#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xtt s LEU 3 N 0.00 3.32 -0.30 1.53 2.96 -1.26 -0.75 118.68 124.17 1xtt s LEU 3 Ca 0.00 -0.10 0.03 0.00 -0.22 0.00 0.00 54.13 53.84 1xtt s LEU 3 Cb 0.00 -1.80 0.09 0.00 0.50 0.00 0.00 46.19 44.97 1xtt s LEU 3 CO 0.00 0.17 0.01 -0.31 -1.32 0.00 0.00 176.35 174.90 1xtt s TYR 4 N 0.35 3.25 -0.39 5.38 1.51 0.47 -4.97 117.35 122.95 1xtt s TYR 4 Ca -0.03 -2.55 -0.18 0.00 -1.01 0.00 0.00 57.07 53.30 1xtt s TYR 4 Cb -0.14 -2.39 0.01 0.00 -0.11 0.00 0.00 41.96 39.33 1xtt s TYR 4 CO 0.03 -0.90 0.49 0.08 -1.11 0.00 0.00 175.55 174.13 1xtt s VAL 5 N 1.09 5.03 -1.06 0.71 1.01 -1.26 -1.73 120.40 124.19 1xtt s VAL 5 Ca 0.04 -0.02 -0.14 0.00 0.00 0.00 0.00 61.98 61.86 1xtt s VAL 5 Cb -0.19 -4.02 0.19 0.00 0.00 0.00 0.00 36.38 32.36 1xtt s VAL 5 CO -0.09 -0.35 1.20 -0.63 0.00 0.00 0.00 175.10 175.23 1xtt s ILE 6 N 2.32 5.20 -0.59 2.22 -1.09 0.71 -4.87 121.20 125.10 1xtt s ILE 6 Ca 0.16 -2.45 0.04 0.00 -2.23 0.00 0.00 60.65 56.16 1xtt s ILE 6 Cb -0.16 -4.76 0.37 0.00 -1.58 0.00 0.00 42.46 36.33 1xtt s ILE 6 CO 0.14 -1.43 1.19 -0.90 -1.23 0.00 0.00 174.94 172.71 1xtt n ASP 7 N 5.15 5.12 -4.90 3.58 5.68 -1.26 -4.49 116.55 125.44 1xtt n ASP 7 Ca 0.28 -3.72 -0.28 0.00 -0.50 0.00 0.00 54.79 50.57 1xtt n ASP 7 Cb 0.44 -0.62 0.01 0.00 -1.14 0.00 0.00 41.12 39.81 1xtt n ASP 7 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1xtt s LYS 8 N -3.64 3.35 0.25 0.11 -0.14 -1.26 -4.81 119.74 113.60 1xtt s LYS 8 Ca 0.48 0.31 -0.09 0.00 -1.36 0.00 0.00 55.97 55.30 1xtt s LYS 8 Cb 0.33 -2.25 0.39 0.00 -1.68 0.00 0.00 37.83 34.62 1xtt s LYS 8 CO -0.18 -0.48 1.61 -1.35 -0.76 0.00 0.00 175.35 174.18 1xtt h PRO 9 N -0.08 0.03 -0.29 -1.68 0.11 -1.99 -0.62 132.00 127.49 1xtt h PRO 9 Ca -0.46 -0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.55 1xtt h PRO 9 Cb 1.22 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1xtt h PRO 9 CO 0.62 0.02 -0.26 0.97 -0.21 0.00 0.00 178.00 179.13 1xtt h ILE 10 N 0.03 1.27 -0.13 4.15 6.09 -1.98 0.42 117.51 127.36 1xtt h ILE 10 Ca 0.40 -1.33 -0.17 0.00 -1.37 0.00 0.00 64.86 62.40 1xtt h ILE 10 Cb 0.66 1.34 -0.01 0.00 0.47 0.00 0.00 36.82 39.28 1xtt h ILE 10 CO -0.78 0.43 -0.61 0.71 -3.07 0.00 0.00 178.15 174.83 1xtt h THR 11 N 0.50 1.35 -0.17 2.19 1.35 -1.61 -0.68 112.91 115.84 1xtt h THR 11 Ca 0.07 -1.93 -0.14 0.00 -0.55 0.00 0.00 66.41 63.87 1xtt h THR 11 Cb 0.72 1.91 -0.01 0.00 -1.73 0.00 0.00 68.15 69.04 1xtt h THR 11 CO 0.06 0.59 -0.47 -0.07 -0.25 0.00 0.00 175.52 175.37 1xtt h LEU 12 N 0.34 0.48 -0.23 3.87 3.38 -0.94 0.17 115.31 122.37 1xtt h LEU 12 Ca -0.01 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 57.71 1xtt h LEU 12 Cb 1.16 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 1xtt h LEU 12 CO 0.11 0.89 0.09 -0.74 0.09 0.00 0.00 178.44 178.87 1xtt h HIS 13 N 0.36 0.36 -0.28 1.13 2.76 -0.67 -0.10 115.15 118.71 1xtt h HIS 13 Ca 0.02 -0.03 -0.03 0.00 -2.20 0.00 0.00 60.37 58.13 1xtt h HIS 13 Cb 0.97 -0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.81 1xtt h HIS 13 CO 0.03 0.40 0.08 0.82 -1.30 0.00 0.00 177.93 177.96 1xtt h ILE 14 N 0.22 1.21 -0.67 6.26 2.04 -0.93 -2.55 117.51 123.10 1xtt h ILE 14 Ca 0.08 -0.68 0.07 0.00 1.00 0.00 0.00 64.86 65.33 1xtt h ILE 14 Cb 0.20 1.13 -0.04 0.00 -0.74 0.00 0.00 36.82 37.36 1xtt h ILE 14 CO -0.00 0.22 0.44 0.25 0.00 0.00 0.00 178.15 179.06 1xtt h LEU 15 N 0.29 0.57 -0.99 1.44 5.85 -0.51 -0.43 115.31 121.53 1xtt h LEU 15 Ca 0.09 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 1xtt h LEU 15 Cb 0.27 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.14 1xtt h LEU 15 CO -0.00 0.37 0.50 0.74 -0.34 0.00 0.00 178.44 179.70 1xtt h THR 16 N 0.65 1.25 -0.63 1.05 2.02 -0.60 -0.01 112.91 116.64 1xtt h THR 16 Ca 0.29 -0.58 -0.08 0.00 0.77 0.00 0.00 66.41 66.81 1xtt h THR 16 Cb 0.31 0.05 -0.02 0.00 -1.74 0.00 0.00 68.15 66.75 1xtt h THR 16 CO -0.09 0.27 0.08 1.56 0.37 0.00 0.00 175.52 177.71 1xtt h GLN 17 N 1.21 1.05 -0.66 6.66 1.08 -0.88 -1.73 115.11 121.83 1xtt h GLN 17 Ca 0.31 -0.29 -0.08 0.00 -1.45 0.00 0.00 58.65 57.14 1xtt h GLN 17 Cb -0.01 -0.12 -0.03 0.00 -0.05 0.00 0.00 27.48 27.28 1xtt h GLN 17 CO -0.05 0.99 0.11 -0.07 -0.95 0.00 0.00 178.83 178.86 1xtt h LEU 18 N 0.96 1.04 -0.34 1.46 3.38 -0.68 -3.10 115.31 118.04 1xtt h LEU 18 Ca 0.19 -0.24 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 1xtt h LEU 18 Cb 0.46 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1xtt h LEU 18 CO 0.02 1.03 -0.09 0.03 0.09 0.00 0.00 178.44 179.51 1xtt h ARG 19 N 1.02 0.66 -6.09 1.13 3.08 -0.84 -3.44 114.38 109.89 1xtt h ARG 19 Ca 0.20 -0.26 -0.72 0.00 0.07 0.00 0.00 59.98 59.27 1xtt h ARG 19 Cb 0.43 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.44 1xtt h ARG 19 CO 0.01 0.84 1.09 -3.47 -1.07 0.00 0.00 179.97 177.36 1xtt n ASP 20 N -4.41 2.21 0.28 7.04 -0.08 -0.67 -4.79 116.55 116.14 1xtt n ASP 20 Ca -0.02 0.86 0.19 0.00 -1.51 0.00 0.00 54.79 54.31 1xtt n ASP 20 Cb 0.34 -1.16 0.97 0.00 2.34 0.00 0.00 41.12 43.62 1xtt n ASP 20 CO 0.00 0.00 0.00 0.07 0.12 0.00 0.00 177.20 177.39 1xtt h LYS 21 N 8.82 0.00 -0.00 -0.67 2.10 -1.87 -2.03 116.57 122.92 1xtt h LYS 21 Ca -0.38 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.27 1xtt h LYS 21 Cb 1.33 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.66 1xtt h LYS 21 CO 0.99 0.00 -0.16 0.66 -2.00 0.00 0.00 179.45 178.93 1xtt n TYR 22 N -2.87 0.00 -2.49 0.07 0.53 -1.26 -4.81 117.16 106.33 1xtt n TYR 22 Ca -0.02 0.00 -0.43 0.00 -1.02 0.00 0.00 57.90 56.43 1xtt n TYR 22 Cb 0.11 -0.23 -0.02 0.00 -1.03 0.00 0.00 39.34 38.17 1xtt n TYR 22 CO 0.00 0.00 0.00 0.99 -1.02 0.00 0.00 176.86 176.83 1xtt s THR 23 N -2.62 4.38 1.21 -0.72 2.01 -0.76 -5.01 115.64 114.12 1xtt s THR 23 Ca 0.24 1.67 -0.20 0.00 0.31 0.00 0.00 61.69 63.71 1xtt s THR 23 Cb 0.19 -4.09 0.29 0.00 0.01 0.00 0.00 72.50 68.90 1xtt s THR 23 CO 0.52 -0.16 1.12 1.51 -0.69 0.00 0.00 174.62 176.92 1xtt s ASP 24 N 1.80 0.90 0.13 3.53 1.47 -1.26 -4.70 116.67 118.54 1xtt s ASP 24 Ca 0.52 0.57 -0.18 0.00 1.18 0.00 0.00 52.55 54.64 1xtt s ASP 24 Cb -0.20 -0.77 -0.04 0.00 -0.34 0.00 0.00 42.92 41.57 1xtt s ASP 24 CO 0.13 -4.13 1.79 1.56 0.68 0.00 0.00 175.17 175.20 1xtt h GLN 25 N -2.59 0.36 -0.19 2.11 7.50 -1.86 0.09 115.11 120.54 1xtt h GLN 25 Ca -0.44 -0.02 0.04 0.00 0.50 0.00 0.00 58.65 58.72 1xtt h GLN 25 Cb 1.29 -0.08 -0.03 0.00 0.05 0.00 0.00 27.48 28.70 1xtt h GLN 25 CO 0.32 0.24 -0.04 0.82 -1.50 0.00 0.00 178.83 178.68 1xtt h ILE 26 N 0.37 0.83 0.00 2.54 2.04 -1.87 0.02 117.51 121.43 1xtt h ILE 26 Ca 0.10 -0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.87 1xtt h ILE 26 Cb -0.04 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 1xtt h ILE 26 CO -0.02 0.00 -0.42 0.78 0.00 0.00 0.00 178.15 178.49 1xtt h ASN 27 N 0.01 0.00 -0.09 1.72 2.35 -1.89 -0.89 115.58 116.78 1xtt h ASN 27 Ca 0.09 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.81 1xtt h ASN 27 Cb 0.13 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.50 1xtt h ASN 27 CO -0.18 0.42 -0.05 0.15 -1.65 0.00 0.00 177.43 176.11 1xtt h PHE 28 N 0.00 0.24 -0.54 1.19 3.57 -0.52 -1.51 116.94 119.36 1xtt h PHE 28 Ca -0.00 -0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.42 1xtt h PHE 28 Cb 0.99 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.65 1xtt h PHE 28 CO 0.00 0.58 0.27 0.00 -2.23 0.00 0.00 178.31 176.93 1xtt