#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xqw s ILE 6 N -2.96 5.27 -0.08 0.00 2.07 0.09 -4.92 121.20 120.67 1xqw s ILE 6 Ca 0.61 0.00 -0.04 0.00 -1.41 0.00 0.00 60.65 59.81 1xqw s ILE 6 Cb -0.16 -3.59 -0.04 0.00 0.13 0.00 0.00 42.46 38.80 1xqw s ILE 6 CO 0.56 0.14 0.08 -1.61 -1.91 0.00 0.00 174.94 172.20 1xqw s GLU 7 N 1.74 3.19 0.20 3.50 2.02 -1.26 -1.21 118.70 126.88 1xqw s GLU 7 Ca 0.07 -0.31 -0.09 0.00 0.02 0.00 0.00 54.97 54.65 1xqw s GLU 7 Cb -0.17 -2.97 -0.01 0.00 0.10 0.00 0.00 34.13 31.08 1xqw s GLU 7 CO 0.11 0.72 0.34 1.21 0.02 0.00 0.00 175.26 177.66 1xqw s ASN 8 N -1.13 -0.00 -0.39 -0.19 3.04 -0.89 -5.03 114.94 110.35 1xqw s ASN 8 Ca 0.16 -0.97 0.03 0.00 0.04 0.00 0.00 52.86 52.12 1xqw s ASN 8 Cb -0.12 0.49 0.16 0.00 -1.54 0.00 0.00 41.25 40.24 1xqw s ASN 8 CO 0.06 -0.99 0.31 -0.47 -3.04 0.00 0.00 177.10 172.97 1xqw s TYR 9 N -4.02 0.82 0.33 0.43 6.14 -1.26 -2.29 117.35 117.50 1xqw s TYR 9 Ca 0.23 -1.98 0.09 0.00 0.64 0.00 0.00 57.07 56.05 1xqw s TYR 9 Cb 0.02 -0.85 -0.05 0.00 0.42 0.00 0.00 41.96 41.50 1xqw s TYR 9 CO 0.06 -0.85 0.05 0.00 0.64 0.00 0.00 175.55 175.45 1xqw s ALA 10 N 0.48 3.30 0.02 3.97 0.00 -1.10 -4.86 121.76 123.57 1xqw s ALA 10 Ca 0.27 -1.85 -0.24 0.00 0.00 0.00 0.00 51.96 50.14 1xqw s ALA 10 Cb -0.06 -0.58 -0.05 0.00 0.00 0.00 0.00 23.12 22.43 1xqw s ALA 10 CO -0.12 0.09 0.75 0.21 0.00 0.00 0.00 175.76 176.69 1xqw s LYS 11 N -3.75 4.47 0.00 0.00 2.20 -1.26 -0.13 119.74 121.27 1xqw s LYS 11 Ca 0.35 1.02 0.00 0.00 -0.36 0.00 0.00 55.97 56.98 1xqw s LYS 11 Cb -0.02 -3.38 0.00 0.00 -1.51 0.00 0.00 37.83 32.92 1xqw s LYS 11 CO 0.21 0.24 0.00 1.33 -0.36 0.00 0.00 175.35 176.76 1xqw n VAL 12 N 3.03 0.00 -0.55 4.02 0.24 0.44 -4.85 118.33 120.66 1xqw n VAL 12 Ca -0.02 0.00 -0.07 0.00 -2.04 0.00 0.00 64.34 62.20 1xqw n VAL 12 Cb 0.50 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.79 1xqw n VAL 12 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1xqw n ASN 13 N 0.00 2.92 0.00 -1.34 2.04 -1.26 -4.29 115.26 113.33 1xqw n ASN 13 Ca 0.00 -2.04 0.00 0.00 -0.44 0.00 0.00 54.58 52.10 1xqw n ASN 13 Cb 0.00 -0.78 0.00 0.00 -2.53 0.00 0.00 39.78 36.47 1xqw n ASN 13 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1xqw n GLY 14 N 2.79 2.97 3.28 4.83 0.00 -1.26 -5.05 105.19 112.74 1xqw n GLY 14 Ca 0.24 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.09 1xqw n GLY 14 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1xqw s ILE 15 N -2.61 1.42 -0.25 -0.61 -4.36 -1.26 -5.08 121.20 108.44 1xqw s ILE 15 Ca 0.00 -2.02 -0.29 0.00 -0.26 0.00 0.00 60.65 58.08 1xqw s ILE 15 Cb 0.00 -1.83 0.01 0.00 1.25 0.00 0.00 42.46 41.89 1xqw s ILE 15 CO 0.00 -0.60 1.11 -0.31 0.24 0.00 0.00 174.94 175.38 1xqw s TYR 16 N -2.86 3.15 -0.09 1.37 1.51 -1.26 -0.42 117.35 118.75 1xqw s TYR 16 Ca 0.16 1.27 0.02 0.00 -1.01 0.00 0.00 57.07 57.51 1xqw s TYR 16 Cb -0.01 -3.49 -0.02 0.00 -0.11 0.00 0.00 41.96 38.33 1xqw s TYR 16 CO 0.03 -0.86 -0.13 0.42 -1.11 0.00 0.00 175.55 173.91 1xqw s ILE 17 N 3.48 3.12 0.00 2.71 -1.09 0.81 -1.76 121.20 128.48 1xqw s ILE 17 Ca 0.47 -0.67 -0.21 0.00 -2.23 0.00 0.00 60.65 58.01 1xqw s ILE 17 Cb -0.15 -2.27 -0.05 0.00 -1.58 0.00 0.00 42.46 38.41 1xqw s ILE 17 CO 0.12 0.56 0.63 -0.47 -1.23 0.00 0.00 174.94 174.54 1xqw s TYR 18 N -0.24 3.69 0.03 3.97 5.04 -1.26 -2.70 117.35 125.87 1xqw s TYR 18 Ca 0.01 1.25 -0.03 0.00 -2.44 0.00 0.00 57.07 55.86 1xqw s TYR 18 Cb -0.13 -2.65 -0.02 0.00 0.35 0.00 0.00 41.96 39.51 1xqw s TYR 18 CO 0.03 0.33 0.04 1.52 -1.34 0.00 0.00 175.55 176.13 1xqw s TYR 19 N -0.14 0.26 -0.21 4.97 1.13 -0.97 -1.74 117.35 120.66 1xqw s TYR 19 Ca 0.32 -0.58 -0.01 0.00 -1.41 0.00 0.00 57.07 55.39 1xqw s TYR 19 Cb -0.19 -0.19 0.06 0.00 -1.10 0.00 0.00 41.96 40.54 1xqw s TYR 19 CO 0.18 -0.31 -0.01 0.21 -2.51 0.00 0.00 175.55 173.12 1xqw s LYS 20 N -2.39 1.10 -0.39 -3.49 2.20 0.96 -2.09 119.74 115.64 1xqw s LYS 20 Ca -0.07 -0.66 -0.14 0.00 -0.36 0.00 0.00 55.97 54.75 1xqw s LYS 20 Cb -0.03 -2.29 0.02 0.00 -1.51 0.00 0.00 37.83 34.02 1xqw s LYS 20 CO -0.04 -0.61 0.27 -1.17 -0.36 0.00 0.00 175.35 173.44 1xqw s LEU 21 N 1.65 4.95 -0.55 5.43 2.96 -0.35 0.10 118.68 132.87 1xqw s LEU 21 Ca -0.03 -0.91 -0.12 0.00 -0.22 0.00 0.00 54.13 52.85 1xqw s LEU 21 Cb -0.18 -2.11 0.14 0.00 0.50 0.00 0.00 46.19 44.54 1xqw s LEU 21 CO -0.07 -0.42 0.46 0.00 -1.32 0.00 0.00 176.35 175.00 1xqw s LYS 23 N 1.26 2.36 0.33 0.00 -2.85 -1.26 -0.58 119.74 119.00 1xqw s LYS 23 Ca 0.06 -1.79 0.00 0.00 -1.00 0.00 0.00 55.97 53.25 1xqw s LYS 23 Cb -0.26 -2.18 0.00 0.00 -2.06 0.00 0.00 37.83 33.33 1xqw s LYS 23 CO -0.00 -0.34 0.00 0.00 0.10 0.00 0.00 175.35 175.11 1xqw n ALA 24 N -1.56 -3.35 -2.13 0.59 0.00 -1.26 -4.99 120.51 107.81 1xqw n ALA 24 Ca 0.01 0.47 -0.29 0.00 0.00 0.00 0.00 53.44 53.63 1xqw n ALA 24 Cb 0.63 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.91 1xqw n ALA 24 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1xqw s PRO 25 N -2.78 3.53 -0.96 0.00 0.02 -1.26 -4.74 135.00 128.81 1xqw s PRO 25 Ca 0.00 0.38 -0.12 0.00 0.02 0.00 0.00 61.00 61.27 1xqw s PRO 25 Cb 0.00 -2.27 0.01 0.00 0.02 0.00 0.00 34.50 32.26 1xqw s PRO 25 CO 0.00 -0.36 0.67 0.39 -0.33 0.00 0.00 177.00 177.37 1xqw n GLU 26 N -2.45 -1.15 -1.93 5.54 -0.58 -1.26 -4.26 120.64 114.55 1xqw n GLU 26 Ca 0.03 0.64 -0.42 0.00 -0.42 0.00 0.00 57.16 56.98 1xqw n GLU 26 Cb 0.55 -3.12 -0.03 0.00 -0.57 0.00 0.00 31.44 28.27 1xqw n GLU 26 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 1xqw s GLU 27 N -5.47 4.21 -0.10 3.49 2.12 -1.26 -4.37 118.70 117.31 1xqw s GLU 27 Ca 0.21 2.34 0.14 0.00 0.36 0.00 0.00 54.97 58.01 1xqw s GLU 27 Cb -0.10 -3.43 -0.20 0.00 0.26 0.00 0.00 34.13 30.67 1xqw s GLU 27 CO 0.89 -0.68 0.15 1.63 -0.54 0.00 0.00 175.26 176.71 1xqw n LYS 28 N 4.96 1.25 -3.64 4.30 4.76 0.33 -5.01 118.16 125.11 1xqw n LYS 28 Ca 0.15 -0.05 -0.07 0.00 -2.87 0.00 0.00 58.31 55.47 1xqw n LYS 28 Cb 0.40 -1.36 -0.02 0.00 -1.84 0.00 0.00 35.03 32.21 1xqw n LYS 28 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1xqw s ALA 29 N -2.60 -1.62 -0.02 7.82 0.00 -1.02 -5.04 121.76 119.28 1xqw s ALA 29 Ca -0.06 0.37 0.05 0.00 0.00 0.00 0.00 51.96 52.31 1xqw s ALA 29 Cb 0.06 0.66 -0.03 0.00 0.00 0.00 0.00 23.12 23.81 1xqw s ALA 29 CO 0.60 -0.89 -0.16 0.15 0.00 0.00 0.00 175.76 175.46 1xqw s LYS 30 N -3.43 2.36 -0.09 0.00 1.02 -1.26 -0.59 119.74 117.75 1xqw s LYS 30 Ca 0.08 -0.79 -0.01 0.00 0.02 0.00 0.00 55.97 55.27 1xqw s LYS 30 Cb -0.02 -2.30 0.03 0.00 -0.52 0.00 0.00 37.83 35.02 1xqw s LYS 30 CO -0.03 0.60 -0.03 -1.17 -0.92 0.00 0.00 175.35 173.80 1xqw s LEU 31 N -0.91 0.86 0.11 3.17 2.96 0.62 -1.71 118.68 123.78 1xqw s LEU 31 Ca 0.12 -0.18 -0.11 0.00 -0.22 0.00 0.00 54.13 53.74 1xqw s LEU 31 Cb -0.11 -0.61 -0.06 0.00 0.50 0.00 0.00 46.19 45.91 1xqw s LEU 31 CO 0.02 -0.16 0.46 -0.04 -1.32 0.00 0.00 176.35 175.30 1xqw s MET 32 N 1.83 3.83 0.03 1.98 -1.94 -0.64 -0.25 119.30 124.14 1xqw s MET 32 Ca 0.05 0.28 0.08 0.00 -1.71 0.00 0.00 55.69 54.38 1xqw s MET 32 Cb -0.12 -2.96 -0.02 0.00 2.01 0.00 0.00 34.83 33.73 1xqw s MET 32 CO -0.06 0.52 -0.24 0.95 -0.01 0.00 0.00 175.02 176.18 1xqw s THR 33 N -1.44 1.89 -0.23 2.05 -4.23 -0.69 -1.13 115.64 111.85 1xqw s THR 33 Ca 0.35 -1.23 0.02 0.00 -1.18 0.00 0.00 61.69 59.66 1xqw s THR 33 Cb -0.14 -1.61 0.05 0.00 1.34 0.00 0.00 72.50 72.14 1xqw s THR 33 CO 0.19 0.34 -0.10 -0.04 -0.54 0.00 0.00 174.62 174.47 1xqw s MET 34 N -1.05 2.05 1.09 3.99 -1.94 0.64 -4.53 119.30 119.55 1xqw s MET 34 Ca 0.09 -1.10 -0.14 0.00 -1.71 0.00 0.00 55.69 52.83 1xqw s MET 34 Cb -0.09 -2.68 0.24 0.00 2.01 0.00 0.00 34.83 34.30 1xqw s MET 34 CO 0.01 -0.53 1.07 -3.38 -0.01 0.00 0.00 175.02 172.19 1xqw s HIS 35 N 1.26 1.60 0.00 -0.03 -3.43 -1.26 -1.85 115.29 111.58 1xqw s HIS 35 Ca -0.06 0.92 0.00 0.00 -0.80 0.00 0.00 55.06 55.12 1xqw s HIS 35 Cb -0.18 -3.25 0.00 0.00 -1.43 0.00 0.00 32.58 27.72 1xqw s HIS 35 CO -0.06 -3.37 0.00 0.41 -2.00 0.00 0.00 174.74 169.72 1xqw n GLY 36 N -0.59 1.78 0.00 -1.38 0.00 -1.20 -2.90 105.19 100.90 1xqw n GLY 36 Ca 0.06 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 44.25 1xqw n GLY 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xqw n GLY 37 N 5.00 1.38 3.76 -0.02 0.00 -1.26 -3.01 105.19 111.04 1xqw n GLY 37 Ca 0.00 -0.70 -0.36 0.00 0.00 0.00 0.00 46.02 44.96 1xqw n GLY 37 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1xqw s PRO 38 N 0.00 3.05 0.00 1.61 0.02 -1.26 -4.80 135.00 133.63 1xqw s PRO 38 Ca 0.00 1.82 0.00 0.00 0.02 0.00 0.00 61.00 62.84 1xqw s PRO 38 Cb 0.00 -1.97 0.00 0.00 0.02 0.00 0.00 34.50 32.55 1xqw s PRO 38 CO 0.00 -1.14 0.00 0.41 -0.33 0.00 0.00 177.00 175.94 1xqw n GLY 39 N 0.49 1.26 0.00 0.52 0.00 -1.22 -3.02 105.19 103.22 1xqw n GLY 39 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1xqw n GLY 39 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1xqw n MET 40 N -1.36 0.00 -3.69 1.61 2.81 -1.16 -3.25 117.12 112.07 1xqw n MET 40 Ca 0.00 0.00 -0.04 0.00 -1.81 0.00 0.00 57.70 55.85 1xqw n MET 40 Cb 0.00 0.00 -0.01 0.00 -0.71 0.00 0.00 33.22 32.50 1xqw n MET 40 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1xqw s SER 41 N -1.00 -0.20 0.47 7.83 1.04 -1.26 -3.05 113.70 117.53 1xqw s SER 41 Ca 0.00 -0.30 0.25 0.00 0.48 0.00 0.00 55.95 56.38 1xqw s SER 41 Cb 0.00 0.44 1.17 0.00 0.10 0.00 0.00 66.02 67.73 1xqw s SER 41 CO 0.00 -0.79 1.95 1.12 0.98 0.00 0.00 173.24 176.50 1xqw h HIS 42 N 2.00 0.00 -0.94 5.02 2.07 -1.97 -3.35 115.15 117.98 1xqw h HIS 42 Ca -0.24 0.00 0.19 0.00 -2.85 0.00 0.00 60.37 57.47 1xqw h HIS 42 Cb 1.23 0.00 -0.18 0.00 2.57 0.00 0.00 27.41 31.03 1xqw h HIS 42 CO 0.35 0.19 -0.22 -0.25 -3.07 0.00 0.00 177.93 174.93 1xqw n ASP 43 N -3.56 -0.33 0.00 3.10 8.00 -1.26 -0.57 116.55 121.93 1xqw n ASP 43 Ca -0.01 1.61 0.07 0.00 0.71 0.00 0.00 54.79 57.17 1xqw n ASP 43 Cb 0.33 -0.49 0.37 0.00 -0.02 0.00 0.00 41.12 41.31 1xqw n ASP 43 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xqw n TYR 44 N -5.52 0.00 0.99 1.24 4.11 -1.19 -1.76 117.16 115.02 1xqw n TYR 44 Ca 0.15 0.00 0.12 0.00 -0.00 0.00 0.00 57.90 58.17 1xqw n TYR 44 Cb 0.48 -0.22 0.07 0.00 -0.00 0.00 0.00 39.34 39.67 1xqw n TYR 44 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.86 178.14 1xqw n LEU 45 N -1.22 2.75 0.16 -3.48 4.77 0.26 -4.54 117.00 115.71 1xqw n LEU 45 Ca 0.08 -0.94 0.19 0.00 -0.03 0.00 0.00 56.01 55.30 1xqw n LEU 45 Cb 0.10 0.00 0.74 0.00 -2.33 0.00 0.00 43.42 41.93 1xqw n LEU 45 CO 0.10 0.47 1.16 -0.07 -1.33 0.00 0.00 177.39 177.72 1xqw h LEU 46 N 4.13 0.00 -2.39 2.23 3.38 -1.41 0.37 115.31 121.62 1xqw h LEU 46 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xqw h LEU 46 Cb 0.93 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.68 1xqw h LEU 46 CO 0.00 0.00 0.00 0.77 0.09 0.00 0.00 178.44 179.30 1xqw h SER 47 N 0.00 0.00 0.80 -0.43 4.64 -1.84 -0.12 113.55 116.59 1xqw h SER 47 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1xqw h SER 47 Cb 1.