLU 198 CO 0.14 -0.60 1.08 0.45 0.02 0.00 0.00 175.26 176.35 1xtg n SER 199 N -0.82 0.84 -4.68 -0.19 2.88 -1.26 -4.85 113.62 105.54 1xtg n SER 199 Ca 0.09 1.14 -0.44 0.00 -1.33 0.00 0.00 58.87 58.34 1xtg n SER 199 Cb 0.50 -1.14 -0.02 0.00 -0.75 0.00 0.00 64.21 62.81 1xtg n SER 199 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1xtg n LEU 200 N 1.95 3.29 0.00 2.46 4.77 -1.26 -4.84 117.00 123.37 1xtg n LEU 200 Ca 0.16 1.18 0.05 0.00 -0.03 0.00 0.00 56.01 57.37 1xtg n LEU 200 Cb 0.22 -1.45 0.29 0.00 -2.33 0.00 0.00 43.42 40.15 1xtg n LEU 200 CO 0.60 -0.51 0.60 -0.62 -1.33 0.00 0.00 177.39 176.13 1xtg n GLU 201 N 1.24 0.79 -1.03 3.23 1.02 -1.26 -4.82 120.64 119.80 1xtg n GLU 201 Ca 0.08 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.18 1xtg n GLU 201 Cb 0.34 -1.20 -0.02 0.00 -0.02 0.00 0.00 31.44 30.55 1xtg n GLU 201 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1xtg n VAL 202 N -0.70 0.00 -3.55 2.62 0.31 -1.26 -4.89 118.33 110.87 1xtg n VAL 202 Ca 0.07 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.32 1xtg n VAL 202 Cb 0.03 -1.09 -0.09 0.00 -0.91 0.00 0.00 33.84 31.79 1xtg n VAL 202 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1xtg s ASP 203 N -1.97 -0.12 -0.29 4.52 1.01 -1.26 -5.03 116.67 113.53 1xtg s ASP 203 Ca 0.00 0.75 -0.09 0.00 0.71 0.00 0.00 52.55 53.91 1xtg s ASP 203 Cb 0.00 1.29 0.01 0.00 1.01 0.00 0.00 42.92 45.23 1xtg s ASP 203 CO 0.00 -0.25 0.24 0.41 0.21 0.00 0.00 175.17 175.77 1xtg n THR 204 N 5.38 -8.44 -2.95 -1.27 -1.04 -1.26 -5.04 114.28 99.66 1xtg n THR 204 Ca -0.07 1.08 -0.01 0.00 -2.04 0.00 0.00 64.05 63.02 1xtg n THR 204 Cb 0.50 -5.66 0.00 0.00 -1.82 0.00 0.00 70.33 63.34 1xtg n THR 204 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1xtg s ASN 205 N -1.70 -1.16 -0.41 8.00 3.84 -1.26 -4.96 114.94 117.29 1xtg s ASN 205 Ca 0.11 -0.87 -0.32 0.00 0.21 0.00 0.00 52.86 51.99 1xtg s ASN 205 Cb -0.02 1.50 -0.11 0.00 -0.55 0.00 0.00 41.25 42.07 1xtg s ASN 205 CO 0.62 -0.10 2.28 -2.65 -2.79 0.00 0.00 177.10 174.46 1xtg n PRO 206 N 3.71 1.10 0.00 0.43 -0.02 -1.26 -4.78 135.00 134.18 1xtg n PRO 206 Ca 0.12 0.25 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 1xtg n PRO 206 Cb 0.59 -2.65 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 1xtg n PRO 206 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1xtg n LEU 207 N 11.17 0.00 -3.57 2.45 4.77 -1.26 -4.04 117.00 126.52 1xtg n LEU 207 Ca 0.41 0.22 -0.40 0.00 -0.03 0.00 0.00 56.01 56.21 1xtg n LEU 207 Cb 0.29 -0.22 -0.04 0.00 -2.33 0.00 0.00 43.42 41.12 1xtg n LEU 207 CO 0.75 -0.22 2.23 0.18 -1.33 0.00 0.00 177.39 179.01 1xtg n LEU 208 N -1.21 4.59 0.00 2.23 4.77 -1.26 -4.79 117.00 121.33 1xtg n LEU 208 Ca 0.00 -3.05 0.00 0.00 -0.03 0.00 0.00 56.01 52.93 1xtg n LEU 208 Cb 0.26 -1.18 0.00 0.00 -2.33 0.00 0.00 43.42 40.17 1xtg n LEU 208 CO 0.00 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.64 1xtg n GLY 209 N 4.36 5.78 0.67 -0.72 0.00 -1.26 -5.11 105.19 108.91 1xtg n GLY 209 Ca 0.49 -1.99 -0.03 0.00 0.00 0.00 0.00 46.02 44.50 1xtg n GLY 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xtg n ALA 210 N -3.00 2.08 -2.25 4.61 0.00 -1.26 -5.06 120.51 115.63 1xtg n ALA 210 Ca 0.00 -0.30 -0.02 0.00 0.00 0.00 0.00 53.44 53.12 1xtg n ALA 210 Cb 0.00 -0.18 0.01 0.00 0.00 0.00 0.00 19.45 19.28 1xtg n ALA 210 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xtg n GLY 211 N 0.00 -0.54 0.24 0.00 0.00 -1.26 -4.44 105.19 99.18 1xtg n GLY 211 Ca -0.12 0.12 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 1xtg n GLY 211 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1xtg h LYS 212 N 0.01 0.48 -6.01 1.61 3.64 -1.86 -3.33 116.57 111.11 1xtg h LYS 212 Ca -0.08 -0.18 -0.61 0.00 -1.27 0.00 0.00 60.65 58.51 1xtg h LYS 212 Cb 1.04 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.78 1xtg h LYS 212 CO 0.16 0.70 -0.21 -0.06 -2.27 0.00 0.00 179.45 177.77 1xtg s PHE 213 N -4.49 3.72 -0.13 1.91 0.08 -0.65 -1.20 117.98 117.22 1xtg s PHE 213 Ca -0.07 0.98 -0.09 0.00 0.12 0.00 0.00 56.93 57.87 1xtg s PHE 213 Cb 0.14 -2.28 -0.05 0.00 -0.57 0.00 0.00 43.02 40.26 1xtg s PHE 213 CO 0.79 0.64 0.19 0.00 -0.10 0.00 0.00 175.22 176.74 1xtg s ALA 214 N -1.09 3.78 0.30 5.36 0.00 0.64 -0.44 121.76 130.30 1xtg s ALA 214 Ca 0.24 -0.58 -0.29 0.00 0.00 0.00 0.00 51.96 51.33 1xtg s ALA 214 Cb -0.17 -2.12 -0.10 0.00 0.00 0.00 0.00 23.12 20.74 1xtg s ALA 214 CO 0.13 0.42 1.13 0.99 0.00 0.00 0.00 175.76 178.43 1xtg s THR 215 N -0.50 3.38 -0.13 0.00 2.01 -0.37 -4.83 115.64 115.21 1xtg s THR 215 Ca 0.14 1.35 -0.29 0.00 0.31 0.00 0.00 61.69 63.20 1xtg s THR 215 Cb -0.12 -3.84 -0.02 0.00 0.01 0.00 0.00 72.50 68.53 1xtg s THR 215 CO 0.03 0.29 1.15 -0.62 -0.69 0.00 0.00 174.62 174.79 1xtg s ASP 216 N -0.90 7.07 0.47 3.53 -1.08 -1.26 -4.62 116.67 119.88 1xtg s ASP 216 Ca 0.47 1.65 0.25 0.00 -0.52 0.00 0.00 52.55 54.39 1xtg s ASP 216 Cb -0.32 -2.55 1.28 0.00 -1.46 0.00 0.00 42.92 39.87 1xtg s ASP 216 CO 0.41 -0.62 1.85 -0.65 0.52 0.00 0.00 175.17 176.69 1xtg h PRO 217 N 7.58 0.21 -0.26 4.34 0.11 -1.93 -1.04 132.00 141.01 1xtg h PRO 217 Ca -0.29 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.78 1xtg h PRO 217 Cb 1.13 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1xtg h PRO 217 CO 0.92 0.14 0.02 0.00 -0.21 0.00 0.00 178.00 178.86 1xtg h ALA 218 N 1.58 1.56 -0.10 -0.75 0.00 -1.92 -1.33 119.26 118.28 1xtg h ALA 218 Ca 0.48 -0.14 -0.22 0.00 0.00 0.00 0.00 54.91 55.03 1xtg h ALA 218 Cb 1.51 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 19.20 1xtg h ALA 218 CO -0.12 0.33 -0.78 0.28 0.00 0.00 0.00 179.25 178.96 1xtg h VAL 219 N 0.37 1.30 -0.75 0.00 2.07 -1.59 -1.73 116.25 115.92 1xtg h VAL 219 Ca 0.09 -2.01 -0.02 0.00 0.82 0.00 0.00 66.70 65.58 1xtg h VAL 219 Cb 0.22 2.14 -0.03 0.00 -1.52 0.00 0.00 31.29 32.09 1xtg h VAL 219 CO 0.00 0.63 0.39 0.74 0.02 0.00 0.00 177.57 179.35 1xtg h THR 220 N 0.40 1.23 -0.28 2.57 2.02 -1.39 0.35 112.91 117.81 1xtg h THR 220 Ca -0.07 -0.61 -0.12 0.00 0.77 0.00 0.00 66.41 66.38 1xtg h THR 220 Cb 1.42 0.27 -0.00 0.00 -1.74 0.00 0.00 68.15 68.09 1xtg h THR 220 CO 0.16 0.26 -0.30 0.25 0.37 0.00 0.00 175.52 176.27 1xtg h LEU 221 N 1.04 0.75 -0.96 2.58 5.85 -1.26 -2.78 115.31 120.52 1xtg h LEU 221 Ca 0.26 -0.48 0.06 0.00 0.84 0.00 0.00 57.88 58.56 1xtg h LEU 221 Cb 0.07 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 40.83 1xtg h LEU 221 CO -0.04 1.07 0.62 0.00 -0.34 0.00 0.00 178.44 179.75 1xtg h ALA 222 N 0.70 1.32 -0.19 1.25 0.00 -0.98 -0.52 119.26 120.83 1xtg h ALA 222 Ca 0.04 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.97 1xtg h ALA 222 Cb 0.87 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 1xtg h ALA 222 CO 0.07 0.42 -0.07 1.25 0.00 0.00 0.00 179.25 180.92 1xtg h HIS 223 N 1.14 -0.17 -0.36 0.00 -0.00 -0.74 -0.44 115.15 114.58 1xtg h HIS 223 Ca 0.41 0.02 -0.09 0.00 -0.00 0.00 0.00 60.37 60.71 1xtg h HIS 223 Cb 0.13 0.10 -0.02 0.00 -0.00 0.00 0.00 27.41 27.63 1xtg h HIS 223 CO -0.01 -0.12 -0.16 1.96 -0.00 0.00 0.00 177.93 179.60 1xtg h GLN 224 N -0.04 0.66 -0.12 5.26 1.08 -1.11 -2.76 115.11 118.07 1xtg h GLN 224 Ca 0.10 -0.22 -0.05 0.00 -1.45 0.00 0.00 58.65 57.03 1xtg h GLN 224 Cb 0.19 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.56 1xtg h GLN 224 CO -0.22 0.79 -0.13 -0.07 -0.95 0.00 0.00 178.83 178.24 1xtg h LEU 225 N 0.59 0.18 -0.51 1.46 3.38 -0.39 -0.92 115.31 119.11 1xtg h LEU 225 Ca 0.10 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1xtg h LEU 225 Cb 0.61 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 1xtg h LEU 225 CO 0.04 0.34 0.04 0.40 0.09 0.00 0.00 178.44 179.35 1xtg h ILE 226 N 0.19 1.26 -0.36 1.22 2.04 -0.82 0.92 117.51 121.96 1xtg h ILE 226 Ca 0.04 -1.02 -0.00 0.00 1.00 0.00 0.00 64.86 64.88 1xtg h ILE 226 Cb 0.35 0.92 -0.02 0.00 -0.74 0.00 0.00 36.82 37.34 1xtg h ILE 226 CO 0.02 0.36 0.21 0.45 0.00 0.00 0.00 178.15 179.19 1xtg h HIS 227 N 0.74 0.49 -0.83 1.37 3.86 -1.24 -1.70 115.15 117.84 1xtg h HIS 227 Ca 0.15 -0.01 0.07 0.00 -1.16 0.00 0.00 60.37 59.42 1xtg h HIS 227 Cb 0.46 -0.16 -0.06 0.00 1.06 0.00 0.00 27.41 28.71 1xtg h HIS 227 CO 0.03 0.36 0.50 0.00 0.86 0.00 0.00 177.93 179.69 1xtg h ALA 228 N 1.08 1.15 -0.12 2.45 0.00 -0.82 0.13 119.26 123.14 1xtg h ALA 228 Ca 0.13 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.06 1xtg h ALA 228 Cb 0.03 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1xtg h ALA 228 CO -0.02 0.21 0.01 0.78 0.00 0.00 0.00 179.25 180.22 1xtg h GLY 229 N 0.89 0.11 0.96 0.00 0.00 -0.13 0.23 103.07 105.14 1xtg h GLY 229 Ca 0.37 0.01 0.01 0.00 0.00 0.00 0.00 47.33 47.72 1xtg h GLY 229 CO -0.19 -0.01 0.41 0.45 0.00 0.00 0.00 176.54 177.20 1xtg h HIS 230 N 0.05 0.78 0.00 5.60 3.86 -0.66 -2.66 115.15 122.12 1xtg h HIS 230 Ca 0.05 0.02 -0.11 0.00 -1.16 0.00 0.00 60.37 59.17 1xtg h HIS 230 Cb 0.06 -0.26 -0.02 0.00 1.06 0.00 0.00 27.41 28.25 1xtg h HIS 230 CO -0.13 0.48 -0.52 0.00 0.86 0.00 0.00 177.93 178.62 1xtg h ARG 231 N 0.84 0.00 0.00 2.45 3.08 -0.56 -0.49 114.38 119.70 1xtg h ARG 231 Ca 0.24 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 60.16 1xtg h ARG 231 Cb -0.06 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 1xtg h ARG 231 CO -0.07 0.52 -0.62 -0.07 -1.07 0.00 0.00 179.97 178.65 1xtg h LEU 232 N 0.00 0.00 -1.84 3.04 3.38 -0.29 -2.84 115.31 116.76 1xtg h LEU 232 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1xtg h LEU 232 Cb 1.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.75 1xtg h LEU 232 CO 0.07 0.62 0.00 -1.22 0.09 0.00 0.00 178.44 178.00 1xtg n TYR 233 N -3.58 0.44 -2.42 1.13 4.02 -1.03 -3.75 117.16 111.97 1xtg n TYR 233 Ca -0.00 -0.22 -0.18 0.00 -0.01 0.00 0.00 57.90 57.48 1xtg n TYR 233 Cb 0.67 0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 39.98 1xtg n TYR 233 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1xtg n GLY 234 N 1.35 -0.38 0.52 2.72 0.00 -0.88 -4.18 105.19 104.34 1xtg n GLY 234 Ca 0.18 -0.10 0.08 0.00 0.00 0.00 0.00 46.02 46.18 1xtg n GLY 234 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1xtg n ILE 235 N -4.06 2.13 -2.17 -0.61 -5.35 -0.24 -0.92 119.36 108.13 1xtg n ILE 235 Ca -0.20 -2.21 -0.41 0.00 -0.27 0.00 0.00 62.75 59.66 1xtg n ILE 235 Cb 0.66 -0.25 -0.03 0.00 -1.74 0.00 0.00 39.64 38.28 1xtg n ILE 235 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1xtg s ALA 236 N -2.91 3.50 0.18 -1.28 0.00 -0.65 -4.94 121.76 115.65 1xtg s ALA 236 Ca 0.38 1.20 -0.30 0.00 0.00 0.00 0.00 51.96 53.23 1xtg s ALA 236 Cb 0.32 -3.46 -0.08 0.00 0.00 0.00 0.00 23.12 19.90 1xtg s ALA 236 CO 0.04 -0.57 1.18 0.42 0.00 0.00 0.00 175.76 176.84 1xtg s ILE 237 N -0.87 3.63 0.02 0.00 1.01 -1.26 -4.59 121.20 119.14 1xtg s ILE 237 Ca 0.50 1.37 -0.37 0.00 0.00 0.00 0.00 60.65 62.14 1xtg s ILE 237 Cb -0.38 -3.87 -0.17 0.00 0.01 0.00 0.00 42.46 38.05 1xtg s ILE 237 CO 0.48 0.22 1.41 -3.20 0.00 0.00 0.00 174.94 173.85 1xtg n ASN 238 N 2.56 1.77 0.00 3.58 4.05 -1.26 -4.63 115.26 121.32 1xtg n ASN 238 Ca 0.04 1.11 0.03 0.00 0.45 0.00 0.00 54.58 56.22 1xtg n ASN 238 Cb 0.45 -1.18 0.16 0.00 1.23 0.00 0.00 39.78 40.43 1xtg n ASN 238 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 177.26 173.40 1xtg n PRO 239 N 3.03 0.06 0.18 1.20 -0.04 -1.26 -1.17 135.00 137.00 1xtg n PRO 239 Ca 0.20 0.29 0.06 0.00 -0.04 0.00 0.00 63.50 64.01 1xtg n PRO 239 Cb 0.18 -1.50 0.24 0.00 -0.04 0.00 0.00 33.50 32.38 1xtg n PRO 239 CO 0.00 0.00 0.00 -2.95 -0.04 0.00 0.00 175.50 172.51 1xtg h ASN 240 N 0.00 0.00 -3.64 3.54 -1.07 -2.03 -3.41 115.58 108.98 1xtg h ASN 240 Ca 0.00 0.00 -0.58 0.00 0.07 0.00 0.00 56.30 55.79 1xtg h ASN 240 Cb 0.08 0.00 -0.08 0.00 -2.07 0.00 0.00 38.32 36.25 1xtg h ASN 240 CO 0.00 0.37 0.80 -0.13 0.07 0.00 0.00 177.43 178.54 1xtg s ARG 241 N -3.33 3.62 0.14 4.14 1.81 -0.32 -4.99 118.95 120.02 1xtg s ARG 241 Ca 0.02 0.36 0.02 0.00 -1.72 0.00 0.00 55.73 54.41 1xtg s ARG 241 Cb 0.09 -3.93 -0.04 0.00 -0.45 0.00 0.00 34.95 30.62 1xtg s ARG 241 CO 0.69 -1.36 -0.03 0.14 -0.68 0.00 0.00 175.30 174.06 1xtg s VAL 242 N 4.25 0.73 -0.20 3.52 -7.23 -1.26 -1.35 120.40 118.86 1xtg s VAL 242 Ca 0.43 -1.97 -0.02 0.00 -1.81 0.00 0.00 61.98 58.61 1xtg s VAL 242 Cb -0.08 -1.94 0.00 0.00 0.56 0.00 0.00 36.38 34.93 1xtg s VAL 242 CO 0.29 -0.65 -0.12 0.12 -0.31 0.00 0.00 175.10 174.44 1xtg s PHE 243 N -3.61 2.87 -0.02 2.82 5.36 0.12 -4.87 117.98 120.65 1xtg s PHE 243 Ca 0.19 -1.23 -0.24 0.00 -0.96 0.00 0.00 56.93 54.70 1xtg s PHE 243 Cb 0.05 -2.01 -0.05 0.00 -0.34 0.00 0.00 43.02 40.68 1xtg s PHE 243 CO 0.00 -0.64 0.71 0.15 -1.46 0.00 0.00 175.22 173.98 1xtg s LYS 244 N 1.34 4.44 -0.04 10.12 3.01 -1.26 -1.40 119.74 135.94 1xtg s LYS 244 Ca 0.04 0.93 0.02 0.00 -1.01 0.00 0.00 55.97 55.96 1xtg s LYS 244 Cb -0.14 -3.40 0.01 0.00 -1.01 0.00 0.00 37.83 33.29 1xtg s LYS 244 CO -0.07 0.19 -0.11 0.08 0.51 0.00 0.00 175.35 175.96 1xtg s VAL 245 N 0.34 0.95 0.11 3.17 1.01 0.21 -4.97 120.40 121.22 1xtg s VAL 245 Ca 0.37 -0.42 -0.26 0.00 0.00 0.00 0.00 61.98 61.68 1xtg s VAL 245 Cb -0.19 -0.86 -0.07 0.00 0.00 0.00 0.00 36.38 35.26 1xtg s VAL 245 CO 0.20 0.30 0.80 0.21 0.00 0.00 0.00 175.10 176.61 1xtg s ASN 246 N 0.41 7.33 0.02 3.32 3.84 -1.26 0.13 114.94 128.72 1xtg s ASN 246 Ca -0.08 1.58 0.01 0.00 0.21 0.00 0.00 52.86 54.59 1xtg s ASN 246 Cb -0.12 -2.50 -0.01 0.00 -0.55 0.00 0.00 41.25 38.07 1xtg s ASN 246 CO 0.02 0.09 -0.05 0.28 -2.79 0.00 0.00 177.10 174.65 1xtg s THR 247 N -0.54 0.36 -0.45 -5.21 -1.32 -0.68 -4.88 115.64 102.92 1xtg s THR 247 Ca 0.38 -0.61 0.05 0.00 -1.21 0.00 0.00 61.69 60.30 1xtg s THR 247 Cb -0.22 -0.38 0.13 0.00 -1.51 0.00 0.00 72.50 70.51 1xtg s THR 247 CO 0.25 -0.17 1.07 0.59 -2.21 0.00 0.00 174.62 174.15 1xtg n ASN 248 N 2.22 2.31 0.23 8.08 3.02 -1.26 -4.23 115.26 125.64 1xtg n ASN 248 Ca -0.18 -1.91 0.09 0.00 -0.03 0.00 0.00 54.58 52.54 1xtg n ASN 248 Cb 0.57 -0.09 0.58 0.00 -0.61 0.00 0.00 39.78 40.22 1xtg n ASN 248 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xtg h ALA 249 N 0.93 1.33 -3.34 5.41 0.00 -1.95 -3.43 119.26 118.22 1xtg h ALA 249 Ca 0.00 -0.18 -0.40 0.00 0.00 0.00 0.00 54.91 54.33 1xtg h ALA 249 Cb 0.56 -0.03 -0.21 0.00 0.00 0.00 0.00 17.79 18.11 1xtg h ALA 249 CO 0.00 0.25 -0.77 0.71 0.00 0.00 0.00 179.25 179.44 1xtg s TYR 250 N -4.19 1.17 0.40 0.00 2.02 -1.26 -0.69 117.35 114.80 1xtg s TYR 250 Ca -0.03 -0.48 -0.26 0.00 -0.37 0.00 0.00 57.07 55.94 1xtg s TYR 250 Cb 0.13 -0.66 -0.09 0.00 -0.40 0.00 0.00 41.96 40.95 1xtg s TYR 250 CO 0.64 0.05 1.19 0.71 -1.57 0.00 0.00 175.55 176.57 1xtg s TYR 251 N -1.38 3.04 0.00 2.71 2.02 -0.52 -2.88 117.35 120.34 1xtg s TYR 251 Ca -0.02 1.53 0.00 0.00 -0.37 0.00 0.00 57.07 58.21 1xtg s TYR 251 Cb -0.09 -3.45 0.00 0.00 -0.40 0.00 0.00 41.96 38.02 1xtg s TYR 251 CO 0.02 -1.44 0.00 0.39 -1.57 0.00 0.00 175.55 172.95 1xtg n GLU 252 N 0.14 -0.91 -4.49 -0.62 4.71 -1.26 -4.69 120.64 113.52 1xtg n GLU 252 Ca 0.04 0.23 -0.29 0.00 -0.01 0.00 0.00 57.16 57.13 1xtg n GLU 252 Cb 0.46 -4.12 -0.13 0.00 -1.01 0.00 0.00 31.44 26.63 1xtg n GLU 252 CO 0.00 0.00 0.00 -1.64 0.09 0.00 0.00 177.13 175.58 1xtg s MET 253 N -1.09 1.46 0.00 3.49 -1.94 -1.14 -5.02 119.30 115.06 1xtg s MET 253 Ca 0.00 -1.29 0.00 0.00 -1.71 0.00 0.00 55.69 52.69 1xtg s MET 253 Cb 0.00 -1.88 0.00 0.00 2.01 0.00 0.00 34.83 34.96 1xtg s MET 253 CO 0.00 0.45 0.00 -1.13 -0.01 0.00 0.00 175.02 174.33 1xtg n SER 254 N 1.10 0.10 -3.25 3.03 3.41 -1.26 -4.71 113.62 112.04 1xtg n SER 254 Ca -0.18 -0.10 -0.12 0.00 -0.26 0.00 0.00 58.87 58.21 1xtg n SER 254 Cb 0.53 0.22 -0.02 0.00 -0.26 0.00 0.00 64.21 64.67 1xtg n SER 254 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1xtg s GLY 255 N -0.24 1.07 -0.05 5.00 0.00 -1.26 -1.69 107.32 110.15 1xtg s GLY 255 Ca 0.00 -1.23 -0.08 0.00 0.00 0.00 0.00 44.72 43.41 1xtg s GLY 255 CO 0.00 -0.77 0.20 -2.27 0.00 0.00 0.00 173.10 170.26 1xtg s LEU 256 N -3.17 1.26 -0.15 0.66 2.96 0.34 -4.75 118.68 115.84 1xtg s LEU 256 Ca 0.25 0.22 0.01 0.00 -0.22 0.00 0.00 54.13 54.40 1xtg s LEU 256 Cb -0.02 0.76 0.02 0.00 0.50 0.00 0.00 46.19 47.45 1xtg s LEU 256 CO 0.17 -0.19 -0.18 -0.70 -1.32 0.00 0.00 176.35 174.13 1xtg s GLU 257 N -0.43 2.69 -0.11 1.98 2.12 -1.26 0.66 118.70 124.35 1xtg s GLU 257 Ca -0.05 -0.72 0.02 0.00 0.36 0.00 0.00 54.97 54.58 1xtg s GLU 257 Cb -0.03 -2.31 0.01 0.00 0.26 0.00 0.00 34.13 32.05 1xtg s GLU 257 CO 0.01 -0.16 -0.18 0.14 -0.54 0.00 0.00 175.26 174.53 1xtg s VAL 258 N 1.20 1.68 0.62 3.70 -7.23 -0.49 -4.94 120.40 114.95 1xtg s VAL 258 Ca 0.01 -0.77 -0.17 0.00 -1.81 0.00 0.00 61.98 59.24 1xtg s VAL 258 Cb -0.14 -1.50 -0.02 0.00 0.56 0.00 0.00 36.38 35.28 1xtg s VAL 258 CO -0.08 0.48 1.15 -0.94 -0.31 0.00 0.00 175.10 175.39 1xtg s SER 259 N 0.78 5.15 0.40 4.85 1.04 -1.26 0.13 113.70 124.79 1xtg s SER 259 Ca -0.10 2.18 0.10 0.00 0.48 0.00 0.00 55.95 58.61 1xtg s SER 259 Cb -0.16 -2.57 0.84 0.00 0.10 0.00 0.00 66.02 64.23 1xtg s SER 259 CO 0.01 -1.61 1.95 -0.26 0.98 0.00 0.00 173.24 174.32 1xtg h PHE 260 N 0.48 0.24 -0.40 5.02 -1.00 -1.52 -1.97 116.94 117.79 1xtg h PHE 260 Ca -0.49 -0.02 0.04 0.00 2.81 0.00 0.00 57.97 60.32 1xtg h PHE 260 Cb 1.27 -0.07 -0.04 0.00 3.61 0.00 0.00 35.95 40.72 1xtg h PHE 260 CO 0.51 0.32 0.15 1.49 -1.61 0.00 0.00 178.31 179.18 1xtg h GLU 261 N 0.23 0.31 -0.08 1.51 4.22 -1.82 0.13 114.58 119.09 1xtg h GLU 261 Ca 0.05 -0.02 -0.00 0.00 0.08 0.00 0.00 59.36 59.47 1xtg h GLU 261 Cb 0.29 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.47 1xtg h GLU 261 CO 0.01 0.21 0.05 0.93 -2.18 0.00 0.00 179.01 178.03 1xtg h GLU 262 N 0.32 0.10 -0.83 1.92 4.39 -1.75 -0.22 114.58 118.52 1xtg h GLU 262 Ca 0.18 -0.01 0.02 0.00 0.34 0.00 0.00 59.36 59.89 1xtg h GLU 262 Cb 0.14 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 28.73 1xtg h GLU 262 CO -0.17 0.10 0.54 -0.07 -1.16 0.00 0.00 179.01 178.26 1xtg h LEU 263 N 0.08 0.93 -0.36 1.33 3.38 -0.91 -0.28 115.31 119.48 1xtg h LEU 263 Ca 0.03 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1xtg h LEU 263 Cb 0.02 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 1xtg h LEU 263 CO -0.01 0.66 0.16 -0.09 0.09 0.00 0.00 178.44 179.26 1xtg h ARG 264 N 1.10 0.52 -0.35 1.13 2.43 -0.50 -2.77 114.38 115.93 1xtg h ARG 264 Ca 0.31 -0.08 -0.05 0.00 -0.81 0.00 0.00 59.98 59.35 1xtg h ARG 264 Cb -0.08 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.36 1xtg h ARG 264 CO -0.08 0.49 -0.01 1.15 -1.51 0.00 0.00 179.97 180.01 1xtg h THR 265 N 0.43 1.21 -0.53 0.20 2.02 -0.43 -2.82 112.91 112.99 1xtg h THR 265 Ca 0.12 -0.83 -0.07 0.00 0.77 0.00 0.00 66.41 66.41 1xtg h THR 265 Cb 0.15 0.95 -0.02 0.00 -1.74 0.00 0.00 68.15 67.48 1xtg h THR 265 CO -0.01 0.28 0.08 -0.26 0.37 0.00 0.00 175.52 175.98 1xtg h PHE 266 N 0.53 0.94 -0.16 3.16 0.04 -0.93 -1.10 116.94 119.44 1xtg h PHE 266 Ca 0.11 -0.13 0.00 0.00 2.80 0.00 0.00 57.97 60.75 1xtg h PHE 266 Cb 0.35 -0.26 0.00 0.00 2.20 0.00 0.00 35.95 38.25 1xtg h PHE 266 CO 0.01 0.85 0.00 0.41 -0.60 0.00 0.00 178.31 178.98 1xtg n GLY 267 N -0.52 -0.60 7.00 -1.45 0.00 -1.06 -1.60 105.19 106.97 1xtg n GLY 267 Ca 0.02 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.92 1xtg n GLY 267 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xtg n GLY 268 N 0.00 2.57 0.07 -0.02 0.00 -1.26 -2.37 105.19 104.17 1xtg n GLY 268 Ca 0.00 -0.16 -0.12 0.00 0.00 0.00 0.00 46.02 45.74 1xtg n GLY 268 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1xtg h HIS 269 N 0.00 0.08 -0.84 1.61 -0.00 -1.92 -3.27 115.15 110.81 1xtg h HIS 269 Ca 0.00 -0.01 0.11 0.00 -0.00 0.00 0.00 60.37 60.47 1xtg h HIS 269 Cb 0.00 -0.02 -0.06 0.00 -0.00 0.00 0.00 27.41 27.33 1xtg h HIS 269 CO 0.00 0.27 0.55 -0.44 -0.00 0.00 0.00 177.93 178.31 1xtg h ASP 270 N -0.14 0.68 0.39 3.26 3.32 -1.81 -1.02 116.42 121.10 1xtg h ASP 270 Ca 0.02 0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.08 1xtg h ASP 270 Cb 0.23 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.67 1xtg h ASP 270 CO 0.00 0.39 -0.07 0.00 -1.72 0.00 0.00 179.24 177.84 1xtg h ALA 271 N 1.59 1.19 0.00 3.45 0.00 -1.47 -1.87 119.26 122.15 1xtg h ALA 271 Ca 0.40 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1xtg h ALA 271 Cb 0.53 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1xtg h ALA 271 CO -0.17 0.09 0.00 1.63 0.00 0.00 0.00 179.25 180.80 1xtg n LYS 272 N -3.45 0.00 0.09 0.00 5.02 -0.39 -2.32 118.16 117.12 1xtg n LYS 272 Ca -0.02 0.22 0.11 0.00 -2.02 0.00 0.00 58.31 56.60 1xtg n LYS 272 Cb 0.21 -1.50 0.45 0.00 -0.02 0.00 0.00 35.03 34.17 1xtg n LYS 272 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1xtg n PHE 273 N -1.51 0.62 -3.03 2.13 3.72 -0.70 -4.58 117.46 114.10 1xtg n PHE 273 Ca 0.04 0.23 -0.40 0.00 -0.05 0.00 0.00 57.45 57.26 1xtg n PHE 273 Cb 0.19 -0.87 -0.05 0.00 -0.94 0.00 0.00 39.48 37.81 1xtg n PHE 273 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1xtg s ILE 274 N -3.21 4.98 0.67 4.37 1.01 -0.98 -5.03 121.20 123.00 1xtg s ILE 274 Ca 0.06 1.36 -0.17 0.00 0.00 0.00 0.00 60.65 61.91 1xtg s ILE 274 Cb 0.10 -4.02 0.00 0.00 0.01 0.00 0.00 42.46 38.56 1xtg s ILE 274 CO 0.40 0.10 1.23 -0.62 0.00 0.00 0.00 174.94 176.05 1xtg s ASP 275 N 1.14 4.59 0.22 3.58 2.15 -1.26 -4.83 116.67 122.26 1xtg s ASP 275 Ca 0.33 2.45 -0.07 0.00 0.43 0.00 0.00 52.55 55.68 1xtg s ASP 275 Cb -0.16 -2.60 0.17 0.00 -0.30 0.00 0.00 42.92 40.03 1xtg s ASP 275 CO 0.12 -2.00 1.80 0.28 -0.17 0.00 0.00 175.17 175.19 1xtg h SER 276 N 0.29 1.11 -0.45 -0.34 0.02 -1.96 -0.10 113.55 112.13 1xtg h SER 276 Ca -0.49 -0.16 0.01 0.00 -0.84 0.00 0.00 61.79 60.31 1xtg h SER 276 Cb 1.31 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 63.54 1xtg h SER 276 CO 0.52 0.96 0.29 -0.07 -1.14 0.00 0.00 176.83 177.39 1xtg h LEU 277 N 1.19 0.49 -0.52 5.07 3.38 -2.00 -1.40 115.31 121.53 1xtg h LEU 277 Ca 0.28 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.20 1xtg h LEU 277 Cb 0.17 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1xtg h LEU 277 CO -0.03 0.36 0.17 1.56 0.09 0.00 0.00 178.44 180.59 1xtg h GLN 278 N 0.59 0.80 -0.39 1.13 4.20 -1.84 -1.29 115.11 118.32 1xtg h GLN 278 Ca 0.17 -0.17 0.02 0.00 0.06 0.00 0.00 58.65 58.73 1xtg h GLN 278 Cb -0.05 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 27.59 1xtg h GLN 278 CO -0.05 0.73 0.23 1.49 -0.67 0.00 0.00 178.83 180.56 1xtg h GLU 279 N 0.71 0.45 -0.38 1.46 4.81 -0.66 -0.89 114.58 120.08 1xtg h GLU 279 Ca 0.17 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.29 1xtg h GLU 279 Cb 0.26 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 1xtg h GLU 279 CO -0.01 0.30 -0.11 -0.91 -0.73 0.00 0.00 179.01 177.55 1xtg h ASN 280 N 0.46 0.64 -0.60 1.04 2.35 -1.15 -1.83 115.58 116.49 1xtg h ASN 280 Ca 0.15 -0.18 0.03 0.00 -0.55 0.00 0.00 56.30 55.76 1xtg h ASN 280 Cb 0.01 -0.17 -0.04 0.00 0.05 0.00 0.00 38.32 38.16 1xtg h ASN 280 CO -0.07 0.78 0.35 -0.08 -1.65 0.00 0.00 177.43 176.76 1xtg h GLU 281 N 0.60 0.67 -0.04 0.81 4.81 -0.49 -1.27 114.58 119.67 1xtg h GLU 281 Ca 0.11 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.29 1xtg h GLU 281 Cb 0.54 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 29.77 1xtg h GLU 281 CO 0.03 0.44 -0.01 0.74 -0.73 0.00 0.00 179.01 179.49 1xtg h PHE 282 N 0.69 0.09 -0.84 0.92 0.04 -0.84 -1.15 116.94 115.85 1xtg h PHE 282 Ca 0.25 -0.02 0.07 0.00 2.80 0.00 0.00 57.97 61.07 1xtg h PHE 282 Cb 0.06 -0.02 -0.06 0.00 2.20 0.00 0.00 35.95 38.12 1xtg h PHE 282 CO -0.06 0.40 0.51 -0.09 -0.60 0.00 0.00 178.31 178.46 1xtg h ARG 283 N -0.24 0.88 -0.29 1.51 2.43 -1.16 -0.97 114.38 116.53 1xtg h ARG 283 Ca 0.01 -0.05 -0.15 0.00 -0.81 0.00 0.00 59.98 58.98 1xtg h ARG 283 Cb 0.37 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.71 1xtg h ARG 283 CO 0.00 0.58 -0.42 1.25 -1.51 0.00 0.00 179.97 179.87 1xtg h LEU 284 N 0.91 0.77 0.29 3.80 7.12 -1.21 -1.78 115.31 125.21 1xtg h LEU 284 