h ARG 29 N -0.17 0.76 -0.50 1.11 3.08 -0.87 -0.48 114.38 117.31 1xtt h ARG 29 Ca 0.02 -0.10 0.05 0.00 0.07 0.00 0.00 59.98 60.02 1xtt h ARG 29 Cb 0.52 -0.14 -0.05 0.00 0.08 0.00 0.00 29.97 30.38 1xtt h ARG 29 CO 0.02 0.61 0.22 -0.22 -1.07 0.00 0.00 179.97 179.53 1xtt h LYS 30 N 0.72 0.42 -0.05 0.04 3.64 -1.10 0.13 116.57 120.36 1xtt h LYS 30 Ca 0.19 -0.03 -0.14 0.00 -1.27 0.00 0.00 60.65 59.40 1xtt h LYS 30 Cb 0.09 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.80 1xtt h LYS 30 CO -0.03 0.28 -0.59 -0.91 -2.27 0.00 0.00 179.45 175.93 1xtt h ASN 31 N 0.43 0.21 -0.19 4.20 2.35 -1.01 -2.18 115.58 119.39 1xtt h ASN 31 Ca 0.23 -0.12 -0.13 0.00 -0.55 0.00 0.00 56.30 55.73 1xtt h ASN 31 Cb 0.19 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.49 1xtt h ASN 31 CO -0.19 0.75 -0.34 0.25 -1.65 0.00 0.00 177.43 176.25 1xtt h LEU 32 N 0.14 0.73 -0.54 1.61 5.85 -0.51 -1.37 115.31 121.22 1xtt h LEU 32 Ca -0.00 -0.30 -0.03 0.00 0.84 0.00 0.00 57.88 58.38 1xtt h LEU 32 Cb 1.08 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.88 1xtt h LEU 32 CO 0.09 1.01 0.21 0.58 -0.34 0.00 0.00 178.44 179.99 1xtt h VAL 33 N 0.59 1.22 -0.85 1.05 2.07 -0.82 -0.75 116.25 118.76 1xtt h VAL 33 Ca 0.06 -0.68 0.04 0.00 0.82 0.00 0.00 66.70 66.95 1xtt h VAL 33 Cb 0.86 0.66 -0.05 0.00 -1.52 0.00 0.00 31.29 31.23 1xtt h VAL 33 CO 0.07 0.26 0.54 0.03 0.02 0.00 0.00 177.57 178.49 1xtt h ARG 34 N 0.73 0.99 -0.03 1.57 3.08 -1.09 -0.90 114.38 118.73 1xtt h ARG 34 Ca 0.18 -0.06 -0.10 0.00 0.07 0.00 0.00 59.98 60.07 1xtt h ARG 34 Cb 0.20 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 1xtt h ARG 34 CO -0.01 0.65 -0.47 -0.07 -1.07 0.00 0.00 179.97 179.00 1xtt h LEU 35 N 1.02 0.07 -0.57 3.04 3.38 -0.81 -1.19 115.31 120.24 1xtt h LEU 35 Ca 0.35 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.22 1xtt h LEU 35 Cb 0.07 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1xtt h LEU 35 CO -0.14 0.53 0.09 1.23 0.09 0.00 0.00 178.44 180.24 1xtt h GLY 36 N 1.39 1.02 0.84 0.83 0.00 0.13 0.30 103.07 107.57 1xtt h GLY 36 Ca 0.00 -0.68 -0.01 0.00 0.00 0.00 0.00 47.33 46.64 1xtt h GLY 36 CO 0.06 0.63 0.04 3.21 0.00 0.00 0.00 176.54 180.48 1xtt h ARG 37 N 0.84 0.25 -0.42 4.80 3.08 -0.90 -0.34 114.38 121.68 1xtt h ARG 37 Ca 0.17 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.15 1xtt h ARG 37 Cb 0.42 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.42 1xtt h ARG 37 CO 0.01 0.39 0.19 0.82 -1.07 0.00 0.00 179.97 180.32 1xtt h ILE 38 N 0.06 1.18 -0.08 2.04 2.04 -1.05 -0.45 117.51 121.25 1xtt h ILE 38 Ca 0.05 -0.53 -0.08 0.00 1.00 0.00 0.00 64.86 65.29 1xtt h ILE 38 Cb 0.25 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 37.08 1xtt h ILE 38 CO 0.00 0.20 -0.32 -0.07 0.00 0.00 0.00 178.15 177.96 1xtt h LEU 39 N 0.54 0.16 -0.46 1.44 3.38 -0.35 -0.49 115.31 119.52 1xtt h LEU 39 Ca 0.14 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 58.00 1xtt h LEU 39 Cb 0.14 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1xtt h LEU 39 CO -0.02 0.48 0.05 1.23 0.09 0.00 0.00 178.44 180.27 1xtt h GLY 40 N 1.06 0.84 0.94 0.83 0.00 -0.57 0.98 103.07 107.15 1xtt h GLY 40 Ca 0.02 -0.58 0.01 0.00 0.00 0.00 0.00 47.33 46.78 1xtt h GLY 40 CO 0.05 0.54 0.08 -1.82 0.00 0.00 0.00 176.54 175.39 1xtt h TYR 41 N 0.64 0.16 -0.67 5.60 3.20 -0.54 0.14 116.97 125.50 1xtt h TYR 41 Ca 0.14 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.96 1xtt h TYR 41 Cb 0.43 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.62 1xtt h TYR 41 CO 0.03 0.09 0.21 0.93 -1.64 0.00 0.00 178.16 177.79 1xtt h GLU 42 N 0.18 1.04 -0.58 1.82 4.39 -0.88 -2.57 114.58 117.98 1xtt h GLU 42 Ca 0.07 -0.22 -0.04 0.00 0.34 0.00 0.00 59.36 59.51 1xtt h GLU 42 Cb 0.01 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 28.48 1xtt h GLU 42 CO -0.04 0.90 0.22 0.82 -1.16 0.00 0.00 179.01 179.74 1xtt h ILE 43 N 0.97 1.23 -0.77 3.13 2.04 -0.54 -2.67 117.51 120.90 1xtt h ILE 43 Ca 0.22 -0.73 0.12 0.00 1.00 0.00 0.00 64.86 65.46 1xtt h ILE 43 Cb 0.29 0.63 -0.05 0.00 -0.74 0.00 0.00 36.82 36.94 1xtt h ILE 43 CO -0.01 0.28 0.51 0.28 0.00 0.00 0.00 178.15 179.21 1xtt h SER 44 N 0.80 0.55 0.00 1.72 0.02 -0.35 -0.16 113.55 116.13 1xtt h SER 44 Ca 0.19 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 1xtt h SER 44 Cb 0.22 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.68 1xtt h SER 44 CO -0.01 0.31 0.00 0.59 -1.14 0.00 0.00 176.83 176.57 1xtt n ASN 45 N -4.50 0.00 -0.01 3.07 3.02 -1.00 -2.44 115.26 113.39 1xtt n ASN 45 Ca 0.14 -0.78 0.04 0.00 -0.03 0.00 0.00 54.58 53.95 1xtt n ASN 45 Cb 0.41 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.54 1xtt n ASN 45 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1xtt n THR 46 N -0.94 0.00 -1.89 3.41 -2.24 -0.08 -5.03 114.28 107.51 1xtt n THR 46 Ca 0.15 -0.32 -0.33 0.00 -2.27 0.00 0.00 64.05 61.27 1xtt n THR 46 Cb 0.07 1.01 0.03 0.00 -2.10 0.00 0.00 70.33 69.34 1xtt n THR 46 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1xtt s LEU 47 N -2.31 3.48 0.54 3.22 1.43 -1.02 -4.99 118.68 119.03 1xtt s LEU 47 Ca 0.03 2.03 -0.20 0.00 -1.03 0.00 0.00 54.13 54.95 1xtt s LEU 47 Cb 0.06 -4.56 -0.05 0.00 0.03 0.00 0.00 46.19 41.67 1xtt s LEU 47 CO 0.31 -1.50 1.18 -1.81 0.23 0.00 0.00 176.35 174.76 1xtt s ASP 48 N -2.42 5.63 0.12 2.29 1.01 -1.26 -5.03 116.67 117.01 1xtt s ASP 48 Ca 0.68 2.32 -0.10 0.00 0.71 0.00 0.00 52.55 56.16 1xtt s ASP 48 Cb -0.21 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.13 1xtt s ASP 48 CO 0.38 -1.29 0.25 -0.72 0.21 0.00 0.00 175.17 174.00 1xtt s TYR 49 N -1.63 0.17 0.12 4.23 -0.85 -1.26 -4.33 117.35 113.81 1xtt s TYR 49 Ca 0.72 -0.57 0.10 0.00 -0.52 0.00 0.00 57.07 56.80 1xtt s TYR 49 Cb -0.28 -0.01 -0.04 0.00 0.38 0.00 0.00 41.96 42.01 1xtt s TYR 49 CO 0.32 -0.63 -0.24 -1.21 -1.52 0.00 0.00 175.55 172.28 1xtt s GLU 50 N -3.89 1.28 -0.12 -3.49 2.02 -0.20 -4.95 118.70 109.35 1xtt s GLU 50 Ca 0.08 -1.28 -0.21 0.00 0.02 0.00 0.00 54.97 53.58 1xtt s GLU 50 Cb 0.04 -1.64 -0.03 0.00 0.10 0.00 0.00 34.13 32.59 1xtt s GLU 50 CO -0.08 0.38 0.62 0.42 0.02 0.00 0.00 175.26 176.62 1xtt s ILE 51 N -1.19 5.08 0.47 -1.63 1.01 -1.26 -0.43 121.20 123.25 1xtt s ILE 51 Ca 0.11 1.23 0.02 0.00 0.00 0.00 0.00 60.65 62.01 1xtt s ILE 51 Cb -0.10 -3.95 -0.02 0.00 0.01 0.00 0.00 42.46 38.41 1xtt s ILE 51 CO 0.05 0.23 0.05 0.68 0.00 0.00 0.00 174.94 175.95 1xtt s VAL 52 N 1.11 0.92 -0.06 2.92 -7.23 -0.27 -4.94 120.40 112.86 1xtt s VAL 52 Ca 0.32 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.53 1xtt s VAL 52 Cb -0.16 -2.22 -0.02 0.00 0.56 0.00 0.00 36.38 34.54 1xtt s VAL 52 CO 0.13 0.00 -0.17 -0.70 -0.31 0.00 0.00 175.10 174.06 1xtt s GLU 53 N -3.81 2.55 -0.01 4.82 2.12 -1.26 -0.54 118.70 122.57 1xtt s GLU 53 Ca 0.12 -0.75 0.02 0.00 0.36 0.00 0.00 54.97 54.72 1xtt s GLU 53 Cb 0.02 -2.34 -0.00 0.00 0.26 0.00 0.00 34.13 32.07 1xtt s GLU 53 CO 0.07 0.55 -0.05 0.54 -0.54 0.00 0.00 175.26 175.83 1xtt s VAL 54 N -0.54 0.40 -0.20 3.70 0.11 -0.55 -4.93 120.40 118.40 1xtt s VAL 54 Ca 0.07 -0.20 -0.16 0.00 -2.93 0.00 0.00 61.98 58.77 1xtt s VAL 54 Cb -0.11 -0.36 -0.04 0.00 -1.53 0.00 0.00 36.38 34.34 1xtt s VAL 54 CO 0.01 0.12 0.39 -1.61 -3.33 0.00 0.00 175.10 170.68 1xtt s GLU 55 N -0.00 4.18 0.52 1.54 2.02 -1.26 -1.44 118.70 124.26 1xtt s GLU 55 Ca 0.00 0.19 0.01 0.00 0.02 0.00 0.00 54.97 55.19 1xtt s GLU 55 Cb -0.03 -3.52 0.02 0.00 