#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xhc s LYS 2 N 0.00 4.00 -0.25 1.43 1.02 -1.26 -1.85 119.74 122.83 1xhc s LYS 2 Ca 0.00 0.77 -0.09 0.00 0.02 0.00 0.00 55.97 56.67 1xhc s LYS 2 Cb 0.00 -3.73 -0.04 0.00 -0.52 0.00 0.00 37.83 33.54 1xhc s LYS 2 CO 0.00 -0.76 0.13 0.08 -0.92 0.00 0.00 175.35 173.88 1xhc s VAL 3 N 3.21 4.90 -0.11 3.17 1.01 0.13 -1.51 120.40 131.19 1xhc s VAL 3 Ca 0.37 0.02 -0.02 0.00 0.00 0.00 0.00 61.98 62.36 1xhc s VAL 3 Cb -0.13 -3.30 -0.03 0.00 0.00 0.00 0.00 36.38 32.92 1xhc s VAL 3 CO 0.13 0.32 -0.04 -0.69 0.00 0.00 0.00 175.10 174.83 1xhc s VAL 4 N 1.43 3.96 -0.12 2.92 1.01 -0.18 -0.93 120.40 128.49 1xhc s VAL 4 Ca 0.06 -0.36 0.00 0.00 0.00 0.00 0.00 61.98 61.69 1xhc s VAL 4 Cb -0.15 -2.68 0.02 0.00 0.00 0.00 0.00 36.38 33.57 1xhc s VAL 4 CO 0.06 0.56 -0.12 -0.63 0.00 0.00 0.00 175.10 174.97 1xhc s ILE 5 N -0.33 1.30 -0.36 2.22 1.01 -0.04 -0.20 121.20 124.79 1xhc s ILE 5 Ca 0.06 -0.48 -0.16 0.00 0.00 0.00 0.00 60.65 60.07 1xhc s ILE 5 Cb -0.12 -1.25 -0.00 0.00 0.01 0.00 0.00 42.46 41.10 1xhc s ILE 5 CO 0.02 0.41 0.37 -0.69 0.00 0.00 0.00 174.94 175.06 1xhc s VAL 6 N 1.42 5.16 0.00 2.92 1.01 -0.73 -0.48 120.40 129.69 1xhc s VAL 6 Ca 0.01 -0.07 0.00 0.00 0.00 0.00 0.00 61.98 61.93 1xhc s VAL 6 Cb -0.13 -3.87 0.00 0.00 0.00 0.00 0.00 36.38 32.38 1xhc s VAL 6 CO -0.07 -0.17 0.00 0.61 0.00 0.00 0.00 175.10 175.47 1xhc n GLY 7 N 5.00 3.15 0.81 4.51 0.00 0.96 -0.69 105.19 118.91 1xhc n GLY 7 Ca -0.09 -1.32 0.02 0.00 0.00 0.00 0.00 46.02 44.62 1xhc n GLY 7 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1xhc n ASN 8 N 0.00 2.17 -2.73 1.61 5.15 -1.26 -4.09 115.26 116.11 1xhc n ASN 8 Ca 0.00 -3.89 -0.08 0.00 -0.60 0.00 0.00 54.58 50.01 1xhc n ASN 8 Cb 0.00 -0.50 0.06 0.00 -0.53 0.00 0.00 39.78 38.81 1xhc n ASN 8 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1xhc n GLY 9 N -1.06 -2.29 0.29 8.20 0.00 -1.26 -4.51 105.19 104.56 1xhc n GLY 9 Ca 0.23 -1.50 0.11 0.00 0.00 0.00 0.00 46.02 44.86 1xhc n GLY 9 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xhc h PRO 10 N 0.00 0.00 0.50 1.61 0.13 -1.92 -0.41 132.00 131.91 1xhc h PRO 10 Ca -0.11 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.00 1xhc h PRO 10 Cb 0.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.47 1xhc h PRO 10 CO 0.07 0.00 -0.24 0.78 -0.23 0.00 0.00 178.00 178.38 1xhc h GLY 11 N 0.00 -0.70 1.35 1.56 0.00 -1.88 -2.11 103.07 101.29 1xhc h GLY 11 Ca 0.06 0.26 -0.04 0.00 0.00 0.00 0.00 47.33 47.61 1xhc h GLY 11 CO -0.00 -0.25 0.17 -1.33 0.00 0.00 0.00 176.54 175.13 1xhc h GLY 12 N -0.76 0.88 0.90 4.60 0.00 -1.67 -1.40 103.07 105.62 1xhc h GLY 12 Ca -0.07 -0.48 -0.06 0.00 0.00 0.00 0.00 47.33 46.72 1xhc h GLY 12 CO 0.11 0.45 -0.04 -2.75 0.00 0.00 0.00 176.54 174.31 1xhc h PHE 13 N 0.80 0.64 -0.27 5.60 3.57 -1.17 -1.39 116.94 124.72 1xhc h PHE 13 Ca 0.18 -0.13 -0.04 0.00 3.53 0.00 0.00 57.97 61.52 1xhc h PHE 13 Cb 0.23 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 1xhc h PHE 13 CO 0.01 0.74 0.02 1.49 -2.23 0.00 0.00 178.31 178.34 1xhc h GLU 14 N 0.36 0.46 -0.57 1.11 4.57 -1.21 -2.08 114.58 117.23 1xhc h GLU 14 Ca 0.08 -0.14 0.09 0.00 -1.18 0.00 0.00 59.36 58.21 1xhc h GLU 14 Cb 0.51 -0.05 -0.07 0.00 -0.16 0.00 0.00 28.75 28.98 1xhc h GLU 14 CO 0.02 0.61 0.18 1.25 -1.18 0.00 0.00 179.01 179.89 1xhc h LEU 15 N 0.26 0.14 0.03 1.64 5.85 -1.23 -1.27 115.31 120.73 1xhc h LEU 15 Ca 0.08 0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.88 1xhc h LEU 15 Cb 0.39 0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.50 1xhc h LEU 15 CO 0.01 0.09 -0.02 0.00 -0.34 0.00 0.00 178.44 178.19 1xhc h ALA 16 N 1.41 -0.04 -0.86 1.25 0.00 -1.10 -1.41 119.26 118.50 1xhc h ALA 16 Ca 0.29 -0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.28 1xhc h ALA 16 Cb 0.36 0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.09 1xhc h ALA 16 CO -0.31 -0.50 0.49 0.87 0.00 0.00 0.00 179.25 179.80 1xhc h LYS 17 N -0.08 0.76 0.00 0.00 1.57 -1.14 -1.07 116.57 116.61 1xhc h LYS 17 Ca -0.00 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 1xhc h LYS 17 Cb 0.07 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.21 1xhc h LYS 17 CO 0.01 0.51 -0.03 1.96 -0.57 0.00 0.00 179.45 181.32 1xhc h GLN 18 N 0.79 0.00 0.00 3.15 1.08 -0.83 -3.31 115.11 115.99 1xhc h GLN 18 Ca 0.43 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.63 1xhc h GLN 18 Cb 0.46 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.89 1xhc h GLN 18 CO -0.28 0.03 -1.60 1.28 -0.95 0.00 0.00 178.83 177.31 1xhc n LEU 19 N -3.11 0.17 0.16 1.46 4.77 -0.57 -4.73 117.00 115.14 1xhc n LEU 19 Ca 0.02 -0.10 0.01 0.00 -0.03 0.00 0.00 56.01 55.91 1xhc n LEU 19 Cb 0.45 0.00 0.26 0.00 -2.33 0.00 0.00 43.42 41.80 1xhc n LEU 19 CO 0.32 0.04 0.61 0.77 -1.33 0.00 0.00 177.39 177.79 1xhc h SER 20 N 0.00 0.00 0.51 -1.43 4.64 -1.30 0.26 113.55 116.23 1xhc h SER 20 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xhc h SER 20 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 1xhc h SER 20 CO 0.00 0.50 0.00 0.00 -0.87 0.00 0.00 176.83 176.46 1xhc n GLN 21 N -3.90 0.27 0.00 4.77 6.02 -1.26 -4.22 117.38 119.06 1xhc n GLN 21 Ca -0.01 0.07 0.00 0.00 -0.01 0.00 0.00 57.00 57.05 1xhc n GLN 21 Cb 0.52 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.28 1xhc n GLN 21 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1xhc n THR 22 N -1.33 0.00 -4.03 5.09 -1.04 -0.58 -5.10 114.28 107.29 1xhc n THR 22 Ca 0.10 0.00 -0.24 0.00 -2.04 0.00 0.00 64.05 61.87 1xhc n THR 22 Cb 0.20 -1.31 -0.06 0.00 -1.82 0.00 0.00 70.33 67.34 1xhc n THR 22 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1xhc s TYR 23 N -2.00 2.59 -0.57 -1.42 1.51 0.80 -4.90 117.35 113.36 1xhc s TYR 23 Ca 0.00 -0.58 -0.23 0.00 -1.01 0.00 0.00 57.07 55.25 1xhc s TYR 23 Cb 0.00 -1.99 0.05 0.00 -0.11 0.00 0.00 41.96 39.91 1xhc s TYR 23 CO 0.00 0.11 0.90 -2.00 -1.11 0.00 0.00 175.55 173.46 1xhc s GLU 24 N -3.95 3.24 -0.20 -0.62 2.12 -0.77 -4.50 118.70 114.01 1xhc s GLU 24 Ca 0.42 -0.51 -0.07 0.00 0.36 0.00 0.00 54.97 55.17 1xhc s GLU 24 Cb 0.03 -4.11 -0.03 0.00 0.26 0.00 0.00 34.13 30.28 1xhc s GLU 24 CO 0.23 -1.54 0.04 0.08 -0.54 0.00 0.00 175.26 173.54 1xhc s VAL 25 N 3.79 4.39 -0.12 3.70 1.01 -1.26 -0.69 120.40 131.21 1xhc s VAL 25 Ca 0.26 -0.16 0.01 0.00 0.00 0.00 0.00 61.98 62.09 1xhc s VAL 25 Cb -0.15 -3.00 -0.01 0.00 0.00 0.00 0.00 36.38 33.22 1xhc s VAL 25 CO 0.16 0.42 -0.16 -0.89 0.00 0.00 0.00 175.10 174.62 1xhc s THR 26 N 0.89 2.74 -0.13 3.92 2.01 -0.11 -1.35 115.64 123.62 1xhc s THR 26 Ca 0.03 -0.77 -0.03 0.00 0.31 0.00 0.00 61.69 61.22 1xhc s THR 26 Cb -0.14 -2.13 -0.03 0.00 0.01 0.00 0.00 72.50 70.21 1xhc s THR 26 CO 0.02 0.54 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.79 1xhc s VAL 27 N 0.35 4.17 -0.15 3.82 1.01 0.11 -0.86 120.40 128.84 1xhc s VAL 27 Ca -0.13 -0.28 0.01 0.00 0.00 0.00 0.00 61.98 61.58 1xhc s VAL 27 Cb -0.17 -2.80 0.02 0.00 0.00 0.00 0.00 36.38 33.43 1xhc s VAL 27 CO 0.07 0.54 -0.19 -0.63 0.00 0.00 0.00 175.10 174.88 1xhc s ILE 28 N -0.18 1.91 0.01 2.22 1.01 0.36 0.10 121.20 126.63 1xhc s ILE 28 Ca 0.05 -0.86 0.00 0.00 0.00 0.00 0.00 60.65 59.84 1xhc s ILE 28 Cb -0.13 -1.72 -0.01 0.00 0.01 0.00 0.00 42.46 40.61 1xhc s ILE 28 CO 0.02 0.52 -0.02 -0.62 0.00 0.00 0.00 174.94 174.84 1xhc s ASP 29 N 1.14 0.23 0.23 3.58 -1.08 -0.40 -0.03 116.67 120.34 1xhc s ASP 29 Ca -0.00 -0.20 0.25 0.00 -0.52 0.00 0.00 52.55 52.09 1xhc s ASP 29 Cb -0.14 0.02 0.65 0.00 -1.46 0.00 0.00 42.92 41.99 1xhc s ASP 29 CO -0.08 -0.09 1.66 0.07 0.52 0.00 0.00 175.17 177.26 1xhc h LYS 30 N 5.59 0.00 -6.84 4.34 2.10 -1.80 -1.83 116.57 118.13 1xhc h LYS 30 Ca -0.28 0.00 -0.49 0.00 -2.00 0.00 0.00 60.65 57.89 1xhc h LYS 30 Cb 1.21 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.53 1xhc h LYS 30 CO 0.47 0.00 0.39 -1.21 -2.00 0.00 0.00 179.45 177.10 1xhc s GLU 31 N -3.13 4.61 0.00 0.07 2.02 -1.26 -3.81 118.70 117.20 1xhc s GLU 31 Ca 0.09 1.53 0.08 0.00 0.02 0.00 0.00 54.97 56.69 1xhc s GLU 31 Cb 0.11 -3.00 0.48 0.00 0.10 0.00 0.00 34.13 31.82 1xhc s GLU 31 CO 0.63 0.26 1.27 -0.35 0.02 0.00 0.00 175.26 177.10 1xhc n PRO 32 N 0.89 0.96 -4.25 0.39 -0.04 -1.26 -1.78 135.00 129.90 1xhc n PRO 32 Ca 0.00 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.26 1xhc n PRO 32 Cb 0.48 -1.13 -0.12 0.00 -0.04 0.00 0.00 33.50 32.69 1xhc n PRO 32 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1xhc s VAL 33 N -2.00 1.46 1.22 0.52 -7.23 -1.26 -4.75 120.40 108.36 1xhc s VAL 33 Ca 0.12 -1.64 -0.20 0.00 -1.81 0.00 0.00 61.98 58.45 1xhc s VAL 33 Cb 0.06 -1.51 0.30 0.00 0.56 0.00 0.00 36.38 35.79 1xhc s VAL 33 CO 0.09 -0.28 1.13 -0.81 -0.31 0.00 0.00 175.10 174.92 1xhc n PRO 34 N 0.76 -2.97 -1.68 4.82 -0.04 -1.26 -4.92 135.00 129.71 1xhc n PRO 34 Ca -0.17 -1.80 -0.45 0.00 -0.04 0.00 0.00 63.50 61.04 1xhc n PRO 34 Cb 0.56 -1.62 -0.03 0.00 -0.04 0.00 0.00 33.50 32.36 1xhc n PRO 34 CO 0.00 0.00 0.00 0.98 -0.04 0.00 0.00 175.50 176.44 1xhc n TYR 35 N -4.77 2.29 -4.16 0.54 4.19 -1.26 -5.00 117.16 108.99 1xhc n TYR 35 Ca 0.15 0.34 -0.15 0.00 3.31 0.00 0.00 57.90 61.55 1xhc n TYR 35 Cb 0.59 -2.51 -0.11 0.00 0.49 0.00 0.00 39.34 37.80 1xhc n TYR 35 CO 0.00 0.00 0.00 1.52 0.91 0.00 0.00 176.86 179.29 1xhc s TYR 36 N 0.35 1.04 -0.32 2.98 -0.85 -1.26 -4.34 117.35 114.95 1xhc s TYR 36 Ca 0.72 -0.58 -0.29 0.00 -0.52 0.00 0.00 57.07 56.40 1xhc s TYR 36 Cb -0.64 -0.58 0.01 0.00 0.38 0.00 0.00 41.96 41.13 1xhc s TYR 36 CO 0.44 0.00 1.17 0.45 -1.52 0.00 0.00 175.55 176.10 1xhc s SER 37 N -2.14 6.81 0.09 -0.18 0.15 -0.72 -4.88 113.70 112.83 1xhc s SER 37 Ca 0.01 1.07 -0.15 0.00 0.70 0.00 0.00 55.95 57.59 1xhc s SER 37 Cb -0.06 -2.54 -0.11 0.00 -1.71 0.00 0.00 66.02 61.60 1xhc s SER 37 CO 0.01 -0.98 1.38 0.11 1.20 0.00 0.00 173.24 174.95 1xhc h LYS 38 N 8.63 0.69 -0.19 5.44 1.57 -1.94 -3.15 116.57 127.61 1xhc h LYS 38 Ca -0.23 -0.41 0.05 0.00 -1.87 0.00 0.00 60.65 58.20 1xhc h LYS 38 Cb 1.07 