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 1xqw h SER 47 CO -0.00 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.14 1xqw n LEU 48 N -3.04 0.34 0.29 5.97 4.32 0.12 -2.81 117.00 122.20 1xqw n LEU 48 Ca -0.02 0.57 0.17 0.00 -0.02 0.00 0.00 56.01 56.71 1xqw n LEU 48 Cb 0.15 -0.50 0.96 0.00 -1.62 0.00 0.00 43.42 42.41 1xqw n LEU 48 CO 0.22 -0.31 1.14 -0.09 -1.22 0.00 0.00 177.39 177.14 1xqw h ARG 49 N 0.00 0.00 -0.44 3.23 2.43 -1.19 -1.63 114.38 116.78 1xqw h ARG 49 Ca 0.00 0.00 0.11 0.00 -0.81 0.00 0.00 59.98 59.28 1xqw h ARG 49 Cb 0.40 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.93 1xqw h ARG 49 CO 0.00 0.00 0.31 -0.44 -1.51 0.00 0.00 179.97 178.33 1xqw h ASP 50 N 0.00 0.08 0.18 -3.80 3.45 -1.73 -2.06 116.42 112.54 1xqw h ASP 50 Ca 0.02 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.48 1xqw h ASP 50 Cb 0.11 -0.01 0.00 0.00 -0.56 0.00 0.00 39.33 38.86 1xqw h ASP 50 CO -0.00 0.05 0.00 0.23 -1.57 0.00 0.00 179.24 177.95 1xqw n MET 51 N -4.43 0.12 0.26 3.56 2.81 -0.61 -2.17 117.12 116.65 1xqw n MET 51 Ca 0.07 0.55 0.12 0.00 -1.81 0.00 0.00 57.70 56.62 1xqw n MET 51 Cb 0.45 -1.83 0.72 0.00 -0.71 0.00 0.00 33.22 31.85 1xqw n MET 51 CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 1xqw h THR 52 N 0.00 0.67 0.00 2.03 1.35 -1.33 -0.13 112.91 115.50 1xqw h THR 52 Ca 0.00 -0.44 0.00 0.00 -0.55 0.00 0.00 66.41 65.42 1xqw h THR 52 Cb 0.09 1.27 0.00 0.00 -1.73 0.00 0.00 68.15 67.78 1xqw h THR 52 CO 0.00 0.10 0.00 2.29 -0.25 0.00 0.00 175.52 177.66 1xqw n LYS 53 N -3.82 0.21 -0.85 4.72 2.85 -0.92 -2.39 118.16 117.96 1xqw n LYS 53 Ca -0.02 0.38 0.07 0.00 -1.05 0.00 0.00 58.31 57.69 1xqw n LYS 53 Cb 0.21 -1.86 0.39 0.00 -0.65 0.00 0.00 35.03 33.12 1xqw n LYS 53 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1xqw n GLU 54 N -2.25 4.69 -1.09 -1.58 -0.58 -0.08 -4.91 120.64 114.84 1xqw n GLU 54 Ca 0.03 -3.14 -0.02 0.00 -0.42 0.00 0.00 57.16 53.61 1xqw n GLU 54 Cb 0.27 -2.22 -0.01 0.00 -0.57 0.00 0.00 31.44 28.91 1xqw n GLU 54 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1xqw n GLY 55 N 0.49 0.56 3.21 0.62 0.00 -1.00 -4.85 105.19 104.21 1xqw n GLY 55 Ca 0.27 -0.97 -0.35 0.00 0.00 0.00 0.00 46.02 44.97 1xqw n GLY 55 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xqw s ILE 56 N -2.09 3.17 0.13 -0.61 -1.09 -1.08 0.12 121.20 119.75 1xqw s ILE 56 Ca 0.00 -1.20 -0.30 0.00 -2.23 0.00 0.00 60.65 56.92 1xqw s ILE 56 Cb 0.00 -2.75 -0.07 0.00 -1.58 0.00 0.00 42.46 38.06 1xqw s ILE 56 CO 0.00 -0.03 1.18 -0.89 -1.23 0.00 0.00 174.94 173.97 1xqw s THR 57 N 1.31 3.83 -0.13 2.92 2.01 0.24 -3.18 115.64 122.64 1xqw s THR 57 Ca -0.03 1.44 0.01 0.00 0.31 0.00 0.00 61.69 63.43 1xqw s THR 57 Cb -0.19 -3.92 -0.00 0.00 0.01 0.00 0.00 72.50 68.40 1xqw s THR 57 CO -0.01 0.19 -0.17 0.68 -0.69 0.00 0.00 174.62 174.61 1xqw s VAL 58 N 0.37 2.58 -0.24 3.82 -7.23 0.26 -0.28 120.40 119.68 1xqw s VAL 58 Ca 0.54 -0.82 -0.07 0.00 -1.81 0.00 0.00 61.98 59.83 1xqw s VAL 58 Cb -0.31 -2.06 -0.03 0.00 0.56 0.00 0.00 36.38 34.54 1xqw s VAL 58 CO 0.33 0.53 0.06 -0.22 -0.31 0.00 0.00 175.10 175.50 1xqw s LEU 59 N 0.54 3.46 0.17 1.32 2.96 0.66 -0.68 118.68 127.11 1xqw s LEU 59 Ca -0.11 -0.17 0.07 0.00 -0.22 0.00 0.00 54.13 53.70 1xqw s LEU 59 Cb -0.16 -1.92 -0.04 0.00 0.50 0.00 0.00 46.19 44.57 1xqw s LEU 59 CO 0.04 -0.00 -0.02 -0.36 -1.32 0.00 0.00 176.35 174.70 1xqw s PHE 60 N 1.41 2.82 -0.20 5.38 0.08 0.11 -1.70 117.98 125.88 1xqw s PHE 60 Ca 0.05 -0.15 -0.29 0.00 0.12 0.00 0.00 56.93 56.67 1xqw s PHE 60 Cb -0.15 -1.37 0.14 0.00 -0.57 0.00 0.00 43.02 41.07 1xqw s PHE 60 CO 0.03 0.51 1.07 1.52 -0.10 0.00 0.00 175.22 178.25 1xqw s TYR 61 N -1.70 -0.32 -0.30 0.36 1.13 -1.26 -0.02 117.35 115.23 1xqw s TYR 61 Ca 0.27 0.60 -0.19 0.00 -1.41 0.00 0.00 57.07 56.34 1xqw s TYR 61 Cb -0.09 0.45 -0.02 0.00 -1.10 0.00 0.00 41.96 41.20 1xqw s TYR 61 CO 0.18 -0.27 0.54 -0.51 -2.51 0.00 0.00 175.55 172.98 1xqw s ASP 62 N -0.89 6.42 1.27 -0.18 -0.00 -0.71 -4.22 116.67 118.35 1xqw s ASP 62 Ca 0.01 0.35 -0.16 0.00 -0.00 0.00 0.00 52.55 52.75 1xqw s ASP 62 Cb -0.01 -2.29 0.32 0.00 -0.00 0.00 0.00 42.92 40.94 1xqw s ASP 62 CO -0.01 -0.39 0.99 -1.10 -0.00 0.00 0.00 175.17 174.65 1xqw s GLN 63 N 2.41 -1.74 0.26 8.23 -0.21 -1.26 -4.35 119.66 123.00 1xqw s GLN 63 Ca 0.22 0.64 -0.29 0.00 0.02 0.00 0.00 55.36 55.94 1xqw s GLN 63 Cb -0.15 -1.47 -0.14 0.00 1.00 0.00 0.00 33.01 32.24 1xqw s GLN 63 CO 0.11 -4.22 1.10 1.97 -2.12 0.00 0.00 175.29 172.13 1xqw n PHE 64 N -5.24 1.43 -0.80 0.91 -1.74 -1.26 -0.91 117.46 109.85 1xqw n PHE 64 Ca 0.05 0.66 0.00 0.00 -0.56 0.00 0.00 57.45 57.60 1xqw n PHE 64 Cb 0.56 -2.29 0.00 0.00 1.52 0.00 0.00 39.48 39.27 1xqw n PHE 64 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1xqw n GLY 65 N 1.46 0.20 3.72 4.97 0.00 -0.72 -4.93 105.19 109.89 1xqw n GLY 65 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 1xqw n GLY 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xqw n GLY 67 N 0.87 2.19 0.11 0.00 0.00 -1.17 -0.79 105.19 106.40 1xqw n GLY 67 Ca -0.12 0.42 0.12 0.00 0.00 0.00 0.00 46.02 46.44 1xqw n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xqw n ARG 68 N 5.32 0.33 -2.78 1.61 1.74 -1.26 -4.95 116.66 116.67 1xqw n ARG 68 Ca 0.00 -0.22 -0.36 0.00 -0.77 0.00 0.00 57.85 56.50 1xqw n ARG 68 Cb 0.00 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 29.88 1xqw n ARG 68 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1xqw s SER 69 N -2.83 7.16 0.60 0.55 0.01 0.03 -4.75 113.70 114.47 1xqw s SER 69 Ca 0.14 1.80 -0.17 0.00 1.31 0.00 0.00 55.95 59.03 1xqw s SER 69 Cb 0.18 -2.57 -0.03 0.00 0.21 0.00 0.00 66.02 63.81 1xqw s SER 69 CO 0.68 -0.20 1.09 -1.83 0.41 0.00 0.00 173.24 173.39 1xqw s GLU 70 N -2.48 3.19 -0.05 12.44 -1.05 -0.72 -4.00 118.70 126.03 1xqw s GLU 70 Ca 0.55 1.36 -0.19 0.00 -0.15 0.00 0.00 54.97 56.55 1xqw s GLU 70 Cb -0.15 -2.00 -0.05 0.00 -0.44 0.00 0.00 34.13 31.48 1xqw s GLU 70 CO 0.20 -0.93 0.52 -2.00 0.95 0.00 0.00 175.26 173.99 1xqw s GLU 71 N -3.84 4.26 0.44 -4.83 2.12 -1.26 -1.76 118.70 113.83 1xqw s GLU 71 Ca 0.67 0.56 -0.04 0.00 0.36 0.00 0.00 54.97 56.53 1xqw s GLU 71 Cb -0.19 -3.36 0.09 0.00 0.26 0.00 0.00 34.13 30.93 1xqw s GLU 71 CO 0.35 0.34 0.60 -0.35 -0.54 0.00 0.00 175.26 175.66 1xqw n PRO 72 N 2.96 -0.14 -2.02 4.30 -0.04 -1.26 -4.89 135.00 133.92 1xqw n PRO 72 Ca -0.08 -1.31 -0.39 0.00 -0.04 0.00 0.00 63.50 61.68 1xqw n PRO 72 Cb 0.51 -0.50 0.01 0.00 -0.04 0.00 0.00 33.50 33.48 1xqw n PRO 72 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1xqw s ASP 73 N -3.34 5.97 0.46 3.54 2.15 -1.26 -4.89 116.67 119.31 1xqw s ASP 73 Ca 0.37 2.61 0.26 0.00 0.43 0.00 0.00 52.55 56.22 1xqw s ASP 73 Cb -0.02 -2.63 1.31 0.00 -0.30 0.00 0.00 42.92 41.28 1xqw s ASP 73 CO 0.25 -1.08 1.79 1.56 -0.17 0.00 0.00 175.17 177.52 1xqw h GLN 74 N 2.16 0.20 0.00 4.34 1.08 -2.01 0.31 115.11 121.20 1xqw h GLN 74 Ca -0.50 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 56.69 1xqw h GLN 74 Cb 1.26 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 28.65 1xqw h GLN 74 CO 0.60 0.13 0.00 0.66 -0.95 0.00 0.00 178.83 179.28 1xqw h SER 75 N 0.21 0.00 -0.58 1.46 4.64 -2.05 -1.88 113.55 115.35 1xqw h SER 75 Ca 0.57 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.89 1xqw h SER 75 Cb 1.82 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.91 1xqw h SER 75 CO -0.17 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.08 1xqw n LYS 76 N -2.32 2.50 -1.61 4.77 5.02 0.11 -4.66 118.16 121.96 1xqw n LYS 76 Ca 0.00 -2.32 -0.41 0.00 -2.02 0.00 0.00 58.31 53.57 1xqw n LYS 76 Cb 0.14 -1.51 -0.01 0.00 -0.02 0.00 0.00 35.03 33.63 1xqw n LYS 76 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1xqw n PHE 77 N 1.41 3.04 -4.19 2.13 0.99 -0.71 -4.69 117.46 115.45 1xqw n PHE 77 Ca 0.21 -3.01 -0.11 0.00 -0.00 0.00 0.00 57.45 54.54 1xqw n PHE 77 Cb 0.56 -2.48 -0.10 0.00 -1.00 0.00 0.00 39.48 36.47 1xqw n PHE 77 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.76 177.71 1xqw s THR 78 N 2.49 0.62 0.18 4.37 -4.23 -1.26 -4.97 115.64 112.83 1xqw s THR 78 Ca 0.56 -1.94 -0.06 0.00 -1.18 0.00 0.00 61.69 59.06 1xqw s THR 78 Cb 0.15 -1.85 -0.02 0.00 1.34 0.00 0.00 72.50 72.13 1xqw s THR 78 CO -0.07 -0.72 1.53 0.40 -0.54 0.00 0.00 174.62 175.22 1xqw h ILE 79 N 2.88 1.28 -0.84 2.99 2.04 -1.99 -2.06 117.51 121.81 1xqw h ILE 79 Ca -0.36 -1.56 0.05 0.00 1.00 0.00 0.00 64.86 63.99 1xqw h ILE 79 Cb 1.18 1.45 -0.06 0.00 -0.74 0.00 0.00 36.82 38.66 1xqw h ILE 79 CO 0.64 0.51 0.53 0.44 0.00 0.00 0.00 178.15 180.26 1xqw h ASP 80 N 0.63 0.85 -0.70 1.72 3.45 -1.96 -0.01 116.42 120.40 1xqw h ASP 80 Ca 0.05 0.01 -0.07 0.00 0.43 0.00 0.00 57.03 57.45 1xqw h ASP 80 Cb 0.94 -0.17 -0.03 0.00 -0.56 0.00 0.00 39.33 39.51 1xqw h ASP 80 CO 0.09 0.56 0.17 0.22 -1.57 0.00 0.00 179.24 178.71 1xqw h TYR 81 N 0.99 1.18 -0.53 4.55 3.20 -1.78 -2.46 116.97 122.13 1xqw h TYR 81 Ca 0.35 -0.14 -0.01 0.00 3.14 0.00 0.00 58.73 62.07 1xqw h TYR 81 Cb 0.10 -0.33 -0.03 0.00 1.54 0.00 0.00 36.73 38.01 1xqw h TYR 81 CO -0.03 0.96 0.27 0.78 -1.64 0.00 0.00 178.16 178.50 1xqw h GLY 82 N 1.09 0.78 0.81 1.82 0.00 -0.39 -0.42 103.07 106.76 1xqw h GLY 82 Ca 0.22 -0.35 -0.01 0.00 0.00 0.00 0.00 47.33 47.19 1xqw h GLY 82 CO 0.00 0.33 0.02 -2.08 0.00 0.00 0.00 176.54 174.82 1xqw h VAL 83 N 0.74 1.20 -0.61 4.60 2.07 -0.62 -1.18 116.25 122.46 1xqw h VAL 83 Ca 0.19 -0.63 -0.05 0.00 0.82 0.00 0.00 66.70 67.02 1xqw h VAL 83 Cb 0.05 1.42 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 1xqw h VAL 83 CO -0.03 0.18 0.17 -0.33 0.02 0.00 0.00 177.57 177.58 1xqw h GLU 84 N -0.04 0.94 -0.74 1.57 4.39 -1.24 -0.98 114.58 118.49 1xqw h GLU 84 Ca 0.03 -0.20 0.01 0.00 0.34 0.00 0.00 59.36 59.54 1xqw h GLU 84 Cb 0.27 -0.14 -0.04 0.00 -0.10 0.00 0.00 28.75 28.74 1xqw h GLU 84 CO 0.00 0.83 0.48 1.49 -1.16 0.00 0.00 179.01 180.65 1xqw h GLU 85 N 0.91 0.98 -0.42 2.33 4.81 -0.92 -1.00 114.58 121.26 1xqw h GLU 85 Ca 0.20 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.32 1xqw h GLU 85 Cb 0.30 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 1xqw h GLU 85 CO -0.00 0.66 0.08 0.00 -0.73 0.00 0.00 179.01 179.01 1xqw h ALA 86 N 1.26 0.56 -0.51 2.92 0.00 -0.54 -1.94 119.26 121.00 1xqw h ALA 86 Ca 0.27 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 1xqw h ALA 86 Cb -0.10 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1xqw h ALA 86 CO -0.06 0.26 -0.06 1.49 0.00 0.00 0.00 179.25 180.89 1xqw h GLU 87 N 0.55 0.91 -0.69 0.00 4.57 -0.94 -1.63 114.58 117.35 1xqw h GLU 87 Ca 0.13 -0.29 -0.00 0.00 -1.18 0.00 0.00 59.36 58.02 1xqw h GLU 87 Cb 0.36 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 28.83 1xqw h GLU 87 CO 0.01 0.94 0.42 0.00 -1.18 0.00 0.00 179.01 179.19 1xqw h ALA 88 N 1.10 0.87 -0.37 2.92 0.00 -1.03 -0.69 119.26 122.07 1xqw h ALA 88 Ca 0.14 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1xqw h ALA 88 Cb 0.57 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1xqw h ALA 88 CO 0.03 0.34 -0.00 1.25 0.00 0.00 0.00 179.25 180.87 1xqw h LEU 89 N 0.93 0.64 -0.08 0.00 5.85 -1.07 0.42 115.31 122.01 1xqw h LEU 89 Ca 0.25 -0.31 -0.00 0.00 0.84 0.00 0.00 57.88 58.66 1xqw h LEU 89 Cb -0.04 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 40.81 1xqw h LEU 89 CO -0.05 0.80 0.05 -0.09 -0.34 0.00 0.00 178.44 178.81 1xqw h ARG 90 N 0.47 0.11 0.15 1.25 2.43 -1.01 -2.59 114.38 115.19 1xqw h ARG 90 Ca 0.10 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.26 1xqw h ARG 90 Cb 0.47 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 1xqw h ARG 90 CO 0.02 0.10 -0.07 1.03 -1.51 0.00 0.00 179.97 179.54 1xqw h SER 91 N 0.08 -0.17 0.00 -3.80 0.87 -1.11 0.40 113.55 109.83 1xqw h SER 91 Ca 0.03 -0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.43 1xqw h SER 91 Cb 0.02 0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.02 1xqw h SER 91 CO -0.01 0.06 0.00 1.17 -0.53 0.00 0.00 176.83 177.53 1xqw n LYS 92 N -5.09 0.68 0.00 2.24 3.00 0.13 -0.42 118.16 118.71 1xqw n LYS 92 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.22 1xqw n LYS 92 Cb 0.18 -1.31 0.00 0.00 0.00 0.00 0.00 35.03 33.90 1xqw n LYS 92 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 1xqw n LEU 93 N 0.26 0.00 0.00 3.14 7.94 -0.98 -4.92 117.00 122.43 1xqw n LEU 93 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 1xqw n LEU 93 Cb 0.20 0.01 0.00 0.00 0.53 0.00 0.00 43.42 44.16 1xqw n LEU 93 CO 0.00 -0.04 0.47 0.49 -1.11 0.00 0.00 177.39 177.20 1xqw n PHE 94 N -1.58 0.00 0.00 1.96 3.72 0.14 -5.09 117.46 116.62 1xqw n PHE 94 Ca 0.00 -0.43 0.00 0.00 -0.05 0.00 0.00 57.45 56.97 1xqw n PHE 94 Cb 0.00 -0.04 0.00 0.00 -0.94 0.00 0.00 39.48 38.50 1xqw n PHE 94 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xqw n GLY 95 N -0.43 3.92 1.13 1.37 0.00 0.44 -1.56 105.19 110.06 1xqw n GLY 95 Ca 0.00 0.20 0.11 0.00 0.00 0.00 0.00 46.02 46.33 1xqw n GLY 95 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xqw n ASN 96 N 9.34 3.45 -4.71 1.61 3.02 -1.26 -4.31 115.26 122.40 1xqw n ASN 96 Ca 0.00 -1.98 -0.41 0.00 -0.03 0.00 0.00 54.58 52.17 1xqw n ASN 96 Cb 0.00 -0.26 0.01 0.00 -0.61 0.00 0.00 39.78 38.92 1xqw n ASN 96 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1xqw n GLU 97 N 1.44 2.00 -2.93 3.52 1.02 -0.60 -4.96 120.64 120.13 1xqw n GLU 97 Ca 0.19 0.71 -0.40 0.00 -0.02 0.00 0.00 57.16 57.64 1xqw n GLU 97 Cb 0.59 -2.44 -0.05 0.00 -0.02 0.00 0.00 31.44 29.52 1xqw n GLU 97 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1xqw s LYS 98 N -2.26 4.56 0.13 3.49 -0.14 -1.26 -4.92 119.74 119.35 1xqw s LYS 98 Ca 0.61 1.17 0.02 0.00 -1.36 0.00 0.00 55.97 56.41 1xqw s LYS 98 Cb -0.50 -3.33 -0.04 0.00 -1.68 0.00 0.00 37.83 32.28 1xqw s LYS 98 CO 0.58 0.36 -0.04 0.08 -0.76 0.00 0.00 175.35 175.57 1xqw s VAL 99 N -0.41 0.72 0.18 3.17 1.01 -0.61 -4.75 120.40 119.72 1xqw s VAL 99 Ca 0.39 -1.96 -0.08 0.00 0.00 0.00 0.00 61.98 60.33 1xqw s VAL 99 Cb -0.22 -1.86 -0.06 0.00 0.00 0.00 0.00 36.38 34.23 1xqw s VAL 99 CO 0.25 -0.71 0.48 -0.36 0.00 0.00 0.00 175.10 174.76 1xqw s PHE 100 N -3.62 3.47 -0.07 5.22 0.08 -0.69 -1.08 117.98 121.29 1xqw s PHE 100 Ca 0.17 0.77 0.04 0.00 0.12 0.00 0.00 56.93 58.02 1xqw s PHE 100 Cb 0.05 -2.17 0.00 0.00 -0.57 0.00 0.00 43.02 40.34 1xqw s PHE 100 CO -0.01 0.36 -0.17 -1.17 -0.10 0.00 0.00 175.22 174.13 1xqw s LEU 101 N -2.62 1.86 -0.06 -0.37 0.20 -0.45 -1.62 118.68 115.61 1xqw s LEU 101 Ca 0.43 -0.39 0.04 0.00 0.69 0.00 0.00 54.13 54.90 1xqw s LEU 101 Cb -0.12 -1.04 0.00 0.00 -0.43 0.00 0.00 46.19 44.60 1xqw s LEU 101 CO 0.22 0.11 -0.18 -0.32 -0.29 0.00 0.00 176.35 175.89 1xqw s MET 102 N 0.33 2.12 0.02 1.98 -2.45 -0.29 0.22 119.30 121.23 1xqw s MET 102 Ca -0.11 -0.64 0.04 0.00 -1.25 0.00 0.00 55.69 53.73 1xqw s MET 102 Cb -0.15 -1.73 -0.02 0.00 1.25 0.00 0.00 34.83 34.18 1xqw s MET 102 CO 0.04 0.18 -0.13 0.20 1.05 0.00 0.00 175.02 176.36 1xqw s GLY 103 N 0.27 0.73 -0.19 2.11 0.00 0.23 -0.26 107.32 110.21 1xqw s GLY 103 Ca -0.10 -0.73 -0.01 0.00 0.00 0.00 0.00 44.72 43.88 1xqw s GLY 103 CO 0.04 -0.69 -0.13 -0.45 0.00 0.00 0.00 173.10 171.87 1xqw s SER 104 N -0.87 3.67 1.59 1.64 0.15 -0.77 -0.61 113.70 118.50 1xqw s SER 104 Ca 0.02 -0.51 0.00 0.00 0.70 0.00 0.00 55.95 56.16 1xqw s SER 104 Cb -0.07 -1.59 0.00 0.00 -1.71 0.00 0.00 66.02 62.65 1xqw s SER 104 CO 0.01 0.02 0.00 0.00 1.20 0.00 0.00 173.24 174.46 1xqw n ALA 105 N 4.52 0.00 -0.05 5.45 0.00 0.40 0.10 120.51 130.93 1xqw n ALA 105 Ca -0.20 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.32 1xqw n ALA 105 Cb 0.51 0.00 0.46 0.00 0.00 0.00 0.00 19.45 20.42 1xqw n ALA 105 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1xqw h TYR 106 N 0.00 0.49 0.00 0.00 5.03 -1.85 0.47 116.97 121.11 1xqw h TYR 106 Ca 0.00 0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.30 1xqw h TYR 106 Cb 0.00 -0.16 -0.00 0.00 1.55 0.00 0.00 36.73 38.12 1xqw h TYR 106 CO 0.00 0.27 -0.09 0.78 -1.32 0.00 0.00 178.16 177.80 1xqw h GLY 107 N 0.49 0.00 0.67 1.82 0.00 -0.20 -0.15 103.07 105.70 1xqw h GLY 107 Ca 0.22 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.50 1xqw h GLY 107 CO -0.06 0.00 -0.11 -1.33 0.00 0.00 0.00 176.54 175.04 1xqw h GLY 108 N 0.32 0.28 1.04 4.60 0.00 -0.07 0.16 103.07 109.40 1xqw h GLY 108 Ca -0.00 -0.29 0.01 0.00 0.00 0.00 0.00 47.33 47.05 1xqw h GLY 108 CO 0.01 0.26 0.62 0.00 0.00 0.00 0.00 176.54 177.43 1xqw h ALA 109 N 0.58 1.28 -0.40 3.60 0.00 -0.78 -0.31 119.26 123.22 1xqw h ALA 109 Ca 0.02 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 1xqw h ALA 109 Cb 0.63 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1xqw h ALA 109 CO 0.03 0.65 -0.09 1.25 0.00 0.00 0.00 179.25 181.09 1xqw h LEU 110 N 1.32 0.68 -0.99 0.00 5.85 -0.93 -0.95 115.31 120.29 1xqw h LEU 110 Ca 0.35 -0.19 -0.10 0.00 0.84 0.00 0.00 57.88 58.78 1xqw h LEU 110 Cb -0.13 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.71 1xqw h LEU 110 CO -0.07 0.81 -0.48 0.00 -0.34 0.00 0.00 178.44 178.35 1xqw h ALA 111 N 1.26 1.14 -0.12 1.25 0.00 -0.19 -0.47 119.26 122.12 1xqw h ALA 111 Ca 0.12 -0.44 -0.12 0.00 0.00 0.00 0.00 54.91 54.47 1xqw h ALA 111 Cb 0.53 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1xqw h ALA 111 CO 0.03 0.61 -0.39 -0.07 0.00 0.00 0.00 179.25 179.43 1xqw h LEU 112 N 0.00 0.55 -0.61 0.00 3.38 -0.47 -1.66 115.31 116.50 1xqw h LEU 112 Ca -0.00 -0.60 -0.01 0.00 0.09 0.00 0.00 57.88 57.35 1xqw h LEU 112 Cb 0.89 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.45 1xqw h LEU 112 CO 0.06 1.06 0.35 0.00 0.09 0.00 0.00 178.44 180.00 1xqw h ALA 113 N 0.50 0.78 0.33 1.53 0.00 -1.00 -1.39 119.26 120.02 1xqw h ALA 113 Ca -0.01 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1xqw h ALA 113 Cb 1.01 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 1xqw h ALA 113 CO 0.08 0.29 -0.28 -0.92 0.00 0.00 0.00 179.25 178.42 1xqw h TYR 114 N 0.83 -0.74 -0.98 0.00 3.20 -1.05 -2.68 116.97 115.55 1xqw h TYR 114 Ca 0.22 0.00 0.14 0.00 3.14 0.00 0.00 58.73 62.23 1xqw h TYR 114 Cb 0.02 0.28 -0.09 0.00 1.54 0.00 0.00 36.73 38.48 1xqw h TYR 114 CO -0.01 -0.41 0.60 0.00 -1.64 0.00 0.00 178.16 176.70 1xqw h ALA 115 N -0.05 1.51 -0.86 1.82 0.00 -1.04 0.63 119.26 121.27 1xqw h ALA 115 Ca -0.02 0.04 0.14 0.00 0.00 0.00 0.00 54.91 55.07 1xqw h ALA 115 Cb 0.55 -0.16 -0.07 0.00 0.00 0.00 0.00 17.79 18.11 1xqw h ALA 115 CO -0.02 0.13 0.56 0.28 0.00 0.00 0.00 179.25 180.20 1xqw h VAL 116 N 0.90 0.84 0.00 0.00 2.07 -0.91 -1.52 116.25 117.64 1xqw h VAL 116 Ca 0.51 -0.22 -0.36 0.00 0.82 0.00 0.00 66.70 67.44 1xqw h VAL 116 