0.10 0.00 0.00 34.13 30.69 1xtt s GLU 55 CO -0.00 -0.01 0.74 0.95 0.02 0.00 0.00 175.26 176.96 1xtt s THR 56 N 1.21 3.18 -0.10 3.63 -4.23 -0.24 -4.96 115.64 114.13 1xtt s THR 56 Ca 0.19 -0.58 0.26 0.00 -1.18 0.00 0.00 61.69 60.37 1xtt s THR 56 Cb -0.15 -3.19 0.26 0.00 1.34 0.00 0.00 72.50 70.76 1xtt s THR 56 CO 0.08 -0.14 1.78 -0.65 -0.54 0.00 0.00 174.62 175.15 1xtt h PRO 57 N 0.18 0.00 0.00 3.99 0.11 -1.98 -1.60 132.00 132.70 1xtt h PRO 57 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1xtt h PRO 57 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1xtt h PRO 57 CO 0.54 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.61 1xtt n LEU 58 N -2.40 0.00 -0.35 2.35 7.99 -1.26 -4.86 117.00 118.47 1xtt n LEU 58 Ca -0.01 0.00 -0.05 0.00 -0.01 0.00 0.00 56.01 55.94 1xtt n LEU 58 Cb 0.07 0.00 -0.02 0.00 -0.11 0.00 0.00 43.42 43.36 1xtt n LEU 58 CO 0.13 0.00 -0.04 0.61 -1.51 0.00 0.00 177.39 176.58 1xtt n GLY 59 N 0.56 0.70 3.45 -0.72 0.00 -0.60 -5.02 105.19 103.56 1xtt n GLY 59 Ca 0.03 -0.36 -0.26 0.00 0.00 0.00 0.00 46.02 45.43 1xtt n GLY 59 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xtt s VAL 60 N -1.99 2.49 0.04 1.61 -7.23 -1.25 -4.95 120.40 109.12 1xtt s VAL 60 Ca 0.00 -2.03 0.00 0.00 -1.81 0.00 0.00 61.98 58.14 1xtt s VAL 60 Cb 0.00 -2.21 -0.04 0.00 0.56 0.00 0.00 36.38 34.69 1xtt s VAL 60 CO 0.00 -0.15 0.13 -0.54 -0.31 0.00 0.00 175.10 174.22 1xtt s LYS 61 N -2.80 3.15 0.17 4.82 1.02 -1.26 -1.08 119.74 123.75 1xtt s LYS 61 Ca 0.23 -0.51 -0.13 0.00 0.02 0.00 0.00 55.97 55.57 1xtt s LYS 61 Cb -0.08 -2.90 0.01 0.00 -0.52 0.00 0.00 37.83 34.35 1xtt s LYS 61 CO 0.11 0.62 0.39 -0.08 -0.92 0.00 0.00 175.35 175.47 1xtt s THR 62 N -1.35 0.06 0.45 2.17 -1.32 -0.52 -4.96 115.64 110.16 1xtt s THR 62 Ca 0.28 -1.01 -0.23 0.00 -1.21 0.00 0.00 61.69 59.52 1xtt s THR 62 Cb -0.12 -1.60 -0.08 0.00 -1.51 0.00 0.00 72.50 69.19 1xtt s THR 62 CO 0.20 -0.26 1.15 -0.54 -2.21 0.00 0.00 174.62 172.97 1xtt s LYS 63 N -3.90 3.84 0.32 7.08 -0.14 -1.26 -1.49 119.74 124.19 1xtt s LYS 63 Ca 0.11 1.74 0.00 0.00 -1.36 0.00 0.00 55.97 56.46 1xtt s LYS 63 Cb 0.01 -2.44 0.00 0.00 -1.68 0.00 0.00 37.83 33.72 1xtt s LYS 63 CO -0.04 -0.48 0.41 0.41 -0.76 0.00 0.00 175.35 174.89 1xtt n GLY 64 N 0.44 2.36 3.25 -3.33 0.00 0.30 -4.84 105.19 103.36 1xtt n GLY 64 Ca 0.07 -1.66 -0.24 0.00 0.00 0.00 0.00 46.02 44.19 1xtt n GLY 64 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xtt s VAL 65 N -2.88 1.60 -0.18 1.61 1.01 -1.26 -1.11 120.40 119.18 1xtt s VAL 65 Ca 0.29 -1.28 -0.04 0.00 0.00 0.00 0.00 61.98 60.95 1xtt s VAL 65 Cb -0.00 -1.42 0.06 0.00 0.00 0.00 0.00 36.38 35.02 1xtt s VAL 65 CO 0.21 0.09 0.07 -0.62 0.00 0.00 0.00 175.10 174.85 1xtt s ASP 66 N -1.40 2.62 -1.19 3.32 2.15 0.42 -4.85 116.67 117.74 1xtt s ASP 66 Ca 0.06 -0.73 -0.16 0.00 0.43 0.00 0.00 52.55 52.15 1xtt s ASP 66 Cb -0.09 -0.38 0.13 0.00 -0.30 0.00 0.00 42.92 42.27 1xtt s ASP 66 CO 0.02 -0.34 1.49 -0.63 -0.17 0.00 0.00 175.17 175.55 1xtt s ILE 67 N 2.03 4.65 0.42 4.11 1.01 -1.26 -1.03 121.20 131.12 1xtt s ILE 67 Ca 0.01 -2.17 0.14 0.00 0.00 0.00 0.00 60.65 58.64 1xtt s ILE 67 Cb -0.16 -4.99 0.35 0.00 0.01 0.00 0.00 42.46 37.66 1xtt s ILE 67 CO -0.10 -1.75 1.92 0.71 0.00 0.00 0.00 174.94 175.72 1xtt h THR 68 N 5.22 0.82 0.00 2.92 1.35 -1.94 -1.29 112.91 119.98 1xtt h THR 68 Ca 0.33 -0.16 0.00 0.00 -0.55 0.00 0.00 66.41 66.03 1xtt h THR 68 Cb 0.90 0.31 0.00 0.00 -1.73 0.00 0.00 68.15 67.63 1xtt h THR 68 CO 1.31 0.08 0.00 0.47 -0.25 0.00 0.00 175.52 177.13 1xtt n ASP 69 N -4.49 0.00 0.32 5.36 9.92 -1.26 -1.11 116.55 125.29 1xtt n ASP 69 Ca 0.14 0.21 0.21 0.00 -0.53 0.00 0.00 54.79 54.82 1xtt n ASP 69 Cb 0.50 -0.30 1.02 0.00 -0.64 0.00 0.00 41.12 41.70 1xtt n ASP 69 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 1xtt h LEU 70 N 0.00 0.00 0.00 0.64 3.38 -1.58 0.49 115.31 118.24 1xtt h LEU 70 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xtt h LEU 70 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1xtt h LEU 70 CO 0.00 0.00 -0.51 0.59 0.09 0.00 0.00 178.44 178.61 1xtt n ASN 71 N -3.09 0.51 -3.26 -0.43 4.13 -0.26 -4.47 115.26 108.39 1xtt n ASN 71 Ca -0.02 -0.24 -0.27 0.00 1.68 0.00 0.00 54.58 55.73 1xtt n ASN 71 Cb 0.16 0.25 -0.07 0.00 -1.54 0.00 0.00 39.78 38.59 1xtt n ASN 71 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1xtt n ASN 72 N -1.52 3.99 -4.10 6.41 3.02 0.16 -4.92 115.26 118.31 1xtt n ASN 72 Ca 0.05 -3.53 -0.22 0.00 -0.03 0.00 0.00 54.58 50.86 1xtt n ASN 72 Cb 0.34 -0.63 -0.15 0.00 -0.61 0.00 0.00 39.78 38.72 1xtt n ASN 72 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1xtt s ILE 73 N -3.16 1.09 -0.11 2.41 -1.09 -1.25 -0.58 121.20 118.51 1xtt s ILE 73 Ca 0.43 -0.58 0.00 0.00 -2.23 0.00 0.00 60.65 58.27 1xtt s ILE 73 Cb 0.19 -0.92 0.02 0.00 -1.58 0.00 0.00 42.46 40.18 1xtt s ILE 73 CO -0.05 0.31 -0.10 -0.69 -1.23 0.00 0.00 174.94 173.18 1xtt s VAL 74 N -0.26 1.17 -0.20 2.92 1.01 -0.49 -1.23 120.40 123.33 1xtt s VAL 74 Ca 0.04 -0.41 -0.06 0.00 0.00 0.00 0.00 61.98 61.55 1xtt s VAL 74 Cb -0.06 -1.14 -0.03 0.00 0.00 0.00 0.00 36.38 35.15 1xtt s VAL 74 CO -0.00 0.39 0.03 -0.63 0.00 0.00 0.00 175.10 174.89 1xtt s ILE 75 N 1.41 4.35 -0.31 2.22 1.01 0.02 -0.58 121.20 129.31 1xtt s ILE 75 Ca 0.00 -0.18 -0.11 0.00 0.00 0.00 0.00 60.65 60.36 1xtt s ILE 75 Cb -0.13 -2.97 -0.02 0.00 0.01 0.00 0.00 42.46 39.34 1xtt s ILE 75 CO -0.06 0.43 0.19 -0.63 0.00 0.00 0.00 174.94 174.88 1xtt s ILE 76 N 0.77 5.05 -0.44 2.92 1.01 0.11 -0.72 121.20 129.89 1xtt s ILE 76 Ca 0.02 -0.18 -0.21 0.00 0.00 0.00 0.00 60.65 60.29 1xtt s ILE 76 Cb -0.14 -3.53 0.02 0.00 0.01 0.00 0.00 42.46 38.83 1xtt s ILE 76 CO 0.02 0.10 0.64 0.21 0.00 0.00 0.00 174.94 175.90 1xtt s ASN 77 N 1.70 6.32 -0.55 3.58 3.04 0.50 -1.20 114.94 128.33 1xtt s ASN 77 Ca 0.06 -0.35 -0.22 0.00 0.04 0.00 0.00 52.86 52.39 1xtt s ASN 77 Cb -0.17 -2.32 0.05 0.00 -1.54 0.00 0.00 41.25 37.27 1xtt s ASN 77 CO 0.09 -0.77 0.84 -0.63 -3.04 0.00 0.00 177.10 173.59 1xtt s ILE 78 N 2.79 4.54 0.53 -5.21 1.01 -1.10 -1.24 121.20 122.53 1xtt s ILE 78 Ca 0.22 -0.02 -0.19 0.00 0.00 0.00 0.00 60.65 60.67 1xtt s ILE 78 Cb -0.14 -4.48 -0.06 0.00 0.01 0.00 0.00 42.46 37.79 1xtt s ILE 78 CO 0.19 -1.05 1.07 -0.76 0.00 0.00 0.00 174.94 174.39 1xtt s LEU 79 N 3.54 3.73 -0.01 2.97 1.43 0.56 -1.68 118.68 129.23 1xtt s LEU 79 Ca 0.25 1.99 0.21 0.00 -1.03 0.00 0.00 54.13 55.55 1xtt s LEU 79 Cb -0.15 -4.56 -0.26 0.00 0.03 0.00 0.00 46.19 41.25 1xtt s LEU 79 CO 0.16 -1.03 0.76 -2.11 0.23 0.00 0.00 176.35 174.36 1xtt n ARG 80 N -1.34 0.24 0.11 1.70 1.85 -1.26 -2.44 116.66 115.52 1xtt n ARG 80 Ca 0.10 -0.07 0.00 0.00 -1.00 0.00 0.00 57.85 56.88 1xtt n ARG 80 Cb 0.52 -1.51 0.31 0.00 -1.05 0.00 0.00 32.46 30.74 1xtt n ARG 80 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1xtt h ALA 81 N 2.63 1.32 0.00 2.89 0.00 -1.88 -3.22 119.26 121.00 1xtt h ALA 81 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1xtt h ALA 81 Cb 0.68 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1xtt h ALA 81 CO 0.00 0.46 0.00 0.00 0.00 0.00 0.00 179.25 179.71 1xtt n ALA 82 N -2.48 1.88 -0.26 0.00 0.00 -0.68 -4.25 120.51 114.73 1xtt n ALA 82 Ca -0.01 -0.02 -0.08 0.00 0.00 0.00 0.00 53.44 53.32 1xtt n ALA 82 Cb 0.37 -1.35 -0.04 0.00 0.00 0.00 0.00 19.45 18.43 1xtt n ALA 82 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1xtt h VAL 