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.41 1xhc h LYS 38 CO 1.04 1.02 0.36 -1.35 -0.57 0.00 0.00 179.45 179.96 1xhc h PRO 39 N 0.40 0.00 -0.01 3.15 0.11 -1.99 -1.38 132.00 132.28 1xhc h PRO 39 Ca 0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.13 1xhc h PRO 39 Cb 0.96 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.07 1xhc h PRO 39 CO 0.08 0.00 -0.14 -1.33 -0.21 0.00 0.00 178.00 176.41 1xhc n MET 40 N -3.32 1.45 -0.27 1.05 2.81 -1.19 -4.48 117.12 113.16 1xhc n MET 40 Ca 0.02 -0.96 -0.06 0.00 -1.81 0.00 0.00 57.70 54.88 1xhc n MET 40 Cb 0.47 -1.48 0.06 0.00 -0.71 0.00 0.00 33.22 31.56 1xhc n MET 40 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 1xhc h LEU 41 N 2.35 1.08 -1.12 4.03 3.38 -1.30 -2.21 115.31 121.52 1xhc h LEU 41 Ca 0.00 -0.20 0.08 0.00 0.09 0.00 0.00 57.88 57.85 1xhc h LEU 41 Cb 0.61 -0.28 -0.07 0.00 0.09 0.00 0.00 40.66 41.01 1xhc h LEU 41 CO 0.00 0.99 0.60 0.28 0.09 0.00 0.00 178.44 180.40 1xhc h SER 42 N 1.12 0.90 -0.55 -0.43 0.02 -1.78 -0.25 113.55 112.58 1xhc h SER 42 Ca 0.25 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.20 1xhc h SER 42 Cb 0.28 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.62 1xhc h SER 42 CO -0.01 0.55 0.29 0.45 -1.14 0.00 0.00 176.83 176.97 1xhc h HIS 43 N 1.01 0.75 0.20 3.45 3.86 -1.70 -1.19 115.15 121.53 1xhc h HIS 43 Ca 0.42 -0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.60 1xhc h HIS 43 Cb 0.29 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 28.53 1xhc h HIS 43 CO -0.00 0.56 -0.10 -0.92 0.86 0.00 0.00 177.93 178.33 1xhc h TYR 44 N 0.73 -0.25 -0.73 2.45 -0.00 -1.08 -0.99 116.97 117.11 1xhc h TYR 44 Ca 0.19 -0.01 0.08 0.00 -0.00 0.00 0.00 58.73 59.00 1xhc h TYR 44 Cb 0.06 0.08 -0.07 0.00 -0.00 0.00 0.00 36.73 36.80 1xhc h TYR 44 CO -0.01 -0.12 0.39 0.82 -0.00 0.00 0.00 178.16 179.24 1xhc h ILE 45 N -0.31 0.91 0.00 1.81 2.04 -0.90 -0.31 117.51 120.74 1xhc h ILE 45 Ca -0.03 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 65.60 1xhc h ILE 45 Cb 0.24 0.16 0.00 0.00 -0.74 0.00 0.00 36.82 36.48 1xhc h ILE 45 CO 0.04 0.12 0.00 0.00 0.00 0.00 0.00 178.15 178.32 1xhc n ALA 46 N -2.38 1.87 -0.45 1.87 0.00 -0.46 -4.73 120.51 116.21 1xhc n ALA 46 Ca 0.11 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1xhc n ALA 46 Cb 0.24 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.38 1xhc n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xhc n GLY 47 N 0.45 0.74 0.09 0.00 0.00 -0.13 -4.79 105.19 101.56 1xhc n GLY 47 Ca 0.05 -0.31 -0.03 0.00 0.00 0.00 0.00 46.02 45.72 1xhc n GLY 47 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1xhc h PHE 48 N 0.00 0.00 -3.96 1.61 0.04 -1.38 -3.46 116.94 109.79 1xhc h PHE 48 Ca 0.00 0.00 -0.33 0.00 2.80 0.00 0.00 57.97 60.44 1xhc h PHE 48 Cb 0.00 0.00 -0.22 0.00 2.20 0.00 0.00 35.95 37.93 1xhc h PHE 48 CO 0.00 0.78 -0.75 0.96 -0.60 0.00 0.00 178.31 178.70 1xhc s ILE 49 N -2.80 0.77 0.62 -0.55 -4.36 -1.23 -5.01 121.20 108.64 1xhc s ILE 49 Ca 0.00 -1.14 -0.17 0.00 -0.26 0.00 0.00 60.65 59.08 1xhc s ILE 49 Cb 0.09 -0.79 -0.02 0.00 1.25 0.00 0.00 42.46 42.99 1xhc s ILE 49 CO 0.80 -0.30 1.17 -2.16 0.24 0.00 0.00 174.94 174.69 1xhc s PRO 50 N -1.59 2.89 0.34 0.37 0.04 -1.26 -4.48 135.00 131.31 1xhc s PRO 50 Ca -0.06 1.66 0.11 0.00 0.04 0.00 0.00 61.00 62.74 1xhc s PRO 50 Cb -0.10 -1.94 0.89 0.00 0.04 0.00 0.00 34.50 33.40 1xhc s PRO 50 CO 0.01 -1.23 1.77 -0.09 0.04 0.00 0.00 177.00 177.50 1xhc h ARG 51 N 0.57 0.59 0.00 4.56 2.43 -2.00 -1.74 114.38 118.78 1xhc h ARG 51 Ca -0.49 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 58.62 1xhc h ARG 51 Cb 1.28 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.69 1xhc h ARG 51 CO 0.54 0.39 -0.14 -2.95 -1.51 0.00 0.00 179.97 176.30 1xhc h ASN 52 N 0.60 0.00 0.69 -3.80 -1.07 -1.97 -2.54 115.58 107.49 1xhc h ASN 52 Ca 0.59 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.96 1xhc h ASN 52 Cb 1.14 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.39 1xhc h ASN 52 CO -0.36 0.14 0.00 0.03 0.07 0.00 0.00 177.43 177.31 1xhc h ARG 53 N 0.00 0.00 0.00 4.14 3.08 -1.68 -2.09 114.38 117.83 1xhc h ARG 53 Ca -0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 1xhc h ARG 53 Cb 0.34 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.39 1xhc h ARG 53 CO 0.02 0.00 -0.11 -0.07 -1.07 0.00 0.00 179.97 178.74 1xhc h LEU 54 N 0.00 0.00 -8.06 3.04 3.38 -1.59 -3.41 115.31 108.68 1xhc h LEU 54 Ca 0.00 0.00 -0.75 0.00 0.09 0.00 0.00 57.88 57.22 1xhc h LEU 54 Cb 0.35 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 40.87 1xhc h LEU 54 CO 0.00 0.11 -0.03 -0.36 0.09 0.00 0.00 178.44 178.25 1xhc s PHE 55 N -3.71 3.27 0.33 1.13 0.08 -0.79 -1.75 117.98 116.54 1xhc s PHE 55 Ca 0.00 -1.34 0.08 0.00 0.12 0.00 0.00 56.93 55.80 1xhc s PHE 55 Cb 0.10 -3.88 0.56 0.00 -0.57 0.00 0.00 43.02 39.23 1xhc s PHE 55 CO 0.59 -1.11 1.76 -1.00 -0.10 0.00 0.00 175.22 175.36 1xhc h PRO 56 N 8.76 0.18 -4.98 0.24 0.13 -1.80 -3.44 132.00 131.09 1xhc h PRO 56 Ca -0.20 -0.07 -0.41 0.00 -0.87 0.00 0.00 66.00 64.44 1xhc h PRO 56 Cb 1.08 -0.01 -0.27 0.00 0.13 0.00 0.00 31.00 31.94 1xhc h PRO 56 CO 1.00 0.52 -0.78 0.71 -0.23 0.00 0.00 178.00 179.22 1xhc s TYR 57 N -4.23 0.99 0.94 1.56 2.02 -1.26 -5.16 117.35 112.21 1xhc s TYR 57 Ca -0.04 -0.26 -0.15 0.00 -0.37 0.00 0.00 57.07 56.25 1xhc s TYR 57 Cb 0.14 -0.62 0.17 0.00 -0.40 0.00 0.00 41.96 41.25 1xhc s TYR 57 CO 0.75 -0.00 1.25 -1.54 -1.57 0.00 0.00 175.55 174.44 1xhc s SER 58 N -0.64 3.33 0.40 2.29 1.04 -1.26 -4.82 113.70 114.04 1xhc s SER 58 Ca 0.02 0.50 0.11 0.00 0.48 0.00 0.00 55.95 57.06 1xhc s SER 58 Cb -0.06 -0.73 0.84 0.00 0.10 0.00 0.00 66.02 66.18 1xhc s SER 58 CO 0.00 -2.62 1.94 -0.07 0.98 0.00 0.00 173.24 173.47 1xhc h LEU 59 N -1.56 0.18 -2.32 2.42 3.38 -2.01 -2.10 115.31 113.30 1xhc h LEU 59 Ca -0.45 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.48 1xhc h LEU 59 Cb 1.27 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.97 1xhc h LEU 59 CO 0.47 0.33 -0.03 0.44 0.09 0.00 0.00 178.44 179.74 1xhc h ASP 60 N 0.19 0.00 0.21 -0.43 5.19 -1.99 -2.44 116.42 117.14 1xhc h ASP 60 Ca 0.04 0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 56.26 1xhc h ASP 60 Cb 0.34 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.84 1xhc h ASP 60 CO 0.02 0.03 -0.76 -0.25 -3.12 0.00 0.00 179.24 175.16 1xhc h TRP 61 N 0.00 0.63 -0.67 4.55 7.01 -1.74 0.96 115.95 126.69 1xhc h TRP 61 Ca -0.00 -0.29 0.03 0.00 2.11 0.00 0.00 58.89 60.74 1xhc h TRP 61 Cb 0.08 -0.09 -0.04 0.00 -2.10 0.00 0.00 29.16 27.00 1xhc h TRP 61 CO 0.00 1.06 0.42 1.88 -2.79 0.00 0.00 178.44 179.01 1xhc h TYR 62 N 0.31 0.79 0.56 2.65 0.05 -1.53 -2.03 116.97 117.77 1xhc h TYR 62 Ca -0.04 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.74 1xhc h TYR 62 Cb 1.35 -0.26 -0.02 0.00 1.01 0.00 0.00 36.73 38.81 1xhc h TYR 62 CO 0.05 0.46 -0.47 0.00 -1.05 0.00 0.00 178.16 177.15 1xhc h ARG 63 N 0.83 -0.97 -0.96 4.88 3.08 -1.17 -1.40 114.38 118.66 1xhc h ARG 63 Ca 0.26 0.07 0.27 0.00 0.07 0.00 0.00 59.98 60.65 1xhc h ARG 63 Cb -0.00 0.22 -0.04 0.00 0.08 0.00 0.00 29.97 30.22 1xhc h ARG 63 CO -0.10 -0.65 0.68 1.57 -1.07 0.00 0.00 179.97 180.41 1xhc h LYS 64 N -1.01 0.06 -0.00 0.04 5.09 -0.70 -0.57 116.57 119.48 1xhc h LYS 64 Ca -0.07 -0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.67 1xhc h LYS 64 Cb 0.86 -0.01 0.00 0.00 0.10 0.00 0.00 32.23 33.18 1xhc h LYS 64 CO -0.01 0.04 -0.33 0.54 -2.09 0.00 0.00 179.45 177.60 1xhc n ARG 65 N -4.29 0.23 -1.57 0.07 5.12 -0.77 -4.96 116.66 110.49 1xhc n ARG 65 Ca 0.20 -0.12 -0.02 0.00 -1.93 0.00 0.00 57.85 55.98 1xhc n ARG 65 Cb 0.99 -1.50 -0.01 0.00 -1.16 0.00 0.00 32.46 30.79 1xhc n ARG 65 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1xhc n GLY 66 N 1.44 0.41 3.55 -0.13 0.00 -0.22 -4.55 105.19 105.70 1xhc n GLY 66 Ca 0.08 -0.88 -0.40 0.00 0.00 0.00 0.00 46.02 44.82 1xhc n GLY 66 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xhc s ILE 67 N -2.10 5.26 -0.18 -0.61 1.01 -0.58 -4.46 121.20 119.54 1xhc s ILE 67 Ca 0.00 -0.03 -0.29 0.00 0.00 0.00 0.00 60.65 60.33 1xhc s ILE 67 Cb 0.00 -3.69 -0.02 0.00 0.01 0.00 0.00 42.46 38.76 1xhc s ILE 67 CO 0.00 0.04 1.41 -0.70 0.00 0.00 0.00 174.94 175.69 1xhc s GLU 68 N 1.81 4.08 -0.28 2.79 2.12 -0.46 -4.36 118.70 124.40 1xhc s GLU 68 Ca 0.08 1.68 -0.02 0.00 0.36 0.00 0.00 54.97 57.06 1xhc s GLU 68 Cb -0.17 -3.88 0.04 0.00 0.26 0.00 0.00 34.13 30.38 1xhc s GLU 68 CO 0.11 -0.93 -0.01 -1.50 -0.54 0.00 0.00 175.26 172.39 1xhc s ILE 69 N 4.09 3.07 -0.54 -3.70 1.10 -1.26 0.06 121.20 124.02 1xhc s ILE 69 Ca 0.62 -1.15 -0.07 0.00 -0.51 0.00 0.00 60.65 59.53 1xhc s ILE 69 Cb -0.23 -2.66 0.14 0.00 0.15 0.00 0.00 42.46 39.86 1xhc s ILE 69 CO 0.22 0.04 0.40 -0.13 -2.11 0.00 0.00 174.94 173.35 1xhc s ARG 70 N 1.31 2.57 0.55 3.50 0.52 0.12 -4.98 118.95 122.54 1xhc s ARG 70 Ca -0.02 -2.04 -0.00 0.00 -0.52 0.00 0.00 55.73 53.15 1xhc s ARG 70 Cb -0.18 -3.90 0.03 0.00 0.52 0.00 0.00 34.95 31.42 1xhc s ARG 70 CO -0.02 -1.19 0.78 -0.51 0.02 0.00 0.00 175.30 174.39 1xhc s LEU 71 N 0.86 3.30 -1.70 2.53 1.43 -1.26 -1.27 118.68 122.56 1xhc s LEU 71 Ca 0.10 0.12 -0.16 0.00 -1.03 0.00 0.00 54.13 53.16 1xhc s LEU 71 Cb -0.22 -2.98 0.14 0.00 0.03 0.00 0.00 46.19 43.16 1xhc s LEU 71 CO -0.03 -1.10 0.63 0.00 0.23 0.00 0.00 176.35 176.08 1xhc n ALA 72 N -2.36 -1.41 -3.71 4.21 0.00 -0.74 -4.90 120.51 111.60 1xhc n ALA 72 Ca 0.07 -0.12 -0.23 0.00 0.00 0.00 0.00 53.44 53.15 1xhc n ALA 72 Cb 0.59 -2.77 -0.17 0.00 0.00 0.00 0.00 19.45 17.10 1xhc n ALA 72 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1xhc s GLU 73 N -7.00 0.35 -0.19 0.00 2.12 -0.75 -4.93 118.70 108.29 1xhc s GLU 73 Ca 0.60 0.06 -0.12 0.00 0.36 0.00 0.00 54.97 55.87 1xhc s GLU 73 Cb -0.34 -1.19 -0.05 0.00 0.26 0.00 0.00 34.13 32.82 1xhc s GLU 73 CO 0.95 -0.43 0.23 -2.00 -0.54 0.00 0.00 175.26 173.47 1xhc s GLU 74 N 2.03 4.19 -0.11 4.30 2.12 -1.26 -2.80 118.70 127.17 1xhc s GLU 74 Ca 0.03 -0.07 -0.30 