Cb 0.59 0.13 -0.07 0.00 -1.52 0.00 0.00 31.29 30.42 1xqw h VAL 116 CO -0.30 0.12 -2.38 1.17 0.02 0.00 0.00 177.57 176.20 1xqw n LYS 117 N -4.54 0.61 -0.51 1.57 4.81 -0.27 -4.74 118.16 115.09 1xqw n LYS 117 Ca 0.16 0.14 0.04 0.00 -0.87 0.00 0.00 58.31 57.79 1xqw n LYS 117 Cb 0.46 -1.48 0.20 0.00 0.02 0.00 0.00 35.03 34.22 1xqw n LYS 117 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1xqw n TYR 118 N -3.20 0.47 0.17 5.64 4.01 0.20 -4.73 117.16 119.72 1xqw n TYR 118 Ca -0.43 -1.31 0.10 0.00 -0.16 0.00 0.00 57.90 56.11 1xqw n TYR 118 Cb 0.96 -0.31 0.56 0.00 -0.31 0.00 0.00 39.34 40.24 1xqw n TYR 118 CO 0.00 0.00 0.00 -0.56 -0.46 0.00 0.00 176.86 175.84 1xqw h GLN 119 N 0.88 0.00 0.00 -0.72 3.07 -1.40 0.74 115.11 117.68 1xqw h GLN 119 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.81 1xqw h GLN 119 Cb 1.27 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.83 1xqw h GLN 119 CO 0.15 0.00 0.00 -0.40 0.09 0.00 0.00 178.83 178.67 1xqw n ASP 120 N -2.25 0.43 -1.20 0.06 5.68 -1.26 -1.86 116.55 116.14 1xqw n ASP 120 Ca -0.01 0.59 0.12 0.00 -0.50 0.00 0.00 54.79 54.98 1xqw n ASP 120 Cb 0.12 -0.68 0.24 0.00 -1.14 0.00 0.00 41.12 39.65 1xqw n ASP 120 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 1xqw n HIS 121 N -1.95 0.59 -4.96 2.11 8.25 0.25 -4.96 115.22 114.56 1xqw n HIS 121 Ca 0.04 -0.30 -0.30 0.00 -0.26 0.00 0.00 57.72 56.90 1xqw n HIS 121 Cb 0.26 -0.00 -0.15 0.00 1.12 0.00 0.00 29.99 31.22 1xqw n HIS 121 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1xqw s LEU 122 N -1.40 2.16 -0.03 2.41 1.43 -0.78 -1.57 118.68 120.89 1xqw s LEU 122 Ca 0.41 -0.57 0.17 0.00 -1.03 0.00 0.00 54.13 53.11 1xqw s LEU 122 Cb 0.23 -1.30 -0.20 0.00 0.03 0.00 0.00 46.19 44.95 1xqw s LEU 122 CO 0.32 0.27 0.56 0.29 0.23 0.00 0.00 176.35 178.02 1xqw n LYS 123 N 1.85 0.65 -3.65 1.70 5.02 -0.24 -4.81 118.16 118.68 1xqw n LYS 123 Ca -0.17 0.12 -0.08 0.00 -2.02 0.00 0.00 58.31 56.17 1xqw n LYS 123 Cb 0.52 -1.69 -0.02 0.00 -0.02 0.00 0.00 35.03 33.81 1xqw n LYS 123 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1xqw s GLY 124 N -4.99 -0.34 -0.01 0.72 0.00 -1.25 -4.13 107.32 97.32 1xqw s GLY 124 Ca -0.06 0.26 0.02 0.00 0.00 0.00 0.00 44.72 44.95 1xqw s GLY 124 CO 0.83 0.08 -0.06 -2.27 0.00 0.00 0.00 173.10 171.68 1xqw s LEU 125 N -2.80 1.88 -0.09 0.66 2.96 0.72 -1.35 118.68 120.66 1xqw s LEU 125 Ca 0.08 -0.12 0.00 0.00 -0.22 0.00 0.00 54.13 53.87 1xqw s LEU 125 Cb -0.03 -0.36 0.02 0.00 0.50 0.00 0.00 46.19 46.33 1xqw s LEU 125 CO -0.03 0.06 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.35 1xqw s ILE 126 N 0.05 0.96 -0.20 6.68 1.01 0.13 -0.35 121.20 129.48 1xqw s ILE 126 Ca -0.00 -0.30 0.01 0.00 0.00 0.00 0.00 60.65 60.36 1xqw s ILE 126 Cb -0.05 -0.96 0.03 0.00 0.01 0.00 0.00 42.46 41.50 1xqw s ILE 126 CO -0.00 0.34 -0.16 -0.69 0.00 0.00 0.00 174.94 174.43 1xqw s VAL 127 N 1.33 1.97 -0.22 2.92 1.01 -0.44 -0.60 120.40 126.37 1xqw s VAL 127 Ca -0.02 -1.09 -0.02 0.00 0.00 0.00 0.00 61.98 60.84 1xqw s VAL 127 Cb -0.14 -1.90 0.01 0.00 0.00 0.00 0.00 36.38 34.35 1xqw s VAL 127 CO -0.04 0.33 -0.07 -0.44 0.00 0.00 0.00 175.10 174.88 1xqw s SER 128 N 1.28 4.11 -1.75 3.32 0.01 0.22 -0.95 113.70 119.94 1xqw s SER 128 Ca 0.01 -0.58 0.00 0.00 1.31 0.00 0.00 55.95 56.69 1xqw s SER 128 Cb -0.15 -1.67 0.00 0.00 0.21 0.00 0.00 66.02 64.40 1xqw s SER 128 CO -0.10 -0.05 0.00 0.61 0.41 0.00 0.00 173.24 174.11 1xqw n GLY 129 N 4.73 -0.39 3.16 3.44 0.00 -0.62 -0.45 105.19 115.06 1xqw n GLY 129 Ca -0.18 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.62 1xqw n GLY 129 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xqw n GLY 130 N -0.97 -0.45 3.35 -0.02 0.00 -1.26 -2.97 105.19 102.86 1xqw n GLY 130 Ca -0.24 -1.85 -0.13 0.00 0.00 0.00 0.00 46.02 43.80 1xqw n GLY 130 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1xqw s LEU 131 N 0.00 0.23 0.00 0.99 2.34 -1.26 -4.58 118.68 116.40 1xqw s LEU 131 Ca 0.58 0.10 0.08 0.00 0.06 0.00 0.00 54.13 54.94 1xqw s LEU 131 Cb -0.02 1.87 -0.06 0.00 -0.56 0.00 0.00 46.19 47.42 1xqw s LEU 131 CO 0.40 -0.66 0.39 -1.54 -1.06 0.00 0.00 176.35 173.88 1xqw n SER 132 N 0.55 0.58 -3.62 1.48 3.41 -1.26 -3.75 113.62 111.01 1xqw n SER 132 Ca -0.19 -0.79 -0.14 0.00 -0.26 0.00 0.00 58.87 57.49 1xqw n SER 132 Cb 0.59 0.83 -0.13 0.00 -0.26 0.00 0.00 64.21 65.25 1xqw n SER 132 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1xqw s SER 133 N -1.54 0.52 0.11 4.04 0.15 -1.26 -1.08 113.70 114.64 1xqw s SER 133 Ca 0.04 0.44 -0.15 0.00 0.70 0.00 0.00 55.95 56.97 1xqw s SER 133 Cb 0.06 0.67 -0.05 0.00 -1.71 0.00 0.00 66.02 64.99 1xqw s SER 133 CO 0.27 -0.26 1.53 0.58 1.20 0.00 0.00 173.24 176.56 1xqw h VAL 134 N 6.29 1.27 -0.62 4.45 2.07 -1.42 -2.32 116.25 125.97 1xqw h VAL 134 Ca -0.15 -1.09 0.07 0.00 0.82 0.00 0.00 66.70 66.35 1xqw h VAL 134 Cb 1.12 1.27 -0.06 0.00 -1.52 0.00 0.00 31.29 32.11 1xqw h VAL 134 CO 0.17 0.36 0.31 -0.65 0.02 0.00 0.00 177.57 177.78 1xqw h PRO 135 N 0.45 0.55 -0.39 1.57 0.11 -1.74 0.23 132.00 132.78 1xqw h PRO 135 Ca 0.09 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.17 1xqw h PRO 135 Cb 0.54 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.51 1xqw h PRO 135 CO 0.03 0.37 0.25 1.25 -0.21 0.00 0.00 178.00 179.69 1xqw h LEU 136 N 0.57 0.45 -1.08 2.35 5.85 -1.91 -0.11 115.31 121.43 1xqw h LEU 136 Ca 0.29 -0.02 0.03 0.00 0.84 0.00 0.00 57.88 59.02 1xqw h LEU 136 Cb 0.24 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.10 1xqw h LEU 136 CO -0.21 0.34 0.62 0.74 -0.34 0.00 0.00 178.44 179.59 1xqw h THR 137 N 0.52 1.17 -0.42 1.05 2.02 -0.77 -1.38 112.91 115.10 1xqw h THR 137 Ca 0.14 -0.41 -0.06 0.00 0.77 0.00 0.00 66.41 66.85 1xqw h THR 137 Cb -0.05 -0.14 -0.02 0.00 -1.74 0.00 0.00 68.15 66.20 1xqw h THR 137 CO -0.03 0.22 0.05 0.58 0.37 0.00 0.00 175.52 176.71 1xqw h VAL 138 N 1.21 1.25 -0.33 3.16 2.07 -0.32 -0.32 116.25 122.97 1xqw h VAL 138 Ca 0.37 -0.93 0.06 0.00 0.82 0.00 0.00 66.70 67.02 1xqw h VAL 138 Cb -0.01 1.03 -0.05 0.00 -1.52 0.00 0.00 31.29 30.74 1xqw h VAL 138 CO -0.11 0.32 0.02 0.50 0.02 0.00 0.00 177.57 178.32 1xqw h LYS 139 N 0.56 0.12 -0.40 1.57 3.64 -0.17 0.29 116.57 122.18 1xqw h LYS 139 Ca 0.12 -0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.39 1xqw h LYS 139 Cb 0.41 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.19 1xqw h LYS 139 CO 0.01 0.08 -0.18 0.93 -2.27 0.00 0.00 179.45 178.02 1xqw h GLU 140 N 0.12 0.76 -0.41 1.90 4.39 -1.11 -2.77 114.58 117.46 1xqw h GLU 140 Ca 0.16 -0.28 -0.10 0.00 0.34 0.00 0.00 59.36 59.48 1xqw h GLU 140 Cb 0.20 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.79 1xqw h GLU 140 CO -0.25 0.89 -0.13 0.52 -1.16 0.00 0.00 179.01 178.88 1xqw h MET 141 N 0.68 0.75 -0.92 2.33 2.86 -0.52 -2.20 114.93 117.92 1xqw h MET 141 Ca 0.10 -0.26 -0.00 0.00 -2.06 0.00 0.00 59.70 57.48 1xqw h MET 141 Cb 0.67 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 32.23 1xqw h MET 141 CO 0.05 0.85 0.55 -0.91 1.06 0.00 0.00 176.91 178.51 1xqw h ASN 142 N 0.68 1.10 -0.73 1.22 -0.26 -0.76 -0.23 115.58 116.60 1xqw h ASN 142 Ca 0.11 -0.06 -0.04 0.00 -0.56 0.00 0.00 56.30 55.75 1xqw h ASN 142 Cb 0.61 -0.28 -0.03 0.00 -1.06 0.00 0.00 38.32 37.56 1xqw h ASN 142 CO 0.04 0.84 0.31 -0.09 -1.06 0.00 0.00 177.43 177.47 1xqw h ARG 143 N 1.26 1.10 -0.72 0.81 2.43 -1.18 -2.14 114.38 115.94 1xqw h ARG 143 Ca 0.33 -0.18 -0.05 0.00 -0.81 0.00 0.00 59.98 59.26 1xqw h ARG 143 Cb -0.06 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.27 1xqw h ARG 143 CO -0.06 0.88 0.25 -0.07 -1.51 0.00 0.00 179.97 179.45 1xqw h LEU 144 N 1.08 1.04 -0.35 3.80 3.38 -0.62 -1.60 115.31 122.03 1xqw h LEU 144 Ca 0.25 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1xqw h LEU 144 Cb 0.18 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1xqw h LEU 144 CO -0.02 0.96 0.22 0.40 0.09 0.00 0.00 178.44 180.08 1xqw h ILE 145 N 1.06 1.10 0.00 1.22 2.04 -0.60 -2.30 117.51 120.04 1xqw h ILE 145 Ca 0.24 -0.22 -0.05 0.00 1.00 0.00 0.00 64.86 65.83 1xqw h ILE 145 Cb 0.28 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 1xqw h ILE 145 CO -0.01 0.10 -0.25 0.44 0.00 0.00 0.00 178.15 178.43 1xqw h ASP 146 N 0.46 0.00 0.69 1.72 3.32 -1.16 -1.81 116.42 119.64 1xqw h ASP 146 Ca 0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.18 1xqw h ASP 146 Cb -0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.53 1xqw h ASP 146 CO -0.03 0.25 0.00 -0.62 -1.72 0.00 0.00 179.24 177.12 1xqw n GLU 147 N -4.17 0.10 -1.73 3.56 1.02 -0.62 -4.80 120.64 113.99 1xqw n GLU 147 Ca -0.02 0.09 -0.31 0.00 -0.02 0.00 0.00 57.16 56.90 1xqw n GLU 147 Cb 0.31 -1.50 0.03 0.00 -0.02 0.00 0.00 31.44 30.26 1xqw n GLU 147 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1xqw s LEU 148 N -2.87 3.20 0.24 -4.62 1.02 -0.68 -4.97 118.68 109.99 1xqw s LEU 148 Ca 0.14 1.54 -0.31 0.00 0.02 0.00 0.00 54.13 55.53 1xqw s LEU 148 Cb 0.15 -4.49 -0.11 0.00 0.02 0.00 0.00 46.19 41.77 1xqw s LEU 148 CO 0.40 -1.17 1.59 -2.16 0.02 0.00 0.00 176.35 175.03 1xqw s PRO 149 N -5.04 4.17 0.23 1.29 0.04 -1.26 -4.61 135.00 129.82 1xqw s PRO 149 Ca 0.57 2.48 0.09 0.00 0.04 0.00 0.00 61.00 64.18 1xqw s PRO 149 Cb -0.13 -3.08 0.74 0.00 0.04 0.00 0.00 34.50 32.07 1xqw s PRO 149 CO 0.53 -0.61 1.05 0.00 0.04 0.00 0.00 177.00 178.01 1xqw n ALA 150 N 3.02 0.54 -0.14 8.56 0.00 -1.26 -0.73 120.51 130.49 1xqw n ALA 150 Ca 0.11 0.70 -0.07 0.00 0.00 0.00 0.00 53.44 54.17 1xqw n ALA 150 Cb 0.38 -0.62 -0.06 0.00 0.00 0.00 0.00 19.45 19.15 1xqw n ALA 150 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1xqw h LYS 151 N 0.00 -0.14 -0.08 0.00 3.11 -2.00 0.43 116.57 117.89 1xqw h LYS 151 Ca 0.50 0.01 -0.21 0.00 -2.81 0.00 0.00 60.65 58.13 1xqw h LYS 151 Cb 1.22 0.03 0.00 0.00 -1.00 0.00 0.00 32.23 32.49 1xqw h LYS 151 CO -0.56 -0.09 -0.82 1.88 -2.81 0.00 0.00 179.45 