83 N 0.00 0.06 -0.34 0.00 2.07 -1.78 0.14 116.25 116.40 1xtt h VAL 83 Ca 0.00 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.45 1xtt h VAL 83 Cb 0.39 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.20 1xtt h VAL 83 CO 0.00 0.00 -0.07 -0.65 0.02 0.00 0.00 177.57 176.87 1xtt h PRO 84 N -0.17 0.57 -0.55 1.57 0.11 -1.88 -0.93 132.00 130.72 1xtt h PRO 84 Ca 0.19 -0.15 -0.04 0.00 0.11 0.00 0.00 66.00 66.11 1xtt h PRO 84 Cb 0.55 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 31.57 1xtt h PRO 84 CO -0.76 0.64 0.18 1.25 -0.21 0.00 0.00 178.00 179.10 1xtt h LEU 85 N 0.53 0.79 -0.69 2.35 5.85 -1.43 -2.26 115.31 120.45 1xtt h LEU 85 Ca 0.10 -0.20 -0.09 0.00 0.84 0.00 0.00 57.88 58.53 1xtt h LEU 85 Cb 0.44 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 1xtt h LEU 85 CO 0.02 0.78 -0.02 0.58 -0.34 0.00 0.00 178.44 179.46 1xtt h VAL 86 N 0.76 1.26 -0.77 1.05 2.07 -0.45 -0.87 116.25 119.29 1xtt h VAL 86 Ca 0.18 -1.14 0.08 0.00 0.82 0.00 0.00 66.70 66.64 1xtt h VAL 86 Cb 0.27 0.85 -0.07 0.00 -1.52 0.00 0.00 31.29 30.82 1xtt h VAL 86 CO -0.01 0.41 0.43 -0.33 0.02 0.00 0.00 177.57 178.09 1xtt h GLU 87 N 0.91 0.72 -0.27 1.57 5.08 -0.79 0.20 114.58 121.99 1xtt h GLU 87 Ca 0.16 -0.04 -0.11 0.00 -1.00 0.00 0.00 59.36 58.37 1xtt h GLU 87 Cb 0.56 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 1xtt h GLU 87 CO 0.03 0.48 -0.26 0.78 -1.00 0.00 0.00 179.01 179.04 1xtt h GLY 88 N 0.74 0.72 1.29 -3.84 0.00 -1.07 -3.08 103.07 97.83 1xtt h GLY 88 Ca 0.37 -0.73 -0.00 0.00 0.00 0.00 0.00 47.33 46.97 1xtt h GLY 88 CO -0.23 0.66 0.43 1.41 0.00 0.00 0.00 176.54 178.81 1xtt h LEU 89 N 0.39 0.83 -1.96 3.11 3.38 -0.33 -1.31 115.31 119.41 1xtt h LEU 89 Ca 0.05 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1xtt h LEU 89 Cb 0.82 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.36 1xtt h LEU 89 CO 0.06 0.63 -0.04 -0.07 0.09 0.00 0.00 178.44 179.11 1xtt h LEU 90 N 0.96 0.00 -0.59 1.67 3.38 -0.57 -1.15 115.31 119.01 1xtt h LEU 90 Ca 0.25 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.07 1xtt h LEU 90 Cb -0.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1xtt h LEU 90 CO -0.05 0.04 -0.65 0.11 0.09 0.00 0.00 178.44 177.98 1xtt h LYS 91 N 0.00 0.24 0.00 1.13 1.79 -1.15 -2.45 116.57 116.13 1xtt h LYS 91 Ca -0.00 -0.18 -0.12 0.00 -2.18 0.00 0.00 60.65 58.17 1xtt h LYS 91 Cb 0.35 0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 31.01 1xtt h LYS 91 CO 0.01 0.81 -0.77 0.00 -1.08 0.00 0.00 179.45 178.41 1xtt h ALA 92 N 1.15 0.65 -2.10 3.86 0.00 -1.25 -3.38 119.26 118.19 1xtt h ALA 92 Ca -0.01 -0.57 -0.58 0.00 0.00 0.00 0.00 54.91 53.75 1xtt h ALA 92 Cb 1.17 0.01 -0.41 0.00 0.00 0.00 0.00 17.79 18.57 1xtt h ALA 92 CO 0.10 0.71 -0.83 1.19 0.00 0.00 0.00 179.25 180.43 1xtt n PHE 93 N -3.13 1.83 0.30 0.00 3.01 -0.54 -4.95 117.46 113.99 1xtt n PHE 93 Ca -0.01 -3.89 0.19 0.00 1.01 0.00 0.00 57.45 54.76 1xtt n PHE 93 Cb 0.77 -0.46 1.03 0.00 -0.01 0.00 0.00 39.48 40.81 1xtt n PHE 93 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 1xtt h PRO 94 N 4.09 0.00 -0.52 -1.08 0.13 -1.64 -1.20 132.00 131.79 1xtt h PRO 94 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1xtt h PRO 94 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 1xtt h PRO 94 CO 0.67 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.07 1xtt n LYS 95 N -2.86 2.55 -2.51 0.86 5.02 -1.26 -4.96 118.16 115.00 1xtt n LYS 95 Ca -0.03 -2.37 -0.40 0.00 -2.02 0.00 0.00 58.31 53.50 1xtt n LYS 95 Cb 0.10 -1.53 -0.04 0.00 -0.02 0.00 0.00 35.03 33.53 1xtt n LYS 95 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xtt s ALA 96 N -1.32 3.34 0.34 7.82 0.00 -0.46 -4.69 121.76 126.79 1xtt s ALA 96 Ca 0.42 0.84 -0.09 0.00 0.00 0.00 0.00 51.96 53.14 1xtt s ALA 96 Cb 0.24 -3.31 -0.06 0.00 0.00 0.00 0.00 23.12 19.99 1xtt s ALA 96 CO 0.32 -0.15 0.66 1.03 0.00 0.00 0.00 175.76 177.63 1xtt s ARG 97 N -1.63 3.74 0.07 0.00 3.00 -0.36 -4.90 118.95 118.86 1xtt s ARG 97 Ca 0.47 0.28 0.09 0.00 0.00 0.00 0.00 55.73 56.57 1xtt s ARG 97 Cb -0.30 -2.52 -0.03 0.00 0.00 0.00 0.00 34.95 32.11 1xtt s ARG 97 CO 0.38 0.11 -0.25 -1.14 0.00 0.00 0.00 175.30 174.40 1xtt s GLN 98 N -3.58 1.76 0.14 3.54 0.74 -1.26 -0.80 119.66 120.20 1xtt s GLN 98 Ca 0.48 -1.14 0.06 0.00 0.05 0.00 0.00 55.36 54.81 1xtt s GLN 98 Cb -0.11 -2.00 -0.04 0.00 1.10 0.00 0.00 33.01 31.96 1xtt s GLN 98 CO 0.29 0.50 -0.14 0.20 -0.55 0.00 0.00 175.29 175.59 1xtt s GLY 99 N -1.50 1.17 0.02 2.59 0.00 0.10 -4.42 107.32 105.28 1xtt s GLY 99 Ca 0.13 -1.39 0.04 0.00 0.00 0.00 0.00 44.72 43.50 1xtt s GLY 99 CO 0.04 -1.46 -0.12 -1.34 0.00 0.00 0.00 173.10 170.22 1xtt s VAL 100 N -2.36 0.94 -0.05 1.40 -7.23 0.23 -0.37 120.40 112.96 1xtt s VAL 100 Ca 0.13 -0.78 -0.01 0.00 -1.81 0.00 0.00 61.98 59.51 1xtt s VAL 100 Cb -0.04 -0.84 0.03 0.00 0.56 0.00 0.00 36.38 36.09 1xtt s VAL 100 CO 0.04 0.06 0.01 -0.63 -0.31 0.00 0.00 175.10 174.26 1xtt s ILE 101 N -0.65 0.26 -0.27 -0.62 1.01 -0.37 -1.19 121.20 119.37 1xtt s ILE 101 Ca 0.01 0.14 -0.16 0.00 0.00 0.00 0.00 60.65 60.64 1xtt s ILE 101 Cb -0.06 -0.40 -0.03 0.00 0.01 0.00 0.00 42.46 41.97 1xtt s ILE 101 CO 0.01 0.21 0.42 -0.83 0.00 0.00 0.00 174.94 174.75 1xtt s GLY 102 N 1.63 1.87 0.01 6.18 0.00 0.17 -0.32 107.32 116.86 1xtt s GLY 102 Ca -0.01 -0.76 0.05 0.00 0.00 0.00 0.00 44.72 44.00 1xtt s GLY 102 CO -0.03 1.07 -0.14 0.00 0.00 0.00 0.00 173.10 173.99 1xtt s ALA 103 N 2.15 1.17 -0.09 3.20 0.00 -1.02 -0.76 121.76 126.39 1xtt s ALA 103 Ca 0.17 -0.68 -0.04 0.00 0.00 0.00 0.00 51.96 51.41 1xtt s ALA 103 Cb -0.16 -0.26 0.05 0.00 0.00 0.00 0.00 23.12 22.76 1xtt s ALA 103 CO 0.10 0.26 0.20 0.45 0.00 0.00 0.00 175.76 176.77 1xtt s SER 104 N -0.62 0.12 0.26 0.00 0.15 -0.34 -4.54 113.70 108.73 1xtt s SER 104 Ca 0.04 0.44 -0.30 0.00 0.70 0.00 0.00 55.95 56.83 1xtt s SER 104 Cb -0.06 0.38 -0.09 0.00 -1.71 0.00 0.00 66.02 64.53 1xtt s SER 104 CO 0.00 -0.19 0.98 -0.13 1.20 0.00 0.00 173.24 175.10 1xtt s ARG 105 N 1.69 4.78 -0.15 5.44 0.52 -1.26 -0.68 118.95 129.29 1xtt s ARG 105 Ca -0.05 1.56 -0.29 0.00 -0.52 0.00 0.00 55.73 56.43 1xtt s ARG 105 Cb -0.11 -3.23 -0.02 0.00 0.52 0.00 0.00 34.95 32.11 1xtt s ARG 105 CO -0.07 0.42 1.37 0.08 0.02 0.00 0.00 175.30 177.12 1xtt s VAL 106 N -1.20 4.09 0.59 3.52 1.01 0.37 -4.93 120.40 123.86 1xtt s VAL 106 Ca 0.42 1.30 -0.19 0.00 0.00 0.00 0.00 61.98 63.52 1xtt s VAL 106 Cb -0.27 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.21 1xtt s VAL 106 CO 0.34 -0.14 1.25 -1.61 0.00 0.00 0.00 175.10 174.94 1xtt s GLU 107 N 3.71 2.92 0.03 2.72 2.02 -1.26 -4.62 118.70 124.22 1xtt s GLU 107 Ca 0.60 1.95 0.03 0.00 0.02 0.00 0.00 54.97 57.57 1xtt s GLU 107 Cb -0.24 -1.98 -0.02 0.00 0.10 0.00 0.00 34.13 31.99 1xtt s GLU 107 CO 0.19 -1.28 -0.09 0.14 0.02 0.00 0.00 175.26 174.24 1xtt s VAL 108 N -1.49 0.65 0.60 2.63 -7.23 -1.26 -5.10 120.40 109.21 1xtt s VAL 108 Ca 0.77 -0.79 0.07 0.00 -1.81 0.00 0.00 61.98 60.22 1xtt s VAL 108 Cb -0.34 -0.63 0.09 0.00 0.56 0.00 0.00 36.38 36.06 1xtt s VAL 108 CO 0.37 -0.13 0.83 1.51 -0.31 0.00 0.00 175.10 177.38 1xtt s ASP 109 N -1.01 4.93 -0.15 4.85 -4.77 -1.26 -4.42 116.67 114.83 1xtt s ASP 109 Ca -0.03 -0.68 -0.31 0.00 -3.30 0.00 0.00 52.55 48.23 1xtt s ASP 109 Cb -0.07 0.14 -0.08 0.00 -1.09 0.00 0.00 42.92 41.83 1xtt s ASP 109 CO 0.00 -1.45 2.10 0.61 0.70 0.00 0.00 175.17 177.14 1xtt n GLY 110 N -2.38 1.23 