0.00 0.36 0.00 0.00 54.97 55.00 1xhc s GLU 74 Cb -0.14 -3.46 -0.02 0.00 0.26 0.00 0.00 34.13 30.77 1xhc s GLU 74 CO -0.06 0.18 1.20 0.00 -0.54 0.00 0.00 175.26 176.05 1xhc s ALA 75 N 0.67 3.56 -0.22 6.30 0.00 -1.26 -2.92 121.76 127.89 1xhc s ALA 75 Ca 0.12 0.51 0.03 0.00 0.00 0.00 0.00 51.96 52.62 1xhc s ALA 75 Cb -0.13 -3.55 -0.20 0.00 0.00 0.00 0.00 23.12 19.24 1xhc s ALA 75 CO 0.03 -0.92 -0.07 1.63 0.00 0.00 0.00 175.76 176.42 1xhc n LYS 76 N 5.79 0.67 -3.64 0.00 4.76 0.35 -4.95 118.16 121.14 1xhc n LYS 76 Ca 0.12 0.15 -0.16 0.00 -2.87 0.00 0.00 58.31 55.56 1xhc n LYS 76 Cb 0.46 -1.56 -0.07 0.00 -1.84 0.00 0.00 35.03 32.02 1xhc n LYS 76 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1xhc s LEU 77 N -6.46 -0.01 -0.28 -0.35 2.96 -1.13 -4.89 118.68 108.51 1xhc s LEU 77 Ca -0.29 0.56 -0.09 0.00 -0.22 0.00 0.00 54.13 54.09 1xhc s LEU 77 Cb 0.08 1.97 -0.02 0.00 0.50 0.00 0.00 46.19 48.72 1xhc s LEU 77 CO 0.66 -0.48 0.12 -0.63 -1.32 0.00 0.00 176.35 174.70 1xhc s ILE 78 N -0.99 4.54 -0.73 6.68 1.01 -1.26 -0.79 121.20 129.67 1xhc s ILE 78 Ca -0.10 -0.26 -0.18 0.00 0.00 0.00 0.00 60.65 60.11 1xhc s ILE 78 Cb -0.03 -3.22 0.13 0.00 0.01 0.00 0.00 42.46 39.35 1xhc s ILE 78 CO 0.06 0.20 0.85 -0.62 0.00 0.00 0.00 174.94 175.43 1xhc s ASP 79 N 1.63 6.41 0.27 3.58 -1.08 -0.03 -4.76 116.67 122.69 1xhc s ASP 79 Ca 0.06 -1.79 0.11 0.00 -0.52 0.00 0.00 52.55 50.41 1xhc s ASP 79 Cb -0.16 -2.32 0.34 0.00 -1.46 0.00 0.00 42.92 39.32 1xhc s ASP 79 CO 0.06 -1.03 1.60 0.03 0.52 0.00 0.00 175.17 176.34 1xhc h ARG 80 N 8.87 0.00 -0.86 4.34 3.08 -1.89 -1.33 114.38 126.58 1xhc h ARG 80 Ca -0.10 0.00 0.21 0.00 0.07 0.00 0.00 59.98 60.16 1xhc h ARG 80 Cb 1.06 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.99 1xhc h ARG 80 CO 1.05 0.62 0.32 0.78 -1.07 0.00 0.00 179.97 181.66 1xhc h GLY 81 N 2.02 1.40 0.00 0.04 0.00 -1.95 -3.40 103.07 101.19 1xhc h GLY 81 Ca -0.01 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.21 1xhc h GLY 81 CO 0.08 -0.27 -0.76 0.54 0.00 0.00 0.00 176.54 176.13 1xhc n ARG 82 N -5.10 1.81 -3.32 4.80 1.74 -1.02 -4.97 116.66 110.61 1xhc n ARG 82 Ca 0.20 -0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.85 1xhc n ARG 82 Cb 0.62 -1.24 -0.08 0.00 -1.02 0.00 0.00 32.46 30.74 1xhc n ARG 82 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1xhc s LYS 83 N -2.49 3.07 0.08 5.56 1.02 -1.26 -5.01 119.74 120.72 1xhc s LYS 83 Ca 0.06 -0.87 0.03 0.00 0.02 0.00 0.00 55.97 55.20 1xhc s LYS 83 Cb 0.12 -4.01 -0.03 0.00 -0.52 0.00 0.00 37.83 33.38 1xhc s LYS 83 CO 0.64 -0.92 -0.08 0.14 -0.92 0.00 0.00 175.35 174.21 1xhc s VAL 84 N 2.11 0.74 -0.20 3.17 -7.23 -0.53 -1.72 120.40 116.72 1xhc s VAL 84 Ca 0.11 -1.57 -0.08 0.00 -1.81 0.00 0.00 61.98 58.62 1xhc s VAL 84 Cb -0.18 -1.25 -0.04 0.00 0.56 0.00 0.00 36.38 35.47 1xhc s VAL 84 CO 0.12 -0.61 0.08 -0.69 -0.31 0.00 0.00 175.10 173.69 1xhc s VAL 85 N -2.53 4.84 -0.28 1.32 1.01 0.82 -0.85 120.40 124.74 1xhc s VAL 85 Ca 0.03 -0.01 -0.16 0.00 0.00 0.00 0.00 61.98 61.84 1xhc s VAL 85 Cb -0.02 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 33.12 1xhc s VAL 85 CO -0.02 0.42 0.43 -0.63 0.00 0.00 0.00 175.10 175.30 1xhc s ILE 86 N 0.70 5.13 0.31 2.22 1.01 0.03 -0.43 121.20 130.17 1xhc s ILE 86 Ca 0.04 0.64 0.03 0.00 0.00 0.00 0.00 60.65 61.36 1xhc s ILE 86 Cb -0.13 -3.77 0.03 0.00 0.01 0.00 0.00 42.46 38.60 1xhc s ILE 86 CO 0.02 0.10 0.24 0.35 0.00 0.00 0.00 174.94 175.65 1xhc n THR 87 N 5.16 0.00 0.17 2.92 -2.24 0.13 -0.50 114.28 119.92 1xhc n THR 87 Ca -0.07 -1.21 0.05 0.00 -2.27 0.00 0.00 64.05 60.55 1xhc n THR 87 Cb 0.50 -0.27 0.18 0.00 -2.10 0.00 0.00 70.33 68.64 1xhc n THR 87 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1xhc h GLU 88 N 0.00 0.00 0.00 -0.78 9.09 -1.92 -3.27 114.58 117.70 1xhc h GLU 88 Ca -0.19 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.22 1xhc h GLU 88 Cb 0.71 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.81 1xhc h GLU 88 CO 0.30 0.42 -0.39 0.87 0.05 0.00 0.00 179.01 180.26 1xhc h LYS 89 N 0.00 0.00 0.00 1.06 1.57 -1.95 -3.50 116.57 113.75 1xhc h LYS 89 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1xhc h LYS 89 Cb 1.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.46 1xhc h LYS 89 CO 0.05 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.34 1xhc n GLY 90 N 1.26 -0.33 3.15 3.86 0.00 -1.23 -5.13 105.19 106.77 1xhc n GLY 90 Ca 0.04 -0.80 -0.25 0.00 0.00 0.00 0.00 46.02 45.00 1xhc n GLY 90 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xhc s GLU 91 N -2.00 1.58 -0.25 1.61 2.02 -1.26 0.18 118.70 120.58 1xhc s GLU 91 Ca 0.00 -0.62 0.00 0.00 0.02 0.00 0.00 54.97 54.38 1xhc s GLU 91 Cb 0.00 -1.45 0.07 0.00 0.10 0.00 0.00 34.13 32.85 1xhc s GLU 91 CO 0.00 0.32 -0.01 0.08 0.02 0.00 0.00 175.26 175.66 1xhc s VAL 92 N -0.21 1.36 0.46 2.63 1.01 0.43 -4.93 120.40 121.15 1xhc s VAL 92 Ca 0.02 -1.24 -0.22 0.00 0.00 0.00 0.00 61.98 60.54 1xhc s VAL 92 Cb -0.09 -1.74 -0.08 0.00 0.00 0.00 0.00 36.38 34.47 1xhc s VAL 92 CO 0.01 -0.23 1.10 -2.16 0.00 0.00 0.00 175.10 173.81 1xhc s PRO 93 N 1.45 3.83 -0.00 2.72 0.04 -1.26 -0.13 135.00 141.66 1xhc s PRO 93 Ca -0.02 1.58 -0.04 0.00 0.04 0.00 0.00 61.00 62.56 1xhc s PRO 93 Cb -0.18 -2.32 -0.00 0.00 0.04 0.00 0.00 34.50 32.03 1xhc s PRO 93 CO -0.09 -0.44 0.06 1.52 0.04 0.00 0.00 177.00 178.09 1xhc s TYR 94 N -1.71 0.08 -0.17 0.56 -0.85 -0.70 -4.85 117.35 109.71 1xhc s TYR 94 Ca 0.64 -0.18 -0.10 0.00 -0.52 0.00 0.00 57.07 56.92 1xhc s TYR 94 Cb -0.23 -0.08 -0.23 0.00 0.38 0.00 0.00 41.96 41.81 1xhc s TYR 94 CO 0.28 -0.19 0.21 -0.25 -1.52 0.00 0.00 175.55 174.09 1xhc n ASP 95 N 1.94 2.04 -4.11 -0.18 8.00 -0.57 -4.63 116.55 119.03 1xhc n ASP 95 Ca -0.20 0.23 -0.27 0.00 0.71 0.00 0.00 54.79 55.25 1xhc n ASP 95 Cb 0.56 -0.83 -0.17 0.00 -0.02 0.00 0.00 41.12 40.67 1xhc n ASP 95 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1xhc s THR 96 N -2.50 1.46 -0.17 -3.53 2.01 -0.69 -4.89 115.64 107.32 1xhc s THR 96 Ca -0.27 -0.69 -0.03 0.00 0.31 0.00 0.00 61.69 61.02 1xhc s THR 96 Cb 0.07 -1.29 -0.02 0.00 0.01 0.00 0.00 72.50 71.27 1xhc s THR 96 CO 0.69 0.43 -0.05 -0.22 -0.69 0.00 0.00 174.62 174.77 1xhc s LEU 97 N 0.41 3.07 -0.17 4.42 2.96 -0.57 -1.01 118.68 127.79 1xhc s LEU 97 Ca -0.13 -0.23 -0.01 0.00 -0.22 0.00 0.00 54.13 53.54 1xhc s LEU 97 Cb -0.15 -1.74 -0.00 0.00 0.50 0.00 0.00 46.19 44.79 1xhc s LEU 97 CO 0.05 0.12 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.39 1xhc s VAL 98 N 0.66 2.91 -0.29 1.68 1.01 0.71 -1.11 120.40 125.97 1xhc s VAL 98 Ca -0.03 -0.68 -0.20 0.00 0.00 0.00 0.00 61.98 61.07 1xhc s VAL 98 Cb -0.15 -2.26 -0.01 0.00 0.00 0.00 0.00 36.38 33.96 1xhc s VAL 98 CO 0.02 0.49 0.62 -0.76 0.00 0.00 0.00 175.10 175.47 1xhc s LEU 99 N 0.95 4.13 -0.42 3.92 1.43 0.35 -1.77 118.68 127.27 1xhc s LEU 99 Ca -0.02 0.48 0.10 0.00 -1.03 0.00 0.00 54.13 53.66 1xhc s LEU 99 Cb -0.15 -2.81 0.41 0.00 0.03 0.00 0.00 46.19 43.68 1xhc s LEU 99 CO -0.01 -0.44 0.99 0.00 0.23 0.00 0.00 176.35 177.12 1xhc n ALA 100 N 5.82 4.14 1.43 4.21 0.00 0.13 -1.57 120.51 134.66 1xhc n ALA 100 Ca -0.01 -3.91 0.13 0.00 0.00 0.00 0.00 53.44 49.65 1xhc n ALA 100 Cb 0.49 -0.74 0.73 0.00 0.00 0.00 0.00 19.45 19.93 1xhc n ALA 100 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1xhc n THR 101 N -0.23 0.09 -4.82 0.00 -2.24 -1.19 -4.25 114.28 101.64 1xhc n THR 101 Ca 0.27 0.02 0.00 0.00 -2.27 0.00 0.00 64.05 62.07 1xhc n THR 101 Cb 0.67 -0.58 0.00 0.00 -2.10 0.00 0.00 70.33 68.32 1xhc n THR 101 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xhc n GLY 102 N 0.91 2.15 3.29 3.38 0.00 -1.26 -4.56 105.19 109.10 1xhc n GLY 102 Ca 0.15 -0.52 -0.10 0.00 0.00 0.00 0.00 46.02 45.56 1xhc n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xhc s ALA 103 N -1.96 0.34 0.23 4.61 0.00 -1.26 -1.01 121.76 122.71 1xhc s ALA 103 Ca 0.00 -1.13 0.09 0.00 0.00 0.00 0.00 51.96 50.92 1xhc s ALA 103 Cb 0.00 0.92 -0.04 0.00 0.00 0.00 0.00 23.12 24.00 1xhc s ALA 103 CO 0.00 -0.61 -0.01 1.03 0.00 0.00 0.00 175.76 176.17 1xhc s ARG 104 N -4.01 2.32 0.29 0.00 0.52 0.01 -4.88 118.95 113.20 1xhc s ARG 104 Ca 0.21 -1.31 -0.30 0.00 -0.52 0.00 0.00 55.73 53.81 1xhc s ARG 104 Cb 0.05 -2.22 -0.11 0.00 0.52 0.00 0.00 34.95 33.18 1xhc s ARG 104 CO 0.02 0.40 1.60 0.00 0.02 0.00 0.00 175.30 177.33 1xhc s ALA 105 N -2.10 3.75 0.06 2.13 0.00 -1.26 -0.27 121.76 124.06 1xhc s ALA 105 Ca 0.30 1.57 -0.31 0.00 0.00 0.00 0.00 51.96 53.53 1xhc s ALA 105 Cb -0.07 -3.65 -0.08 0.00 0.00 0.00 0.00 23.12 19.31 1xhc s ALA 105 CO 0.19 -0.99 1.70 0.50 0.00 0.00 0.00 175.76 177.17 1xhc s ARG 106 N -0.50 4.18 0.25 0.00 3.52 -0.00 -4.69 118.95 121.72 1xhc s ARG 106 Ca 0.63 2.37 -0.29 0.00 -0.13 0.00 0.00 55.73 58.32 1xhc s ARG 106 Cb -0.48 -3.70 -0.09 0.00 -1.56 0.00 0.00 34.95 29.12 1xhc s ARG 106 CO 0.48 -0.78 0.93 -1.21 -0.81 0.00 0.00 175.30 173.90 1xhc s GLU 107 N 3.01 4.78 0.41 5.12 0.41 -1.26 -4.76 118.70 126.41 1xhc s GLU 107 Ca 0.76 1.43 -0.24 0.00 -0.41 0.00 0.00 54.97 56.51 1xhc s GLU 107 Cb -0.40 -3.19 -0.08 0.00 -1.78 0.00 0.00 34.13 28.68 1xhc s GLU 107 CO 0.33 0.48 1.10 -1.25 -0.49 0.00 0.00 175.26 175.44 1xhc s PRO 108 N -1.34 4.06 -0.17 0.39 0.04 -1.26 -4.98 135.00 131.73 1xhc s PRO 108 Ca 0.42 1.65 0.15 0.00 0.04 0.00 0.00 61.00 63.27 1xhc s PRO 108 Cb -0.24 -2.56 0.36 0.00 0.04 0.00 0.00 34.50 32.10 1xhc s PRO 108 CO 0.30 -0.27 1.20 1.04 0.04 0.00 0.00 177.00 179.31 1xhc n GLN 109 N -0.10 1.47 -2.34 4.56 6.02 -1.26 -4.86 117.38 120.88 1xhc n GLN 109 Ca 0.05 -2.94 -0.27 0.00 -0.01 0.00 0.00 57.00 53.83 1xhc n GLN 109 Cb 0.48 -1.57 0.04 0.00 1.02 0.00 0.00 30.24 30.21 1xhc n GLN 109 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 1xhc s ILE 110 N -3.06 3.47 -0.13 5.09 -4.36 -1.26 -4.98 121.20 115.97 1xhc s ILE 110 Ca 0.35 0.00 -0.37 0.00 -0.26 0.00 0.00 60.65 60.38 1xhc s ILE 110 Cb 0.33 -3.40 -0.14 0.00 1.25 0.00 0.00 42.46 40.50 1xhc s ILE 110 CO -0.02 -0.42 1.76 0.29 0.24 0.00 0.00 174.94 