Ca 0.38 -0.36 -0.01 0.00 0.13 0.00 0.00 57.88 58.02 1xtg h LEU 284 Cb 0.23 -0.22 -0.01 0.00 -0.53 0.00 0.00 40.66 40.13 1xtg h LEU 284 CO -0.19 1.09 -0.19 0.22 -0.13 0.00 0.00 178.44 179.24 1xtg h TYR 285 N 0.59 -0.50 0.00 1.25 3.20 -0.08 -1.94 116.97 119.49 1xtg h TYR 285 Ca 0.04 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.83 1xtg h TYR 285 Cb 0.97 0.18 -0.01 0.00 1.54 0.00 0.00 36.73 39.41 1xtg h TYR 285 CO 0.05 -0.29 -0.36 1.88 -1.64 0.00 0.00 178.16 177.80 1xtg h TYR 286 N -0.47 0.00 -0.83 -3.82 0.05 -1.24 -2.32 116.97 108.34 1xtg h TYR 286 Ca -0.03 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.73 1xtg h TYR 286 Cb 0.40 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.10 1xtg h TYR 286 CO -0.10 0.36 0.41 -0.92 -1.05 0.00 0.00 178.16 176.86 1xtg h TYR 287 N 0.00 1.19 -0.31 4.88 3.20 -1.02 -0.89 116.97 124.01 1xtg h TYR 287 Ca -0.00 -0.05 -0.11 0.00 3.14 0.00 0.00 58.73 61.70 1xtg h TYR 287 Cb 0.77 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 38.65 1xtg h TYR 287 CO 0.00 0.86 -0.26 -0.91 -1.64 0.00 0.00 178.16 176.21 1xtg h ASN 288 N 1.18 0.63 -0.69 -2.11 -0.26 -0.89 -2.27 115.58 111.17 1xtg h ASN 288 Ca 0.29 -0.23 -0.06 0.00 -0.56 0.00 0.00 56.30 55.74 1xtg h ASN 288 Cb 0.10 -0.17 -0.03 0.00 -1.06 0.00 0.00 38.32 37.16 1xtg h ASN 288 CO -0.04 0.87 0.21 0.11 -1.06 0.00 0.00 177.43 177.52 1xtg h LYS 289 N 0.54 1.09 -0.20 0.81 1.79 -0.83 -1.29 116.57 118.47 1xtg h LYS 289 Ca 0.07 -0.23 -0.09 0.00 -2.18 0.00 0.00 60.65 58.23 1xtg h LYS 289 Cb 0.72 -0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 31.20 1xtg h LYS 289 CO 0.06 0.93 -0.26 0.74 -1.08 0.00 0.00 179.45 179.84 1xtg h PHE 290 N 1.05 0.42 -0.34 -1.35 -1.00 -0.93 -2.21 116.94 112.57 1xtg h PHE 290 Ca 0.23 -0.08 -0.13 0.00 2.81 0.00 0.00 57.97 60.79 1xtg h PHE 290 Cb 0.30 -0.10 -0.01 0.00 3.61 0.00 0.00 35.95 39.75 1xtg h PHE 290 CO 0.02 0.60 -0.32 0.87 -1.61 0.00 0.00 178.31 177.87 1xtg h LYS 291 N 0.34 0.76 -0.58 1.51 1.57 -0.83 -1.63 116.57 117.69 1xtg h LYS 291 Ca 0.05 -0.36 -0.06 0.00 -1.87 0.00 0.00 60.65 58.41 1xtg h LYS 291 Cb 0.63 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.91 1xtg h LYS 291 CO 0.05 0.98 0.12 -0.44 -0.57 0.00 0.00 179.45 179.59 1xtg h ASP 292 N 0.64 0.86 -0.11 0.86 3.32 -0.87 -0.62 116.42 120.50 1xtg h ASP 292 Ca 0.07 -0.17 -0.01 0.00 0.02 0.00 0.00 57.03 56.93 1xtg h ASP 292 Cb 0.86 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 40.18 1xtg h ASP 292 CO 0.07 0.85 0.02 0.40 -1.72 0.00 0.00 179.24 178.86 1xtg h ILE 293 N 0.87 1.22 -0.56 0.35 2.04 -1.17 0.26 117.51 120.53 1xtg h ILE 293 Ca 0.19 -0.69 0.03 0.00 1.00 0.00 0.00 64.86 65.39 1xtg h ILE 293 Cb 0.34 1.47 -0.03 0.00 -0.74 0.00 0.00 36.82 37.85 1xtg h ILE 293 CO 0.00 0.20 0.37 0.00 0.00 0.00 0.00 178.15 178.72 1xtg h ALA 294 N 0.79 1.73 -0.35 1.87 0.00 -1.04 0.55 119.26 122.80 1xtg h ALA 294 Ca 0.03 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 1xtg h ALA 294 Cb 0.30 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1xtg h ALA 294 CO 0.00 0.21 -0.02 1.03 0.00 0.00 0.00 179.25 180.46 1xtg h SER 295 N 0.64 0.63 -0.86 0.00 0.87 -0.72 -1.16 113.55 112.95 1xtg h SER 295 Ca 0.23 -0.33 -0.03 0.00 -1.23 0.00 0.00 61.79 60.43 1xtg h SER 295 Cb 0.11 -0.17 -0.04 0.00 -0.44 0.00 0.00 62.40 61.86 1xtg h SER 295 CO -0.06 0.81 0.42 0.74 -0.53 0.00 0.00 176.83 178.21 1xtg h THR 296 N 0.45 1.26 -0.21 2.23 2.02 0.36 -2.26 112.91 116.76 1xtg h THR 296 Ca 0.10 -0.72 -0.09 0.00 0.77 0.00 0.00 66.41 66.47 1xtg h THR 296 Cb 0.50 0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 1xtg h THR 296 CO 0.02 0.31 -0.25 -0.07 0.37 0.00 0.00 175.52 175.91 1xtg h LEU 297 N 1.23 0.38 -1.03 2.58 3.38 -0.71 -2.21 115.31 118.94 1xtg h LEU 297 Ca 0.30 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 58.07 1xtg h LEU 297 Cb 0.11 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1xtg h LEU 297 CO -0.04 0.63 -0.35 0.78 0.09 0.00 0.00 178.44 179.56 1xtg h ASN 298 N 0.35 0.00 0.19 -0.43 2.35 -0.67 -3.01 115.58 114.36 1xtg h ASN 298 Ca 0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1xtg h ASN 298 Cb 0.62 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.99 1xtg h ASN 298 CO 0.04 0.35 -0.41 0.29 -1.65 0.00 0.00 177.43 176.05 1xtg n LYS 299 N -3.56 0.73 -2.12 0.81 5.02 -0.91 -4.91 118.16 113.22 1xtg n LYS 299 Ca -0.00 -0.50 -0.42 0.00 -2.02 0.00 0.00 58.31 55.36 1xtg n LYS 299 Cb 0.48 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.97 1xtg n LYS 299 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xtg s ALA 300 N -2.61 3.62 -0.04 7.82 0.00 -0.87 -4.56 121.76 125.12 1xtg s ALA 300 Ca 0.19 0.97 0.08 0.00 0.00 0.00 0.00 51.96 53.20 1xtg s ALA 300 Cb 0.18 -3.64 -0.12 0.00 0.00 0.00 0.00 23.12 19.54 1xtg s ALA 300 CO 0.59 -1.03 0.12 1.63 0.00 0.00 0.00 175.76 177.07 1xtg n LYS 301 N 5.68 1.30 -4.17 0.00 4.76 0.54 -5.02 118.16 121.26 1xtg n LYS 301 Ca 0.14 -0.05 -0.12 0.00 -2.87 0.00 0.00 58.31 55.42 1xtg n LYS 301 Cb 0.43 -1.21 -0.09 0.00 -1.84 0.00 0.00 35.03 32.31 1xtg n LYS 301 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1xtg s SER 302 N -3.44 0.14 -0.05 4.39 1.04 -1.01 -5.06 113.70 109.70 1xtg s SER 302 Ca -0.04 -1.33 -0.08 0.00 0.48 0.00 0.00 55.95 54.99 1xtg s SER 302 Cb 0.04 0.41 0.02 0.00 0.10 0.00 0.00 66.02 66.59 1xtg s SER 302 CO 0.35 -0.89 0.20 -0.51 0.98 0.00 0.00 173.24 173.37 1xtg s ILE 303 N -4.12 0.03 0.06 -1.02 2.07 -1.26 -1.01 121.20 115.94 1xtg s ILE 303 Ca 0.37 -0.21 0.05 0.00 -1.41 0.00 0.00 60.65 59.45 1xtg s ILE 303 Cb 0.06 -0.36 -0.03 0.00 0.13 0.00 0.00 42.46 42.26 1xtg s ILE 303 CO 0.12 -0.11 -0.14 0.68 -1.91 0.00 0.00 174.94 173.57 1xtg s VAL 304 N -0.37 1.10 0.00 4.00 -7.23 -0.97 -4.89 120.40 112.03 1xtg s VAL 304 Ca -0.05 -1.21 0.00 0.00 -1.81 0.00 0.00 61.98 58.91 1xtg s VAL 304 Cb -0.03 -1.04 0.00 0.00 0.56 0.00 0.00 36.38 35.87 1xtg s VAL 304 CO 0.01 -0.16 0.00 0.61 -0.31 0.00 0.00 175.10 175.25 1xtg n GLY 305 N 1.46 0.77 3.17 2.32 0.00 -1.26 -4.55 105.19 107.10 1xtg n GLY 305 Ca -0.20 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.71 1xtg n GLY 305 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1xtg s THR 306 N -2.25 0.10 -0.06 2.61 -1.32 -1.26 -5.02 115.64 108.44 1xtg s THR 306 Ca 0.00 -0.79 0.30 0.00 -1.21 0.00 0.00 61.69 59.99 1xtg s THR 306 Cb 0.00 -0.76 0.37 0.00 -1.51 0.00 0.00 72.50 70.60 1xtg s THR 306 CO 0.00 -0.44 1.87 0.71 -2.21 0.00 0.00 174.62 174.55 1xtg h THR 307 N 3.69 0.02 -4.18 5.08 1.35 -2.01 -3.45 112.91 113.41 1xtg h THR 307 Ca -0.31 -0.68 -0.49 0.00 -0.55 0.00 0.00 66.41 64.38 1xtg h THR 307 Cb 1.19 1.66 0.05 0.00 -1.73 0.00 0.00 68.15 69.33 1xtg h THR 307 CO 0.45 0.01 0.38 0.00 -0.25 0.00 0.00 175.52 176.11 1xtg s ALA 308 N -3.53 2.81 0.65 6.62 0.00 -1.26 -5.04 121.76 122.00 1xtg s ALA 308 Ca 0.03 0.39 -0.12 0.00 0.00 0.00 0.00 51.96 52.26 1xtg s ALA 308 Cb 0.08 -3.22 -0.02 0.00 0.00 0.00 0.00 23.12 19.96 1xtg s ALA 308 CO 0.58 -0.66 1.05 -1.54 0.00 0.00 0.00 175.76 175.20 1xtg s SER 309 N -2.72 5.71 0.16 0.00 1.04 -1.26 -4.92 113.70 111.72 1xtg s SER 309 Ca 0.63 1.60 -0.15 0.00 0.48 0.00 0.00 55.95 58.51 1xtg s SER 309 Cb -0.15 -2.50 0.04 0.00 0.10 0.00 0.00 66.02 63.51 1xtg s SER 309 CO 0.34 -1.22 1.82 0.25 0.98 0.00 0.00 173.24 175.41 1xtg h LEU 310 N -0.35 0.50 -0.72 2.42 5.85 -1.96 -2.16 115.31 118.89 1xtg h LEU 310 Ca -0.44 -0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.30 1xtg h LEU 310 Cb 1.21 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 42.07 1xtg h LEU 310 CO 0.58 0.36 0.45 -0.61 -0.34 0.00 0.00 178.44 178.88 1xtg h GLN 311 N 0.60 0.83 -0.35 1.25 4.15 -1.99 -1.14 115.11 118.46 1xtg h GLN 311 Ca 0.17 -0.05 -0.02 0.00 0.77 0.00 0.00 58.65 59.51 1xtg h GLN 311 Cb -0.05 -0.19 -0.02 0.00 0.21 0.00 0.00 27.48 27.43 1xtg h GLN 311 CO -0.05 0.55 0.12 -0.92 -1.93 0.00 0.00 178.83 176.61 1xtg h TYR 312 N 0.86 0.55 -0.13 3.99 5.03 -1.87 -1.16 116.97 