2.10 2.12 0.00 -1.26 -4.56 105.19 102.44 1xtt n GLY 110 Ca 0.15 0.83 0.00 0.00 0.00 0.00 0.00 46.02 46.99 1xtt n GLY 110 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xtt n LYS 111 N 8.05 0.00 -3.67 1.61 5.02 -1.26 -5.13 118.16 122.78 1xtt n LYS 111 Ca 0.28 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.43 1xtt n LYS 111 Cb 0.38 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 35.31 1xtt n LYS 111 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1xtt s GLU 112 N -1.72 0.72 -0.10 1.97 2.02 -1.26 -5.11 118.70 115.22 1xtt s GLU 112 Ca 0.00 0.57 -0.35 0.00 0.02 0.00 0.00 54.97 55.21 1xtt s GLU 112 Cb 0.00 0.35 -0.13 0.00 0.10 0.00 0.00 34.13 34.45 1xtt s GLU 112 CO 0.00 -0.13 1.83 0.28 0.02 0.00 0.00 175.26 177.26 1xtt n VAL 113 N 2.28 0.49 -1.66 2.63 0.31 -1.26 -4.84 118.33 116.27 1xtt n VAL 113 Ca -0.15 -0.09 -0.44 0.00 -0.01 0.00 0.00 64.34 63.64 1xtt n VAL 113 Cb 0.56 -1.74 -0.02 0.00 -0.91 0.00 0.00 33.84 31.73 1xtt n VAL 113 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1xtt n PRO 114 N 6.18 1.93 -0.04 5.55 -0.02 -1.26 -4.90 135.00 142.44 1xtt n PRO 114 Ca 0.23 0.68 0.01 0.00 -2.02 0.00 0.00 63.50 62.40 1xtt n PRO 114 Cb 0.27 -2.28 -0.13 0.00 -0.02 0.00 0.00 33.50 31.33 1xtt n PRO 114 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1xtt n LYS 115 N 1.54 0.90 -3.46 -0.52 5.02 -1.26 -4.90 118.16 115.48 1xtt n LYS 115 Ca 0.10 -0.09 -0.12 0.00 -2.02 0.00 0.00 58.31 56.18 1xtt n LYS 115 Cb 0.32 -1.41 -0.02 0.00 -0.02 0.00 0.00 35.03 33.90 1xtt n LYS 115 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 1xtt s ASP 116 N -4.42 -0.52 0.08 4.39 -4.77 -1.26 -4.89 116.67 105.28 1xtt s ASP 116 Ca -0.07 -0.07 -0.08 0.00 -3.30 0.00 0.00 52.55 49.03 1xtt s ASP 116 Cb 0.08 0.59 -0.00 0.00 -1.09 0.00 0.00 42.92 42.50 1xtt s ASP 116 CO 0.69 -0.97 0.17 -0.04 0.70 0.00 0.00 175.17 175.72 1xtt s MET 117 N -3.76 0.80 -0.02 2.11 -1.94 -1.26 -5.08 119.30 110.16 1xtt s MET 117 Ca 0.02 -0.94 -0.30 0.00 -1.71 0.00 0.00 55.69 52.76 1xtt s MET 117 Cb -0.01 0.32 -0.03 0.00 2.01 0.00 0.00 34.83 37.13 1xtt s MET 117 CO -0.12 -0.24 0.99 -0.51 -0.01 0.00 0.00 175.02 175.12 1xtt s ASP 118 N -2.77 7.34 -0.17 3.03 1.01 -1.26 -4.87 116.67 118.98 1xtt s ASP 118 Ca 0.04 1.65 -0.01 0.00 0.71 0.00 0.00 52.55 54.94 1xtt s ASP 118 Cb 0.04 -2.57 -0.00 0.00 1.01 0.00 0.00 42.92 41.40 1xtt s ASP 118 CO -0.10 -0.29 -0.13 -0.69 0.21 0.00 0.00 175.17 174.16 1xtt s VAL 119 N 1.18 2.78 -0.29 -1.27 1.01 -1.26 -0.47 120.40 122.07 1xtt s VAL 119 Ca 0.52 -0.72 -0.16 0.00 0.00 0.00 0.00 61.98 61.62 1xtt s VAL 119 Cb -0.21 -2.19 -0.03 0.00 0.00 0.00 0.00 36.38 33.95 1xtt s VAL 119 CO 0.26 0.50 0.40 -0.47 0.00 0.00 0.00 175.10 175.79 1xtt s TYR 120 N 0.98 3.24 -0.46 5.22 5.04 0.14 -4.93 117.35 126.58 1xtt s TYR 120 Ca -0.02 0.36 -0.18 0.00 -2.44 0.00 0.00 57.07 54.78 1xtt s TYR 120 Cb -0.15 -2.63 0.04 0.00 0.35 0.00 0.00 41.96 39.57 1xtt s TYR 120 CO -0.02 -0.29 0.53 0.42 -1.34 0.00 0.00 175.55 174.85 1xtt s ILE 121 N 2.12 4.99 -1.28 3.14 -1.09 -1.26 -1.20 121.20 126.62 1xtt s ILE 121 Ca 0.16 -0.44 0.23 0.00 -2.23 0.00 0.00 60.65 58.37 1xtt s ILE 121 Cb -0.16 -4.17 -0.06 0.00 -1.58 0.00 0.00 42.46 36.49 1xtt s ILE 121 CO 0.10 -0.62 1.17 0.00 -1.23 0.00 0.00 174.94 174.36 1xtt n TYR 122 N 5.86 0.00 -3.65 3.97 0.18 0.06 -4.93 117.16 118.64 1xtt n TYR 122 Ca -0.07 0.00 -0.14 0.00 1.88 0.00 0.00 57.90 59.57 1xtt n TYR 122 Cb 0.46 -0.09 -0.08 0.00 -0.38 0.00 0.00 39.34 39.26 1xtt n TYR 122 CO 0.00 0.00 0.00 -0.47 -2.08 0.00 0.00 176.86 174.31 1xtt s TYR 123 N -2.84 -0.73 -0.23 -3.48 5.04 -1.21 -4.90 117.35 109.00 1xtt s TYR 123 Ca 0.13 1.76 -0.10 0.00 -2.44 0.00 0.00 57.07 56.42 1xtt s TYR 123 Cb 0.17 0.26 0.09 0.00 0.35 0.00 0.00 41.96 42.83 1xtt s TYR 123 CO 0.72 -0.35 0.51 0.21 -1.34 0.00 0.00 175.55 175.31 1xtt s LYS 124 N 0.39 0.46 -0.28 4.97 2.20 -1.26 0.46 119.74 126.69 1xtt s LYS 124 Ca -0.00 1.09 0.01 0.00 -0.36 0.00 0.00 55.97 56.71 1xtt s LYS 124 Cb -0.05 0.32 0.15 0.00 -1.51 0.00 0.00 37.83 36.74 1xtt s LYS 124 CO 0.00 -0.20 0.38 0.21 -0.36 0.00 0.00 175.35 175.38 1xtt s LYS 125 N 2.18 0.38 -0.04 4.03 2.47 -0.33 -5.01 119.74 123.42 1xtt s LYS 125 Ca -0.06 0.16 0.07 0.00 -1.56 0.00 0.00 55.97 54.57 1xtt s LYS 125 Cb -0.10 -0.42 -0.02 0.00 -1.46 0.00 0.00 37.83 35.84 1xtt s LYS 125 CO -0.15 -0.95 -0.24 0.42 0.16 0.00 0.00 175.35 174.58 1xtt s ILE 126 N 2.51 2.18 0.98 5.43 -1.09 -1.26 -0.60 121.20 129.35 1xtt s ILE 126 Ca 0.10 -1.04 -0.12 0.00 -2.23 0.00 0.00 60.65 57.36 1xtt s ILE 126 Cb -0.13 -1.78 0.18 0.00 -1.58 0.00 0.00 42.46 39.14 1xtt s ILE 126 CO -0.28 0.58 1.09 -2.84 -1.23 0.00 0.00 174.94 172.25 1xtt s PRO 127 N -0.40 0.58 0.10 2.79 0.02 -1.26 -4.92 135.00 131.91 1xtt s PRO 127 Ca 0.03 0.71 -0.31 0.00 0.02 0.00 0.00 61.00 61.45 1xtt s PRO 127 Cb -0.12 -1.74 -0.08 0.00 0.02 0.00 0.00 34.50 32.58 1xtt s PRO 127 CO 0.01 -2.67 1.48 -0.51 -0.33 0.00 0.00 177.00 174.98 1xtt s ASP 128 N -3.30 6.73 -0.24 2.53 1.01 -1.26 -4.97 116.67 117.18 1xtt s ASP 128 Ca 0.65 2.39 -0.13 0.00 0.71 0.00 0.00 52.55 56.17 1xtt s ASP 128 Cb -0.19 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.11 1xtt s ASP 128 CO 0.58 -0.75 0.28 -0.63 0.21 0.00 0.00 175.17 174.86 1xtt s ILE 129 N 1.61 5.27 -0.46 0.77 1.01 -1.26 -5.04 121.20 123.10 1xtt s ILE 129 Ca 0.67 0.41 -0.28 0.00 0.00 0.00 0.00 60.65 61.46 1xtt s ILE 129 Cb -0.38 -3.61 0.03 0.00 0.01 0.00 0.00 42.46 38.51 1xtt s ILE 129 CO 0.30 0.27 1.06 -0.13 0.00 0.00 0.00 174.94 176.44 1xtt s ARG 130 N 1.41 3.68 0.22 2.79 0.52 -1.26 -4.98 118.95 121.33 1xtt s ARG 130 Ca 0.12 0.46 -0.31 0.00 -0.52 0.00 0.00 55.73 55.48 1xtt s ARG 130 Cb -0.15 -3.90 -0.14 0.00 0.52 0.00 0.00 34.95 31.28 1xtt s ARG 130 CO 0.07 -1.29 1.31 0.00 0.02 0.00 0.00 175.30 175.41 1xtt n ALA 131 N 7.53 0.44 -0.76 2.13 0.00 -1.25 -1.36 120.51 127.24 1xtt n ALA 131 Ca 0.10 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.96 1xtt n ALA 131 Cb 0.49 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.76 1xtt n ALA 131 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1xtt n LYS 132 N 1.84 -0.60 0.00 0.00 5.02 0.50 -4.69 118.16 120.23 1xtt n LYS 132 Ca 0.12 0.15 0.00 0.00 -2.02 0.00 0.00 58.31 56.56 1xtt n LYS 132 Cb 0.29 -4.27 0.00 0.00 -0.02 0.00 0.00 35.03 31.03 1xtt n LYS 132 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1xtt n VAL 133 N -2.08 0.00 -2.60 -0.18 0.31 -0.55 -4.41 118.33 108.82 1xtt n VAL 133 Ca 0.00 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 63.97 1xtt n VAL 133 Cb 0.15 -1.37 -0.05 0.00 -0.91 0.00 0.00 33.84 31.67 1xtt n VAL 133 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1xtt s ASP 134 N -4.91 6.80 -0.28 4.52 1.01 -0.46 -4.61 116.67 118.74 1xtt s ASP 134 Ca 0.00 1.97 -0.08 0.00 0.71 0.00 0.00 52.55 55.15 1xtt s ASP 134 Cb 0.00 -2.58 -0.01 0.00 1.01 0.00 0.00 42.92 41.34 1xtt s ASP 134 CO 0.00 -0.46 0.10 0.20 0.21 0.00 0.00 175.17 175.23 1xtt s ASN 135 N -1.68 5.29 -0.18 0.27 0.01 0.25 -0.53 114.94 118.38 1xtt s ASN 135 Ca 0.58 -0.41 -0.12 0.00 -0.71 0.00 0.00 52.86 52.20 1xtt s ASN 135 Cb -0.20 -1.95 -0.05 0.00 0.41 0.00 0.00 41.25 39.47 1xtt s ASN 135 CO 0.25 -0.12 0.22 -0.69 -1.51 0.00 0.00 177.10 175.25 1xtt s VAL 136 N 1.59 5.35 -0.23 1.60 1.01 -0.29 -1.39 120.40 128.03 1xtt s VAL 136 Ca 0.05 0.40 -0.01 0.00 0.00 0.00 0.00 61.98 62.42 1xtt s VAL 136 Cb -0.16 -3.56 0.03 0.00 0.00 0.00 0.00 36.38 32.68 1xtt s VAL 136 CO 0.04 0.41 -0.10 -0.63 0.00 0.00 0.00 175.10 174.83 1xtt s ILE 137 N 0.42 2.63 -0.28 2.22 1.01 0.25 0.27 121.20 127.72 1xtt s ILE 137 Ca 0.13 -1.05 -0.11 0.00 0.00 0.00 0.00 60.65 59.62 1xtt s ILE 137 Cb -0.12 -2.30 -0.05 0.00 0.01 0.00 0.00 42.46 40.00 1xtt s ILE 137 CO 0.01 0.26 0.19 -0.63 0.00 0.00 0.00 174.94 174.78 1xtt s ILE 138 N 1.30 5.28 -0.20 2.92 1.01 0.51 0.10 121.20 132.12 1xtt s ILE 138 Ca 0.01 0.14 -0.06 0.00 0.00 0.00 0.00 60.65 60.74 1xtt s ILE 138 Cb -0.16 -3.53 -0.03 0.00 0.01 0.00 0.00 42.46 38.75 1xtt s ILE 138 CO -0.06 0.24 0.02 0.00 0.00 0.00 0.00 174.94 175.13 1xtt s ALA 139 N 1.75 3.13 -0.29 9.38 0.00 -0.34 -0.54 121.76 134.85 1xtt s ALA 139 Ca 0.07 -0.93 -0.05 0.00 0.00 0.00 0.00 51.96 51.05 1xtt s ALA 139 Cb -0.16 -1.82 0.16 0.00 0.00 0.00 0.00 23.12 21.30 1xtt s ALA 139 CO 0.11 -0.07 0.60 0.34 0.00 0.00 0.00 175.76 176.74 1xtt s ASP 140 N 0.85 -1.16 0.34 0.00 2.15 -0.54 -2.69 116.67 115.61 1xtt s ASP 140 Ca 0.02 1.15 0.13 0.00 0.43 0.00 0.00 52.55 54.28 1xtt s ASP 140 Cb -0.14 2.15 1.00 0.00 -0.30 0.00 0.00 42.92 45.62 1xtt s ASP 140 CO 0.02 -0.24 1.72 -0.65 -0.17 0.00 0.00 175.17 175.84 1xtt h PRO 141 N 8.02 0.45 -5.49 4.34 0.11 -1.86 -3.33 132.00 134.23 1xtt h PRO 141 Ca -0.20 -0.03 -0.62 0.00 0.11 0.00 0.00 66.00 65.26 1xtt h PRO 141 Cb 1.13 -0.10 -0.32 0.00 0.11 0.00 0.00 31.00 31.82 1xtt h PRO 141 CO 0.19 0.30 -0.86 -1.64 -0.21 0.00 0.00 178.00 175.78 1xtt s MET 142 N -5.67 2.18 -0.25 1.05 -1.94 -1.26 0.08 119.30 113.49 1xtt s MET 142 Ca -0.10 -0.73 0.01 0.00 -1.71 0.00 0.00 55.69 53.17 1xtt s MET 142 Cb 0.28 -1.83 0.06 0.00 2.01 0.00 0.00 34.83 35.35 1xtt s MET 142 CO 0.80 0.27 -0.05 0.42 -0.01 0.00 0.00 175.02 176.44 1xtt s ILE 143 N 0.05 1.71 0.00 2.53 1.01 -0.56 -5.01 121.20 120.94 1xtt s ILE 143 Ca -0.06 -1.41 0.00 0.00 0.00 0.00 0.00 60.65 59.18 1xtt s ILE 143 Cb -0.13 -1.97 0.00 0.00 0.01 0.00 0.00 42.46 40.37 1xtt s ILE 143 CO 0.04 -0.14 0.00 0.00 0.00 0.00 0.00 174.94 174.83 1xtt n ALA 144 N 4.59 0.14 0.80 9.38 0.00 -1.26 -0.77 120.51 133.39 1xtt n ALA 144 Ca -0.11 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.46 1xtt n ALA 144 Cb 0.43 0.00 0.33 0.00 0.00 0.00 0.00 19.45 20.22 1xtt n ALA 144 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1xtt n THR 145 N -1.09 0.22 -0.98 0.00 -2.24 -1.26 -3.07 114.28 105.86 1xtt n THR 145 Ca 0.00 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1xtt n THR 145 Cb 0.00 -0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.05 1xtt n THR 145 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xtt n ALA 146 N -1.65 0.00 -0.21 6.98 0.00 -1.26 -4.67 120.51 119.69 1xtt n ALA 146 Ca 0.05 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.44 1xtt n ALA 146 Cb 0.39 -0.29 0.04 0.00 0.00 0.00 0.00 19.45 19.59 1xtt n ALA 146 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1xtt h SER 147 N 0.00 0.68 -0.18 0.00 0.02 -1.91 0.15 113.55 112.31 1xtt h SER 147 Ca 0.00 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 60.92 1xtt h SER 147 Cb 0.16 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1xtt h SER 147 CO 0.00 0.49 0.04 0.74 -1.14 0.00 0.00 176.83 176.95 1xtt h THR 148 N 0.81 1.22 -0.54 -2.27 2.02 -1.91 -1.83 112.91 110.40 1xtt h THR 148 Ca 0.23 -0.70 -0.04 0.00 0.77 0.00 0.00 66.41 66.67 1xtt h THR 148 Cb -0.07 1.33 -0.02 0.00 -1.74 0.00 0.00 68.15 67.65 1xtt h THR 148 CO -0.06 0.21 0.18 -0.03 0.37 0.00 0.00 175.52 176.19 1xtt h MET 149 N 0.10 0.84 -0.66 6.66 -1.53 -1.89 -2.19 114.93 116.25 1xtt h MET 149 Ca 0.06 -0.17 -0.03 0.00 -3.44 0.00 0.00 59.70 56.11 1xtt h MET 149 Cb 0.29 -0.12 -0.03 0.00 -0.55 0.00 0.00 31.60 31.19 1xtt h MET 149 CO 0.00 0.76 0.29 -0.07 0.14 0.00 0.00 176.91 178.03 1xtt h LEU 150 N 0.75 0.87 -0.82 3.39 3.38 -0.64 0.15 115.31 122.39 1xtt h LEU 150 Ca 0.18 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.95 1xtt h LEU 150 Cb 0.26 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1xtt h LEU 150 CO -0.01 0.76 -0.14 0.50 0.09 0.00 0.00 178.44 179.64 1xtt h LYS 151 N 0.95 0.73 -0.07 1.13 3.64 -1.02 -1.59 116.57 120.34 1xtt h LYS 151 Ca 0.23 -0.25 -0.24 0.00 -1.27 0.00 0.00 60.65 59.12 1xtt h LYS 151 Cb 0.14 -0.06 0.01 0.00 -0.41 0.00 0.00 32.23 31.92 1xtt h LYS 151 CO -0.02 0.84 -0.90 0.28 -2.27 0.00 0.00 179.45 177.37 1xtt h VAL 152 N 0.66 1.30 -0.74 2.00 2.07 -0.85 -3.27 116.25 117.42 1xtt h VAL 152 Ca 0.11 -2.15 -0.03 0.00 0.82 0.00 0.00 66.70 65.44 1xtt h VAL 152 Cb 0.61 2.20 -0.03 0.00 -1.52 0.00 0.00 31.29 32.55 1xtt h VAL 152 CO 0.04 0.67 0.33 -0.07 0.02 0.00 0.00 177.57 178.56 1xtt h LEU 153 N 0.42 0.98 -0.91 2.57 3.38 -0.55 -2.09 115.31 119.11 1xtt h LEU 153 Ca -0.08 -0.13 0.22 0.00 0.09 0.00 0.00 57.88 57.98 1xtt h LEU 153 Cb 1.54 -0.25 -0.12 0.00 0.09 0.00 0.00 40.66 41.91 1xtt h LEU 153 CO 0.18 0.85 0.42 -0.08 0.09 0.00 0.00 178.44 179.89 1xtt h GLU 154 N 1.06 0.41 0.16 1.13 4.81 -1.34 0.11 114.58 120.93 1xtt h GLU 154 Ca 0.25 -0.02 -0.23 0.00 -0.13 0.00 0.00 59.36 59.22 1xtt h GLU 154 Cb 0.15 -0.09 0.02 0.00 0.63 0.00 0.00 28.75 29.45 1xtt h GLU 154 CO -0.03 0.27 -1.07 1.49 -0.73 0.00 0.00 179.01 178.95 1xtt h GLU 155 N 0.43 0.34 -0.85 1.92 4.81 -1.62 -3.34 114.58 116.27 1xtt h GLU 155 Ca 0.57 -0.57 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1xtt h GLU 155 Cb 1.08 0.21 -0.04 0.00 0.63 0.00 0.00 28.75 30.63 1xtt h GLU 155 CO -0.52 1.27 0.53 0.28 -0.73 0.00 0.00 179.01 179.85 1xtt h VAL 156 N -0.26 1.23 0.00 0.32 2.07 -0.67 -2.50 116.25 116.44 1xtt h VAL 156 Ca -0.20 -0.46 -0.02 0.00 0.82 0.00 0.00 66.70 66.84 1xtt h VAL 156 Cb 1.77 0.02 -0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1xtt h VAL 156 CO 0.16 0.23 -0.08 0.58 0.02 0.00 0.00 177.57 178.47 1xtt h VAL 157 N 1.15 0.95 0.00 2.57 2.07 -0.97 -1.41 116.25 120.62 1xtt h VAL 157 Ca 0.31 -0.30 -0.03 0.00 0.82 0.00 0.00 66.70 67.50 1xtt h VAL 157 Cb -0.08 1.16 -0.00 0.00 -1.52 0.00 0.00 31.29 30.84 1xtt h VAL 157 CO -0.06 0.08 -0.16 0.11 0.02 0.00 0.00 177.57 177.56 1xtt h LYS 158 N 0.00 0.00 0.00 1.57 1.57 -1.56 -1.54 116.57 116.61 1xtt h LYS 158 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1xtt h LYS 158 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.47 1xtt h LYS 158 CO 0.01 0.16 0.00 0.00 -0.57 0.00 0.00 179.45 179.06 1xtt n ALA 159 N -2.29 2.04 -3.80 3.86 0.00 -0.53 -4.92 120.51 114.87 1xtt n ALA 159 Ca -0.01 -0.08 -0.25 0.00 0.00 0.00 0.00 53.44 53.10 1xtt n ALA 159 Cb 0.29 -1.36 0.01 0.00 0.00 0.00 0.00 19.45 18.39 1xtt n ALA 159 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1xtt n ASN 160 N -1.49 -1.59 -4.68 0.00 4.05 -0.58 -3.92 115.26 107.05 1xtt n ASN 160 Ca 0.06 -0.94 -0.30 0.00 0.45 0.00 0.00 54.58 53.85 1xtt n ASN 160 Cb 0.26 -3.51 0.15 0.00 1.23 0.00 0.00 39.78 37.91 1xtt n ASN 160 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 1xtt s PRO 161 N -6.21 1.07 0.25 1.20 0.04 -1.26 -0.37 135.00 129.72 1xtt s PRO 161 Ca 0.09 1.05 -0.05 0.00 0.04 0.00 0.00 61.00 62.13 1xtt s PRO 161 Cb -0.03 -1.77 0.33 0.00 0.04 0.00 0.00 34.50 33.07 1xtt s PRO 161 CO 0.85 -2.43 1.88 -0.22 0.04 0.00 0.00 177.00 177.12 1xtt h LYS 162 N -1.70 1.11 -2.38 4.56 3.64 -1.02 -3.39 116.57 117.38 1xtt h LYS 162 Ca -0.49 -0.07 -0.07 0.00 -1.27 0.00 0.00 60.65 58.76 1xtt h LYS 162 Cb 1.28 -0.25 -0.18 0.00 -0.41 0.00 0.00 32.23 32.67 