176.80 1xhc n LYS 111 N -2.65 1.70 -0.66 0.37 5.02 -1.26 -2.11 118.16 118.57 1xhc n LYS 111 Ca 0.05 0.62 0.00 0.00 -2.02 0.00 0.00 58.31 56.96 1xhc n LYS 111 Cb 0.58 -2.38 0.00 0.00 -0.02 0.00 0.00 35.03 33.21 1xhc n LYS 111 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xhc n GLY 112 N 4.10 0.64 0.30 0.72 0.00 -1.26 -0.94 105.19 108.75 1xhc n GLY 112 Ca 0.23 -0.67 0.14 0.00 0.00 0.00 0.00 46.02 45.72 1xhc n GLY 112 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1xhc h LYS 113 N 0.00 0.00 0.00 1.61 2.10 -1.73 -1.49 116.57 117.07 1xhc h LYS 113 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1xhc h LYS 113 Cb 0.04 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.37 1xhc h LYS 113 CO 0.00 0.00 0.00 -0.85 -2.00 0.00 0.00 179.45 176.60 1xhc n GLU 114 N -4.03 0.04 0.00 0.07 0.00 -1.26 -1.51 120.64 113.96 1xhc n GLU 114 Ca -0.02 0.32 0.11 0.00 0.00 0.00 0.00 57.16 57.57 1xhc n GLU 114 Cb 0.14 -1.50 0.05 0.00 0.00 0.00 0.00 31.44 30.13 1xhc n GLU 114 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1xhc n TYR 115 N -1.39 0.00 -4.02 -1.84 4.02 -0.56 -4.95 117.16 108.42 1xhc n TYR 115 Ca 0.02 0.00 -0.36 0.00 -0.01 0.00 0.00 57.90 57.55 1xhc n TYR 115 Cb 0.06 -0.01 -0.08 0.00 -0.02 0.00 0.00 39.34 39.29 1xhc n TYR 115 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1xhc s LEU 116 N -2.37 4.02 0.11 7.72 1.43 -0.57 -4.27 118.68 124.75 1xhc s LEU 116 Ca 0.21 0.26 0.03 0.00 -1.03 0.00 0.00 54.13 53.61 1xhc s LEU 116 Cb 0.19 -1.98 -0.04 0.00 0.03 0.00 0.00 46.19 44.38 1xhc s LEU 116 CO 0.51 0.32 0.12 -0.76 0.23 0.00 0.00 176.35 176.76 1xhc s LEU 117 N -0.48 3.88 0.34 1.79 1.43 0.23 -4.92 118.68 120.95 1xhc s LEU 117 Ca 0.11 -0.01 0.09 0.00 -1.03 0.00 0.00 54.13 53.29 1xhc s LEU 117 Cb -0.12 -2.53 -0.06 0.00 0.03 0.00 0.00 46.19 43.51 1xhc s LEU 117 CO 0.02 0.14 -0.09 0.42 0.23 0.00 0.00 176.35 177.06 1xhc s THR 118 N -1.52 2.20 -0.13 5.49 -4.23 -1.26 0.21 115.64 116.39 1xhc s THR 118 Ca 0.31 -2.20 -0.01 0.00 -1.18 0.00 0.00 61.69 58.61 1xhc s THR 118 Cb -0.12 -2.63 0.03 0.00 1.34 0.00 0.00 72.50 71.13 1xhc s THR 118 CO 0.23 -0.21 -0.07 -0.22 -0.54 0.00 0.00 174.62 173.82 1xhc s LEU 119 N -3.59 1.28 0.07 4.79 2.96 -1.26 -4.84 118.68 118.09 1xhc s LEU 119 Ca 0.32 -0.40 0.00 0.00 -0.22 0.00 0.00 54.13 53.83 1xhc s LEU 119 Cb 0.02 -0.84 0.00 0.00 0.50 0.00 0.00 46.19 45.87 1xhc s LEU 119 CO 0.16 -0.14 0.00 -1.14 -1.32 0.00 0.00 176.35 173.91 1xhc n ARG 120 N 4.93 0.00 -3.50 1.98 3.00 -1.26 -4.82 116.66 117.00 1xhc n ARG 120 Ca -0.12 0.00 -0.20 0.00 -0.00 0.00 0.00 57.85 57.53 1xhc n ARG 120 Cb 0.49 0.00 -0.02 0.00 0.00 0.00 0.00 32.46 32.94 1xhc n ARG 120 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 1xhc s THR 121 N -2.00 3.44 0.54 5.15 -4.23 -1.26 -4.99 115.64 112.29 1xhc s THR 121 Ca 0.00 -1.17 0.23 0.00 -1.18 0.00 0.00 61.69 59.57 1xhc s THR 121 Cb 0.00 -3.19 0.35 0.00 1.34 0.00 0.00 72.50 71.00 1xhc s THR 121 CO 0.00 -0.10 2.07 -0.29 -0.54 0.00 0.00 174.62 175.76 1xhc h ILE 122 N 0.97 0.77 0.03 2.99 2.10 -1.99 -1.54 117.51 120.86 1xhc h ILE 122 Ca -0.43 0.00 -0.25 0.00 1.08 0.00 0.00 64.86 65.26 1xhc h ILE 122 Cb 1.26 0.85 0.01 0.00 -1.09 0.00 0.00 36.82 37.85 1xhc h ILE 122 CO 0.54 0.00 -1.03 -0.26 -1.08 0.00 0.00 178.15 176.32 1xhc h PHE 123 N 0.00 0.71 -0.68 2.19 0.04 -1.99 -0.84 116.94 116.37 1xhc h PHE 123 Ca 0.13 -0.41 -0.00 0.00 2.80 0.00 0.00 57.97 60.49 1xhc h PHE 123 Cb 0.55 -0.07 -0.03 0.00 2.20 0.00 0.00 35.95 38.60 1xhc h PHE 123 CO 0.00 1.24 0.42 -0.44 -0.60 0.00 0.00 178.31 178.93 1xhc h ASP 124 N 0.24 0.80 -0.58 2.17 3.32 -1.76 -2.69 116.42 117.93 1xhc h ASP 124 Ca -0.11 -0.05 0.01 0.00 0.02 0.00 0.00 57.03 56.90 1xhc h ASP 124 Cb 1.68 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 41.00 1xhc h ASP 124 CO 0.18 0.62 0.38 0.00 -1.72 0.00 0.00 179.24 178.70 1xhc h ALA 125 N 1.22 0.74 -0.48 3.45 0.00 -1.01 -1.21 119.26 121.97 1xhc h ALA 125 Ca 0.25 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.17 1xhc h ALA 125 Cb -0.05 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.46 1xhc h ALA 125 CO -0.05 0.17 0.20 -0.44 0.00 0.00 0.00 179.25 179.13 1xhc h ASP 126 N 0.78 0.26 -0.32 0.00 3.32 -1.06 0.22 116.42 119.62 1xhc h ASP 126 Ca 0.21 0.04 -0.06 0.00 0.02 0.00 0.00 57.03 57.24 1xhc h ASP 126 Cb -0.08 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 1xhc h ASP 126 CO -0.05 0.18 -0.06 0.03 -1.72 0.00 0.00 179.24 177.63 1xhc h ARG 127 N 0.41 0.60 -0.28 3.56 3.08 -1.29 -1.64 114.38 118.81 1xhc h ARG 127 Ca 0.22 -0.22 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1xhc h ARG 127 Cb 0.18 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 1xhc h ARG 127 CO -0.19 0.77 0.18 0.82 -1.07 0.00 0.00 179.97 180.48 1xhc h ILE 128 N 0.37 1.08 0.14 2.04 2.04 -1.10 -0.91 117.51 121.18 1xhc h ILE 128 Ca 0.08 -0.15 0.02 0.00 1.00 0.00 0.00 64.86 65.80 1xhc h ILE 128 Cb 0.54 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 37.27 1xhc h ILE 128 CO 0.03 0.08 -0.26 0.50 0.00 0.00 0.00 178.15 178.49 1xhc h LYS 129 N 0.37 -0.47 -0.88 2.37 3.64 -0.48 -1.79 116.57 119.33 1xhc h LYS 129 Ca 0.10 0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.55 1xhc h LYS 129 Cb -0.03 0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 31.85 1xhc h LYS 129 CO -0.02 -0.31 0.58 0.93 -2.27 0.00 0.00 179.45 178.36 1xhc h GLU 130 N -0.48 1.08 -0.74 1.90 5.08 -1.24 -0.53 114.58 119.65 1xhc h GLU 130 Ca 0.02 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 1xhc h GLU 130 Cb 0.50 -0.24 -0.03 0.00 0.50 0.00 0.00 28.75 29.47 1xhc h GLU 130 CO -0.13 0.71 0.30 0.77 -1.00 0.00 0.00 179.01 179.66 1xhc h SER 131 N 1.11 1.02 0.83 1.42 0.02 -0.93 -1.15 113.55 115.88 1xhc h SER 131 Ca 0.35 -0.17 -0.17 0.00 -0.84 0.00 0.00 61.79 60.96 1xhc h SER 131 Cb 0.01 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.26 1xhc h SER 131 CO -0.10 0.91 -0.81 0.16 -1.14 0.00 0.00 176.83 175.85 1xhc h ILE 132 N 1.07 1.57 -0.46 3.27 3.07 -1.01 -0.47 117.51 124.55 1xhc h ILE 132 Ca 0.25 -2.78 -0.09 0.00 1.55 0.00 0.00 64.86 63.79 1xhc h ILE 132 Cb 0.21 2.51 -0.02 0.00 -0.27 0.00 0.00 36.82 39.25 1xhc h ILE 132 CO -0.02 0.79 -0.06 -0.33 -1.05 0.00 0.00 178.15 177.48 1xhc h GLU 133 N 0.00 0.80 -0.24 0.16 5.08 -1.05 0.33 114.58 119.67 1xhc h GLU 133 Ca -0.01 -0.25 -0.09 0.00 -1.00 0.00 0.00 59.36 58.02 1xhc h GLU 133 Cb 1.44 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 30.61 1xhc h GLU 133 CO 0.11 0.85 -0.20 -0.97 -1.00 0.00 0.00 179.01 177.80 1xhc h ASN 134 N 0.73 0.58 0.33 1.42 -0.73 -1.09 -3.38 115.58 113.45 1xhc h ASN 134 Ca 0.13 -0.46 -0.32 0.00 1.87 0.00 0.00 56.30 57.53 1xhc h ASN 134 Cb 0.54 -0.16 -0.05 0.00 0.27 0.00 0.00 38.32 38.91 1xhc h ASN 134 CO 0.03 0.92 -1.92 -1.54 -0.37 0.00 0.00 177.43 174.55 1xhc n SER 135 N -4.41 0.72 0.00 1.15 3.41 -0.20 -5.00 113.62 109.29 1xhc n SER 135 Ca -0.05 0.29 0.00 0.00 -0.26 0.00 0.00 58.87 58.85 1xhc n SER 135 Cb 0.41 0.18 0.00 0.00 -0.26 0.00 0.00 64.21 64.53 1xhc n SER 135 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xhc n GLY 136 N 1.64 0.62 3.31 5.00 0.00 0.12 -5.01 105.19 110.87 1xhc n GLY 136 Ca -0.22 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.68 1xhc n GLY 136 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1xhc s GLU 137 N -0.15 1.00 -0.03 1.61 4.04 -1.26 -2.49 118.70 121.42 1xhc s GLU 137 Ca 0.00 -0.58 -0.04 0.00 0.04 0.00 0.00 54.97 54.39 1xhc s GLU 137 Cb 0.00 0.44 0.01 0.00 0.02 0.00 0.00 34.13 34.60 1xhc s GLU 137 CO 0.00 -0.37 0.11 0.00 -1.84 0.00 0.00 175.26 173.16 1xhc s ALA 138 N -3.28 -0.26 -0.17 -0.84 0.00 -0.32 -4.47 121.76 112.41 1xhc s ALA 138 Ca -0.00 0.21 -0.14 0.00 0.00 0.00 0.00 51.96 52.04 1xhc s ALA 138 Cb 0.01 -0.13 -0.05 0.00 0.00 0.00 0.00 23.12 22.95 1xhc s ALA 138 CO -0.08 -0.08 0.28 0.42 0.00 0.00 0.00 175.76 176.30 1xhc s ILE 139 N -0.19 5.31 -0.18 0.00 1.01 0.11 -1.71 121.20 125.55 1xhc s ILE 139 Ca -0.03 0.52 -0.03 0.00 0.00 0.00 0.00 60.65 61.11 1xhc s ILE 139 Cb -0.02 -3.62 -0.02 0.00 0.01 0.00 0.00 42.46 38.81 1xhc s ILE 139 CO 0.00 0.38 -0.05 -0.63 0.00 0.00 0.00 174.94 174.64 1xhc s ILE 140 N 0.56 3.60 -0.36 2.92 1.01 0.99 -0.31 121.20 129.61 1xhc s ILE 140 Ca 0.16 -0.44 -0.09 0.00 0.00 0.00 0.00 60.65 60.27 1xhc s ILE 140 Cb -0.13 -2.59 0.04 0.00 0.01 0.00 0.00 42.46 39.78 1xhc s ILE 140 CO 0.04 0.47 0.17 -0.63 0.00 0.00 0.00 174.94 174.99 1xhc s ILE 141 N 0.79 4.26 -5.00 2.92 1.09 -0.16 0.39 121.20 125.49 1xhc s ILE 141 Ca -0.02 -1.00 0.00 0.00 -1.10 0.00 0.00 60.65 58.54 1xhc s ILE 141 Cb -0.15 -3.41 0.00 0.00 -1.06 0.00 0.00 42.46 37.85 1xhc s ILE 141 CO 0.02 -0.23 0.00 0.61 -0.10 0.00 0.00 174.94 175.23 1xhc n GLY 142 N 4.92 0.40 0.00 6.18 0.00 -0.54 0.18 105.19 116.34 1xhc n GLY 142 Ca -0.12 -1.66 0.00 0.00 0.00 0.00 0.00 46.02 44.24 1xhc n GLY 142 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xhc n GLY 143 N 0.00 0.00 0.00 -0.02 0.00 -1.24 -4.50 105.19 99.43 1xhc n GLY 143 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1xhc n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xhc n GLY 144 N 0.00 3.38 0.23 -0.02 0.00 -1.26 -3.03 105.19 104.48 1xhc n GLY 144 Ca 0.00 -2.10 0.01 0.00 0.00 0.00 0.00 46.02 43.93 1xhc n GLY 144 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 1xhc h PHE 145 N 0.20 0.25 -0.10 1.61 -5.15 -1.98 -2.25 116.94 109.52 1xhc h PHE 145 Ca 0.00 -0.04 -0.02 0.00 -0.20 0.00 0.00 57.97 57.71 1xhc h PHE 145 Cb 0.00 -0.07 -0.00 0.00 0.22 0.00 0.00 35.95 36.10 1xhc h PHE 145 CO 0.00 0.43 -0.01 0.82 -2.00 0.00 0.00 178.31 177.55 1xhc h ILE 146 N 0.22 1.27 -0.74 0.88 2.04 -1.96 0.56 117.51 119.78 1xhc h ILE 146 Ca 0.04 -0.86 -0.01 0.00 1.00 0.00 0.00 64.86 65.02 1xhc h ILE 146 Cb 0.49 1.65 -0.03 0.00 -0.74 0.00 0.00 36.82 38.19 1xhc h ILE 146 CO 0.03 0.24 0.40 1.23 0.00 0.00 0.00 178.15 180.06 1xhc h GLY 147 N -0.12 1.10 1.63 5.37 0.00 -1.81 -1.78 103.07 107.46 1xhc h GLY 147 Ca 0.03 -0.50 -0.20 0.00 0.00 0.00 0.00 47.33 