177.04 1xqw h TYR 152 N -0.14 0.80 -0.86 1.91 -1.99 -1.29 -3.11 116.97 112.29 1xqw h TYR 152 Ca 0.06 -0.38 0.09 0.00 2.00 0.00 0.00 58.73 60.51 1xqw h TYR 152 Cb 0.30 -0.11 -0.07 0.00 2.00 0.00 0.00 36.73 38.85 1xqw h TYR 152 CO -0.79 1.18 0.51 -0.09 -0.00 0.00 0.00 178.16 178.96 1xqw h ARG 153 N 0.37 0.84 -0.13 4.88 2.43 -0.80 -1.49 114.38 120.49 1xqw h ARG 153 Ca -0.06 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.04 1xqw h ARG 153 Cb 1.43 -0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1xqw h ARG 153 CO 0.15 0.55 -0.01 -0.44 -1.51 0.00 0.00 179.97 178.71 1xqw h ASP 154 N 0.86 0.24 -0.89 -3.80 3.32 -0.16 -2.51 116.42 113.48 1xqw h ASP 154 Ca 0.41 -0.33 0.11 0.00 0.02 0.00 0.00 57.03 57.24 1xqw h ASP 154 Cb 0.34 -0.07 -0.07 0.00 0.22 0.00 0.00 39.33 39.75 1xqw h ASP 154 CO -0.23 0.52 0.58 0.00 -1.72 0.00 0.00 179.24 178.38 1xqw h ALA 155 N 0.73 1.69 -0.09 3.45 0.00 -1.38 0.27 119.26 123.94 1xqw h ALA 155 Ca 0.04 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1xqw h ALA 155 Cb 0.40 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1xqw h ALA 155 CO 0.01 0.10 0.03 0.82 0.00 0.00 0.00 179.25 180.21 1xqw h ILE 156 N 0.82 1.17 0.00 0.00 1.08 -1.12 -1.65 117.51 117.81 1xqw h ILE 156 Ca 0.43 -0.51 -0.09 0.00 -0.39 0.00 0.00 64.86 64.30 1xqw h ILE 156 Cb 0.51 1.34 -0.01 0.00 -3.07 0.00 0.00 36.82 35.59 1xqw h ILE 156 CO -0.19 0.15 -0.41 0.07 -0.69 0.00 0.00 178.15 177.07 1xqw h LYS 157 N -0.04 0.00 0.00 2.37 2.10 -0.92 -1.30 116.57 118.77 1xqw h LYS 157 Ca 0.03 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.68 1xqw h LYS 157 Cb 0.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.54 1xqw h LYS 157 CO -0.00 0.41 0.00 1.63 -2.00 0.00 0.00 179.45 179.49 1xqw n LYS 158 N -3.42 0.00 0.18 0.07 5.02 0.87 -2.98 118.16 117.90 1xqw n LYS 158 Ca 0.00 0.48 0.03 0.00 -2.02 0.00 0.00 58.31 56.81 1xqw n LYS 158 Cb 0.58 -1.04 0.33 0.00 -0.02 0.00 0.00 35.03 34.88 1xqw n LYS 158 CO 0.00 0.00 0.00 1.88 -0.52 0.00 0.00 177.40 178.76 1xqw h TYR 159 N 0.00 0.00 -0.29 2.13 -1.99 -1.47 -2.79 116.97 112.55 1xqw h TYR 159 Ca 0.00 0.00 -0.08 0.00 2.00 0.00 0.00 58.73 60.65 1xqw h TYR 159 Cb 0.00 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.71 1xqw h TYR 159 CO 0.02 0.42 -0.17 0.78 -0.00 0.00 0.00 178.16 179.22 1xqw h GLY 160 N 1.47 0.56 1.34 3.88 0.00 -1.30 -0.60 103.07 108.43 1xqw h GLY 160 Ca -0.00 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 46.91 1xqw h GLY 160 CO 0.05 0.38 -0.10 -1.26 0.00 0.00 0.00 176.54 175.62 1xqw n SER 161 N -4.17 0.24 -0.46 0.19 2.88 -1.07 -3.23 113.62 108.01 1xqw n SER 161 Ca 0.00 -0.18 0.06 0.00 -1.33 0.00 0.00 58.87 57.42 1xqw n SER 161 Cb 0.36 -0.19 0.05 0.00 -0.75 0.00 0.00 64.21 63.67 1xqw n SER 161 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1xqw n SER 162 N -1.23 1.97 -1.74 -3.46 3.41 -0.83 -4.99 113.62 106.75 1xqw n SER 162 Ca 0.12 -1.48 -0.17 0.00 -0.26 0.00 0.00 58.87 57.08 1xqw n SER 162 Cb 0.29 -0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 64.21 1xqw n SER 162 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xqw n GLY 163 N 0.63 0.15 2.75 5.00 0.00 -0.46 -4.92 105.19 108.34 1xqw n GLY 163 Ca 0.07 -0.20 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 1xqw n GLY 163 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1xqw n SER 164 N -1.05 6.59 0.00 1.61 7.64 -0.36 -4.77 113.62 123.28 1xqw n SER 164 Ca -0.19 -3.62 0.09 0.00 1.01 0.00 0.00 58.87 56.16 1xqw n SER 164 Cb 0.62 -1.08 0.48 0.00 -1.01 0.00 0.00 64.21 63.23 1xqw n SER 164 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1xqw n TYR 165 N 0.25 0.00 0.36 1.43 4.02 -1.26 -2.56 117.16 119.40 1xqw n TYR 165 Ca 0.39 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 58.36 1xqw n TYR 165 Cb 0.30 -0.15 0.22 0.00 -0.02 0.00 0.00 39.34 39.70 1xqw n TYR 165 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 1xqw n GLU 166 N -1.15 2.29 -3.12 -0.72 0.00 -1.26 -4.67 120.64 112.01 1xqw n GLU 166 Ca 0.11 -1.80 -0.39 0.00 0.00 0.00 0.00 57.16 55.07 1xqw n GLU 166 Cb 0.10 -1.45 -0.06 0.00 0.00 0.00 0.00 31.44 30.03 1xqw n GLU 166 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 1xqw s ASN 167 N -0.95 7.16 0.26 -1.84 2.47 -1.06 -4.98 114.94 116.00 1xqw s ASN 167 Ca 0.33 1.38 -0.04 0.00 0.42 0.00 0.00 52.86 54.95 1xqw s ASN 167 Cb 0.18 -2.42 0.32 0.00 -1.45 0.00 0.00 41.25 37.88 1xqw s ASN 167 CO 0.21 0.16 1.88 1.55 -3.72 0.00 0.00 177.10 177.18 1xqw h PRO 168 N 4.98 1.12 -0.37 0.43 0.13 -1.92 0.12 132.00 136.50 1xqw h PRO 168 Ca -0.47 -0.13 -0.04 0.00 -0.87 0.00 0.00 66.00 64.50 1xqw h PRO 168 Cb 1.21 -0.22 -0.02 0.00 0.13 0.00 0.00 31.00 32.10 1xqw h PRO 168 CO 0.67 0.83 0.09 0.93 -0.23 0.00 0.00 178.00 180.29 1xqw h GLU 169 N 1.13 0.59 -0.60 0.86 5.08 -1.98 0.30 114.58 119.96 1xqw h GLU 169 Ca 0.28 -0.14 -0.04 0.00 -1.00 0.00 0.00 59.36 58.46 1xqw h GLU 169 Cb 0.04 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 1xqw h GLU 169 CO -0.04 0.62 0.20 -0.92 -1.00 0.00 0.00 179.01 177.87 1xqw h TYR 170 N 0.45 0.96 -0.70 4.33 3.20 -1.77 -1.73 116.97 121.70 1xqw h TYR 170 Ca 0.12 -0.09 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 1xqw h TYR 170 Cb 0.30 -0.28 -0.03 0.00 1.54 0.00 0.00 36.73 38.26 1xqw h TYR 170 CO 0.02 0.78 0.37 0.37 -1.64 0.00 0.00 178.16 178.06 1xqw h GLN 171 N 0.85 0.99 0.00 1.82 5.75 -0.40 -1.00 115.11 123.13 1xqw h GLN 171 Ca 0.20 -0.13 -0.06 0.00 -0.15 0.00 0.00 58.65 58.51 1xqw h GLN 171 Cb 0.27 -0.19 -0.01 0.00 1.07 0.00 0.00 27.48 28.62 1xqw h GLN 171 CO -0.01 0.76 -0.28 1.49 -2.65 0.00 0.00 178.83 178.13 1xqw h GLU 172 N 0.97 0.00 -0.22 1.69 4.81 -0.13 -1.12 114.58 120.58 1xqw h GLU 172 Ca 0.24 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 59.28 1xqw h GLU 172 Cb 0.07 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.45 1xqw h GLU 172 CO -0.04 0.28 -0.63 0.00 -0.73 0.00 0.00 179.01 177.90 1xqw h ALA 173 N 1.72 0.47 -0.23 2.92 0.00 -0.38 -2.42 119.26 121.34 1xqw h ALA 173 Ca -0.00 -0.55 -0.04 0.00 0.00 0.00 0.00 54.91 54.32 1xqw h ALA 173 Cb 0.56 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1xqw h ALA 173 CO 0.04 0.69 -0.03 0.28 0.00 0.00 0.00 179.25 180.23 1xqw h VAL 174 N 0.57 1.27 -0.67 0.00 2.07 -0.72 -2.17 116.25 116.61 1xqw h VAL 174 Ca -0.01 -0.98 0.07 0.00 0.82 0.00 0.00 66.70 66.60 1xqw h VAL 174 Cb 1.23 1.45 -0.06 0.00 -1.52 0.00 0.00 31.29 32.39 1xqw h VAL 174 CO 0.13 0.30 0.35 -1.13 0.02 0.00 0.00 177.57 177.25 1xqw h ASN 175 N 0.18 0.50 0.41 0.57 -1.24 -1.22 -0.37 115.58 114.43 1xqw h ASN 175 Ca 0.06 0.04 -0.02 0.00 0.71 0.00 0.00 56.30 57.09 1xqw h ASN 175 Cb 0.46 -0.06 0.00 0.00 0.73 0.00 0.00 38.32 39.46 1xqw h ASN 175 CO 0.02 0.32 -0.20 0.22 -1.29 0.00 0.00 177.43 176.49 1xqw h TYR 176 N 0.64 -0.53 -0.81 0.67 3.20 -1.33 -0.64 116.97 118.18 1xqw h TYR 176 Ca 0.31 -0.01 0.14 0.00 3.14 0.00 0.00 58.73 62.30 1xqw h TYR 176 Cb 0.24 0.18 -0.09 0.00 1.54 0.00 0.00 36.73 38.59 1xqw h TYR 176 CO -0.09 -0.33 0.40 0.35 -1.64 0.00 0.00 178.16 176.86 1xqw h PHE 177 N -0.56 0.71 -0.44 -3.82 3.04 -0.97 -1.68 116.94 113.22 1xqw h PHE 177 Ca -0.06 0.03 -0.03 0.00 3.98 0.00 0.00 57.97 61.90 1xqw h PHE 177 Cb 0.43 -0.19 -0.02 0.00 2.56 0.00 0.00 35.95 38.73 1xqw h PHE 177 CO -0.05 0.18 0.17 1.88 -2.02 0.00 0.00 178.31 178.47 1xqw h TYR 178 N 0.60 0.68 0.00 0.41 -1.99 -0.76 0.33 116.97 116.24 1xqw h TYR 178 Ca 0.44 -0.06 0.00 0.00 2.00 0.00 0.00 58.73 61.11 1xqw h TYR 178 Cb 0.59 -0.20 0.00 0.00 2.00 0.00 0.00 36.73 39.12 1xqw h TYR 178 CO -0.10 0.59 0.00 0.72 -0.00 0.00 0.00 178.16 179.37 1xqw n HIS 179 N -4.59 0.00 -0.06 4.88 8.25 -0.27 -0.03 115.22 123.39 1xqw n HIS 179 Ca 0.01 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.39 1xqw n HIS 179 Cb 0.16 -0.25 -0.06 0.00 1.12 0.00 0.00 29.99 30.96 1xqw n HIS 179 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 1xqw n GLN 180 N -1.25 0.85 0.00 -0.41 -0.06 -0.74 -4.21 117.38 111.57 1xqw n GLN 180 Ca 0.10 0.05 0.01 0.00 -2.00 0.00 0.00 57.00 55.15 1xqw n GLN 180 Cb 0.14 -1.24 -0.01 0.00 -4.06 0.00 0.00 30.24 25.07 1xqw n GLN 180 CO 0.00 0.00 0.00 0.72 -0.20 0.00 0.00 177.06 177.58 1xqw n HIS 181 N -2.72 0.00 -0.09 3.69 8.25 0.11 -4.80 115.22 119.66 1xqw n HIS 181 Ca -0.20 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.11 1xqw n HIS 181 Cb 0.75 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.80 1xqw n HIS 181 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1xqw n LEU 182 N -0.82 1.74 -3.50 2.41 7.94 0.96 -1.93 117.00 123.79 1xqw n LEU 182 Ca 0.00 0.29 -0.12 0.00 -1.11 0.00 0.00 56.01 55.08 1xqw n LEU 182 Cb 0.02 -0.68 -0.11 0.00 0.53 0.00 0.00 43.42 43.19 1xqw n LEU 182 CO 0.02 0.04 -0.10 -0.22 -1.11 0.00 0.00 177.39 176.02 1xqw s LEU 183 N -7.54 -0.43 -1.24 -1.96 0.20 -0.48 -1.40 118.68 105.82 1xqw s LEU 183 Ca -0.28 0.31 -0.14 0.00 0.69 0.00 0.00 54.13 54.71 1xqw s LEU 183 Cb 0.08 0.88 0.15 0.00 -0.43 0.00 0.00 46.19 46.87 1xqw s LEU 183 CO 0.39 -0.28 1.54 0.54 -0.29 0.00 0.00 176.35 178.24 1xqw n ARG 184 N 5.35 3.35 -3.64 1.98 1.74 -1.26 -4.27 116.66 119.92 1xqw n ARG 184 Ca -0.05 -3.70 -0.15 0.00 -0.77 0.00 0.00 57.85 53.17 1xqw n ARG 184 Cb 0.50 -3.11 -0.08 0.00 -1.02 0.00 0.00 32.46 28.75 1xqw n ARG 184 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1xqw s SER 185 N 2.90 -0.57 0.00 0.55 0.15 -1.26 -5.00 113.70 110.46 1xqw s SER 185 Ca 0.45 0.89 0.27 0.00 0.70 0.00 0.00 55.95 58.26 1xqw s SER 185 Cb -0.00 0.88 0.92 0.00 -1.71 0.00 0.00 66.02 66.10 1xqw s SER 185 CO 0.01 -0.37 1.67 -1.84 1.20 0.00 0.00 173.24 173.92 1xqw n GLU 186 N 1.96 0.65 -3.45 5.44 -0.00 -1.26 -4.54 120.64 119.44 1xqw n GLU 186 Ca -0.17 -0.32 -0.28 0.00 -0.00 0.00 0.00 57.16 56.40 1xqw n GLU 186 Cb 0.56 -1.49 -0.11 0.00 -0.00 0.00 0.00 31.44 30.39 1xqw n GLU 186 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 