1xtt h LYS 162 CO 0.51 0.73 0.09 0.50 -2.27 0.00 0.00 179.45 179.01 1xtt s ARG 163 N -6.07 1.01 -0.13 1.90 3.52 -1.21 -4.98 118.95 113.00 1xtt s ARG 163 Ca -0.13 0.04 0.02 0.00 -0.13 0.00 0.00 55.73 55.53 1xtt s ARG 163 Cb 0.19 0.47 0.01 0.00 -1.56 0.00 0.00 34.95 34.06 1xtt s ARG 163 CO 0.81 -0.33 -0.18 0.42 -0.81 0.00 0.00 175.30 175.20 1xtt s ILE 164 N -1.65 1.74 -0.04 4.11 1.01 -1.26 -1.14 121.20 123.98 1xtt s ILE 164 Ca -0.09 -0.78 0.03 0.00 0.00 0.00 0.00 60.65 59.80 1xtt s ILE 164 Cb -0.01 -1.57 -0.03 0.00 0.01 0.00 0.00 42.46 40.86 1xtt s ILE 164 CO 0.05 0.49 -0.11 -0.31 0.00 0.00 0.00 174.94 175.06 1xtt s TYR 165 N 0.95 2.78 -0.13 3.97 1.51 0.14 -0.73 117.35 125.85 1xtt s TYR 165 Ca -0.06 -0.10 0.03 0.00 -1.01 0.00 0.00 57.07 55.93 1xtt s TYR 165 Cb -0.15 -1.63 0.01 0.00 -0.11 0.00 0.00 41.96 40.08 1xtt s TYR 165 CO -0.03 0.26 -0.22 0.42 -1.11 0.00 0.00 175.55 174.88 1xtt s ILE 166 N -0.82 2.00 -0.20 2.71 1.01 0.10 -0.36 121.20 125.65 1xtt s ILE 166 Ca 0.13 -0.96 0.01 0.00 0.00 0.00 0.00 60.65 59.83 1xtt s ILE 166 Cb -0.11 -1.76 0.02 0.00 0.01 0.00 0.00 42.46 40.62 1xtt s ILE 166 CO 0.02 0.54 -0.17 -0.69 0.00 0.00 0.00 174.94 174.65 1xtt s VAL 167 N 0.69 2.24 0.23 2.92 1.01 0.30 0.19 120.40 127.98 1xtt s VAL 167 Ca -0.10 -0.99 0.01 0.00 0.00 0.00 0.00 61.98 60.90 1xtt s VAL 167 Cb -0.16 -2.01 -0.05 0.00 0.00 0.00 0.00 36.38 34.16 1xtt s VAL 167 CO 0.01 0.44 0.06 -0.94 0.00 0.00 0.00 175.10 174.67 1xtt s SER 168 N 1.29 1.19 -0.25 3.32 1.04 -0.30 -1.47 113.70 118.53 1xtt s SER 168 Ca 0.03 -1.31 -0.17 0.00 0.48 0.00 0.00 55.95 54.99 1xtt s SER 168 Cb -0.14 0.15 -0.14 0.00 0.10 0.00 0.00 66.02 65.99 1xtt s SER 168 CO -0.11 -0.67 -0.16 -0.38 0.98 0.00 0.00 173.24 172.90 1xtt n ILE 169 N -0.38 1.53 -4.72 -1.02 2.08 0.11 -3.77 119.36 113.19 1xtt n ILE 169 Ca -0.02 -0.22 -0.25 0.00 0.56 0.00 0.00 62.75 62.82 1xtt n ILE 169 Cb 0.65 -1.98 -0.16 0.00 -0.75 0.00 0.00 39.64 37.41 1xtt n ILE 169 CO 0.00 0.00 0.00 -0.63 0.56 0.00 0.00 176.55 176.48 1xtt s ILE 170 N -2.47 1.28 0.07 1.39 1.01 -0.52 -1.13 121.20 120.82 1xtt s ILE 170 Ca -0.34 -0.62 0.05 0.00 0.00 0.00 0.00 60.65 59.74 1xtt s ILE 170 Cb 0.11 -1.12 -0.03 0.00 0.01 0.00 0.00 42.46 41.43 1xtt s ILE 170 CO 0.51 0.38 -0.14 -0.44 0.00 0.00 0.00 174.94 175.24 1xtt s SER 171 N 0.20 1.71 0.42 3.58 0.01 -0.81 -1.49 113.70 117.31 1xtt s SER 171 Ca -0.06 -0.59 -0.07 0.00 1.31 0.00 0.00 55.95 56.54 1xtt s SER 171 Cb -0.12 -0.06 -0.05 0.00 0.21 0.00 0.00 66.02 66.00 1xtt s SER 171 CO 0.02 -0.05 0.73 -0.94 0.41 0.00 0.00 173.24 173.41 1xtt s SER 172 N -1.64 6.38 0.24 2.44 1.04 0.05 -0.87 113.70 121.34 1xtt s SER 172 Ca -0.01 0.94 -0.06 0.00 0.48 0.00 0.00 55.95 57.30 1xtt s SER 172 Cb -0.10 -2.25 0.32 0.00 0.10 0.00 0.00 66.02 64.10 1xtt s SER 172 CO 0.02 -0.44 1.84 -0.33 0.98 0.00 0.00 173.24 175.32 1xtt h GLU 173 N 0.84 0.90 -0.21 4.02 5.08 -1.34 -0.56 114.58 123.32 1xtt h GLU 173 Ca -0.47 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 57.83 1xtt h GLU 173 Cb 1.20 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.23 1xtt h GLU 173 CO 0.63 0.60 0.12 -0.92 -1.00 0.00 0.00 179.01 178.44 1xtt h TYR 174 N 0.93 0.28 -0.39 4.33 3.20 -1.85 -2.04 116.97 121.44 1xtt h TYR 174 Ca 0.36 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.23 1xtt h TYR 174 Cb 0.18 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.34 1xtt h TYR 174 CO -0.04 0.23 0.24 0.78 -1.64 0.00 0.00 178.16 177.73 1xtt h GLY 175 N 0.25 0.56 1.01 1.82 0.00 -1.30 -0.35 103.07 105.05 1xtt h GLY 175 Ca 0.08 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.18 1xtt h GLY 175 CO -0.01 0.22 0.49 -2.08 0.00 0.00 0.00 176.54 175.16 1xtt h VAL 176 N 0.51 1.20 -0.46 4.60 2.07 -1.03 -1.71 116.25 121.43 1xtt h VAL 176 Ca 0.14 -0.40 -0.04 0.00 0.82 0.00 0.00 66.70 67.22 1xtt h VAL 176 Cb -0.01 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 29.83 1xtt h VAL 176 CO -0.03 0.20 0.11 -1.13 0.02 0.00 0.00 177.57 176.75 1xtt h ASN 177 N 1.04 0.69 -0.54 0.57 -0.73 -1.03 -1.80 115.58 113.79 1xtt h ASN 177 Ca 0.28 -0.23 -0.04 0.00 1.87 0.00 0.00 56.30 58.18 1xtt h ASN 177 Cb -0.09 -0.18 -0.03 0.00 0.27 0.00 0.00 38.32 38.29 1xtt h ASN 177 CO -0.06 0.74 0.22 0.50 -0.37 0.00 0.00 177.43 178.46 1xtt h LYS 178 N 0.61 0.85 0.07 6.67 3.64 -0.73 -0.86 116.57 126.82 1xtt h LYS 178 Ca 0.14 -0.14 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1xtt h LYS 178 Cb 0.32 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 1xtt h LYS 178 CO 0.00 0.71 -0.03 0.82 -2.27 0.00 0.00 179.45 178.68 1xtt h ILE 179 N 0.84 1.14 -0.03 2.00 2.04 -1.19 -3.23 117.51 119.07 1xtt h ILE 179 Ca 0.20 -1.52 -0.11 0.00 1.00 0.00 0.00 64.86 64.43 1xtt h ILE 179 Cb 0.18 2.02 -0.01 0.00 -0.74 0.00 0.00 36.82 38.27 1xtt h ILE 179 CO -0.02 0.33 -0.49 -0.07 0.00 0.00 0.00 178.15 177.91 1xtt h LEU 180 N -0.87 0.09 -1.15 1.44 3.38 -1.35 0.28 115.31 117.13 1xtt h LEU 180 Ca -0.01 -0.04 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 1xtt h LEU 180 Cb 0.62 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1xtt h LEU 180 CO 0.02 0.56 -0.30 0.77 0.09 0.00 0.00 178.44 179.58 1xtt h SER 181 N 0.07 0.21 0.25 -0.43 4.64 -1.30 -0.43 113.55 116.56 1xtt h SER 181 Ca 0.00 -0.07 -0.34 0.00 -0.47 0.00 0.00 61.79 60.91 1xtt h SER 181 Cb 0.89 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 62.90 1xtt h SER 181 CO 0.07 0.51 -1.87 0.50 -0.87 0.00 0.00 176.83 175.17 1xtt h LYS 182 N 0.18 0.21 -2.43 4.77 3.64 -1.52 -3.41 116.57 118.01 1xtt h LYS 182 Ca 0.03 -0.35 -0.59 0.00 -1.27 0.00 0.00 60.65 58.46 1xtt h LYS 182 Cb 0.63 0.13 -0.40 0.00 -0.41 0.00 0.00 32.23 32.18 1xtt h LYS 182 CO 0.05 1.03 -0.80 0.66 -2.27 0.00 0.00 179.45 178.12 1xtt n TYR 183 N -3.38 1.49 0.27 1.91 4.02 0.95 -4.97 117.16 117.46 1xtt n TYR 183 Ca -0.26 -3.85 0.17 0.00 -0.01 0.00 0.00 57.90 53.95 1xtt n TYR 183 Cb 1.05 -0.32 0.92 0.00 -0.02 0.00 0.00 39.34 40.97 1xtt n TYR 183 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 1xtt h PRO 184 N 4.82 0.00 -0.11 -0.72 0.11 -1.28 -2.48 132.00 132.34 1xtt h PRO 184 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1xtt h PRO 184 Cb 0.80 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.91 1xtt h PRO 184 CO 0.60 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 179.58 1xtt n PHE 185 N -2.74 0.11 -2.62 0.65 3.01 -1.26 -2.96 117.46 111.66 1xtt n PHE 185 Ca -0.02 -0.06 -0.38 0.00 1.01 0.00 0.00 57.45 58.00 1xtt n PHE 185 Cb 0.12 0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 39.54 1xtt n PHE 185 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1xtt s ILE 186 N -1.89 3.84 -0.54 4.37 1.01 -0.93 -4.55 121.20 122.50 1xtt s ILE 186 Ca 0.32 1.64 -0.19 0.00 0.00 0.00 0.00 60.65 62.42 1xtt s ILE 186 Cb 0.21 -3.96 0.08 0.00 0.01 0.00 0.00 42.46 38.80 1xtt s ILE 186 CO 0.31 0.23 0.65 -0.31 0.00 0.00 0.00 174.94 175.81 1xtt s TYR 187 N -1.42 3.04 -0.32 3.97 2.02 0.09 -0.43 117.35 124.30 1xtt s TYR 187 Ca 0.49 -0.76 -0.14 0.00 -0.37 0.00 0.00 57.07 56.29 1xtt s TYR 187 Cb -0.25 -3.73 -0.02 0.00 -0.40 0.00 0.00 41.96 37.56 1xtt s TYR 187 CO 0.31 -1.14 0.31 -1.17 -1.57 0.00 0.00 175.55 172.29 1xtt s LEU 188 N 2.59 4.30 -0.13 -1.29 0.20 0.07 -0.72 118.68 123.70 1xtt s LEU 188 Ca 0.13 -0.14 -0.04 0.00 0.69 0.00 0.00 54.13 54.77 1xtt s LEU 188 Cb -0.22 -2.27 -0.03 0.00 -0.43 0.00 0.00 46.19 43.24 1xtt s LEU 188 CO 0.09 -0.23 0.01 -0.36 -0.29 0.00 0.00 176.35 175.57 1xtt s PHE 189 N 1.92 3.17 0.16 5.38 0.40 0.13 -0.39 117.98 128.74 1xtt s PHE 189 Ca 0.10 0.06 -0.17 0.00 -0.60 0.00 0.00 56.93 56.32 1xtt s PHE 189 Cb -0.16 -1.91 0.03 0.00 0.51 0.00 0.00 43.02 41.49 1xtt s PHE 189 CO 0.11 0.28 0.47 -0.08 0.70 0.00 0.00 175.22 176.69 1xtt s THR 190 N -0.26 0.04 -0.17 0.64 -1.32 -0.71 -1.15 115.64 112.72 1xtt s THR 190 Ca 0.06 -0.64 0.03 0.00 -1.21 0.00 0.00 61.69 59.94 1xtt s THR 190 Cb -0.12 -1.35 -0.22 0.00 -1.51 0.00 0.00 72.50 69.29 1xtt s THR 190 CO 0.02 -0.20 0.16 0.52 -2.21 0.00 0.00 174.62 172.91 1xtt n VAL 191 N -0.29 1.59 -3.81 5.08 0.31 -0.29 -0.21 118.33 120.72 1xtt n VAL 191 Ca -0.13 -0.68 -0.12 0.00 -0.01 0.00 0.00 64.34 63.40 1xtt n VAL 191 Cb 0.63 -1.31 -0.09 0.00 -0.91 0.00 0.00 33.84 32.16 1xtt n VAL 191 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1xtt s ALA 192 N -2.54 -0.53 -0.30 3.52 0.00 -0.90 -4.21 121.76 116.81 1xtt s ALA 192 Ca -0.22 -0.02 -0.00 0.00 0.00 0.00 0.00 51.96 51.73 1xtt s ALA 192 Cb 0.08 0.18 0.06 0.00 0.00 0.00 0.00 23.12 23.43 1xtt s ALA 192 CO 0.73 -0.30 -0.02 0.42 0.00 0.00 0.00 175.76 176.60 1xtt s ILE 193 N -1.86 2.72 0.21 0.00 1.01 -1.26 -1.93 121.20 120.09 1xtt s ILE 193 Ca -0.10 -1.56 -0.19 0.00 0.00 0.00 0.00 60.65 58.80 1xtt s ILE 193 Cb -0.04 -2.62 -0.08 0.00 0.01 0.00 0.00 42.46 39.73 1xtt s ILE 193 CO 0.00 -0.15 0.70 -1.81 0.00 0.00 0.00 174.94 173.69 1xtt s ASP 194 N 1.22 7.04 0.39 3.58 1.01 -0.05 -4.81 116.67 125.06 1xtt s ASP 194 Ca -0.05 1.38 0.07 0.00 0.71 0.00 0.00 52.55 54.67 1xtt s ASP 194 Cb -0.20 -2.40 0.80 0.00 1.01 0.00 0.00 42.92 42.13 1xtt s ASP 194 CO -0.03 0.05 1.98 1.55 0.21 0.00 0.00 175.17 178.94 1xtt h PRO 195 N 3.49 0.43 -3.92 8.23 0.13 -1.89 -0.69 132.00 137.78 1xtt h PRO 195 Ca -0.48 -0.06 -0.23 0.00 -0.87 0.00 0.00 66.00 64.36 1xtt h PRO 195 Cb 1.19 -0.08 -0.06 0.00 0.13 0.00 0.00 31.00 32.18 1xtt h PRO 195 CO 0.65 0.39 -0.11 -1.83 -0.23 0.00 0.00 178.00 176.88 1xtt s GLU 196 N -5.15 1.97 0.12 0.86 -1.05 -1.22 -4.48 118.70 109.74 1xtt s GLU 196 Ca -0.07 -1.70 0.09 0.00 -0.15 0.00 0.00 54.97 53.14 1xtt s GLU 196 Cb 0.16 0.48 -0.04 0.00 -0.44 0.00 0.00 34.13 34.29 1xtt s GLU 196 CO 0.74 -0.84 -0.22 -0.51 0.95 0.00 0.00 175.26 175.37 1xtt s LEU 197 N -3.21 2.32 0.00 1.83 1.43 -1.26 -0.46 118.68 119.33 1xtt s LEU 197 Ca 0.28 -0.72 -0.02 0.00 -1.03 0.00 0.00 54.13 52.63 1xtt s LEU 197 Cb -0.01 -0.97 0.06 0.00 0.03 0.00 0.00 46.19 45.29 1xtt s LEU 197 CO 0.19 0.08 0.36 -0.46 0.23 0.00 0.00 176.35 176.75 1xtt n ASN 198 N 0.94 0.26 0.14 2.29 0.23 0.45 -4.89 115.26 114.69 1xtt n ASN 198 Ca -0.18 -1.27 0.12 0.00 -0.53 0.00 0.00 54.58 52.71 1xtt n ASN 198 Cb 0.54 -0.25 0.53 0.00 -2.08 0.00 0.00 39.78 38.51 1xtt n ASN 198 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 1xtt n ASN 199 N -3.10 0.67 -1.24 0.53 4.05 -1.26 -2.15 115.26 112.76 1xtt n ASN 199 Ca 0.05 0.70 0.11 0.00 0.45 0.00 0.00 54.58 55.89 1xtt n ASN 199 Cb 0.19 -0.83 0.28 0.00 1.23 0.00 0.00 39.78 40.65 1xtt n ASN 199 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 1xtt n LYS 200 N -2.28 2.66 -0.73 1.20 5.02 -1.26 -4.35 118.16 118.41 1xtt n LYS 200 Ca 0.01 -2.51 0.00 0.00 -2.02 0.00 0.00 58.31 53.79 1xtt n LYS 200 Cb 0.18 -1.53 0.00 0.00 -0.02 0.00 0.00 35.03 33.67 1xtt n LYS 200 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xtt n GLY 201 N 1.52 0.62 3.83 0.72 0.00 -0.91 -4.66 105.19 106.30 1xtt n GLY 201 Ca 0.22 -0.14 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 1xtt n GLY 201 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xtt s TYR 202 N -2.00 3.64 0.20 1.61 1.51 -1.26 -4.68 117.35 116.37 1xtt s TYR 202 Ca 0.00 1.17 -0.30 0.00 -1.01 0.00 0.00 57.07 56.93 1xtt s TYR 202 Cb 0.00 -2.45 -0.08 0.00 -0.11 0.00 0.00 41.96 39.32 1xtt s TYR 202 CO 0.00 0.42 1.15 0.42 -1.11 0.00 0.00 175.55 176.43 1xtt s ILE 203 N -1.44 3.65 -0.10 2.71 1.01 -1.26 -0.41 121.20 125.34 1xtt s ILE 203 Ca 0.38 1.43 0.04 0.00 0.00 0.00 0.00 60.65 62.50 1xtt s ILE 203 Cb -0.16 -3.91 0.00 0.00 0.01 0.00 0.00 42.46 38.40 1xtt s ILE 203 CO 0.20 0.25 -0.24 -0.76 0.00 0.00 0.00 174.94 174.39 1xtt s LEU 204 N -0.47 2.10 0.43 2.97 1.43 0.39 -2.69 118.68 122.83 1xtt s LEU 204 Ca 0.50 -0.56 0.23 0.00 -1.03 0.00 0.00 54.13 53.27 1xtt s LEU 204 Cb -0.32 -1.42 0.87 0.00 0.03 0.00 0.00 46.19 45.36 1xtt s LEU 204 CO 0.37 0.15 1.81 1.55 0.23 0.00 0.00 176.35 180.46 1xtt h PRO 205 N 6.78 0.00 0.00 1.29 0.13 -1.96 -3.24 132.00 135.00 1xtt h PRO 205 Ca -0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 1xtt h PRO 205 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1xtt h PRO 205 CO 0.48 0.26 0.00 0.41 -0.23 0.00 0.00 178.00 178.92 1xtt n GLY 206 N 0.15 1.58 0.00 1.56 0.00 -1.10 -4.64 105.19 102.74 1xtt n GLY 206 Ca -0.00 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.55 1xtt n GLY 206 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1xtt n LEU 207 N 0.00 0.00 0.00 0.99 -0.00 -1.26 -4.71 117.00 112.02 1xtt n LEU 207 Ca 0.00 -0.22 0.00 0.00 -0.00 0.00 0.00 56.01 55.79 1xtt n LEU 207 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1xtt n LEU 207 CO 0.00 0.26 0.00 0.61 -0.00 0.00 0.00 177.39 178.26 1xtt n GLY 208 N 0.00 -1.52 3.60 1.47 0.00 -1.26 -4.77 105.19 102.71 1xtt n GLY 208 Ca 0.00 -1.78 -0.43 0.00 0.00 0.00 0.00 46.02 43.81 1xtt n GLY 208 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xtt s ASP 209 N -4.00 6.69 0.34 1.61 2.15 -1.26 -4.91 116.67 117.30 1xtt s ASP 209 Ca 0.00 0.58 0.06 0.00 0.43 0.00 0.00 52.55 53.62 1xtt s ASP 209 Cb 0.00 -2.51 0.71 0.00 -0.30 0.00 0.00 42.92 40.82 1xtt s ASP 209 CO 0.00 -1.01 1.90 0.00 -0.17 0.00 0.00 175.17 175.89 1xtt h ALA 210 N 8.71 1.70 -0.01 3.66 0.00 -1.97 -0.83 119.26 130.52 1xtt h ALA 210 Ca -0.23 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 1xtt h ALA 210 Cb 1.07 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.67 1xtt h ALA 210 CO 1.05 0.12 0.00 0.78 0.00 0.00 0.00 179.25 181.20 1xtt h GLY 211 N 0.81 0.01 1.41 0.00 0.00 -1.90 -2.27 103.07 101.13 1xtt h GLY 211 Ca 0.40 -0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.64 1xtt h GLY 211 CO -0.16 0.00 -0.10 -0.55 0.00 0.00 0.00 176.54 175.73 1xtt h ASP 212 N -0.07 0.70 -0.51 0.19 3.32 -1.64 -0.24 116.42 118.17 1xtt h ASP 212 Ca 0.00 -0.20 -0.00 0.00 0.02 0.00 0.00 57.03 56.85 1xtt h ASP 212 Cb 0.08 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.41 1xtt h ASP 212 CO -0.00 0.83 0.31 0.03 -1.72 0.00 0.00 179.24 178.69 1xtt h ARG 213 N 0.65 0.71 0.08 3.56 2.47 -0.99 0.27 114.38 121.12 1xtt h ARG 213 Ca 0.11 -0.06 -0.33 0.00 -1.26 0.00 0.00 59.98 58.45 1xtt h ARG 213 Cb 0.55 -0.15 -0.03 0.00 -1.65 0.00 0.00 29.97 28.69 1xtt h ARG 213 CO 0.03 0.50 -1.84 0.00 0.56 0.00 0.00 179.97 179.22 1xtt h ALA 214 N 1.63 0.55 0.00 0.04 0.00 -1.11 -3.35 119.26 117.02 1xtt h ALA 214 Ca 0.19 -1.40 0.00 0.00 0.00 0.00 0.00 54.91 53.70 1xtt h ALA 214 Cb -0.03 0.59 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1xtt h ALA 214 CO -0.04 1.40 0.00 1.19 0.00 0.00 0.00 179.25 181.81 1xtt n PHE 215 N -3.31 0.00 -0.72 0.00 3.01 -0.13 -4.69 117.46 111.62 1xtt n PHE 215 Ca -0.25 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.21 1xtt n PHE 215 Cb 1.05 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.52 1xtt n PHE 215 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18