124.25 1xtg h TYR 312 Ca 0.30 -0.05 -0.09 0.00 2.58 0.00 0.00 58.73 61.47 1xtg h TYR 312 Cb 0.05 -0.16 -0.01 0.00 1.55 0.00 0.00 36.73 38.16 1xtg h TYR 312 CO -0.04 0.53 -0.31 0.52 -1.32 0.00 0.00 178.16 177.53 1xtg h MET 313 N 0.41 0.24 -0.16 1.82 2.86 -1.13 -1.00 114.93 117.97 1xtg h MET 313 Ca 0.11 -0.09 -0.14 0.00 -2.06 0.00 0.00 59.70 57.52 1xtg h MET 313 Cb 0.22 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 1xtg h MET 313 CO -0.01 0.54 -0.50 0.87 1.06 0.00 0.00 176.91 178.87 1xtg h LYS 314 N 0.22 0.44 -0.10 1.72 1.57 -1.04 -3.00 116.57 116.37 1xtg h LYS 314 Ca 0.03 -0.25 -0.11 0.00 -1.87 0.00 0.00 60.65 58.45 1xtg h LYS 314 Cb 0.66 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.98 1xtg h LYS 314 CO 0.05 0.84 -0.41 -0.97 -0.57 0.00 0.00 179.45 178.39 1xtg h ASN 315 N 0.35 0.24 -0.35 0.86 -0.73 -0.47 -1.61 115.58 113.87 1xtg h ASN 315 Ca 0.02 -0.10 0.02 0.00 1.87 0.00 0.00 56.30 58.11 1xtg h ASN 315 Cb 1.00 -0.07 -0.03 0.00 0.27 0.00 0.00 38.32 39.49 1xtg h ASN 315 CO 0.09 0.63 0.18 0.58 -0.37 0.00 0.00 177.43 178.54 1xtg h VAL 316 N 0.19 1.00 0.00 2.57 2.07 -1.06 -1.09 116.25 119.93 1xtg h VAL 316 Ca 0.02 -0.13 -0.10 0.00 0.82 0.00 0.00 66.70 67.31 1xtg h VAL 316 Cb 0.81 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 1xtg h VAL 316 CO 0.06 0.07 -0.46 -0.26 0.02 0.00 0.00 177.57 177.00 1xtg h PHE 317 N 0.37 0.00 -0.68 1.57 0.04 -1.52 -0.07 116.94 116.64 1xtg h PHE 317 Ca 0.14 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.88 1xtg h PHE 317 Cb 0.04 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.16 1xtg h PHE 317 CO -0.09 0.46 0.29 -0.22 -0.60 0.00 0.00 178.31 178.15 1xtg h LYS 318 N 0.00 1.01 -0.14 1.51 3.64 -0.85 -1.72 116.57 120.01 1xtg h LYS 318 Ca -0.00 -0.17 -0.20 0.00 -1.27 0.00 0.00 60.65 59.01 1xtg h LYS 318 Cb 1.11 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.77 1xtg h LYS 318 CO 0.06 0.83 -0.70 0.93 -2.27 0.00 0.00 179.45 178.29 1xtg h GLU 319 N 0.96 0.63 -0.26 1.90 5.08 -0.87 0.16 114.58 122.18 1xtg h GLU 319 Ca 0.23 -0.48 -0.01 0.00 -1.00 0.00 0.00 59.36 58.10 1xtg h GLU 319 Cb 0.18 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 1xtg h GLU 319 CO -0.02 1.10 0.14 -0.22 -1.00 0.00 0.00 179.01 179.01 1xtg h LYS 320 N 0.44 0.36 -0.44 2.33 3.64 -0.72 -2.81 116.57 119.38 1xtg h LYS 320 Ca -0.03 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1xtg h LYS 320 Cb 1.30 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 1xtg h LYS 320 CO 0.14 0.33 0.00 0.66 -2.27 0.00 0.00 179.45 178.30 1xtg n TYR 321 N -4.84 0.59 -3.93 1.91 4.01 -0.67 -4.94 117.16 109.28 1xtg n TYR 321 Ca -0.02 -0.29 -0.28 0.00 -0.16 0.00 0.00 57.90 57.15 1xtg n TYR 321 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.11 1xtg n TYR 321 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1xtg n LEU 322 N 0.85 -2.43 -4.84 7.72 4.77 -0.76 -4.90 117.00 117.42 1xtg n LEU 322 Ca 0.16 -0.91 -0.32 0.00 -0.03 0.00 0.00 56.01 54.91 1xtg n LEU 322 Cb 0.40 -2.39 -0.02 0.00 -2.33 0.00 0.00 43.42 39.08 1xtg n LEU 322 CO 0.11 0.41 0.69 -0.76 -1.33 0.00 0.00 177.39 176.52 1xtg s LEU 323 N -7.03 3.52 0.03 2.23 1.43 0.47 -4.65 118.68 114.69 1xtg s LEU 323 Ca 0.30 1.59 -0.10 0.00 -1.03 0.00 0.00 54.13 54.88 1xtg s LEU 323 Cb -0.15 -4.51 -0.05 0.00 0.03 0.00 0.00 46.19 41.50 1xtg s LEU 323 CO 0.86 -0.76 0.36 -0.44 0.23 0.00 0.00 176.35 176.60 1xtg s SER 324 N -3.23 6.65 -0.17 2.29 0.01 0.50 -4.85 113.70 114.89 1xtg s SER 324 Ca 0.59 0.78 0.00 0.00 1.31 0.00 0.00 55.95 58.63 1xtg s SER 324 Cb -0.11 -2.18 0.04 0.00 0.21 0.00 0.00 66.02 63.98 1xtg s SER 324 CO 0.37 0.25 -0.10 -0.70 0.41 0.00 0.00 173.24 173.47 1xtg s GLU 325 N -1.58 1.88 0.95 12.44 2.12 -1.26 -0.98 118.70 132.27 1xtg s GLU 325 Ca 0.28 -0.63 -0.15 0.00 0.36 0.00 0.00 54.97 54.84 1xtg s GLU 325 Cb -0.14 -2.15 0.17 0.00 0.26 0.00 0.00 34.13 32.27 1xtg s GLU 325 CO 0.15 -0.37 1.21 0.16 -0.54 0.00 0.00 175.26 175.88 1xtg s ASP 326 N 1.51 3.21 0.35 -1.70 1.47 -0.89 -4.86 116.67 115.75 1xtg s ASP 326 Ca 0.01 0.61 0.22 0.00 1.18 0.00 0.00 52.55 54.58 1xtg s ASP 326 Cb -0.15 -0.92 1.22 0.00 -0.34 0.00 0.00 42.92 42.73 1xtg s ASP 326 CO -0.09 -2.70 1.67 0.71 0.68 0.00 0.00 175.17 175.44 1xtg h THR 327 N -1.61 0.00 -0.24 2.11 1.35 -2.01 0.87 112.91 113.38 1xtg h THR 327 Ca -0.46 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.40 1xtg h THR 327 Cb 1.29 0.50 0.00 0.00 -1.73 0.00 0.00 68.15 68.21 1xtg h THR 327 CO 0.50 0.00 0.00 -1.54 -0.25 0.00 0.00 175.52 174.23 1xtg n SER 328 N -2.30 2.91 -0.02 5.36 3.41 -1.26 -4.95 113.62 116.76 1xtg n SER 328 Ca -0.01 -1.91 -0.00 0.00 -0.26 0.00 0.00 58.87 56.68 1xtg n SER 328 Cb 0.07 -0.15 -0.00 0.00 -0.26 0.00 0.00 64.21 63.87 1xtg n SER 328 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xtg n GLY 329 N 1.38 0.44 3.84 5.00 0.00 0.30 -5.04 105.19 111.11 1xtg n GLY 329 Ca 0.18 -0.70 -0.36 0.00 0.00 0.00 0.00 46.02 45.13 1xtg n GLY 329 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xtg s LYS 330 N -1.35 3.96 0.03 1.61 2.20 -1.26 -4.86 119.74 120.08 1xtg s LYS 330 Ca 0.00 0.46 -0.04 0.00 -0.36 0.00 0.00 55.97 56.03 1xtg s LYS 330 Cb 0.00 -3.08 -0.04 0.00 -1.51 0.00 0.00 37.83 33.20 1xtg s LYS 330 CO 0.00 0.58 0.25 -0.06 -0.36 0.00 0.00 175.35 175.75 1xtg s PHE 331 N -1.29 3.54 0.04 4.03 0.08 -1.26 -2.10 117.98 121.03 1xtg s PHE 331 Ca 0.32 0.45 -0.12 0.00 0.12 0.00 0.00 56.93 57.69 1xtg s PHE 331 Cb -0.16 -1.90 0.01 0.00 -0.57 0.00 0.00 43.02 40.40 1xtg s PHE 331 CO 0.17 0.60 0.27 -1.54 -0.10 0.00 0.00 175.22 174.62 1xtg s SER 332 N -2.02 -0.07 -0.21 1.36 1.04 -0.15 -4.80 113.70 108.86 1xtg s SER 332 Ca 0.31 -0.26 -0.18 0.00 0.48 0.00 0.00 55.95 56.29 1xtg s SER 332 Cb -0.13 0.34 -0.03 0.00 0.10 0.00 0.00 66.02 66.30 1xtg s SER 332 CO 0.20 -0.60 0.52 -0.69 0.98 0.00 0.00 173.24 173.65 1xtg s VAL 333 N -2.60 5.10 -0.30 5.02 1.01 -1.26 -0.37 120.40 126.99 1xtg s VAL 333 Ca -0.05 0.96 -0.23 0.00 0.00 0.00 0.00 61.98 62.67 1xtg s VAL 333 Cb -0.01 -3.85 -0.00 0.00 0.00 0.00 0.00 36.38 32.52 1xtg s VAL 333 CO -0.04 0.16 0.75 -0.62 0.00 0.00 0.00 175.10 175.36 1xtg s ASP 334 N 1.19 6.64 0.26 3.32 -1.08 -1.26 -4.96 116.67 120.78 1xtg s ASP 334 Ca 0.24 0.65 -0.02 0.00 -0.52 0.00 0.00 52.55 52.89 1xtg s ASP 334 Cb -0.15 -2.39 0.52 0.00 -1.46 0.00 0.00 42.92 39.43 1xtg s ASP 334 CO 0.10 -0.57 1.72 0.11 0.52 0.00 0.00 175.17 177.05 1xtg h LYS 335 N 8.09 0.42 -0.30 4.34 1.57 -1.99 0.84 116.57 129.54 1xtg h LYS 335 Ca -0.25 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.46 1xtg h LYS 335 Cb 1.10 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.31 1xtg h LYS 335 CO 0.86 0.28 -0.00 -0.07 -0.57 0.00 0.00 179.45 179.95 1xtg h LEU 336 N 0.43 0.52 -0.50 2.94 3.38 -2.00 -2.06 115.31 118.03 1xtg h LEU 336 Ca 0.45 -0.31 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 1xtg h LEU 336 Cb 0.72 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 1xtg h LEU 336 CO -0.44 0.70 0.19 0.11 0.09 0.00 0.00 178.44 179.10 1xtg h LYS 337 N 0.32 0.75 -0.25 1.13 1.79 -1.76 -2.30 116.57 116.25 1xtg h LYS 337 Ca 0.08 -0.14 0.00 0.00 -2.18 0.00 0.00 60.65 58.42 1xtg h LYS 337 Cb 0.44 -0.12 -0.01 0.00 -1.58 0.00 0.00 32.23 30.95 1xtg h LYS 337 CO 0.02 0.67 0.16 0.35 -1.08 0.00 0.00 179.45 179.57 1xtg h PHE 338 N 0.66 0.31 -0.90 -1.35 3.57 -0.81 -0.92 116.94 117.50 1xtg h PHE 338 Ca 0.16 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.69 1xtg h PHE 338 Cb 0.21 -0.10 -0.05 0.00 2.79 0.00 0.00 35.95 38.80 1xtg h PHE 338 CO 0.01 0.19 0.59 -0.44 -2.23 0.00 0.00 178.31 176.43 1xtg h ASP 339 N 0.33 1.01 -0.24 0.41 3.32 -1.23 0.38 116.42 120.40 1xtg h ASP 339 Ca 0.09 -0.02 -0.13 0.00 0.02 0.00 0.00 57.03 56.99 1xtg h ASP 339 Cb -0.04 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.26 1xtg h ASP 339 CO -0.02 0.72 -0.31 0.11 -1.72 0.00 0.00 179.24 178.01 1xtg h LYS 340 N 1.18 0.75 -0.13 3.56 1.57 -1.16 0.33 116.57 122.68 1xtg h LYS 