46.65 1xhc h GLY 147 CO 0.01 0.48 -0.85 1.41 0.00 0.00 0.00 176.54 177.59 1xhc h LEU 148 N 1.02 0.43 0.14 3.11 3.38 -1.35 -1.65 115.31 120.39 1xhc h LEU 148 Ca 0.26 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1xhc h LEU 148 Cb 0.04 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1xhc h LEU 148 CO -0.04 1.10 -0.07 -0.33 0.09 0.00 0.00 178.44 179.19 1xhc h GLU 149 N 0.21 -0.18 -0.11 1.13 5.08 -0.81 -0.79 114.58 119.11 1xhc h GLU 149 Ca -0.05 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.35 1xhc h GLU 149 Cb 1.46 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.73 1xhc h GLU 149 CO 0.14 -0.04 -0.05 1.25 -1.00 0.00 0.00 179.01 179.31 1xhc h LEU 150 N -0.28 -0.18 -0.63 1.33 5.85 -1.35 -0.07 115.31 119.97 1xhc h LEU 150 Ca -0.02 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 1xhc h LEU 150 Cb 0.23 0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 1xhc h LEU 150 CO 0.03 -0.07 0.25 0.00 -0.34 0.00 0.00 178.44 178.31 1xhc h ALA 151 N 1.05 0.82 -0.31 1.25 0.00 -1.27 -0.67 119.26 120.14 1xhc h ALA 151 Ca 0.06 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 1xhc h ALA 151 Cb 0.14 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1xhc h ALA 151 CO -0.14 0.44 0.02 0.78 0.00 0.00 0.00 179.25 180.35 1xhc h GLY 152 N 0.88 0.57 1.26 0.00 0.00 -0.94 -1.56 103.07 103.29 1xhc h GLY 152 Ca 0.21 -0.40 -0.14 0.00 0.00 0.00 0.00 47.33 47.00 1xhc h GLY 152 CO -0.02 0.37 -0.33 3.43 0.00 0.00 0.00 176.54 179.99 1xhc h ASN 153 N 0.33 0.86 -0.22 0.19 -0.26 -0.91 -1.88 115.58 113.69 1xhc h ASN 153 Ca 0.09 -0.36 -0.02 0.00 -0.56 0.00 0.00 56.30 55.44 1xhc h ASN 153 Cb 0.40 -0.24 -0.01 0.00 -1.06 0.00 0.00 38.32 37.41 1xhc h ASN 153 CO 0.01 1.11 0.05 -0.07 -1.06 0.00 0.00 177.43 177.47 1xhc h LEU 154 N 0.69 0.34 -0.58 1.61 3.38 -1.11 -1.55 115.31 118.09 1xhc h LEU 154 Ca 0.07 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 1xhc h LEU 154 Cb 0.88 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.52 1xhc h LEU 154 CO 0.08 0.49 0.36 0.00 0.09 0.00 0.00 178.44 179.46 1xhc h ALA 155 N 0.86 0.74 -0.26 1.53 0.00 -1.30 -1.20 119.26 119.63 1xhc h ALA 155 Ca 0.07 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1xhc h ALA 155 Cb 0.28 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1xhc h ALA 155 CO 0.00 0.20 0.14 1.49 0.00 0.00 0.00 179.25 181.08 1xhc h GLU 156 N 0.78 0.35 -0.00 0.00 4.81 -1.21 0.26 114.58 119.58 1xhc h GLU 156 Ca 0.21 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 1xhc h GLU 156 Cb -0.04 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.27 1xhc h GLU 156 CO -0.04 0.27 -0.01 0.00 -0.73 0.00 0.00 179.01 178.50 1xhc n ALA 157 N -2.50 2.62 -0.69 2.92 0.00 -0.59 -4.92 120.51 117.35 1xhc n ALA 157 Ca 0.01 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1xhc n ALA 157 Cb 0.10 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.08 1xhc n ALA 157 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xhc n GLY 158 N 1.14 0.58 3.88 0.00 0.00 0.08 -5.07 105.19 105.80 1xhc n GLY 158 Ca 0.19 -0.75 -0.30 0.00 0.00 0.00 0.00 46.02 45.16 1xhc n GLY 158 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xhc s TYR 159 N -2.00 3.60 -0.14 1.61 1.51 -0.50 -5.00 117.35 116.42 1xhc s TYR 159 Ca 0.00 1.14 -0.29 0.00 -1.01 0.00 0.00 57.07 56.91 1xhc s TYR 159 Cb 0.00 -2.59 -0.01 0.00 -0.11 0.00 0.00 41.96 39.26 1xhc s TYR 159 CO 0.00 -0.54 1.04 -1.01 -1.11 0.00 0.00 175.55 173.93 1xhc s HIS 160 N -3.01 3.41 -0.09 2.71 3.76 -1.04 -4.36 115.29 116.67 1xhc s HIS 160 Ca 0.53 1.50 0.03 0.00 -0.15 0.00 0.00 55.06 56.97 1xhc s HIS 160 Cb -0.11 -3.25 0.00 0.00 1.11 0.00 0.00 32.58 30.34 1xhc s HIS 160 CO 0.50 -0.45 -0.20 0.08 -0.85 0.00 0.00 174.74 173.81 1xhc s VAL 161 N 2.46 1.77 -0.03 -0.90 1.01 -1.26 -1.18 120.40 122.27 1xhc s VAL 161 Ca 0.48 -0.85 0.06 0.00 0.00 0.00 0.00 61.98 61.67 1xhc s VAL 161 Cb -0.18 -1.55 -0.01 0.00 0.00 0.00 0.00 36.38 34.64 1xhc s VAL 161 CO 0.14 0.50 -0.21 -0.54 0.00 0.00 0.00 175.10 174.99 1xhc s LYS 162 N 0.44 1.92 -0.14 2.72 1.02 -0.69 -1.55 119.74 123.46 1xhc s LYS 162 Ca -0.18 -0.75 0.00 0.00 0.02 0.00 0.00 55.97 55.07 1xhc s LYS 162 Cb -0.17 -1.74 0.02 0.00 -0.52 0.00 0.00 37.83 35.42 1xhc s LYS 162 CO 0.07 0.38 -0.12 -1.17 -0.92 0.00 0.00 175.35 173.60 1xhc s LEU 163 N -0.27 1.53 -0.20 3.17 0.20 0.02 -0.01 118.68 123.13 1xhc s LEU 163 Ca 0.02 -0.44 -0.07 0.00 0.69 0.00 0.00 54.13 54.33 1xhc s LEU 163 Cb -0.10 -1.06 -0.04 0.00 -0.43 0.00 0.00 46.19 44.56 1xhc s LEU 163 CO 0.01 -0.08 0.06 -0.63 -0.29 0.00 0.00 176.35 175.42 1xhc s ILE 164 N 1.56 4.67 -0.01 6.68 1.01 0.16 0.05 121.20 135.33 1xhc s ILE 164 Ca 0.05 -0.07 -0.00 0.00 0.00 0.00 0.00 60.65 60.63 1xhc s ILE 164 Cb -0.13 -3.12 0.01 0.00 0.01 0.00 0.00 42.46 39.23 1xhc s ILE 164 CO -0.10 0.43 0.02 -2.28 0.00 0.00 0.00 174.94 173.01 1xhc s HIS 165 N 0.67 0.00 0.19 3.97 2.46 0.62 -1.46 115.29 121.73 1xhc s HIS 165 Ca 0.03 0.07 -0.30 0.00 0.47 0.00 0.00 55.06 55.33 1xhc s HIS 165 Cb -0.13 -0.08 -0.08 0.00 -0.13 0.00 0.00 32.58 32.16 1xhc s HIS 165 CO 0.02 -0.04 1.20 1.03 -2.47 0.00 0.00 174.74 174.48 1xhc s ARG 166 N 0.40 4.49 3.29 2.88 0.52 -1.12 -1.42 118.95 127.99 1xhc s ARG 166 Ca -0.03 1.88 0.00 0.00 -0.52 0.00 0.00 55.73 57.06 1xhc s ARG 166 Cb -0.05 -3.24 0.00 0.00 0.52 0.00 0.00 34.95 32.19 1xhc s ARG 166 CO -0.01 -0.08 0.00 0.41 0.02 0.00 0.00 175.30 175.64 1xhc n GLY 167 N 2.13 0.79 0.00 -3.53 0.00 -1.26 -4.56 105.19 98.76 1xhc n GLY 167 Ca 0.04 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.27 1xhc n GLY 167 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xhc n ALA 168 N 3.14 0.92 -2.51 4.61 0.00 -1.26 -0.68 120.51 124.72 1xhc n ALA 168 Ca 0.00 -0.45 -0.38 0.00 0.00 0.00 0.00 53.44 52.61 1xhc n ALA 168 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 1xhc n ALA 168 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1xhc s MET 169 N -0.07 3.96 0.03 0.00 -1.94 -1.26 -4.61 119.30 115.40 1xhc s MET 169 Ca 0.00 0.42 0.08 0.00 -1.71 0.00 0.00 55.69 54.47 1xhc s MET 169 Cb 0.00 -3.24 -0.02 0.00 2.01 0.00 0.00 34.83 33.58 1xhc s MET 169 CO 0.00 0.65 -0.23 -0.06 -0.01 0.00 0.00 175.02 175.37 1xhc s PHE 170 N -0.94 2.00 -1.17 -0.03 2.99 -1.26 -4.75 117.98 114.83 1xhc s PHE 170 Ca 0.24 -0.39 0.00 0.00 0.00 0.00 0.00 56.93 56.78 1xhc s PHE 170 Cb -0.17 -1.22 0.00 0.00 0.00 0.00 0.00 43.02 41.63 1xhc s PHE 170 CO 0.13 0.07 0.00 1.28 -0.00 0.00 0.00 175.22 176.70 1xhc n LEU 171 N 2.02 -1.12 -0.33 -0.37 4.77 -1.17 -0.91 117.00 119.88 1xhc n LEU 171 Ca -0.17 0.22 -0.04 0.00 -0.03 0.00 0.00 56.01 55.99 1xhc n LEU 171 Cb 0.53 -2.13 -0.02 0.00 -2.33 0.00 0.00 43.42 39.47 1xhc n LEU 171 CO 0.23 -0.29 -0.04 0.61 -1.33 0.00 0.00 177.39 176.57 1xhc n GLY 172 N -0.65 0.57 3.93 -0.72 0.00 -1.26 -4.99 105.19 102.07 1xhc n GLY 172 Ca -0.15 -0.12 -0.25 0.00 0.00 0.00 0.00 46.02 45.51 1xhc n GLY 172 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xhc s LEU 173 N -0.98 3.45 1.15 0.99 1.43 -0.09 -4.91 118.68 119.72 1xhc s LEU 173 Ca 0.00 0.55 -0.13 0.00 -1.03 0.00 0.00 54.13 53.52 1xhc s LEU 173 Cb 0.00 -3.41 0.27 0.00 0.03 0.00 0.00 46.19 43.09 1xhc s LEU 173 CO 0.00 -0.86 1.04 1.51 0.23 0.00 0.00 176.35 178.27 1xhc s ASP 174 N -4.25 1.16 0.22 2.29 1.47 -1.26 -4.39 116.67 111.91 1xhc s ASP 174 Ca 0.51 1.41 0.05 0.00 1.18 0.00 0.00 52.55 55.70 1xhc s ASP 174 Cb -0.10 -2.18 0.20 0.00 -0.34 0.00 0.00 42.92 40.49 1xhc s ASP 174 CO 0.42 -4.07 1.52 1.05 0.68 0.00 0.00 175.17 174.76 1xhc h GLU 175 N -2.54 0.18 0.54 2.11 -0.00 -1.97 -1.41 114.58 111.49 1xhc h GLU 175 Ca -0.61 -0.14 -0.03 0.00 -0.00 0.00 0.00 59.36 58.58 1xhc h GLU 175 Cb 1.34 0.03 0.01 0.00 -0.00 0.00 0.00 28.75 30.12 1xhc h GLU 175 CO 0.52 0.79 -0.26 1.49 -0.00 0.00 0.00 179.01 181.55 1xhc h GLU 176 N 0.12 -0.70 -0.62 1.06 4.81 -1.97 0.99 114.58 118.28 1xhc h GLU 176 Ca -0.02 0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 1xhc h GLU 176 Cb 1.22 0.16 -0.03 0.00 0.63 0.00 0.00 28.75 30.73 1xhc h GLU 176 CO 0.10 -0.45 0.34 -0.07 -0.73 0.00 0.00 179.01 178.20 1xhc h LEU 177 N -0.76 0.78 -0.58 1.64 3.38 -1.91 -1.07 115.31 116.78 1xhc h LEU 177 Ca -0.07 -0.09 0.03 0.00 0.09 0.00 0.00 57.88 57.83 1xhc h LEU 177 Cb 0.57 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.09 1xhc h LEU 177 CO 0.12 0.65 0.35 0.28 0.09 0.00 0.00 178.44 179.93 1xhc h SER 178 N 0.85 0.57 -0.52 -0.43 0.02 -1.23 -0.48 113.55 112.32 1xhc h SER 178 Ca 0.22 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.13 1xhc h SER 178 Cb 0.04 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 1xhc h SER 178 CO -0.04 0.40 0.19 -1.13 -1.14 0.00 0.00 176.83 175.11 1xhc h ASN 179 N 0.70 0.78 -0.45 3.07 -1.24 -0.30 -2.10 115.58 116.03 1xhc h ASN 179 Ca 0.24 -0.12 -0.07 0.00 0.71 0.00 0.00 56.30 57.06 1xhc h ASN 179 Cb 0.03 -0.20 -0.02 0.00 0.73 0.00 0.00 38.32 38.86 1xhc h ASN 179 CO -0.10 0.73 0.01 0.24 -1.29 0.00 0.00 177.43 177.01 1xhc h MET 180 N 0.82 0.79 -0.67 6.67 2.86 -0.58 -0.21 114.93 124.60 1xhc h MET 180 Ca 0.19 -0.25 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 1xhc h MET 180 Cb 0.23 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.78 1xhc h MET 180 CO -0.01 0.85 0.39 0.82 1.06 0.00 0.00 176.91 180.02 1xhc h ILE 181 N 0.64 1.20 0.20 -1.22 2.04 -1.02 -1.74 117.51 117.61 1xhc h ILE 181 Ca 0.13 -0.48 -0.01 0.00 1.00 0.00 0.00 64.86 65.50 1xhc h ILE 181 Cb 0.49 0.30 -0.00 0.00 -0.74 0.00 0.00 36.82 36.86 1xhc h ILE 181 CO 0.02 0.22 -0.13 0.50 0.00 0.00 0.00 178.15 178.76 1xhc h LYS 182 N 0.92 -0.31 -0.80 2.37 3.11 -1.12 -1.18 116.57 119.57 1xhc h LYS 182 Ca 0.24 0.02 0.09 0.00 -2.81 0.00 0.00 60.65 58.19 1xhc h LYS 182 Cb 0.01 0.07 -0.07 0.00 -1.00 0.00 0.00 32.23 31.24 1xhc h LYS 182 CO -0.04 -0.21 0.45 -0.44 -2.81 0.00 0.00 179.45 176.40 1xhc h ASP 183 N -0.32 0.65 -0.25 4.20 3.32 -0.90 0.24 116.42 123.37 1xhc h ASP 183 Ca -0.02 0.04 -0.05 0.00 0.02 0.00 0.00 57.03 57.03 1xhc h ASP 183 Cb 0.27 