1xqw s ASP 187 N -2.57 2.69 0.25 -1.84 3.68 -1.26 -5.13 116.67 112.49 1xqw s ASP 187 Ca 0.24 -2.21 -0.30 0.00 2.13 0.00 0.00 52.55 52.41 1xqw s ASP 187 Cb 0.19 -0.32 -0.10 0.00 -1.45 0.00 0.00 42.92 41.25 1xqw s ASP 187 CO 0.53 -0.29 1.32 0.26 0.13 0.00 0.00 175.17 177.12 1xqw s TRP 188 N 1.02 3.17 0.58 -5.34 0.52 -1.26 -4.99 118.94 112.63 1xqw s TRP 188 Ca 0.19 1.26 -0.19 0.00 0.02 0.00 0.00 56.10 57.39 1xqw s TRP 188 Cb -0.20 -3.65 -0.04 0.00 -1.15 0.00 0.00 33.47 28.43 1xqw s TRP 188 CO -0.01 -1.96 1.21 -1.25 0.02 0.00 0.00 176.95 174.96 1xqw s PRO 189 N -0.74 3.03 0.30 4.98 0.04 -1.26 -4.85 135.00 136.49 1xqw s PRO 189 Ca 0.54 1.83 0.04 0.00 0.04 0.00 0.00 61.00 63.45 1xqw s PRO 189 Cb -0.38 -1.96 0.65 0.00 0.04 0.00 0.00 34.50 32.85 1xqw s PRO 189 CO 0.44 -1.16 1.82 -1.35 0.04 0.00 0.00 177.00 176.78 1xqw h PRO 190 N 0.97 0.85 -0.96 0.56 0.11 -1.99 -1.85 132.00 129.69 1xqw h PRO 190 Ca -0.50 -0.05 0.05 0.00 0.11 0.00 0.00 66.00 65.60 1xqw h PRO 190 Cb 1.29 -0.19 -0.06 0.00 0.11 0.00 0.00 31.00 32.15 1xqw h PRO 190 CO 0.55 0.56 0.62 0.93 -0.21 0.00 0.00 178.00 180.46 1xqw h GLU 191 N 0.88 1.13 -0.20 1.05 3.07 -1.90 0.23 114.58 118.83 1xqw h GLU 191 Ca 0.52 -0.07 -0.07 0.00 -0.50 0.00 0.00 59.36 59.24 1xqw h GLU 191 Cb 0.67 -0.25 -0.00 0.00 -0.84 0.00 0.00 28.75 28.33 1xqw h GLU 191 CO -0.30 0.75 -0.17 0.28 -1.40 0.00 0.00 179.01 178.17 1xqw h VAL 192 N 1.16 1.33 -0.65 3.13 2.07 -1.62 -2.82 116.25 118.85 1xqw h VAL 192 Ca 0.40 -1.31 -0.01 0.00 0.82 0.00 0.00 66.70 66.60 1xqw h VAL 192 Cb 0.08 1.74 -0.03 0.00 -1.52 0.00 0.00 31.29 31.56 1xqw h VAL 192 CO -0.15 0.40 0.37 -0.07 0.02 0.00 0.00 177.57 178.14 1xqw h LEU 193 N 0.14 0.78 -0.61 2.57 3.38 -0.98 -2.05 115.31 118.54 1xqw h LEU 193 Ca 0.04 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1xqw h LEU 193 Cb 0.70 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.22 1xqw h LEU 193 CO 0.04 0.62 0.20 0.50 0.09 0.00 0.00 178.44 179.89 1xqw h LYS 194 N 0.90 0.94 -0.59 1.13 3.64 -0.48 -0.44 116.57 121.67 1xqw h LYS 194 Ca 0.23 -0.20 -0.08 0.00 -1.27 0.00 0.00 60.65 59.33 1xqw h LYS 194 Cb -0.01 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.66 1xqw h LYS 194 CO -0.04 0.83 0.05 0.77 -2.27 0.00 0.00 179.45 178.79 1xqw h SER 195 N 0.86 0.98 -0.24 4.20 0.02 -1.20 0.35 113.55 118.52 1xqw h SER 195 Ca 0.20 -0.28 -0.01 0.00 -0.84 0.00 0.00 61.79 60.86 1xqw h SER 195 Cb 0.28 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 1xqw h SER 195 CO -0.01 1.02 0.13 -0.07 -1.14 0.00 0.00 176.83 176.76 1xqw h LEU 196 N 0.91 0.30 -0.57 5.07 3.38 -1.16 -1.12 115.31 122.12 1xqw h LEU 196 Ca 0.17 -0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.10 1xqw h LEU 196 Cb 0.49 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.12 1xqw h LEU 196 CO 0.02 0.31 0.31 -0.08 0.09 0.00 0.00 178.44 179.09 1xqw h GLU 197 N 0.27 0.58 -0.93 1.13 4.57 -0.83 -1.90 114.58 117.49 1xqw h GLU 197 Ca 0.08 -0.04 0.04 0.00 -1.18 0.00 0.00 59.36 58.27 1xqw h GLU 197 Cb 0.07 -0.13 -0.05 0.00 -0.16 0.00 0.00 28.75 28.48 1xqw h GLU 197 CO -0.01 0.39 0.61 1.88 -1.18 0.00 0.00 179.01 180.69 1xqw h TYR 198 N 0.60 1.12 -0.58 0.92 0.05 -0.51 -0.70 116.97 117.87 1xqw h TYR 198 Ca 0.25 0.03 -0.06 0.00 0.05 0.00 0.00 58.73 58.99 1xqw h TYR 198 Cb 0.12 -0.37 -0.03 0.00 1.01 0.00 0.00 36.73 37.46 1xqw h TYR 198 CO -0.08 0.64 0.12 0.00 -1.05 0.00 0.00 178.16 177.78 1xqw h ALA 199 N 1.47 1.12 0.00 3.88 0.00 -0.43 -1.51 119.26 123.78 1xqw h ALA 199 Ca 0.37 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 1xqw h ALA 199 Cb 0.04 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1xqw h ALA 199 CO -0.12 0.59 -0.55 1.49 0.00 0.00 0.00 179.25 180.65 1xqw h GLU 200 N 0.87 0.00 0.19 0.00 4.81 -0.89 -3.29 114.58 116.27 1xqw h GLU 200 Ca 0.18 0.00 -0.31 0.00 -0.13 0.00 0.00 59.36 59.11 1xqw h GLU 200 Cb 0.35 0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.75 1xqw h GLU 200 CO 0.00 0.55 -1.39 0.00 -0.73 0.00 0.00 179.01 177.45 1xqw h ARG 201 N 0.00 0.40 0.00 1.92 2.47 -0.70 -3.47 114.38 115.00 1xqw h ARG 201 Ca -0.01 -0.68 -0.16 0.00 -1.26 0.00 0.00 59.98 57.87 1xqw h ARG 201 Cb 1.14 0.25 0.04 0.00 -1.65 0.00 0.00 29.97 29.75 1xqw h ARG 201 CO 0.07 1.32 0.08 0.54 0.56 0.00 0.00 179.97 182.54 1xqw n ARG 202 N -3.61 0.09 -0.02 0.04 5.12 -0.61 -5.06 116.66 112.61 1xqw n ARG 202 Ca -0.13 -0.89 0.04 0.00 -1.93 0.00 0.00 57.85 54.94 1xqw n ARG 202 Cb 1.07 -0.32 -0.10 0.00 -1.16 0.00 0.00 32.46 31.95 1xqw n ARG 202 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1xqw n ASN 203 N -3.08 2.00 -0.23 0.55 3.02 -1.26 -4.67 115.26 111.59 1xqw n ASN 203 Ca 0.06 0.00 0.03 0.00 -0.03 0.00 0.00 54.58 54.63 1xqw n ASN 203 Cb 0.21 1.41 0.14 0.00 -0.61 0.00 0.00 39.78 40.93 1xqw n ASN 203 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1xqw h VAL 204 N 0.00 0.67 -0.57 2.41 2.07 -1.89 -0.51 116.25 118.44 1xqw h VAL 204 Ca -0.08 -0.13 0.03 0.00 0.82 0.00 0.00 66.70 67.34 1xqw h VAL 204 Cb 0.87 0.27 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 1xqw h VAL 204 CO 0.00 0.07 0.34 0.22 0.02 0.00 0.00 177.57 178.23 1xqw h TYR 205 N 0.37 0.64 -0.11 1.57 3.20 -1.76 0.24 116.97 121.14 1xqw h TYR 205 Ca 0.36 0.02 -0.14 0.00 3.14 0.00 0.00 58.73 62.11 1xqw h TYR 205 Cb 0.52 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.57 1xqw h TYR 205 CO -0.20 0.37 -0.53 -0.09 -1.64 0.00 0.00 178.16 176.07 1xqw h ARG 206 N 0.68 0.30 0.17 1.82 2.43 -1.60 0.18 114.38 118.36 1xqw h ARG 206 Ca 0.23 -0.18 -0.31 0.00 -0.81 0.00 0.00 59.98 58.91 1xqw h ARG 206 Cb 0.02 0.02 0.01 0.00 -0.42 0.00 0.00 29.97 29.60 1xqw h ARG 206 CO -0.10 0.76 -1.52 0.82 -1.51 0.00 0.00 179.97 178.41 1xqw h ILE 207 N 0.23 1.07 0.04 1.20 1.08 -0.82 -3.36 117.51 116.95 1xqw h ILE 207 Ca 0.01 -2.50 -0.34 0.00 -0.39 0.00 0.00 64.86 61.63 1xqw h ILE 207 Cb 1.01 2.83 -0.05 0.00 -3.07 0.00 0.00 36.82 37.54 1xqw h ILE 207 CO 0.09 0.79 -2.00 0.23 -0.69 0.00 0.00 178.15 176.57 1xqw n MET 208 N -3.77 0.68 0.00 2.37 2.81 0.83 -2.37 117.12 117.67 1xqw n MET 208 Ca -0.23 0.22 0.00 0.00 -1.81 0.00 0.00 57.70 55.88 1xqw n MET 208 Cb 1.00 -1.69 0.00 0.00 -0.71 0.00 0.00 33.22 31.82 1xqw n MET 208 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1xqw n ASN 209 N -3.14 0.00 0.00 7.83 2.85 -0.42 -2.00 115.26 120.37 1xqw n ASN 209 Ca -0.27 0.02 0.00 0.00 -0.11 0.00 0.00 54.58 54.22 1xqw n ASN 209 Cb 1.06 -0.26 0.00 0.00 1.24 0.00 0.00 39.78 41.82 1xqw n ASN 209 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1xqw n GLY 210 N 2.00 0.14 0.38 8.20 0.00 -0.08 0.13 105.19 115.96 1xqw n GLY 210 Ca 0.00 -1.66 0.15 0.00 0.00 0.00 0.00 46.02 44.51 1xqw n GLY 210 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1xqw h PRO 211 N 4.68 0.59 0.00 1.61 0.11 -1.86 -3.40 132.00 133.73 1xqw h PRO 211 Ca 0.00 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 66.11 1xqw h PRO 211 Cb 0.00 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 30.97 1xqw h PRO 211 CO 0.00 0.39 0.36 0.27 -0.21 0.00 0.00 178.00 178.81 1xqw n ASN 212 N -4.59 -1.94 -0.34 -2.05 0.23 -1.26 -5.01 115.26 100.29 1xqw n ASN 212 Ca 0.20 -2.25 0.15 0.00 -0.53 0.00 0.00 54.58 52.15 1xqw n ASN 212 Cb 0.58 3.22 0.35 0.00 -2.08 0.00 0.00 39.78 41.85 1xqw n ASN 212 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1xqw h GLU 213 N 0.00 0.63 -0.46 -3.83 4.39 -1.97 -2.08 114.58 111.26 1xqw h GLU 213 Ca -0.29 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.37 1xqw h GLU 213 Cb 1.13 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.64 1xqw h GLU 213 CO 0.37 0.41 0.00 1.97 -1.16 0.00 0.00 179.01 180.61 1xqw n PHE 214 N -4.85 0.86 -3.02 4.33 1.16 -1.26 -4.58 117.46 110.10 1xqw n PHE 214 Ca 0.25 -0.59 -0.25 0.00 -1.87 0.00 0.00 57.45 54.99 1xqw n PHE 214 Cb 0.66 -0.12 -0.04 0.00 -1.61 0.00 0.00 39.48 38.37 1xqw n PHE 214 CO 0.00 0.00 0.00 2.41 -1.87 0.00 0.00 176.76 177.30 1xqw n THR 215 N 0.66 2.37 -2.52 1.97 -1.04 -0.78 -4.96 114.28 109.98 1xqw n THR 215 Ca 0.18 -5.36 -0.40 0.00 -2.04 0.00 0.00 64.05 56.44 1xqw n THR 215 Cb 0.64 -1.23 -0.03 0.00 -1.82 0.00 0.00 70.33 67.90 1xqw n THR 215 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1xqw s ILE 216 N -3.93 3.91 -0.17 12.58 1.01 -1.26 -3.59 121.20 129.76 1xqw s ILE 216 Ca 0.47 -0.93 0.16 0.00 0.00 0.00 0.00 60.65 60.35 1xqw s ILE 216 Cb 0.28 -5.00 0.42 0.00 0.01 0.00 0.00 42.46 38.17 1xqw s ILE 216 CO -0.12 -1.87 1.29 0.35 0.00 0.00 0.00 174.94 174.60 1xqw n THR 217 N 6.89 2.14 -0.37 2.92 -2.24 -0.20 -4.65 114.28 118.77 1xqw n THR 217 Ca 0.36 -2.25 0.00 0.00 -2.27 0.00 0.00 64.05 59.89 1xqw n THR 217 Cb 0.50 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.47 1xqw n THR 217 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xqw n GLY 218 N -1.03 -0.79 0.00 3.38 0.00 0.34 -4.88 105.19 102.22 1xqw n GLY 218 Ca 0.20 -1.66 0.10 0.00 0.00 0.00 0.00 46.02 44.66 1xqw n GLY 218 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xqw n THR 219 N -0.62 0.00 0.37 2.61 -2.24 -0.85 -3.09 114.28 110.46 1xqw n THR 219 Ca 0.00 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.82 1xqw n THR 219 Cb 0.00 -0.40 0.03 0.00 -2.10 0.00 0.00 70.33 67.86 1xqw n THR 219 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 1xqw n ILE 220 N -0.84 0.00 -0.10 2.28 -5.35 -1.12 -4.73 119.36 109.49 1xqw n ILE 220 Ca 0.15 -0.49 0.26 0.00 -0.27 0.00 0.00 62.75 62.40 1xqw n ILE 220 Cb 0.07 1.17 0.64 0.00 -1.74 0.00 0.00 39.64 39.78 1xqw n ILE 220 CO 0.00 0.00 0.00 0.07 -1.76 0.00 0.00 176.55 174.86 1xqw h LYS 221 N 1.63 0.00 -0.01 6.28 2.10 -1.79 0.15 116.57 124.92 1xqw h LYS 221 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1xqw h LYS 221 Cb 0.36 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.69 1xqw h LYS 221 CO 0.00 0.00 -0.29 -0.25 -2.00 0.00 0.00 179.45 176.91 1xqw n ASP 222 