340 Ca 0.34 -0.35 -0.08 0.00 -1.87 0.00 0.00 60.65 58.69 1xtg h LYS 340 Cb -0.09 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.21 1xtg h LYS 340 CO -0.09 0.96 -0.22 1.25 -0.57 0.00 0.00 179.45 180.78 1xtg h LEU 341 N 0.64 0.42 -0.78 2.94 5.85 -0.68 -1.74 115.31 121.96 1xtg h LEU 341 Ca 0.07 -0.54 -0.01 0.00 0.84 0.00 0.00 57.88 58.24 1xtg h LEU 341 Cb 0.84 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.71 1xtg h LEU 341 CO 0.07 0.88 0.45 0.22 -0.34 0.00 0.00 178.44 179.72 1xtg h TYR 342 N -0.03 1.06 -0.68 1.25 3.20 -0.20 -1.51 116.97 120.05 1xtg h TYR 342 Ca 0.01 -0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.80 1xtg h TYR 342 Cb 0.80 -0.34 -0.03 0.00 1.54 0.00 0.00 36.73 38.71 1xtg h TYR 342 CO 0.10 0.73 0.19 -0.22 -1.64 0.00 0.00 178.16 177.31 1xtg h LYS 343 N 1.08 1.08 -0.39 1.82 3.64 -0.90 -1.50 116.57 121.39 1xtg h LYS 343 Ca 0.28 -0.25 -0.06 0.00 -1.27 0.00 0.00 60.65 59.35 1xtg h LYS 343 Cb 0.00 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 1xtg h LYS 343 CO -0.05 0.95 0.01 1.98 -2.27 0.00 0.00 179.45 180.07 1xtg h MET 344 N 1.01 0.68 0.00 1.90 4.05 -0.89 0.30 114.93 121.98 1xtg h MET 344 Ca 0.22 -0.21 -0.10 0.00 -0.28 0.00 0.00 59.70 59.33 1xtg h MET 344 Cb 0.34 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.06 1xtg h MET 344 CO -0.00 0.77 -0.45 -0.07 0.23 0.00 0.00 176.91 177.38 1xtg h LEU 345 N 0.51 0.00 0.00 3.39 3.38 -1.14 -1.09 115.31 120.36 1xtg h LEU 345 Ca 0.11 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 1xtg h LEU 345 Cb 0.45 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1xtg h LEU 345 CO 0.02 0.45 -1.54 0.35 0.09 0.00 0.00 178.44 177.81 1xtg n THR 346 N -3.86 0.15 -0.03 0.22 -2.24 -0.58 -4.49 114.28 103.46 1xtg n THR 346 Ca -0.01 -0.29 -0.02 0.00 -2.27 0.00 0.00 64.05 61.45 1xtg n THR 346 Cb 0.50 0.03 -0.04 0.00 -2.10 0.00 0.00 70.33 68.72 1xtg n THR 346 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1xtg n GLU 347 N -1.99 3.07 -0.03 -0.78 1.02 1.00 -4.75 120.64 118.18 1xtg n GLU 347 Ca -0.05 -0.00 -0.21 0.00 -0.02 0.00 0.00 57.16 56.87 1xtg n GLU 347 Cb 0.41 -1.14 -0.13 0.00 -0.02 0.00 0.00 31.44 30.56 1xtg n GLU 347 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1xtg h ILE 348 N 0.00 0.97 -1.30 -3.67 2.04 -1.25 -3.41 117.51 110.89 1xtg h ILE 348 Ca -0.14 -2.32 -0.62 0.00 1.00 0.00 0.00 64.86 62.78 1xtg h ILE 348 Cb 1.30 2.58 -0.11 0.00 -0.74 0.00 0.00 36.82 39.85 1xtg h ILE 348 CO 0.01 0.62 1.44 -0.31 0.00 0.00 0.00 178.15 179.91 1xtg s TYR 349 N -2.45 2.64 0.04 1.37 2.02 -0.43 -4.77 117.35 115.78 1xtg s TYR 349 Ca -0.23 -0.98 -0.01 0.00 -0.37 0.00 0.00 57.07 55.48 1xtg s TYR 349 Cb 0.05 -4.64 -0.03 0.00 -0.40 0.00 0.00 41.96 36.94 1xtg s TYR 349 CO 0.71 -1.86 -0.01 0.95 -1.57 0.00 0.00 175.55 173.77 1xtg s THR 350 N 4.57 0.18 0.19 -0.71 -4.23 -1.26 -4.68 115.64 109.70 1xtg s THR 350 Ca 0.44 -1.52 -0.12 0.00 -1.18 0.00 0.00 61.69 59.32 1xtg s THR 350 Cb -0.01 -1.17 0.10 0.00 1.34 0.00 0.00 72.50 72.77 1xtg s THR 350 CO -0.09 -0.84 1.79 -0.08 -0.54 0.00 0.00 174.62 174.86 1xtg h GLU 351 N 3.53 0.52 -0.79 3.99 4.81 -1.10 -2.43 114.58 123.11 1xtg h GLU 351 Ca -0.33 -0.03 0.09 0.00 -0.13 0.00 0.00 59.36 58.95 1xtg h GLU 351 Cb 1.16 -0.12 -0.07 0.00 0.63 0.00 0.00 28.75 30.36 1xtg h GLU 351 CO 0.58 0.35 0.45 0.22 -0.73 0.00 0.00 179.01 179.88 1xtg h ASP 352 N 0.54 0.64 0.37 1.04 3.58 -1.56 -1.28 116.42 119.75 1xtg h ASP 352 Ca 0.25 0.04 -0.10 0.00 0.42 0.00 0.00 57.03 57.64 1xtg h ASP 352 Cb 0.16 -0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.12 1xtg h ASP 352 CO -0.17 0.38 -0.43 0.78 -2.88 0.00 0.00 179.24 176.92 1xtg h ASN 353 N 0.77 0.08 0.37 2.28 2.35 -1.74 -2.25 115.58 117.44 1xtg h ASN 353 Ca 0.37 -0.03 -0.12 0.00 -0.55 0.00 0.00 56.30 55.97 1xtg h ASN 353 Cb 0.32 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.66 1xtg h ASN 353 CO -0.23 0.50 -0.52 -0.26 -1.65 0.00 0.00 177.43 175.27 1xtg h PHE 354 N 0.06 0.20 -0.69 1.19 0.04 -0.98 -1.62 116.94 115.15 1xtg h PHE 354 Ca 0.00 -0.07 -0.05 0.00 2.80 0.00 0.00 57.97 60.66 1xtg h PHE 354 Cb 0.78 -0.04 -0.03 0.00 2.20 0.00 0.00 35.95 38.86 1xtg h PHE 354 CO 0.00 0.65 0.25 0.28 -0.60 0.00 0.00 178.31 178.89 1xtg h VAL 355 N 0.13 1.25 -0.43 -0.55 2.07 -0.71 -0.12 116.25 117.89 1xtg h VAL 355 Ca 0.00 -0.82 -0.09 0.00 0.82 0.00 0.00 66.70 66.62 1xtg h VAL 355 Cb 0.96 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 1xtg h VAL 355 CO 0.08 0.32 -0.08 0.11 0.02 0.00 0.00 177.57 178.01 1xtg h LYS 356 N 1.00 0.81 -0.47 1.57 1.57 -1.14 0.19 116.57 120.09 1xtg h LYS 356 Ca 0.23 -0.30 -0.12 0.00 -1.87 0.00 0.00 60.65 58.59 1xtg h LYS 356 Cb 0.25 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 1xtg h LYS 356 CO -0.01 0.92 -0.17 0.74 -0.57 0.00 0.00 179.45 180.36 1xtg h PHE 357 N 0.64 1.03 0.00 -1.35 -1.00 -1.04 -3.05 116.94 112.17 1xtg h PHE 357 Ca 0.11 -0.23 -0.04 0.00 2.81 0.00 0.00 57.97 60.62 1xtg h PHE 357 Cb 0.61 -0.25 -0.01 0.00 3.61 0.00 0.00 35.95 39.91 1xtg h PHE 357 CO 0.05 1.01 -0.27 0.74 -1.61 0.00 0.00 178.31 178.23 1xtg h PHE 358 N 0.81 0.00 -5.19 -0.55 0.04 -0.99 -3.48 116.94 107.57 1xtg h PHE 358 Ca 0.12 0.00 -0.24 0.00 2.80 0.00 0.00 57.97 60.65 1xtg h PHE 358 Cb 0.71 0.00 0.17 0.00 2.20 0.00 0.00 35.95 39.04 1xtg h PHE 358 CO 0.04 0.21 -0.75 1.17 -0.60 0.00 0.00 178.31 178.38 1xtg n LYS 359 N -3.13 -2.80 -4.43 1.51 4.81 0.05 -5.03 118.16 109.15 1xtg n LYS 359 Ca 0.03 0.77 -0.21 0.00 -0.87 0.00 0.00 58.31 58.03 1xtg n LYS 359 Cb 0.62 -5.39 -0.10 0.00 0.02 0.00 0.00 35.03 30.18 1xtg n LYS 359 CO 0.00 0.00 0.00 0.14 1.17 0.00 0.00 177.40 178.71 1xtg s VAL 360 N -3.34 1.49 0.18 3.15 -7.23 -1.17 -5.00 120.40 108.48 1xtg s VAL 360 Ca 0.32 -2.08 -0.24 0.00 -1.81 0.00 0.00 61.98 58.18 1xtg s VAL 360 Cb -0.04 -2.52 -0.08 0.00 0.56 0.00 0.00 36.38 34.30 1xtg s VAL 360 CO 0.66 -0.24 0.76 -0.22 -0.31 0.00 0.00 175.10 175.74 1xtg s LEU 361 N -3.44 4.52 0.14 1.32 2.96 -1.26 -4.90 118.68 118.01 1xtg s LEU 361 Ca 0.31 1.57 -0.24 0.00 -0.22 0.00 0.00 54.13 55.55 1xtg s LEU 361 Cb 0.05 -3.37 0.07 0.00 0.50 0.00 0.00 46.19 43.44 1xtg s LEU 361 CO 0.12 0.16 0.62 0.21 -1.32 0.00 0.00 176.35 176.14 1xtg s ASN 362 N -1.29 -0.57 0.63 3.68 2.47 -1.26 -4.64 114.94 113.96 1xtg s ASN 362 Ca 0.38 0.06 -0.19 0.00 0.42 0.00 0.00 52.86 53.53 1xtg s ASN 362 Cb -0.21 0.59 -0.02 0.00 -1.45 0.00 0.00 41.25 40.16 1xtg s ASN 362 CO 0.24 -0.93 1.31 -2.11 -3.72 0.00 0.00 177.10 171.90 1xtg n ARG 363 N -0.27 1.21 0.00 0.43 1.85 -1.26 -4.94 116.66 113.68 1xtg n ARG 363 Ca -0.17 0.47 -0.02 0.00 -1.00 0.00 0.00 57.85 57.13 1xtg n ARG 363 Cb 0.64 -2.55 -0.11 0.00 -1.05 0.00 0.00 32.46 29.40 1xtg n ARG 363 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 1xtg n LYS 364 N -1.78 0.63 -3.72 2.89 4.01 -1.26 -4.97 118.16 113.95 1xtg n LYS 364 Ca 0.15 0.18 -0.11 0.00 -0.51 0.00 0.00 58.31 58.01 1xtg n LYS 364 Cb 0.47 -1.75 -0.07 0.00 -0.51 0.00 0.00 35.03 33.18 1xtg n LYS 364 CO 0.00 0.00 0.00 -0.08 -1.11 0.00 0.00 177.40 176.21 1xtg s THR 365 N -2.84 0.08 -0.36 -0.18 -1.32 -1.26 -4.64 115.64 105.11 1xtg s THR 365 Ca -0.05 -0.66 0.22 0.00 -1.21 0.00 0.00 61.69 60.00 1xtg s THR 365 Cb 0.09 -1.02 0.23 0.00 -1.51 0.00 0.00 72.50 70.29 1xtg s THR 365 CO 0.82 -0.36 1.68 2.22 -2.21 0.00 0.00 174.62 176.77 1xtg n PHE 366 N 0.37 0.76 0.71 9.09 -1.74 -1.26 -1.76 117.46 123.64 1xtg n PHE 366 Ca -0.18 0.34 0.10 0.00 -0.56 0.00 0.00 57.45 57.15 1xtg n PHE 366 Cb 0.60 -1.05 0.43 0.00 1.52 0.00 0.00 39.48 40.99 1xtg n PHE 366 CO 0.00 0.00 0.00 1.28 -0.56 0.00 0.00 176.76 177.48 1xtg n LEU 367 N -2.23 0.00 -4.34 5.98 4.77 -1.26 -4.14 117.00 115.78 1xtg n LEU 367 Ca 0.00 0.47 -0.47 0.00 -0.03 0.00 0.00 56.01 55.99 1xtg n LEU 367 Cb 0.14 -0.47 -0.02 0.00 -2.33 0.00 0.00 43.42 40.73 1xtg n LEU 367 CO 0.15 -0.15 0.46 0.21 -1.33 0.00 0.00 177.39 176.73 1xtg s ASN 368 N -2.95 6.76 0.41 -1.43 2.47 -0.72 -5.04 114.94 114.44 1xtg s ASN 