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 1xhc h ASP 183 CO 0.02 0.38 -0.02 0.24 -1.72 0.00 0.00 179.24 178.14 1xhc h MET 184 N 0.77 0.46 -0.21 3.56 2.86 -1.08 -2.15 114.93 119.14 1xhc h MET 184 Ca 0.38 -0.16 -0.08 0.00 -2.06 0.00 0.00 59.70 57.79 1xhc h MET 184 Cb 0.32 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.93 1xhc h MET 184 CO -0.23 0.65 -0.20 -0.07 1.06 0.00 0.00 176.91 178.12 1xhc h LEU 185 N 0.22 0.36 -0.29 1.22 3.38 -0.89 -3.08 115.31 116.24 1xhc h LEU 185 Ca 0.07 -0.10 0.03 0.00 0.09 0.00 0.00 57.88 57.96 1xhc h LEU 185 Cb 0.46 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 1xhc h LEU 185 CO 0.02 0.58 0.12 -0.33 0.09 0.00 0.00 178.44 178.91 1xhc h GLU 186 N 0.34 0.25 -0.94 1.13 5.08 -0.31 -1.94 114.58 118.18 1xhc h GLU 186 Ca 0.06 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.45 1xhc h GLU 186 Cb 0.55 -0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.68 1xhc h GLU 186 CO 0.04 0.16 0.61 1.49 -1.00 0.00 0.00 179.01 180.31 1xhc h GLU 187 N 0.26 1.12 0.00 2.33 4.22 -1.31 0.15 114.58 121.34 1xhc h GLU 187 Ca 0.12 -0.07 0.00 0.00 0.08 0.00 0.00 59.36 59.50 1xhc h GLU 187 Cb 0.07 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.07 1xhc h GLU 187 CO -0.11 0.74 0.03 1.15 -2.18 0.00 0.00 179.01 178.64 1xhc h THR 188 N 1.15 0.00 0.00 0.32 2.02 -1.44 -3.46 112.91 111.50 1xhc h THR 188 Ca 0.38 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.56 1xhc h THR 188 Cb 0.06 0.80 0.00 0.00 -1.74 0.00 0.00 68.15 67.27 1xhc h THR 188 CO -0.13 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.37 1xhc n GLY 189 N -1.16 1.36 3.70 2.16 0.00 0.51 -4.45 105.19 107.31 1xhc n GLY 189 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 1xhc n GLY 189 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xhc s VAL 190 N -2.00 4.95 -0.25 1.61 1.01 -0.74 -4.31 120.40 120.66 1xhc s VAL 190 Ca 0.00 1.63 -0.13 0.00 0.00 0.00 0.00 61.98 63.48 1xhc s VAL 190 Cb 0.00 -4.13 -0.04 0.00 0.00 0.00 0.00 36.38 32.21 1xhc s VAL 190 CO 0.00 0.15 0.30 -0.75 0.00 0.00 0.00 175.10 174.80 1xhc s LYS 191 N 1.33 4.04 -0.12 2.72 2.20 -0.60 -4.07 119.74 125.25 1xhc s LYS 191 Ca 0.41 -0.06 -0.06 0.00 -0.36 0.00 0.00 55.97 55.90 1xhc s LYS 191 Cb -0.18 -3.61 -0.04 0.00 -1.51 0.00 0.00 37.83 32.49 1xhc s LYS 191 CO 0.18 -0.15 0.10 -0.06 -0.36 0.00 0.00 175.35 175.06 1xhc s PHE 192 N 1.67 3.46 -0.45 4.03 0.08 -1.26 -0.80 117.98 124.71 1xhc s PHE 192 Ca 0.13 0.41 0.03 0.00 0.12 0.00 0.00 56.93 57.62 1xhc s PHE 192 Cb -0.15 -1.93 0.12 0.00 -0.57 0.00 0.00 43.02 40.49 1xhc s PHE 192 CO 0.09 0.61 0.19 -0.06 -0.10 0.00 0.00 175.22 175.94 1xhc s PHE 193 N -0.81 3.10 0.47 0.36 0.40 0.11 -4.93 117.98 116.69 1xhc s PHE 193 Ca 0.13 -2.95 -0.01 0.00 -0.60 0.00 0.00 56.93 53.50 1xhc s PHE 193 Cb -0.12 -2.67 -0.00 0.00 0.51 0.00 0.00 43.02 40.74 1xhc s PHE 193 CO 0.03 -0.81 0.71 -0.51 0.70 0.00 0.00 175.22 175.34 1xhc s LEU 194 N 0.22 3.58 -1.44 -0.37 1.43 -1.26 -0.27 118.68 120.56 1xhc s LEU 194 Ca 0.15 0.37 -0.06 0.00 -1.03 0.00 0.00 54.13 53.55 1xhc s LEU 194 Cb -0.23 -3.24 0.03 0.00 0.03 0.00 0.00 46.19 42.78 1xhc s LEU 194 CO -0.03 -0.76 0.55 0.59 0.23 0.00 0.00 176.35 176.93 1xhc n ASN 195 N -2.17 -5.12 -4.08 2.29 3.02 0.14 -4.87 115.26 104.48 1xhc n ASN 195 Ca 0.02 -0.32 -0.26 0.00 -0.03 0.00 0.00 54.58 53.99 1xhc n ASN 195 Cb 0.58 -4.17 -0.16 0.00 -0.61 0.00 0.00 39.78 35.41 1xhc n ASN 195 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1xhc s SER 196 N -2.70 2.00 -0.09 6.41 0.01 -0.51 -4.74 113.70 114.08 1xhc s SER 196 Ca 0.34 -0.34 0.04 0.00 1.31 0.00 0.00 55.95 57.30 1xhc s SER 196 Cb -0.16 -0.79 0.00 0.00 0.21 0.00 0.00 66.02 65.28 1xhc s SER 196 CO 0.42 0.08 -0.22 -0.70 0.41 0.00 0.00 173.24 173.23 1xhc s GLU 197 N 0.42 2.79 0.03 12.44 2.12 -1.26 -2.80 118.70 132.43 1xhc s GLU 197 Ca -0.11 -0.79 -0.30 0.00 0.36 0.00 0.00 54.97 54.12 1xhc s GLU 197 Cb -0.14 -2.13 -0.07 0.00 0.26 0.00 0.00 34.13 32.05 1xhc s GLU 197 CO 0.04 0.15 1.51 -0.51 -0.54 0.00 0.00 175.26 175.91 1xhc s LEU 198 N 0.39 4.34 -0.26 2.70 1.02 -1.26 -1.83 118.68 123.78 1xhc s LEU 198 Ca -0.18 2.28 -0.03 0.00 0.02 0.00 0.00 54.13 56.22 1xhc s LEU 198 Cb -0.18 -3.56 -0.16 0.00 0.02 0.00 0.00 46.19 42.31 1xhc s LEU 198 CO 0.08 -0.79 -0.25 0.18 0.02 0.00 0.00 176.35 175.59 1xhc n LEU 199 N 5.45 2.69 -3.45 1.79 4.77 0.80 -4.96 117.00 124.09 1xhc n LEU 199 Ca 0.14 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 56.00 1xhc n LEU 199 Cb 0.42 -0.89 -0.03 0.00 -2.33 0.00 0.00 43.42 40.59 1xhc n LEU 199 CO 0.60 0.84 0.45 -1.83 -1.33 0.00 0.00 177.39 176.12 1xhc s GLU 200 N -2.52 1.17 0.11 3.23 -1.05 -1.14 -4.40 118.70 114.11 1xhc s GLU 200 Ca -0.36 -0.31 0.09 0.00 -0.15 0.00 0.00 54.97 54.24 1xhc s GLU 200 Cb 0.11 0.54 -0.04 0.00 -0.44 0.00 0.00 34.13 34.30 1xhc s GLU 200 CO 0.57 -0.49 -0.16 0.00 0.95 0.00 0.00 175.26 176.13 1xhc s ALA 201 N -3.18 2.75 0.08 -0.84 0.00 -0.12 0.02 121.76 120.48 1xhc s ALA 201 Ca -0.01 -1.33 0.02 0.00 0.00 0.00 0.00 51.96 50.64 1xhc s ALA 201 Cb -0.01 -0.71 -0.01 0.00 0.00 0.00 0.00 23.12 22.40 1xhc s ALA 201 CO -0.08 0.61 0.06 0.27 0.00 0.00 0.00 175.76 176.62 1xhc n ASN 202 N 0.77 -0.07 -0.13 0.00 0.23 -0.04 -4.01 115.26 112.00 1xhc n ASN 202 Ca -0.15 -1.50 -0.09 0.00 -0.53 0.00 0.00 54.58 52.32 1xhc n ASN 202 Cb 0.53 0.37 -0.00 0.00 -2.08 0.00 0.00 39.78 38.59 1xhc n ASN 202 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1xhc h GLU 203 N 0.00 0.56 -0.01 -3.83 4.22 -1.95 -3.09 114.58 110.48 1xhc h GLU 203 Ca -0.05 -0.07 0.00 0.00 0.08 0.00 0.00 59.36 59.32 1xhc h GLU 203 Cb 0.27 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1xhc h GLU 203 CO 0.08 0.46 -0.24 -0.85 -2.18 0.00 0.00 179.01 176.28 1xhc n GLU 204 N -4.73 0.93 -3.54 1.92 0.00 -1.26 -4.24 120.64 109.73 1xhc n GLU 204 Ca 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 57.16 56.60 1xhc n GLU 204 Cb 0.08 -1.49 0.00 0.00 0.00 0.00 0.00 31.44 30.04 1xhc n GLU 204 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1xhc n GLY 205 N 1.33 -0.64 3.07 -1.84 0.00 -1.14 -0.79 105.19 105.18 1xhc n GLY 205 Ca 0.13 -0.90 -0.21 0.00 0.00 0.00 0.00 46.02 45.04 1xhc n GLY 205 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xhc s VAL 206 N -3.00 0.95 -0.16 1.61 -7.23 -0.24 -0.86 120.40 111.47 1xhc s VAL 206 Ca 0.00 -0.50 -0.14 0.00 -1.81 0.00 0.00 61.98 59.53 1xhc s VAL 206 Cb 0.00 -0.80 -0.05 0.00 0.56 0.00 0.00 36.38 36.09 1xhc s VAL 206 CO 0.00 0.27 0.30 -0.22 -0.31 0.00 0.00 175.10 175.14 1xhc s LEU 207 N -0.20 4.24 0.55 1.32 2.96 0.10 -0.55 118.68 127.12 1xhc s LEU 207 Ca 0.03 0.51 0.04 0.00 -0.22 0.00 0.00 54.13 54.49 1xhc s LEU 207 Cb -0.06 -2.38 0.04 0.00 0.50 0.00 0.00 46.19 44.29 1xhc s LEU 207 CO -0.00 0.09 0.30 0.42 -1.32 0.00 0.00 176.35 175.84 1xhc s THR 208 N 0.50 1.38 0.34 3.68 -4.23 0.11 -0.14 115.64 117.27 1xhc s THR 208 Ca 0.17 -1.64 0.06 0.00 -1.18 0.00 0.00 61.69 59.10 1xhc s THR 208 Cb -0.13 -2.02 0.30 0.00 1.34 0.00 0.00 72.50 72.00 1xhc s THR 208 CO 0.04 0.00 1.89 -0.55 -0.54 0.00 0.00 174.62 175.46 1xhc h ASN 209 N 0.85 0.74 -0.37 3.99 -1.07 -1.73 -3.17 115.58 114.82 1xhc h ASN 209 Ca -0.38 0.03 0.00 0.00 0.07 0.00 0.00 56.30 56.01 1xhc h ASN 209 Cb 1.31 -0.13 0.00 0.00 -2.07 0.00 0.00 38.32 37.44 1xhc h ASN 209 CO 0.61 0.42 0.00 -1.54 0.07 0.00 0.00 177.43 176.99 1xhc n SER 210 N -4.54 3.07 0.00 6.14 3.41 -1.26 -5.07 113.62 115.37 1xhc n SER 210 Ca 0.16 -1.91 0.00 0.00 -0.26 0.00 0.00 58.87 56.86 1xhc n SER 210 Cb 0.35 -0.24 0.00 0.00 -0.26 0.00 0.00 64.21 64.06 1xhc n SER 210 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xhc n GLY 211 N 0.95 0.06 3.18 5.00 0.00 -1.20 -5.10 105.19 108.08 1xhc n GLY 211 Ca 0.15 -1.36 -0.33 0.00 0.00 0.00 0.00 46.02 44.48 1xhc n GLY 211 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1xhc s PHE 212 N -3.17 2.79 -0.25 1.61 2.19 -1.26 0.06 117.98 119.95 1xhc s PHE 212 Ca 0.00 -1.40 -0.08 0.00 0.33 0.00 0.00 56.93 55.78 1xhc s PHE 212 Cb 0.00 -1.93 -0.03 0.00 -1.31 0.00 0.00 43.02 39.75 1xhc s PHE 212 CO 0.00 -0.69 0.09 0.42 1.83 0.00 0.00 175.22 176.87 1xhc s ILE 213 N 1.17 4.52 0.08 3.12 1.09 0.29 -4.97 121.20 126.51 1xhc s ILE 213 Ca 0.02 -0.10 -0.30 0.00 -1.10 0.00 0.00 60.65 59.17 1xhc s ILE 213 Cb -0.14 -3.12 -0.05 0.00 -1.06 0.00 0.00 42.46 38.09 1xhc s ILE 213 CO -0.08 0.33 1.00 -0.70 -0.10 0.00 0.00 174.94 175.40 1xhc s GLU 214 N 1.53 4.61 0.00 2.79 2.12 -1.26 -1.08 118.70 127.42 1xhc s GLU 214 Ca 0.06 1.50 0.00 0.00 0.36 0.00 0.00 54.97 56.89 1xhc s GLU 214 Cb -0.15 -3.39 0.00 0.00 0.26 0.00 0.00 34.13 30.85 1xhc s GLU 214 CO 0.05 0.06 0.00 0.41 -0.54 0.00 0.00 175.26 175.24 1xhc n GLY 215 N 2.54 2.00 0.15 -1.50 0.00 0.03 -4.93 105.19 103.48 1xhc n GLY 215 Ca 0.04 0.26 0.12 0.00 0.00 0.00 0.00 46.02 46.45 1xhc n GLY 215 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1xhc h LYS 216 N 0.00 0.00 -4.86 1.61 2.10 -1.74 -3.01 116.57 110.67 1xhc h LYS 216 Ca 0.00 0.00 -0.66 0.00 -2.00 0.00 0.00 60.65 57.99 1xhc h LYS 216 Cb 0.00 0.00 -0.23 0.00 -0.90 0.00 0.00 32.23 31.10 1xhc h LYS 216 CO 0.00 0.00 -0.60 0.08 -2.00 0.00 0.00 179.45 176.93 1xhc s VAL 217 N -3.19 4.33 -0.11 0.07 1.01 -1.26 -4.95 120.40 116.31 1xhc s VAL 217 Ca 0.07 -0.38 0.03 0.00 0.00 0.00 0.00 61.98 61.71 1xhc s VAL 217 Cb 0.09 -3.14 0.01 0.00 0.00 0.00 0.00 36.38 33.34 1xhc s VAL 217 CO 0.67 0.19 -0.22 -0.54 0.00 0.00 0.00 175.10 175.20 1xhc s LYS 218 N 1.59 2.85 -0.15 2.72 3.01 -1.26 0.04 119.74 128.54 1xhc s LYS 218 Ca 0.05 -0.80 0.02 0.00 -1.01 0.00 0.00 55.97 54.23 1xhc s LYS 218 Cb -0.16 -2.22 0.01 0.00 -1.01 0.00 0.00 37.83 34.45 1xhc s LYS 218 CO 0.04 0.09 -0.21 0.42 0.51 0.00 0.00 175.35 176.20 1xhc s ILE 219 N 0.56 2.03 -0.18 2.17 1.01 0.58 -0.60 121.20 126.77 1xhc s ILE 219 Ca -0.14 -0.95 -0.15 0.00 0.00 0.00 0.00 60.65 59.41 1xhc s ILE 219 Cb -0.17 -1.81 -0.04 0.00 0.01 0.00 0.00 42.46 40.45 1xhc s ILE 219 CO 0.05 0.54 0.37 0.00 0.00 0.00 0.00 174.94 175.89 