N -3.60 1.43 -4.65 7.07 10.43 -1.26 -3.78 116.55 122.19 1xqw n ASP 222 Ca 0.17 -1.22 -0.48 0.00 2.57 0.00 0.00 54.79 55.84 1xqw n ASP 222 Cb 1.09 0.48 -0.05 0.00 1.84 0.00 0.00 41.12 44.48 1xqw n ASP 222 CO 0.00 0.00 0.00 1.87 -1.07 0.00 0.00 177.20 178.00 1xqw n TRP 223 N -0.21 2.12 -3.46 1.24 -0.00 0.51 -4.79 117.44 112.84 1xqw n TRP 223 Ca 0.06 0.33 0.01 0.00 -0.00 0.00 0.00 57.50 57.89 1xqw n TRP 223 Cb 0.28 -2.51 -0.03 0.00 -0.00 0.00 0.00 31.31 29.06 1xqw n TRP 223 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 177.69 178.03 1xqw s ASP 224 N 1.18 -1.23 -0.14 5.87 3.68 -1.26 -1.12 116.67 123.66 1xqw s ASP 224 Ca 0.82 1.30 0.15 0.00 2.13 0.00 0.00 52.55 56.95 1xqw s ASP 224 Cb -0.75 2.24 0.36 0.00 -1.45 0.00 0.00 42.92 43.33 1xqw s ASP 224 CO 0.42 -0.23 1.18 2.30 0.13 0.00 0.00 175.17 178.96 1xqw n ILE 225 N 5.44 1.56 -0.08 4.11 -6.64 -0.24 -4.81 119.36 118.70 1xqw n ILE 225 Ca -0.08 -2.37 0.19 0.00 -1.77 0.00 0.00 62.75 58.72 1xqw n ILE 225 Cb 0.50 0.05 0.62 0.00 -1.44 0.00 0.00 39.64 39.36 1xqw n ILE 225 CO 0.00 0.00 0.00 0.74 -1.77 0.00 0.00 176.55 175.52 1xqw h THR 226 N 2.35 0.74 -0.00 7.28 2.02 -1.95 0.74 112.91 124.09 1xqw h THR 226 Ca -0.04 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.08 1xqw h THR 226 Cb 1.20 0.56 0.00 0.00 -1.74 0.00 0.00 68.15 68.17 1xqw h THR 226 CO 0.02 0.03 -0.01 -0.90 0.37 0.00 0.00 175.52 175.02 1xqw n ASP 227 N -4.41 0.07 -0.09 4.18 5.75 -1.26 -3.80 116.55 116.99 1xqw n ASP 227 Ca 0.12 -0.43 -0.11 0.00 -0.01 0.00 0.00 54.79 54.36 1xqw n ASP 227 Cb 0.61 -0.18 -0.11 0.00 -1.03 0.00 0.00 41.12 40.40 1xqw n ASP 227 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1xqw n LYS 228 N -1.16 0.91 0.33 0.11 4.76 0.22 -4.62 118.16 118.72 1xqw n LYS 228 Ca 0.17 0.06 0.18 0.00 -2.87 0.00 0.00 58.31 55.85 1xqw n LYS 228 Cb 0.21 -1.42 0.97 0.00 -1.84 0.00 0.00 35.03 32.95 1xqw n LYS 228 CO 0.00 0.00 0.00 -0.84 -1.37 0.00 0.00 177.40 175.19 1xqw h ILE 229 N 0.00 0.02 0.00 -0.18 3.07 -1.58 -1.79 117.51 117.05 1xqw h ILE 229 Ca -0.46 0.00 0.00 0.00 1.55 0.00 0.00 64.86 65.95 1xqw h ILE 229 Cb 1.87 0.79 0.00 0.00 -0.27 0.00 0.00 36.82 39.21 1xqw h ILE 229 CO -0.03 0.00 0.00 0.77 -1.05 0.00 0.00 178.15 177.84 1xqw h SER 230 N 0.00 0.00 0.53 2.16 4.64 -1.78 -1.05 113.55 118.05 1xqw h SER 230 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xqw h SER 230 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 1xqw h SER 230 CO -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 1xqw n ALA 231 N -1.95 1.93 -2.64 5.18 0.00 -0.67 -4.69 120.51 117.68 1xqw n ALA 231 Ca -0.01 -0.08 -0.43 0.00 0.00 0.00 0.00 53.44 52.92 1xqw n ALA 231 Cb 0.12 -1.31 -0.02 0.00 0.00 0.00 0.00 19.45 18.24 1xqw n ALA 231 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1xqw s ILE 232 N -2.82 4.60 -0.78 0.00 -1.09 -0.40 -4.89 121.20 115.82 1xqw s ILE 232 Ca 0.13 1.91 0.06 0.00 -2.23 0.00 0.00 60.65 60.53 1xqw s ILE 232 Cb 0.13 -4.32 0.05 0.00 -1.58 0.00 0.00 42.46 36.73 1xqw s ILE 232 CO 0.33 -0.26 0.69 0.29 -1.23 0.00 0.00 174.94 174.75 1xqw n LYS 233 N 6.50 -0.03 -2.41 2.79 4.01 -1.26 -4.41 118.16 123.35 1xqw n LYS 233 Ca 0.12 -0.86 -0.28 0.00 -0.51 0.00 0.00 58.31 56.78 1xqw n LYS 233 Cb 0.46 -1.11 0.01 0.00 -0.51 0.00 0.00 35.03 33.88 1xqw n LYS 233 CO 0.00 0.00 0.00 0.96 -1.11 0.00 0.00 177.40 177.25 1xqw s ILE 234 N -0.54 4.66 0.15 -0.18 -4.36 -1.26 -4.98 121.20 114.69 1xqw s ILE 234 Ca 0.07 0.34 -0.34 0.00 -0.26 0.00 0.00 60.65 60.46 1xqw s ILE 234 Cb 0.05 -3.80 -0.14 0.00 1.25 0.00 0.00 42.46 39.82 1xqw s ILE 234 CO 0.08 -0.86 1.53 -2.65 0.24 0.00 0.00 174.94 173.28 1xqw n PRO 235 N -2.44 1.99 -4.37 0.37 -0.02 -1.26 -4.80 135.00 124.48 1xqw n PRO 235 Ca 0.02 0.72 -0.20 0.00 -2.02 0.00 0.00 63.50 62.03 1xqw n PRO 235 Cb 0.55 -2.46 -0.15 0.00 -0.02 0.00 0.00 33.50 31.42 1xqw n PRO 235 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1xqw s THR 236 N 0.80 0.74 -0.18 3.45 2.01 -1.26 -0.20 115.64 120.99 1xqw s THR 236 Ca 0.79 -0.35 0.01 0.00 0.31 0.00 0.00 61.69 62.45 1xqw s THR 236 Cb -0.72 -0.65 0.03 0.00 0.01 0.00 0.00 72.50 71.17 1xqw s THR 236 CO 0.40 0.23 -0.18 -0.22 -0.69 0.00 0.00 174.62 174.16 1xqw s LEU 237 N 0.08 2.20 -0.18 4.42 2.96 0.52 -1.04 118.68 127.64 1xqw s LEU 237 Ca -0.01 -0.71 -0.03 0.00 -0.22 0.00 0.00 54.13 53.16 1xqw s LEU 237 Cb -0.07 -1.43 -0.02 0.00 0.50 0.00 0.00 46.19 45.17 1xqw s LEU 237 CO 0.00 -0.03 -0.05 -0.63 -1.32 0.00 0.00 176.35 174.31 1xqw s ILE 238 N 1.31 3.54 0.20 6.68 1.01 0.23 -1.32 121.20 132.85 1xqw s ILE 238 Ca 0.03 -0.46 0.10 0.00 0.00 0.00 0.00 60.65 60.32 1xqw s ILE 238 Cb -0.14 -2.57 -0.04 0.00 0.01 0.00 0.00 42.46 39.72 1xqw s ILE 238 CO -0.12 0.46 -0.21 0.42 0.00 0.00 0.00 174.94 175.50 1xqw s THR 239 N 0.85 2.17 -0.10 2.92 -4.23 -0.13 -0.10 115.64 117.03 1xqw s THR 239 Ca -0.01 -2.09 -0.30 0.00 -1.18 0.00 0.00 61.69 58.10 1xqw s THR 239 Cb -0.15 -2.07 0.09 0.00 1.34 0.00 0.00 72.50 71.72 1xqw s THR 239 CO 0.01 -0.28 0.78 0.54 -0.54 0.00 0.00 174.62 175.14 1xqw s VAL 240 N -2.06 0.00 0.28 2.29 0.11 -0.60 -1.59 120.40 118.83 1xqw s VAL 240 Ca 0.21 0.00 -0.11 0.00 -2.93 0.00 0.00 61.98 59.15 1xqw s VAL 240 Cb -0.06 -1.00 -0.08 0.00 -1.53 0.00 0.00 36.38 33.71 1xqw s VAL 240 CO 0.10 0.00 0.64 -0.83 -3.33 0.00 0.00 175.10 171.67 1xqw s GLY 241 N -1.08 2.25 0.21 6.54 0.00 -1.05 -0.25 107.32 113.94 1xqw s GLY 241 Ca -0.08 -0.17 -0.09 0.00 0.00 0.00 0.00 44.72 44.39 1xqw s GLY 241 CO 0.07 -0.00 1.74 -2.09 0.00 0.00 0.00 173.10 172.82 1xqw h GLU 242 N 2.27 0.39 -0.62 2.90 4.81 -0.06 -1.93 114.58 122.34 1xqw h GLU 242 Ca -0.47 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 1xqw h GLU 242 Cb 1.17 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.47 1xqw h GLU 242 CO 0.67 0.26 0.00 0.66 -0.73 0.00 0.00 179.01 179.87 1xqw n TYR 243 N -5.00 1.68 -1.64 0.92 4.01 0.58 -4.80 117.16 112.91 1xqw n TYR 243 Ca 0.09 -0.66 -0.48 0.00 -0.16 0.00 0.00 57.90 56.70 1xqw n TYR 243 Cb 0.29 -0.34 -0.04 0.00 -0.31 0.00 0.00 39.34 38.94 1xqw n TYR 243 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1xqw n ASP 244 N 0.93 2.42 0.30 7.72 4.64 -0.73 -4.23 116.55 127.60 1xqw n ASP 244 Ca 0.27 1.11 0.15 0.00 -1.38 0.00 0.00 54.79 54.94 1xqw n ASP 244 Cb 1.00 -1.34 0.92 0.00 -1.04 0.00 0.00 41.12 40.66 1xqw n ASP 244 CO 0.00 0.00 0.00 1.05 -0.82 0.00 0.00 177.20 177.43 1xqw h GLU 245 N 4.84 0.00 -3.41 -0.67 4.11 -1.70 -2.53 114.58 115.22 1xqw h GLU 245 Ca -0.45 0.00 -0.74 0.00 0.07 0.00 0.00 59.36 58.24 1xqw h GLU 245 Cb 1.29 0.00 -0.33 0.00 0.50 0.00 0.00 28.75 30.21 1xqw h GLU 245 CO 0.80 0.01 0.08 0.08 0.07 0.00 0.00 179.01 180.06 1xqw s VAL 246 N -4.54 4.89 0.79 -1.06 1.01 -1.26 -4.57 120.40 115.66 1xqw s VAL 246 Ca -0.05 -3.70 -0.16 0.00 0.00 0.00 0.00 61.98 58.07 1xqw s VAL 246 Cb 0.15 -4.00 -0.09 0.00 0.00 0.00 0.00 36.38 32.43 1xqw s VAL 246 CO 0.54 -1.12 -0.10 0.35 0.00 0.00 0.00 175.10 174.78 1xqw n THR 247 N 2.49 0.52 0.26 3.92 -2.24 -0.95 -4.74 114.28 113.53 1xqw n THR 247 Ca 0.22 -0.43 0.15 0.00 -2.27 0.00 0.00 64.05 61.72 1xqw n THR 247 Cb 0.38 -0.29 0.79 0.00 -2.10 0.00 0.00 70.33 69.10 1xqw n THR 247 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1xqw h PRO 248 N -0.63 0.00 -0.41 -0.78 0.13 -1.85 -0.23 132.00 128.23 1xqw h PRO 248 Ca -0.44 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.58 1xqw h PRO 248 Cb 1.35 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.47 1xqw h PRO 248 CO 0.35 0.00 -0.22 -0.91 -0.23 0.00 0.00 178.00 176.99 1xqw h ASN 249 N 0.00 0.83 -0.24 1.44 -0.26 -1.98 0.23 115.58 115.60 1xqw h ASN 249 Ca 0.00 -0.30 -0.16 0.00 -0.56 0.00 0.00 56.30 55.28 1xqw h ASN 249 Cb 0.08 -0.23 -0.01 0.00 -1.06 0.00 0.00 38.32 37.11 1xqw h ASN 249 CO 0.00 1.02 -0.42 0.58 -1.06 0.00 0.00 177.43 177.55 1xqw h VAL 250 N 0.71 1.28 -0.55 2.81 2.07 -1.35 -2.93 116.25 118.29 1xqw h VAL 250 Ca 0.10 -1.60 -0.05 0.00 0.82 0.00 0.00 66.70 65.97 1xqw h VAL 250 Cb 0.74 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.97 1xqw h VAL 250 CO 0.06 0.52 0.15 0.00 0.02 0.00 0.00 177.57 178.32 1xqw h ALA 251 N 0.87 0.72 -0.91 1.67 0.00 -1.22 -2.79 119.26 117.60 1xqw h ALA 251 Ca 0.05 -0.21 0.13 0.00 0.00 0.00 0.00 54.91 54.88 1xqw h ALA 251 Cb 0.99 -0.21 -0.09 0.00 0.00 0.00 0.00 17.79 18.48 1xqw h ALA 251 CO 0.09 0.41 0.53 -0.09 0.00 0.00 0.00 179.25 180.19 1xqw h ARG 252 N 0.77 0.77 -0.97 0.00 2.43 -0.42 0.54 114.38 117.50 1xqw h ARG 252 Ca 0.17 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.32 1xqw h ARG 252 Cb 0.32 -0.17 -0.05 0.00 -0.42 0.00 0.00 29.97 29.64 1xqw h ARG 252 CO -0.00 0.51 0.64 0.28 -1.51 0.00 0.00 179.97 179.89 1xqw h VAL 253 N 0.79 1.21 -0.06 0.20 2.07 -1.32 0.41 116.25 119.56 1xqw h VAL 253 Ca 0.48 -0.44 -0.02 0.00 0.82 0.00 0.00 66.70 67.54 1xqw h VAL 253 Cb 0.58 -0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 30.17 1xqw h VAL 253 CO -0.31 0.23 -0.04 0.40 0.02 0.00 0.00 177.57 177.87 1xqw h ILE 254 N 1.27 1.34 -0.77 4.57 2.04 -1.05 -3.19 117.51 121.73 1xqw h ILE 254 Ca 0.37 -1.10 0.13 0.00 1.00 0.00 0.00 64.86 65.26 1xqw h ILE 254 Cb -0.08 1.95 -0.09 0.00 -0.74 0.00 0.00 36.82 37.87 1xqw h ILE 254 CO -0.10 0.30 0.36 -0.74 0.00 0.00 0.00 178.15 177.98 1xqw h HIS 255 N -0.27 0.64 -0.33 1.37 2.76 -0.47 -2.43 115.15 116.41 1xqw h HIS 255 Ca 0.01 0.03 0.04 0.00 -2.20 0.00 0.00 60.37 58.25 1xqw h HIS 255 Cb 0.50 -0.17 -0.04 0.00 1.55 0.00 0.00 27.41 29.26 1xqw h HIS 255 CO 0.08 0.16 0.10 0.93 -1.30 0.00 0.00 177.93 177.90 1xqw h GLU 256 N 0.56 0.23 -0.20 5.26 5.08 -0.95 -3.15 114.58 121.41 1xqw h GLU 256 Ca 0.41 -0.01 -0.14 0.00 -1.00 0.00 0.00 59.36 58.61 1xqw h GLU 256 Cb 0.54 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 1xqw h GLU 256 CO -0.34 0.15 -0.47 0.87 -1.00 0.00 0.00 179.01 178.22 1xqw h LYS 257 N 0.24 0.52 -5.08 2.33 6.56 -1.44 -3.40 116.57 116.30 1xqw h LYS 257 Ca 0.15 -0.29 -0.67 0.00 -1.06 0.00 0.00 60.65 58.78 1xqw h LYS 257 Cb 0.13 0.02 -0.17 0.00 -0.57 0.00 0.00 32.23 31.64 1xqw h LYS 257 CO -0.16 0.88 0.37 0.42 -2.06 0.00 0.00 179.45 178.90 1xqw s ILE 258 N -4.12 4.57 0.47 1.86 1.09 -0.97 -4.15 121.20 119.95 1xqw s ILE 258 Ca -0.07 -0.73 -0.24 0.00 -1.10 0.00 0.00 60.65 58.51 1xqw s ILE 258 Cb 0.12 -4.61 -0.08 0.00 -1.06 0.00 0.00 42.46 36.84 1xqw s ILE 258 CO 0.83 -1.32 1.33 0.00 -0.10 0.00 0.00 174.94 175.68 1xqw n ALA 259 N 7.02 1.55 -0.46 9.38 0.00 -1.26 -1.77 120.51 134.97 1xqw n ALA 259 Ca -0.04 0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.60 1xqw n ALA 259 Cb 0.44 -2.32 0.00 0.00 0.00 0.00 0.00 19.45 17.57 1xqw n ALA 259 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xqw n GLY 260 N 0.75 1.42 3.76 0.00 0.00 -1.26 -4.91 105.19 104.94 1xqw n GLY 260 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 1xqw n GLY 260 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xqw s SER 261 N -3.07 4.27 0.02 1.61 1.04 -0.73 -4.66 113.70 112.18 1xqw s SER 261 Ca 0.00 1.76 0.05 0.00 0.48 0.00 0.00 55.95 58.24 1xqw s SER 261 Cb 0.00 -2.45 -0.03 0.00 0.10 0.00 0.00 66.02 63.64 1xqw s SER 261 CO 0.00 -2.18 -0.13 -1.61 0.98 0.00 0.00 173.24 170.30 1xqw s GLU 262 N -4.91 2.29 -0.13 4.02 2.02 -0.21 -5.00 118.70 116.79 1xqw s GLU 262 Ca 0.62 -0.86 0.01 0.00 0.02 0.00 0.00 54.97 54.75 1xqw s GLU 262 Cb -0.17 -2.32 0.02 0.00 0.10 0.00 0.00 34.13 31.75 1xqw s GLU 262 CO 0.56 0.57 -0.15 -1.17 0.02 0.00 0.00 175.26 175.10 1xqw s LEU 263 N -1.40 1.70 -0.11 1.80 2.96 -1.26 0.77 118.68 123.15 1xqw s LEU 263 Ca 0.16 -0.46 0.01 0.00 -0.22 0.00 0.00 54.13 53.61 1xqw s LEU 263 Cb -0.11 -1.14 0.02 0.00 0.50 0.00 0.00 46.19 45.46 1xqw s LEU 263 CO 0.06 -0.03 -0.11 -2.28 -1.32 0.00 0.00 176.35 172.67 1xqw s HIS 264 N 1.28 1.68 -0.33 5.38 5.65 0.86 -4.98 115.29 124.83 1xqw s HIS 264 Ca 0.00 -0.80 -0.10 0.00 0.25 0.00 0.00 55.06 54.41 1xqw s HIS 264 Cb -0.14 -1.29 -0.00 0.00 -1.18 0.00 0.00 32.58 29.98 1xqw s HIS 264 CO -0.07 -0.47 0.18 0.08 -0.65 0.00 0.00 174.74 173.81 1xqw s VAL 265 N 1.27 4.71 -0.37 0.89 1.01 -1.26 -1.56 120.40 125.09 1xqw s VAL 265 Ca -0.02 -0.48 -0.29 0.00 0.00 0.00 0.00 61.98 61.19 1xqw s VAL 265 Cb -0.14 -3.45 0.01 0.00 0.00 0.00 0.00 36.38 32.80 1xqw s VAL 265 CO -0.04 -0.01 1.33 -0.36 0.00 0.00 0.00 175.10 176.02 1xqw s PHE 266 N 1.62 2.57 0.45 5.22 0.40 0.66 -4.85 117.98 124.05 1xqw s PHE 266 Ca 0.04 0.77 -0.24 0.00 -0.60 0.00 0.00 56.93 56.90 1xqw s PHE 266 Cb -0.18 -4.15 -0.07 0.00 0.51 0.00 0.00 43.02 39.13 1xqw s PHE 266 CO 0.07 -1.77 1.26 1.03 0.70 0.00 0.00 175.22 176.50 1xqw s ARG 267 N 4.55 3.74 -1.91 0.44 1.81 -1.26 -1.44 118.95 124.88 1xqw s ARG 267 Ca 0.57 2.02 0.00 0.00 -1.72 0.00 0.00 55.73 56.60 1xqw s ARG 267 Cb -0.14 -2.54 0.00 0.00 -0.45 0.00 0.00 34.95 31.82 1xqw s ARG 267 CO 0.28 -0.64 0.00 -0.25 -0.68 0.00 0.00 175.30 174.02 1xqw n ASP 268 N -0.31 -5.22 -4.43 0.23 10.43 -1.26 -4.89 116.55 111.11 1xqw n ASP 268 Ca 0.06 0.40 -0.21 0.00 2.57 0.00 0.00 54.79 57.62 1xqw n ASP 268 Cb 0.46 -4.33 -0.10 0.00 1.84 0.00 0.00 41.12 38.98 1xqw n ASP 268 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1xqw n SER 270 N -0.59 0.00 -0.06 0.00 3.41 -1.26 -0.31 113.62 114.81 1xqw n SER 270 Ca -0.05 0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 58.38 1xqw n SER 270 Cb 0.64 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.46 1xqw n SER 270 CO 0.00 0.00 0.00 -0.74 -0.16 0.00 0.00 175.04 174.14 1xqw h HIS 271 N 0.00 0.11 -0.76 7.33 2.76 -1.45 -2.79 115.15 120.35 1xqw h HIS 271 Ca 0.00 -0.08 -0.71 0.00 -2.20 0.00 0.00 60.37 57.38 1xqw h HIS 271 Cb 0.00 -0.00 -0.07 0.00 1.55 0.00 0.00 27.41 28.88 1xqw h HIS 271 CO 0.00 1.25 2.85 1.28 -1.30 0.00 0.00 177.93 182.01 1xqw n LEU 272 N -4.42 8.26 0.20 0.26 4.77 -0.49 -4.69 117.00 120.89 1xqw n LEU 272 Ca -0.19 -4.70 0.18 0.00 -0.03 0.00 0.00 56.01 51.27 1xqw n LEU 272 Cb 0.63 -1.43 0.83 0.00 -2.33 0.00 0.00 43.42 41.12 1xqw n LEU 272 CO 0.32 2.06 1.15 0.71 -1.33 0.00 0.00 177.39 180.30 1xqw h THR 273 N 2.72 0.41 0.00 -5.08 1.35 -1.87 -0.64 112.91 109.79 1xqw h THR 273 Ca 0.76 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.62 1xqw h THR 273 Cb 0.31 0.81 0.00 0.00 -1.73 0.00 0.00 68.15 67.53 1xqw h THR 273 CO 1.56 0.00 0.00 0.23 -0.25 0.00 0.00 175.52 177.06 1xqw n MET 274 N -3.71 0.09 -0.06 4.72 2.81 -1.26 -1.72 117.12 117.99 1xqw n MET 274 Ca 0.02 0.34 -0.08 0.00 -1.81 0.00 0.00 57.70 56.18 1xqw n MET 274 Cb 0.36 -1.67 -0.06 0.00 -0.71 0.00 0.00 33.22 31.15 1xqw n MET 274 CO 0.00 0.00 0.00 0.91 1.51 0.00 0.00 175.97 178.39 1xqw n TRP 275 N -1.84 0.00 -0.01 2.03 7.02 -0.29 -3.65 117.44 120.70 1xqw n TRP 275 Ca 0.03 0.00 -0.02 0.00 -1.02 0.00 0.00 57.50 56.48 1xqw n TRP 275 Cb 0.19 -0.44 0.23 0.00 -2.42 0.00 0.00 31.31 28.86 1xqw n TRP 275 CO 0.00 0.00 0.00 0.93 -2.02 0.00 0.00 177.69 176.60 1xqw h GLU 276 N 0.00 0.53 -1.98 -0.99 5.08 -1.42 -3.29 114.58 112.52 1xqw h GLU 276 Ca -0.26 -0.16 -0.48 0.00 -1.00 0.00 0.00 59.36 57.46 1xqw h GLU 276 Cb 1.42 -0.05 -0.40 0.00 0.50 0.00 0.00 28.75 30.22 1xqw h GLU 276 CO -0.03 0.66 -1.19 -3.47 -1.00 0.00 0.00 179.01 173.98 1xqw n ASP 277 N -4.19 0.91 -0.14 1.42 -0.08 -0.70 -5.00 116.55 108.78 1xqw n ASP 277 Ca 0.01 -3.01 -0.08 0.00 -1.51 0.00 0.00 54.79 50.19 1xqw n ASP 277 Cb 0.34 -0.62 -0.02 0.00 2.34 0.00 0.00 41.12 43.16 1xqw n ASP 277 CO 0.00 0.00 0.00 -0.09 0.12 0.00 0.00 177.20 177.23 1xqw h ARG 278 N 3.00 -0.26 -0.74 -0.67 2.43 -1.63 0.41 114.38 116.92 1xqw h ARG 278 Ca 0.09 0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.23 1xqw h ARG 278 Cb 0.97 0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.54 1xqw h ARG 278 CO 0.51 -0.17 0.26 1.49 -1.51 0.00 0.00 179.97 180.54 1xqw h GLU 279 N -0.27 1.12 -0.11 0.20 4.81 -1.93 -1.55 114.58 116.85 1xqw h GLU 279 Ca 0.17 -0.22 -0.20 0.00 -0.13 0.00 0.00 59.36 58.98 1xqw h GLU 279 Cb 0.56 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.77 1xqw h GLU 279 CO -0.58 0.93 -0.74 0.78 -0.73 0.00 0.00 179.01 178.67 1xqw h GLY 280 N 1.12 0.61 0.74 1.92 0.00 -1.79 -1.98 103.07 103.69 1xqw h GLY 280 Ca 0.24 -0.86 -0.00 0.00 0.00 0.00 0.00 47.33 46.71 1xqw h GLY 280 CO -0.01 0.77 -0.01 -1.82 0.00 0.00 0.00 176.54 175.47 1xqw h TYR 281 N 0.38 -0.02 -0.43 5.60 3.20 -0.04 -2.05 116.97 123.62 1xqw h TYR 281 Ca -0.04 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.78 1xqw h TYR 281 Cb 1.34 0.01 -0.02 0.00 1.54 0.00 0.00 36.73 39.59 1xqw h TYR 281 CO 0.06 0.24 0.07 -0.91 -1.64 0.00 0.00 178.16 175.98 1xqw h ASN 282 N -0.28 0.61 -0.34 -2.11 -0.26 -1.34 -2.11 115.58 109.75 1xqw h ASN 282 Ca -0.00 -0.11 -0.06 0.00 -0.56 0.00 0.00 56.30 55.57 1xqw h ASN 282 Cb 0.27 -0.16 -0.01 0.00 -1.06 0.00 0.00 38.32 37.36 1xqw h ASN 282 CO 0.00 0.64 -0.02 0.50 -1.06 0.00 0.00 177.43 177.49 1xqw h LYS 283 N 0.63 0.62 -0.25 0.81 3.64 -1.28 0.01 116.57 120.76 1xqw h LYS 283 Ca 0.14 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1xqw h LYS 283 Cb 0.30 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 1xqw h LYS 283 CO 0.00 0.76 0.16 1.25 -2.27 0.00 0.00 179.45 179.35 1xqw h LEU 284 N 0.42 0.28 -0.43 5.20 5.85 -1.08 -0.09 115.31 125.46 1xqw h LEU 284 Ca 0.09 -0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.70 1xqw h LEU 284 Cb 0.49 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 1xqw h LEU 284 CO 0.02 0.21 -0.12 -0.07 -0.34 0.00 0.00 178.44 178.15 1xqw h LEU 285 N 0.33 0.85 -0.16 2.25 4.07 -1.34 -2.03 115.31 119.27 1xqw h LEU 285 Ca 0.09 -0.37 0.01 0.00 0.08 0.00 0.00 57.88 57.69 1xqw h LEU 285 Cb -0.03 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 41.46 1xqw h LEU 285 CO -0.02 1.02 0.08 -1.28 -1.08 0.00 0.00 178.44 177.16 1xqw h SER 286 N 0.67 0.12 -0.80 -0.43 0.87 -0.78 0.09 113.55 113.28 1xqw h SER 286 Ca 0.11 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.67 1xqw h SER 286 Cb 0.66 -0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 62.56 1xqw h SER 286 CO 0.05 0.09 0.46 0.44 -0.53 0.00 0.00 176.83 177.34 1xqw h ASP 287 N 0.17 0.98 0.59 6.23 3.32 -0.98 -0.14 116.42 126.58 1xqw h ASP 287 Ca 0.07 -0.08 -0.03 0.00 0.02 0.00 0.00 57.03 57.01 1xqw h ASP 287 Cb 0.02 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.32 1xqw h ASP 287 CO -0.05 0.77 -0.32 0.15 -1.72 0.00 0.00 179.24 178.07 1xqw h PHE 288 N 1.10 -0.84 0.04 4.55 3.57 -0.93 -1.88 116.94 122.55 1xqw h PHE 288 Ca 0.29 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.80 1xqw h PHE 288 Cb -0.01 0.29 -0.04 0.00 2.79 0.00 0.00 35.95 38.98 1xqw h PHE 288 CO -0.00 -0.50 -0.28 0.82 -2.23 0.00 0.00 178.31 176.11 1xqw h ILE 289 N -0.84 0.37 0.00 1.41 1.08 -0.79 -2.21 117.51 116.53 1xqw h ILE 289 Ca -0.07 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.40 1xqw h ILE 289 Cb 0.67 0.37 0.00 0.00 -3.07 0.00 0.00 36.82 34.79 1xqw h ILE 289 CO 0.10 0.00 0.00 -0.07 -0.69 0.00 0.00 178.15 177.49 1xqw h LEU 290 N -0.46 0.00 -2.34 1.44 4.07 -0.99 -1.47 115.31 115.56 1xqw h LEU 290 Ca 0.05 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.01 1xqw h LEU 290 Cb 0.52 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.26 1xqw h LEU 290 CO -0.22 0.00 0.00 2.29 -1.08 0.00 0.00 178.44 179.43 1xqw n LYS 291 N -2.87 2.48 -0.96 1.13 2.85 -0.71 -4.21 118.16 115.87 1xqw n LYS 291 Ca -0.02 -2.29 0.04 0.00 -1.05 0.00 0.00 58.31 54.98 1xqw n LYS 291 Cb 0.09 -1.51 0.06 0.00 -0.65 0.00 0.00 35.03 33.03 1xqw n LYS 291 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1xqw n HIS 292 N 1.39 0.00 0.00 5.58 8.25 -0.56 -5.07 115.22 124.81 1xqw n HIS 292 Ca 0.21 -0.59 0.00 0.00 -0.26 0.00 0.00 57.72 57.08 1xqw n HIS 292 Cb 0.55 -0.14 0.00 0.00 1.12 0.00 0.00 29.99 31.52 1xqw n HIS 292 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26