368 Ca 0.11 -2.65 -0.25 0.00 0.42 0.00 0.00 52.86 50.48 1xtg s ASN 368 Cb 0.13 -2.22 -0.08 0.00 -1.45 0.00 0.00 41.25 37.62 1xtg s ASN 368 CO 0.35 -0.60 1.18 -0.36 -3.72 0.00 0.00 177.10 173.95 1xtg s PHE 369 N 0.32 3.03 0.72 0.43 0.08 -1.26 -4.92 117.98 116.38 1xtg s PHE 369 Ca 0.19 1.54 -0.16 0.00 0.12 0.00 0.00 56.93 58.62 1xtg s PHE 369 Cb -0.10 -3.41 0.03 0.00 -0.57 0.00 0.00 43.02 38.98 1xtg s PHE 369 CO -0.09 -1.38 1.25 -0.51 -0.10 0.00 0.00 175.22 174.38 1xtg s ASP 370 N -1.15 4.17 0.00 1.36 1.01 -1.26 -4.74 116.67 116.07 1xtg s ASP 370 Ca 0.58 2.48 0.00 0.00 0.71 0.00 0.00 52.55 56.32 1xtg s ASP 370 Cb -0.31 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.02 1xtg s ASP 370 CO 0.38 -2.29 0.00 0.29 0.21 0.00 0.00 175.17 173.77 1xtg n LYS 371 N -2.55 3.85 -3.94 8.23 5.02 0.12 -4.65 118.16 124.24 1xtg n LYS 371 Ca 0.15 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.34 1xtg n LYS 371 Cb 0.49 -0.50 -0.05 0.00 -0.02 0.00 0.00 35.03 34.96 1xtg n LYS 371 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xtg s ALA 372 N -0.89 -0.39 -0.03 7.82 0.00 -1.00 -4.79 121.76 122.49 1xtg s ALA 372 Ca 0.00 -0.72 0.03 0.00 0.00 0.00 0.00 51.96 51.27 1xtg s ALA 372 Cb 0.00 0.99 0.00 0.00 0.00 0.00 0.00 23.12 24.11 1xtg s ALA 372 CO 0.00 -0.82 -0.11 0.54 0.00 0.00 0.00 175.76 175.37 1xtg s VAL 373 N -3.98 0.95 0.09 0.00 0.11 -1.26 0.32 120.40 116.63 1xtg s VAL 373 Ca 0.18 -0.45 0.08 0.00 -2.93 0.00 0.00 61.98 58.86 1xtg s VAL 373 Cb -0.00 -0.83 -0.03 0.00 -1.53 0.00 0.00 36.38 33.98 1xtg s VAL 373 CO 0.05 0.29 -0.21 -0.36 -3.33 0.00 0.00 175.10 171.54 1xtg s PHE 374 N 0.16 1.79 -0.09 1.54 0.08 -0.08 -1.26 117.98 120.13 1xtg s PHE 374 Ca -0.03 -0.41 -0.16 0.00 0.12 0.00 0.00 56.93 56.45 1xtg s PHE 374 Cb -0.09 -1.00 -0.05 0.00 -0.57 0.00 0.00 43.02 41.31 1xtg s PHE 374 CO 0.01 0.18 0.42 0.21 -0.10 0.00 0.00 175.22 175.94 1xtg s LYS 375 N -1.73 4.19 0.33 0.44 2.47 -0.27 -1.66 119.74 123.50 1xtg s LYS 375 Ca 0.07 0.37 0.03 0.00 -1.56 0.00 0.00 55.97 54.88 1xtg s LYS 375 Cb -0.10 -3.36 -0.04 0.00 -1.46 0.00 0.00 37.83 32.87 1xtg s LYS 375 CO 0.04 0.35 0.11 0.96 0.16 0.00 0.00 175.35 176.96 1xtg s ILE 376 N 0.03 0.69 -0.35 5.43 -4.36 -0.56 -2.47 121.20 119.61 1xtg s ILE 376 Ca 0.23 -2.00 0.03 0.00 -0.26 0.00 0.00 60.65 58.66 1xtg s ILE 376 Cb -0.15 -2.58 0.16 0.00 1.25 0.00 0.00 42.46 41.14 1xtg s ILE 376 CO 0.10 0.00 0.40 0.21 0.24 0.00 0.00 174.94 175.89 1xtg s ASN 377 N -3.45 0.76 0.00 4.36 2.47 -1.26 -4.62 114.94 113.20 1xtg s ASN 377 Ca 0.33 -1.18 0.27 0.00 0.42 0.00 0.00 52.86 52.71 1xtg s ASN 377 Cb 0.06 0.82 0.91 0.00 -1.45 0.00 0.00 41.25 41.59 1xtg s ASN 377 CO 0.15 -0.28 1.67 2.30 -3.72 0.00 0.00 177.10 177.22 1xtg n ILE 378 N 4.58 0.00 -0.07 -5.21 -5.35 -1.26 -4.33 119.36 107.72 1xtg n ILE 378 Ca 0.08 -0.09 -0.11 0.00 -0.27 0.00 0.00 62.75 62.36 1xtg n ILE 378 Cb 0.47 0.20 -0.04 0.00 -1.74 0.00 0.00 39.64 38.54 1xtg n ILE 378 CO 0.00 0.00 0.00 0.58 -1.76 0.00 0.00 176.55 175.37 1xtg h VAL 379 N 0.89 1.18 -3.14 7.28 2.07 -1.92 -3.38 116.25 119.23 1xtg h VAL 379 Ca 0.00 -0.58 -0.53 0.00 0.82 0.00 0.00 66.70 66.42 1xtg h VAL 379 Cb 0.46 1.13 0.05 0.00 -1.52 0.00 0.00 31.29 31.41 1xtg h VAL 379 CO 0.00 0.19 0.83 -2.84 0.02 0.00 0.00 177.57 175.77 1xtg s PRO 380 N -5.45 4.22 0.55 1.57 0.02 -1.26 -4.90 135.00 129.76 1xtg s PRO 380 Ca -0.14 2.37 0.31 0.00 0.02 0.00 0.00 61.00 63.56 1xtg s PRO 380 Cb 0.08 -3.11 1.63 0.00 0.02 0.00 0.00 34.50 33.11 1xtg s PRO 380 CO 0.72 -0.53 2.13 0.87 -0.33 0.00 0.00 177.00 179.86 1xtg h LYS 381 N 5.75 0.00 0.00 5.54 1.57 -1.84 -1.18 116.57 126.41 1xtg h LYS 381 Ca -0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1xtg h LYS 381 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 1xtg h LYS 381 CO 0.84 0.08 0.00 -0.39 -0.57 0.00 0.00 179.45 179.40 1xtg h VAL 382 N 0.00 0.00 0.01 0.50 -1.51 -1.95 -3.30 116.25 110.00 1xtg h VAL 382 Ca -0.00 -0.36 -0.40 0.00 -1.23 0.00 0.00 66.70 64.70 1xtg h VAL 382 Cb 0.27 1.21 -0.06 0.00 -2.13 0.00 0.00 31.29 30.57 1xtg h VAL 382 CO 0.01 0.00 -2.32 0.59 -1.23 0.00 0.00 177.57 174.62 1xtg n ASN 383 N -2.42 1.97 -3.70 4.19 5.03 -0.49 -5.04 115.26 114.80 1xtg n ASN 383 Ca 0.03 0.17 -0.14 0.00 0.87 0.00 0.00 54.58 55.51 1xtg n ASN 383 Cb 0.30 -0.70 -0.09 0.00 -1.02 0.00 0.00 39.78 38.27 1xtg n ASN 383 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 1xtg s TYR 384 N -2.50 -0.52 0.15 3.10 6.14 -0.93 -4.59 117.35 118.19 1xtg s TYR 384 Ca -0.35 1.23 0.07 0.00 0.64 0.00 0.00 57.07 58.67 1xtg s TYR 384 Cb 0.11 0.19 -0.04 0.00 0.42 0.00 0.00 41.96 42.64 1xtg s TYR 384 CO 0.57 -0.30 -0.17 0.95 0.64 0.00 0.00 175.55 177.24 1xtg s THR 385 N 0.02 1.63 0.24 4.34 -4.23 -0.45 -4.28 115.64 112.91 1xtg s THR 385 Ca -0.02 -1.83 -0.05 0.00 -1.18 0.00 0.00 61.69 58.61 1xtg s THR 385 Cb -0.03 -1.72 0.20 0.00 1.34 0.00 0.00 72.50 72.29 1xtg s THR 385 CO 0.02 -0.35 1.74 0.40 -0.54 0.00 0.00 174.62 175.88 1xtg h ILE 386 N 3.37 0.69 0.00 2.99 2.04 -1.89 0.38 117.51 125.09 1xtg h ILE 386 Ca -0.41 -0.15 -0.20 0.00 1.00 0.00 0.00 64.86 65.09 1xtg h ILE 386 Cb 1.20 0.20 -0.03 0.00 -0.74 0.00 0.00 36.82 37.45 1xtg h ILE 386 CO 0.51 0.08 -1.09 1.88 0.00 0.00 0.00 178.15 179.53 1xtg h TYR 387 N 0.45 0.00 0.00 1.37 0.05 -1.94 -3.41 116.97 113.49 1xtg h TYR 387 Ca 0.39 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.17 1xtg h TYR 387 Cb 0.57 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.31 1xtg h TYR 387 CO -0.16 0.85 0.00 -0.25 -1.05 0.00 0.00 178.16 177.55 1xtg n ASP 388 N -3.21 0.14 0.00 3.88 8.00 -1.13 -5.09 116.55 119.13 1xtg n ASP 388 Ca -0.04 -0.57 0.00 0.00 0.71 0.00 0.00 54.79 54.89 1xtg n ASP 388 Cb 0.91 0.85 0.00 0.00 -0.02 0.00 0.00 41.12 42.86 1xtg n ASP 388 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xtg n GLY 389 N 0.85 2.71 0.10 0.44 0.00 0.13 -2.57 105.19 106.85 1xtg n GLY 389 Ca 0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 46.02 45.75 1xtg n GLY 389 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1xtg h PHE 390 N 0.00 0.00 -0.35 1.61 0.04 -1.86 -1.19 116.94 115.20 1xtg h PHE 390 Ca 0.00 0.00 -0.71 0.00 2.80 0.00 0.00 57.97 60.06 1xtg h PHE 390 Cb 0.00 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.10 1xtg h PHE 390 CO 0.00 0.67 3.03 0.09 -0.60 0.00 0.00 178.31 181.51 1xtg n ASN 391 N -3.08 5.47 -4.64 2.17 3.02 -1.06 -4.45 115.26 112.69 1xtg n ASN 391 Ca -0.05 -2.86 -0.48 0.00 -0.03 0.00 0.00 54.58 51.15 1xtg n ASN 391 Cb 0.85 -1.58 -0.05 0.00 -0.61 0.00 0.00 39.78 38.39 1xtg n ASN 391 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1xtg n LEU 392 N 4.80 2.50 -4.75 3.41 4.77 -1.26 -4.32 117.00 122.16 1xtg n LEU 392 Ca 0.56 1.10 -0.34 0.00 -0.03 0.00 0.00 56.01 57.30 1xtg n LEU 392 Cb 0.34 -1.33 0.06 0.00 -2.33 0.00 0.00 43.42 40.16 1xtg n LEU 392 CO 0.86 -0.60 0.79 0.00 -1.33 0.00 0.00 177.39 177.11 1xtg s ARG 393 N 0.77 2.61 -1.67 3.23 1.70 -1.26 -2.44 118.95 121.88 1xtg s ARG 393 Ca 0.81 1.66 0.00 0.00 -0.47 0.00 0.00 55.73 57.73 1xtg s ARG 393 Cb -0.79 -1.90 0.00 0.00 -0.57 0.00 0.00 34.95 31.69 1xtg s ARG 393 CO 0.42 -1.45 0.00 0.09 -1.08 0.00 0.00 175.30 173.28 1xtg n ASN 394 N -2.27 -4.94 -3.64 -2.89 3.02 -1.26 -4.93 115.26 98.35 1xtg n ASN 394 Ca 0.12 0.32 -0.22 0.00 -0.03 0.00 0.00 54.58 54.78 1xtg n ASN 394 Cb 0.51 -3.91 -0.08 0.00 -0.61 0.00 0.00 39.78 35.68 1xtg n ASN 394 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1xtg s THR 395 N -2.65 0.20 0.30 3.41 -4.23 -1.22 -5.02 115.64 106.44 1xtg s THR 395 Ca 0.00 -2.00 0.35 0.00 -1.18 0.00 0.00 61.69 58.86 1xtg s THR 395 Cb 0.00 -2.43 0.38 0.00 1.34 0.00 0.00 72.50 71.79 1xtg s THR 395 CO 0.00 0.00 2.09 -0.55 -0.54 0.00 0.00 174.62 175.62 1xtg h ASN 396 N 2.00 0.00 1.01 3.99 -1.07 -1.94 -2.63 115.58 116.94 1xtg h ASN 396 Ca -0.29 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.08 1xtg h ASN 396 Cb 1.25 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.50 