1xhc n ALA 221 N 4.03 2.79 -0.07 0.00 0.00 0.13 -4.43 120.51 122.96 1xhc n ALA 221 Ca -0.09 -3.19 0.02 0.00 0.00 0.00 0.00 53.44 50.18 1xhc n ALA 221 Cb 0.51 -0.77 0.07 0.00 0.00 0.00 0.00 19.45 19.26 1xhc n ALA 221 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1xhc n ILE 222 N 2.52 0.97 0.00 0.00 -5.35 -1.26 -3.68 119.36 112.56 1xhc n ILE 222 Ca 0.28 -0.98 0.00 0.00 -0.27 0.00 0.00 62.75 61.78 1xhc n ILE 222 Cb 0.49 0.52 0.00 0.00 -1.74 0.00 0.00 39.64 38.91 1xhc n ILE 222 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1xhc n GLY 223 N -0.04 1.01 3.43 3.28 0.00 -1.26 -4.96 105.19 106.65 1xhc n GLY 223 Ca 0.05 -2.08 -0.23 0.00 0.00 0.00 0.00 46.02 43.76 1xhc n GLY 223 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1xhc s ILE 224 N -1.02 2.26 -0.22 -0.61 -4.36 -1.26 -0.82 121.20 115.17 1xhc s ILE 224 Ca 0.00 -2.27 0.00 0.00 -0.26 0.00 0.00 60.65 58.12 1xhc s ILE 224 Cb 0.00 -2.18 0.06 0.00 1.25 0.00 0.00 42.46 41.58 1xhc s ILE 224 CO 0.00 -0.39 -0.04 -0.69 0.24 0.00 0.00 174.94 174.06 1xhc s VAL 225 N -2.43 1.35 0.33 8.37 1.01 0.62 -4.70 120.40 124.95 1xhc s VAL 225 Ca 0.26 -1.05 -0.29 0.00 0.00 0.00 0.00 61.98 60.91 1xhc s VAL 225 Cb -0.05 -1.63 -0.12 0.00 0.00 0.00 0.00 36.38 34.59 1xhc s VAL 225 CO 0.12 -0.07 1.37 -2.65 0.00 0.00 0.00 175.10 173.87 1xhc n PRO 226 N 4.75 2.26 -2.82 2.72 -0.02 -1.26 -0.81 135.00 139.83 1xhc n PRO 226 Ca -0.12 0.80 -0.43 0.00 -2.02 0.00 0.00 63.50 61.73 1xhc n PRO 226 Cb 0.45 -2.43 -0.04 0.00 -0.02 0.00 0.00 33.50 31.46 1xhc n PRO 226 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 1xhc s ASN 227 N -0.11 6.20 0.00 2.55 0.01 -0.18 -4.81 114.94 118.60 1xhc s ASN 227 Ca 0.58 -0.81 0.00 0.00 -0.71 0.00 0.00 52.86 51.92 1xhc s ASN 227 Cb -0.56 -2.44 0.00 0.00 0.41 0.00 0.00 41.25 38.66 1xhc s ASN 227 CO 0.59 -1.45 0.59 1.33 -1.51 0.00 0.00 177.10 176.65 1xhc n VAL 228 N 6.03 0.19 -0.13 1.60 0.24 -1.26 -4.65 118.33 120.34 1xhc n VAL 228 Ca -0.02 -0.59 -0.07 0.00 -2.04 0.00 0.00 64.34 61.61 1xhc n VAL 228 Cb 0.46 0.91 0.09 0.00 -1.47 0.00 0.00 33.84 33.83 1xhc n VAL 228 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 1xhc h ASP 229 N 0.00 0.87 -0.28 -1.34 3.32 -1.98 0.60 116.42 117.60 1xhc h ASP 229 Ca 0.00 -0.26 -0.00 0.00 0.02 0.00 0.00 57.03 56.79 1xhc h ASP 229 Cb 0.10 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 1xhc h ASP 229 CO 0.00 0.98 0.17 0.25 -1.72 0.00 0.00 179.24 178.93 1xhc h LEU 230 N 0.80 0.34 0.71 1.55 5.85 -1.90 -1.23 115.31 121.42 1xhc h LEU 230 Ca 0.13 -0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 1xhc h LEU 230 Cb 0.60 -0.08 0.01 0.00 0.37 0.00 0.00 40.66 41.55 1xhc h LEU 230 CO 0.04 0.28 -0.34 0.00 -0.34 0.00 0.00 178.44 178.08 1xhc h ALA 231 N 1.07 -0.95 -0.56 1.25 0.00 -1.84 -2.53 119.26 115.69 1xhc h ALA 231 Ca 0.10 -0.21 0.11 0.00 0.00 0.00 0.00 54.91 54.91 1xhc h ALA 231 Cb 0.00 0.37 -0.11 0.00 0.00 0.00 0.00 17.79 18.05 1xhc h ALA 231 CO -0.02 -1.01 -0.24 -0.09 0.00 0.00 0.00 179.25 177.89 1xhc h ARG 232 N -0.99 -0.09 0.00 0.00 2.43 -0.84 0.03 114.38 114.92 1xhc h ARG 232 Ca -0.10 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.08 1xhc h ARG 232 Cb 0.74 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.31 1xhc h ARG 232 CO 0.16 -0.06 0.00 2.89 -1.51 0.00 0.00 179.97 181.45 1xhc n ARG 233 N -5.43 0.19 -0.21 0.20 1.85 -0.47 -2.15 116.66 110.64 1xhc n ARG 233 Ca 0.05 0.04 0.10 0.00 -1.00 0.00 0.00 57.85 57.04 1xhc n ARG 233 Cb 0.34 -1.50 0.27 0.00 -1.05 0.00 0.00 32.46 30.51 1xhc n ARG 233 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1xhc n SER 234 N -1.39 2.89 0.00 2.89 7.64 -0.06 -4.93 113.62 120.65 1xhc n SER 234 Ca 0.10 -1.94 0.00 0.00 1.01 0.00 0.00 58.87 58.04 1xhc n SER 234 Cb 0.27 -0.28 0.00 0.00 -1.01 0.00 0.00 64.21 63.19 1xhc n SER 234 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xhc n GLY 235 N 1.38 0.55 3.76 0.23 0.00 -0.88 -4.87 105.19 105.36 1xhc n GLY 235 Ca 0.19 -0.56 -0.36 0.00 0.00 0.00 0.00 46.02 45.29 1xhc n GLY 235 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xhc s ILE 236 N -2.00 5.36 0.22 -0.61 1.01 -0.83 -4.92 121.20 119.43 1xhc s ILE 236 Ca 0.00 0.38 -0.30 0.00 0.00 0.00 0.00 60.65 60.73 1xhc s ILE 236 Cb 0.00 -3.54 -0.08 0.00 0.01 0.00 0.00 42.46 38.85 1xhc s ILE 236 CO 0.00 0.46 1.04 -1.00 0.00 0.00 0.00 174.94 175.44 1xhc s HIS 237 N 0.04 3.73 0.09 3.97 3.76 -1.26 -3.57 115.29 122.06 1xhc s HIS 237 Ca 0.14 1.75 0.03 0.00 -0.15 0.00 0.00 55.06 56.82 1xhc s HIS 237 Cb -0.12 -3.17 -0.04 0.00 1.11 0.00 0.00 32.58 30.36 1xhc s HIS 237 CO 0.02 -0.18 -0.09 0.95 -0.85 0.00 0.00 174.74 174.60 1xhc s THR 238 N -0.77 0.82 0.00 1.30 -4.23 -1.26 -2.17 115.64 109.33 1xhc s THR 238 Ca 0.45 -1.68 0.00 0.00 -1.18 0.00 0.00 61.69 59.28 1xhc s THR 238 Cb -0.28 -1.39 0.00 0.00 1.34 0.00 0.00 72.50 72.17 1xhc s THR 238 CO 0.35 -0.65 0.00 0.61 -0.54 0.00 0.00 174.62 174.39 1xhc n GLY 239 N 0.44 2.66 0.29 3.99 0.00 -1.26 -4.88 105.19 106.43 1xhc n GLY 239 Ca -0.15 -0.19 -0.06 0.00 0.00 0.00 0.00 46.02 45.62 1xhc n GLY 239 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1xhc h ARG 240 N 0.00 0.89 0.00 1.61 2.43 -1.99 -3.45 114.38 113.87 1xhc h ARG 240 Ca 0.00 -0.26 -0.65 0.00 -0.81 0.00 0.00 59.98 58.26 1xhc h ARG 240 Cb 0.00 -0.09 -0.13 0.00 -0.42 0.00 0.00 29.97 29.33 1xhc h ARG 240 CO 0.00 0.89 -0.48 0.41 -1.51 0.00 0.00 179.97 179.28 1xhc n GLY 241 N -0.54 3.51 3.69 2.80 0.00 -1.26 -4.37 105.19 109.00 1xhc n GLY 241 Ca 0.03 -2.33 -0.42 0.00 0.00 0.00 0.00 46.02 43.29 1xhc n GLY 241 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xhc s ILE 242 N -2.89 3.63 -0.26 -0.61 1.01 0.10 -4.47 121.20 117.72 1xhc s ILE 242 Ca 0.04 1.02 -0.29 0.00 0.00 0.00 0.00 60.65 61.42 1xhc s ILE 242 Cb 0.00 -3.66 0.00 0.00 0.01 0.00 0.00 42.46 38.82 1xhc s ILE 242 CO 0.03 -0.00 1.22 -0.76 0.00 0.00 0.00 174.94 175.42 1xhc s LEU 243 N 2.43 4.00 0.23 2.97 1.43 -0.92 -0.57 118.68 128.25 1xhc s LEU 243 Ca 0.65 1.33 0.11 0.00 -1.03 0.00 0.00 54.13 55.20 1xhc s LEU 243 Cb -0.32 -3.54 -0.05 0.00 0.03 0.00 0.00 46.19 42.31 1xhc s LEU 243 CO 0.27 -0.90 -0.21 0.27 0.23 0.00 0.00 176.35 176.01 1xhc s ILE 244 N 3.85 2.49 0.05 -0.59 -4.36 -0.57 -3.95 121.20 118.12 1xhc s ILE 244 Ca 0.52 -2.16 -0.00 0.00 -0.26 0.00 0.00 60.65 58.75 1xhc s ILE 244 Cb -0.17 -2.25 0.01 0.00 1.25 0.00 0.00 42.46 41.30 1xhc s ILE 244 CO 0.17 -0.24 0.07 -0.90 0.24 0.00 0.00 174.94 174.28 1xhc n ASP 245 N -0.14 0.07 0.00 4.36 5.68 -0.41 -4.50 116.55 121.60 1xhc n ASP 245 Ca -0.09 -1.06 0.10 0.00 -0.50 0.00 0.00 54.79 53.24 1xhc n ASP 245 Cb 0.58 -0.04 0.49 0.00 -1.14 0.00 0.00 41.12 41.00 1xhc n ASP 245 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 1xhc n ASP 246 N -3.01 0.00 -1.46 -1.12 5.68 -1.26 -1.92 116.55 113.46 1xhc n ASP 246 Ca 0.01 0.32 0.10 0.00 -0.50 0.00 0.00 54.79 54.72 1xhc n ASP 246 Cb 0.04 -0.43 0.34 0.00 -1.14 0.00 0.00 41.12 39.93 1xhc n ASP 246 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1xhc n ASN 247 N -1.43 4.49 -0.41 -1.12 4.13 -1.26 -4.69 115.26 114.97 1xhc n ASN 247 Ca 0.07 -2.37 -0.05 0.00 1.68 0.00 0.00 54.58 53.91 1xhc n ASN 247 Cb 0.22 -0.54 -0.02 0.00 -1.54 0.00 0.00 39.78 37.90 1xhc n ASN 247 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 1xhc n PHE 248 N 1.11 0.00 -2.87 3.10 3.72 -0.81 -4.98 117.46 116.73 1xhc n PHE 248 Ca 0.25 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 57.24 1xhc n PHE 248 Cb 0.82 -1.43 -0.04 0.00 -0.94 0.00 0.00 39.48 37.89 1xhc n PHE 248 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1xhc s ARG 249 N -1.97 4.52 0.41 -1.08 0.52 -1.26 -1.27 118.95 118.82 1xhc s ARG 249 Ca 0.00 1.19 -0.07 0.00 -0.52 0.00 0.00 55.73 56.33 1xhc s ARG 249 Cb 0.00 -3.43 0.10 0.00 0.52 0.00 0.00 34.95 32.14 1xhc s ARG 249 CO 0.00 0.07 0.45 0.25 0.02 0.00 0.00 175.30 176.09 1xhc n THR 250 N 3.55 0.00 0.45 0.02 -2.24 -0.14 -1.28 114.28 114.63 1xhc n THR 250 Ca 0.02 -0.27 0.10 0.00 -2.27 0.00 0.00 64.05 61.63 1xhc n THR 250 Cb 0.51 -1.43 0.44 0.00 -2.10 0.00 0.00 70.33 67.74 1xhc n THR 250 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1xhc n SER 251 N -3.51 0.46 -4.64 3.42 3.41 -1.25 -4.72 113.62 106.78 1xhc n SER 251 Ca 0.06 0.61 -0.35 0.00 -0.26 0.00 0.00 58.87 58.93 1xhc n SER 251 Cb 0.22 -0.71 -0.10 0.00 -0.26 0.00 0.00 64.21 63.36 1xhc n SER 251 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xhc s ALA 252 N -3.20 3.46 0.13 7.33 0.00 -1.26 -4.98 121.76 123.23 1xhc s ALA 252 Ca 0.06 -0.79 -0.35 0.00 0.00 0.00 0.00 51.96 50.88 1xhc s ALA 252 Cb 0.10 -2.03 -0.16 0.00 0.00 0.00 0.00 23.12 21.03 1xhc s ALA 252 CO 0.37 0.07 1.31 1.17 0.00 0.00 0.00 175.76 178.67 1xhc n LYS 253 N 3.76 1.29 -0.97 0.00 4.81 -1.26 -2.09 118.16 123.69 1xhc n LYS 253 Ca -0.16 0.46 0.00 0.00 -0.87 0.00 0.00 58.31 57.74 1xhc n LYS 253 Cb 0.52 -2.07 0.00 0.00 0.02 0.00 0.00 35.03 33.50 1xhc n LYS 253 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1xhc n ASP 254 N 2.42 -3.17 -4.17 3.14 8.00 -1.26 -5.00 116.55 116.51 1xhc n ASP 254 Ca 0.17 0.00 -0.33 0.00 0.71 0.00 0.00 54.79 55.34 1xhc n ASP 254 Cb 0.22 -1.37 -0.16 0.00 -0.02 0.00 0.00 41.12 39.80 1xhc n ASP 254 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1xhc s VAL 255 N -1.94 2.14 0.36 2.53 1.01 -0.89 -1.51 120.40 122.11 1xhc s VAL 255 Ca 0.00 -0.94 0.08 0.00 0.00 0.00 0.00 61.98 61.12 1xhc s VAL 255 Cb 0.00 -1.88 -0.05 0.00 0.00 0.00 0.00 36.38 34.46 1xhc s VAL 255 CO 0.00 0.54 0.13 -0.31 0.00 0.00 0.00 175.10 175.46 1xhc s TYR 256 N 0.98 2.64 -0.07 5.22 1.51 -0.27 -0.97 117.35 126.38 1xhc s TYR 256 Ca -0.03 -0.46 -0.07 0.00 -1.01 0.00 0.00 57.07 55.50 1xhc s TYR 256 Cb -0.15 -1.71 0.02 0.00 -0.11 0.00 0.00 41.96 40.01 1xhc s TYR 256 CO -0.05 0.31 0.20 0.00 -1.11 0.00 0.00 175.55 174.90 1xhc s ALA 257 N -2.50 -0.50 0.14 3.71 0.00 -0.40 -0.50 121.76 121.71 1xhc s ALA 257 Ca 0.38 0.56 0.03 0.00 0.00 0.00 0.00 51.96 52.93 1xhc s ALA 257 Cb -0.00 -0.32 -0.04 0.00 0.00 0.00 0.00 