1xtg h ASN 396 CO 0.44 0.04 0.00 0.18 0.07 0.00 0.00 177.43 178.15 1xtg n LEU 397 N -3.20 0.24 0.10 6.14 4.32 -1.26 -3.67 117.00 119.67 1xtg n LEU 397 Ca -0.01 0.53 -0.04 0.00 -0.02 0.00 0.00 56.01 56.47 1xtg n LEU 397 Cb 0.25 -0.46 0.03 0.00 -1.62 0.00 0.00 43.42 41.61 1xtg n LEU 397 CO 0.26 -0.13 0.32 0.00 -1.22 0.00 0.00 177.39 176.63 1xtg h ALA 398 N 2.75 0.67 -2.60 -1.18 0.00 -1.12 -2.83 119.26 114.95 1xtg h ALA 398 Ca 0.00 -0.73 -0.56 0.00 0.00 0.00 0.00 54.91 53.62 1xtg h ALA 398 Cb 0.51 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 1xtg h ALA 398 CO 0.00 1.01 -0.16 0.00 0.00 0.00 0.00 179.25 180.09 1xtg s ALA 399 N -3.17 3.64 -1.16 0.00 0.00 -1.24 -4.42 121.76 115.41 1xtg s ALA 399 Ca -0.00 -0.30 -0.10 0.00 0.00 0.00 0.00 51.96 51.55 1xtg s ALA 399 Cb 0.11 -2.38 0.09 0.00 0.00 0.00 0.00 23.12 20.95 1xtg s ALA 399 CO 0.79 0.53 0.41 0.09 0.00 0.00 0.00 175.76 177.58 1xtg n ASN 400 N 0.33 -2.89 -2.44 0.00 3.02 -1.26 -0.88 115.26 111.14 1xtg n ASN 400 Ca -0.03 -0.37 -0.16 0.00 -0.03 0.00 0.00 54.58 53.99 1xtg n ASN 400 Cb 0.52 -2.44 -0.01 0.00 -0.61 0.00 0.00 39.78 37.24 1xtg n ASN 400 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1xtg n PHE 401 N -3.69 -1.26 0.06 3.10 3.72 -1.26 -4.84 117.46 113.29 1xtg n PHE 401 Ca 0.01 0.01 0.18 0.00 -0.05 0.00 0.00 57.45 57.60 1xtg n PHE 401 Cb 0.52 -3.28 0.68 0.00 -0.94 0.00 0.00 39.48 36.46 1xtg n PHE 401 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 1xtg h ASN 402 N -0.02 0.00 0.26 4.37 2.35 -1.09 -0.04 115.58 121.41 1xtg h ASN 402 Ca -0.38 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.34 1xtg h ASN 402 Cb 1.28 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.65 1xtg h ASN 402 CO 0.45 0.00 -0.15 1.23 -1.65 0.00 0.00 177.43 177.31 1xtg h GLY 403 N 0.00 0.00 0.20 2.83 0.00 -1.71 -1.52 103.07 102.87 1xtg h GLY 403 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.53 1xtg h GLY 403 CO -0.00 0.00 -0.25 -1.06 0.00 0.00 0.00 176.54 175.23 1xtg n GLN 404 N -3.97 0.88 -2.68 4.80 6.02 -0.04 -4.73 117.38 117.66 1xtg n GLN 404 Ca -0.02 -0.52 -0.42 0.00 -0.01 0.00 0.00 57.00 56.03 1xtg n GLN 404 Cb 0.23 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 29.97 1xtg n GLN 404 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1xtg s ASN 405 N -2.48 6.41 0.28 1.08 3.84 -0.57 -0.26 114.94 123.24 1xtg s ASN 405 Ca 0.25 -0.06 0.22 0.00 0.21 0.00 0.00 52.86 53.47 1xtg s ASN 405 Cb 0.19 -2.51 1.05 0.00 -0.55 0.00 0.00 41.25 39.43 1xtg s ASN 405 CO 0.51 -1.37 1.66 0.35 -2.79 0.00 0.00 177.10 175.46 1xtg n THR 406 N 6.49 0.98 0.09 -5.21 -2.24 -0.34 -1.08 114.28 112.97 1xtg n THR 406 Ca 0.06 0.51 0.05 0.00 -2.27 0.00 0.00 64.05 62.40 1xtg n THR 406 Cb 0.48 -1.48 -0.01 0.00 -2.10 0.00 0.00 70.33 67.22 1xtg n THR 406 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1xtg h GLU 407 N 0.00 0.00 0.02 -0.78 5.08 -1.90 -3.10 114.58 113.90 1xtg h GLU 407 Ca 0.00 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.03 1xtg h GLU 407 Cb 0.15 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.36 1xtg h GLU 407 CO 0.00 0.21 -1.82 -0.89 -1.00 0.00 0.00 179.01 175.51 1xtg n ILE 408 N -2.91 1.57 -1.99 3.13 5.41 -0.72 -4.40 119.36 119.45 1xtg n ILE 408 Ca -0.03 -0.27 -0.40 0.00 1.00 0.00 0.00 62.75 63.05 1xtg n ILE 408 Cb 0.70 -1.90 0.04 0.00 -0.71 0.00 0.00 39.64 37.77 1xtg n ILE 408 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 1xtg n ASN 409 N -4.13 7.48 0.25 4.38 5.15 -0.24 -4.81 115.26 123.34 1xtg n ASN 409 Ca -0.39 -3.83 0.17 0.00 -0.60 0.00 0.00 54.58 49.93 1xtg n ASN 409 Cb 0.82 -1.07 0.82 0.00 -0.53 0.00 0.00 39.78 39.82 1xtg n ASN 409 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1xtg h ASN 410 N 3.09 0.00 0.65 1.20 -1.07 -1.75 -2.60 115.58 115.10 1xtg h ASN 410 Ca 0.56 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.93 1xtg h ASN 410 Cb 0.06 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.31 1xtg h ASN 410 CO 1.41 0.00 0.00 1.15 0.07 0.00 0.00 177.43 180.06 1xtg n MET 411 N -2.75 0.15 -0.05 4.14 0.00 -1.26 -2.40 117.12 114.95 1xtg n MET 411 Ca -0.01 0.39 0.12 0.00 0.00 0.00 0.00 57.70 58.21 1xtg n MET 411 Cb 0.15 -1.79 0.34 0.00 0.00 0.00 0.00 33.22 31.92 1xtg n MET 411 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 1xtg n ASN 412 N -2.07 2.17 -3.88 3.17 3.02 -0.98 -4.95 115.26 111.74 1xtg n ASN 412 Ca 0.02 -1.74 -0.11 0.00 -0.03 0.00 0.00 54.58 52.72 1xtg n ASN 412 Cb 0.21 -0.07 -0.10 0.00 -0.61 0.00 0.00 39.78 39.21 1xtg n ASN 412 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1xtg s PHE 413 N -1.86 0.06 -0.14 3.10 0.40 -1.01 -4.44 117.98 114.10 1xtg s PHE 413 Ca 0.34 -0.17 -0.01 0.00 -0.60 0.00 0.00 56.93 56.49 1xtg s PHE 413 Cb 0.20 -0.06 0.03 0.00 0.51 0.00 0.00 43.02 43.70 1xtg s PHE 413 CO 0.30 -0.27 -0.05 0.99 0.70 0.00 0.00 175.22 176.89 1xtg s THR 414 N -1.36 0.96 0.09 0.64 2.01 -1.03 -4.96 115.64 111.99 1xtg s THR 414 Ca -0.15 -0.41 -0.31 0.00 0.31 0.00 0.00 61.69 61.14 1xtg s THR 414 Cb -0.08 -1.09 -0.07 0.00 0.01 0.00 0.00 72.50 71.27 1xtg s THR 414 CO 0.01 0.22 1.30 -0.75 -0.69 0.00 0.00 174.62 174.71 1xtg s LYS 415 N 1.71 4.37 0.39 4.92 2.20 -1.26 -1.12 119.74 130.95 1xtg s LYS 415 Ca 0.03 1.93 0.08 0.00 -0.36 0.00 0.00 55.97 57.65 1xtg s LYS 415 Cb -0.14 -3.29 -0.02 0.00 -1.51 0.00 0.00 37.83 32.87 1xtg s LYS 415 CO -0.08 -0.35 0.35 -0.51 -0.36 0.00 0.00 175.35 174.41 1xtg s LEU 416 N 1.04 3.48 0.17 5.43 1.43 -0.39 -4.94 118.68 124.91 1xtg s LEU 416 Ca 0.62 -0.64 -0.30 0.00 -1.03 0.00 0.00 54.13 52.77 1xtg s LEU 416 Cb -0.33 -2.13 -0.08 0.00 0.03 0.00 0.00 46.19 43.68 1xtg s LEU 416 CO 0.30 -0.54 1.22 -0.75 0.23 0.00 0.00 176.35 176.81 1xtg s LYS 417 N -4.08 4.46 -0.24 1.70 2.20 -1.26 -4.62 119.74 117.90 1xtg s LYS 417 Ca 0.45 1.90 -0.14 0.00 -0.36 0.00 0.00 55.97 57.82 1xtg s LYS 417 Cb -0.04 -3.24 -0.04 0.00 -1.51 0.00 0.00 37.83 32.99 1xtg s LYS 417 CO 0.27 -0.14 0.34 1.21 -0.36 0.00 0.00 175.35 176.67 1xtg s ASN 418 N 0.29 6.28 0.00 1.43 3.84 -1.26 -4.76 114.94 120.75 1xtg s ASN 418 Ca 0.54 0.32 0.15 0.00 0.21 0.00 0.00 52.86 54.08 1xtg s ASN 418 Cb -0.33 -2.20 0.71 0.00 -0.55 0.00 0.00 41.25 38.88 1xtg s ASN 418 CO 0.36 -0.10 1.48 0.49 -2.79 0.00 0.00 177.10 176.54 1xtg n PHE 419 N 4.88 0.11 -1.67 0.43 3.01 -0.47 -4.92 117.46 118.82 1xtg n PHE 419 Ca -0.10 -0.06 -0.40 0.00 1.01 0.00 0.00 57.45 57.91 1xtg n PHE 419 Cb 0.51 0.00 0.03 0.00 -0.01 0.00 0.00 39.48 40.01 1xtg n PHE 419 CO 0.00 0.00 0.00 -2.37 1.01 0.00 0.00 176.76 175.40 1xtg n THR 420 N -0.28 3.02 0.96 4.37 5.66 -1.26 -4.91 114.28 121.84 1xtg n THR 420 Ca 0.12 -0.50 0.10 0.00 -3.05 0.00 0.00 64.05 60.72 1xtg n THR 420 Cb 0.15 -1.42 -0.04 0.00 -1.55 0.00 0.00 70.33 67.47 1xtg n THR 420 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1xtg n PRO 421 N -0.36 0.02 -2.34 1.09 -0.04 -1.26 -4.96 135.00 127.15 1xtg n PRO 421 Ca 0.09 -0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.18 1xtg n PRO 421 Cb 0.42 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.36 1xtg n PRO 421 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1xtg s LEU 422 N -3.06 4.00 -0.24 1.53 1.43 -1.26 -5.04 118.68 116.03 1xtg s LEU 422 Ca 0.08 2.20 0.02 0.00 -1.03 0.00 0.00 54.13 55.41 1xtg s LEU 422 Cb 0.16 -4.29 0.05 0.00 0.03 0.00 0.00 46.19 42.14 1xtg s LEU 422 CO 0.83 -0.85 -0.12 -0.69 0.23 0.00 0.00 176.35 175.75 1xtg s VAL 423 N -1.63 2.08 0.28 -1.59 1.01 -1.26 -5.05 120.40 114.23 1xtg s VAL 423 Ca 0.64 -1.45 -0.30 0.00 0.00 0.00 0.00 61.98 60.87 1xtg s VAL 423 Cb -0.26 -2.14 -0.12 0.00 0.00 0.00 0.00 36.38 33.87 1xtg s VAL 423 CO 0.31 0.08 1.60 -2.65 0.00 0.00 0.00 175.10 174.44 1xtg n PRO 424 N 4.50 2.67 0.00 2.72 -0.02 -1.26 -1.44 135.00 142.16 1xtg n PRO 424 Ca -0.15 0.95 0.13 0.00 -2.02 0.00 0.00 63.50 62.41 1xtg n PRO 424 Cb 0.44 -2.73 0.29 0.00 -0.02 0.00 0.00 33.50 31.47 1xtg n PRO 424 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35