23.12 22.75 1xhc s ALA 257 CO 0.22 -0.10 -0.06 0.96 0.00 0.00 0.00 175.76 176.78 1xhc s ILE 258 N 0.07 0.86 0.00 0.00 -4.36 -0.61 -4.77 121.20 112.39 1xhc s ILE 258 Ca -0.00 -1.99 0.00 0.00 -0.26 0.00 0.00 60.65 58.40 1xhc s ILE 258 Cb -0.02 -1.87 0.00 0.00 1.25 0.00 0.00 42.46 41.83 1xhc s ILE 258 CO 0.00 -0.72 0.00 0.61 0.24 0.00 0.00 174.94 175.08 1xhc n GLY 259 N -0.16 -1.08 0.33 6.27 0.00 -1.26 -4.19 105.19 105.11 1xhc n GLY 259 Ca -0.10 -1.48 0.19 0.00 0.00 0.00 0.00 46.02 44.64 1xhc n GLY 259 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1xhc h ASP 260 N 2.17 0.00 1.36 1.61 5.19 -1.90 -1.91 116.42 122.94 1xhc h ASP 260 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1xhc h ASP 260 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 1xhc h ASP 260 CO 0.00 0.00 -0.33 0.00 -3.12 0.00 0.00 179.24 175.79 1xhc s ALA 262 N -3.19 3.69 -0.18 0.00 0.00 -0.72 0.01 121.76 121.38 1xhc s ALA 262 Ca 0.07 -0.69 -0.00 0.00 0.00 0.00 0.00 51.96 51.34 1xhc s ALA 262 Cb 0.10 -2.12 0.01 0.00 0.00 0.00 0.00 23.12 21.11 1xhc s ALA 262 CO 0.68 0.23 -0.16 -2.00 0.00 0.00 0.00 175.76 174.50 1xhc s GLU 263 N 0.17 3.11 -0.09 0.00 2.12 0.27 -4.46 118.70 119.82 1xhc s GLU 263 Ca 0.09 -0.77 0.03 0.00 0.36 0.00 0.00 54.97 54.67 1xhc s GLU 263 Cb -0.11 -2.66 0.01 0.00 0.26 0.00 0.00 34.13 31.62 1xhc s GLU 263 CO -0.01 -0.15 -0.18 -0.47 -0.54 0.00 0.00 175.26 173.91 1xhc s TYR 264 N 1.22 2.05 -1.15 5.30 5.04 -0.41 -1.52 117.35 127.88 1xhc s TYR 264 Ca 0.03 -0.87 -0.14 0.00 -2.44 0.00 0.00 57.07 53.65 1xhc s TYR 264 Cb -0.14 -1.43 0.02 0.00 0.35 0.00 0.00 41.96 40.76 1xhc s TYR 264 CO -0.08 -0.40 0.26 0.43 -1.34 0.00 0.00 175.55 174.42 1xhc n SER 265 N 3.83 -1.17 0.00 4.32 7.64 -1.26 -0.43 113.62 126.56 1xhc n SER 265 Ca -0.20 -1.08 0.00 0.00 1.01 0.00 0.00 58.87 58.60 1xhc n SER 265 Cb 0.52 -1.31 0.00 0.00 -1.01 0.00 0.00 64.21 62.41 1xhc n SER 265 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xhc n GLY 266 N -2.13 1.66 3.63 0.23 0.00 -1.26 -4.98 105.19 102.35 1xhc n GLY 266 Ca -0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.49 1xhc n GLY 266 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xhc s ILE 267 N -3.11 4.57 -0.17 -0.61 1.01 0.43 -5.06 121.20 118.25 1xhc s ILE 267 Ca 0.00 -0.12 0.01 0.00 0.00 0.00 0.00 60.65 60.54 1xhc s ILE 267 Cb 0.00 -3.02 0.03 0.00 0.01 0.00 0.00 42.46 39.48 1xhc s ILE 267 CO 0.00 0.50 -0.15 -0.63 0.00 0.00 0.00 174.94 174.66 1xhc s ILE 268 N 0.06 1.75 0.08 2.92 1.01 -1.26 -1.29 121.20 124.47 1xhc s ILE 268 Ca 0.04 -0.83 -0.30 0.00 0.00 0.00 0.00 60.65 59.56 1xhc s ILE 268 Cb -0.12 -1.66 -0.16 0.00 0.01 0.00 0.00 42.46 40.52 1xhc s ILE 268 CO 0.01 0.42 1.65 0.00 0.00 0.00 0.00 174.94 177.02 1xhc h ALA 269 N 7.99 -0.66 0.00 9.38 0.00 -1.85 -3.47 119.26 130.64 1xhc h ALA 269 Ca -0.38 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1xhc h ALA 269 Cb 1.13 0.30 0.00 0.00 0.00 0.00 0.00 17.79 19.22 1xhc h ALA 269 CO 0.55 -0.88 0.00 0.41 0.00 0.00 0.00 179.25 179.33 1xhc n GLY 270 N -1.39 0.62 3.35 0.00 0.00 -1.26 -5.07 105.19 101.44 1xhc n GLY 270 Ca -0.11 -0.70 -0.18 0.00 0.00 0.00 0.00 46.02 45.02 1xhc n GLY 270 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1xhc s THR 271 N -2.00 1.49 0.20 2.61 -4.23 -1.26 -5.05 115.64 107.40 1xhc s THR 271 Ca 0.00 -2.13 -0.04 0.00 -1.18 0.00 0.00 61.69 58.33 1xhc s THR 271 Cb 0.00 -2.17 0.01 0.00 1.34 0.00 0.00 72.50 71.68 1xhc s THR 271 CO 0.00 -0.50 1.59 0.00 -0.54 0.00 0.00 174.62 175.17 1xhc h ALA 272 N 2.51 0.81 -0.31 3.99 0.00 -1.98 -1.89 119.26 122.40 1xhc h ALA 272 Ca -0.38 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.09 1xhc h ALA 272 Cb 1.22 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1xhc h ALA 272 CO 0.64 0.64 0.12 -0.22 0.00 0.00 0.00 179.25 180.43 1xhc h LYS 273 N 0.61 0.46 -0.32 0.00 3.64 -1.97 -0.46 116.57 118.53 1xhc h LYS 273 Ca 0.07 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1xhc h LYS 273 Cb 0.85 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.58 1xhc h LYS 273 CO 0.07 0.48 0.20 0.00 -2.27 0.00 0.00 179.45 177.94 1xhc h ALA 274 N 0.96 0.41 -0.62 5.00 0.00 -1.93 -0.46 119.26 122.61 1xhc h ALA 274 Ca 0.10 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.02 1xhc h ALA 274 Cb 0.20 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 1xhc h ALA 274 CO -0.01 -0.11 0.34 0.00 0.00 0.00 0.00 179.25 179.48 1xhc h ALA 275 N 1.09 0.81 -0.40 0.00 0.00 -1.17 -0.30 119.26 119.30 1xhc h ALA 275 Ca 0.12 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.91 1xhc h ALA 275 Cb -0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1xhc h ALA 275 CO -0.02 0.02 -0.25 0.52 0.00 0.00 0.00 179.25 179.52 1xhc h MET 276 N 0.65 0.83 -0.51 0.00 2.07 -1.00 -2.41 114.93 114.55 1xhc h MET 276 Ca 0.27 -0.36 -0.08 0.00 -2.07 0.00 0.00 59.70 57.46 1xhc h MET 276 Cb 0.15 -0.03 -0.02 0.00 -1.87 0.00 0.00 31.60 29.83 1xhc h MET 276 CO -0.16 0.99 -0.00 0.93 1.07 0.00 0.00 176.91 179.73 1xhc h GLU 277 N 0.71 0.90 -1.00 1.72 4.39 -0.78 -2.30 114.58 118.22 1xhc h GLU 277 Ca 0.09 -0.29 0.03 0.00 0.34 0.00 0.00 59.36 59.53 1xhc h GLU 277 Cb 0.79 -0.08 -0.06 0.00 -0.10 0.00 0.00 28.75 29.30 1xhc h GLU 277 CO 0.07 0.93 0.66 1.96 -1.16 0.00 0.00 179.01 181.47 1xhc h GLN 278 N 0.77 1.26 -0.71 2.33 4.20 -1.07 -1.20 115.11 120.70 1xhc h GLN 278 Ca 0.14 -0.08 -0.03 0.00 0.06 0.00 0.00 58.65 58.74 1xhc h GLN 278 Cb 0.52 -0.28 -0.03 0.00 0.30 0.00 0.00 27.48 27.99 1xhc h GLN 278 CO 0.03 0.83 0.31 0.00 -0.67 0.00 0.00 178.83 179.33 1xhc h ALA 279 N 1.40 0.92 -0.43 3.87 0.00 -1.32 0.74 119.26 124.44 1xhc h ALA 279 Ca 0.39 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 1xhc h ALA 279 Cb -0.05 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 1xhc h ALA 279 CO -0.11 0.51 0.09 0.00 0.00 0.00 0.00 179.25 179.74 1xhc h ARG 280 N 1.00 0.70 -0.23 0.00 3.08 -1.07 0.82 114.38 118.68 1xhc h ARG 280 Ca 0.24 -0.18 -0.07 0.00 0.07 0.00 0.00 59.98 60.04 1xhc h ARG 280 Cb 0.17 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 1xhc h ARG 280 CO -0.02 0.72 -0.15 0.28 -1.07 0.00 0.00 179.97 179.73 1xhc h VAL 281 N 0.56 1.31 -0.82 2.04 2.07 -1.11 -1.53 116.25 118.78 1xhc h VAL 281 Ca 0.13 -1.25 -0.01 0.00 0.82 0.00 0.00 66.70 66.39 1xhc h VAL 281 Cb 0.34 1.63 -0.04 0.00 -1.52 0.00 0.00 31.29 31.70 1xhc h VAL 281 CO 0.00 0.39 0.48 0.25 0.02 0.00 0.00 177.57 178.71 1xhc h LEU 282 N 0.21 0.99 -0.26 2.57 5.85 -0.80 -1.04 115.31 122.83 1xhc h LEU 282 Ca 0.05 -0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.72 1xhc h LEU 282 Cb 0.66 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 1xhc h LEU 282 CO 0.04 0.77 0.14 0.00 -0.34 0.00 0.00 178.44 179.05 1xhc h ALA 283 N 1.39 0.32 -0.16 1.25 0.00 -0.64 -0.44 119.26 120.98 1xhc h ALA 283 Ca 0.29 0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.26 1xhc h ALA 283 Cb -0.02 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.65 1xhc h ALA 283 CO -0.05 -0.25 -0.27 -0.44 0.00 0.00 0.00 179.25 178.23 1xhc h ASP 284 N 0.29 -0.85 -0.38 0.00 3.32 -0.82 -1.58 116.42 116.40 1xhc h ASP 284 Ca 0.11 0.14 0.05 0.00 0.02 0.00 0.00 57.03 57.35 1xhc h ASP 284 Cb 0.02 0.38 -0.05 0.00 0.22 0.00 0.00 39.33 39.90 1xhc h ASP 284 CO -0.06 -0.31 0.09 0.40 -1.72 0.00 0.00 179.24 177.64 1xhc h ILE 285 N -0.32 0.83 0.00 0.35 2.04 -0.91 -0.27 117.51 119.22 1xhc h ILE 285 Ca 0.11 -0.08 -0.02 0.00 1.00 0.00 0.00 64.86 65.87 1xhc h ILE 285 Cb 0.49 0.58 -0.00 0.00 -0.74 0.00 0.00 36.82 37.15 1xhc h ILE 285 CO -0.35 0.04 -0.09 -0.07 0.00 0.00 0.00 178.15 177.68 1xhc h LEU 286 N 0.23 0.00 -2.11 1.44 3.38 -0.82 -1.18 115.31 116.25 1xhc h LEU 286 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1xhc h LEU 286 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1xhc h LEU 286 CO -0.22 0.09 0.00 0.29 0.09 0.00 0.00 178.44 178.69 1xhc n LYS 287 N -3.72 2.75 -1.47 1.13 5.02 -0.62 -4.93 118.16 116.33 1xhc n LYS 287 Ca -0.02 -1.65 -0.10 0.00 -2.02 0.00 0.00 58.31 54.51 1xhc n LYS 287 Cb 0.20 -1.72 -0.04 0.00 -0.02 0.00 0.00 35.03 33.45 1xhc n LYS 287 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xhc n GLY 288 N 0.62 0.95 3.16 0.72 0.00 -0.44 -4.98 105.19 105.21 1xhc n GLY 288 Ca 0.15 -0.53 -0.39 0.00 0.00 0.00 0.00 46.02 45.24 1xhc n GLY 288 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xhc s GLU 289 N -3.20 2.59 0.24 1.61 2.02 -0.18 -5.00 118.70 116.78 1xhc s GLU 289 Ca 0.00 -2.19 -0.31 0.00 0.02 0.00 0.00 54.97 52.48 1xhc s GLU 289 Cb 0.00 -3.86 -0.13 0.00 0.10 0.00 0.00 34.13 30.24 1xhc s GLU 289 CO 0.00 -1.18 1.47 -2.30 0.02 0.00 0.00 175.26 173.27 1xhc n PRO 290 N 4.13 2.18 -3.80 0.39 -0.02 -1.26 -3.03 135.00 133.59 1xhc n PRO 290 Ca 0.03 0.78 -0.12 0.00 -2.02 0.00 0.00 63.50 62.16 1xhc n PRO 290 Cb 0.40 -2.48 -0.10 0.00 -0.02 0.00 0.00 33.50 31.31 1xhc n PRO 290 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1xhc s ARG 291 N -0.23 0.44 -0.62 -0.52 3.00 -1.26 -4.96 118.95 114.80 1xhc s ARG 291 Ca 0.69 0.01 -0.01 0.00 0.00 0.00 0.00 55.73 56.42 1xhc s ARG 291 Cb -0.62 0.20 0.16 0.00 0.00 0.00 0.00 34.95 34.68 1xhc s ARG 291 CO 0.48 -0.09 0.42 -0.98 0.00 0.00 0.00 175.30 175.13 1xhc s ARG 292 N -0.64 2.48 0.13 3.54 3.03 -1.26 -4.95 118.95 121.28 1xhc s ARG 292 Ca -0.07 -2.64 -0.35 0.00 2.03 0.00 0.00 55.73 54.70 1xhc s ARG 292 Cb -0.04 -3.64 -0.16 0.00 -1.03 0.00 0.00 34.95 30.08 1xhc s ARG 292 CO 0.02 -1.17 1.35 0.98 -1.13 0.00 0.00 175.30 175.35 1xhc n TYR 293 N 3.26 1.64 -2.50 5.89 4.19 -1.26 -4.92 117.16 123.46 1xhc n TYR 293 Ca 0.09 0.57 -0.41 0.00 3.31 0.00 0.00 57.90 61.46 1xhc n TYR 293 Cb 0.36 -2.37 -0.03 0.00 0.49 0.00 0.00 39.34 37.80 1xhc n TYR 293 CO 0.00 0.00 0.00 1.21 0.91 0.00 0.00 176.86 178.98 1xhc s ASN 294 N 0.44 6.10 0.40 2.98 3.84 -1.26 -4.88 114.94 122.56 1xhc s ASN 294 Ca 0.80 -0.29 0.21 0.00 0.21 0.00 0.00 52.86 53.79 1xhc s ASN 294 Cb -0.87 -2.56 0.76 0.00 -0.55 0.00 0.00 41.25 38.04 1xhc s ASN 294 CO 0.46 -1.85 1.76 -0.26 -2.79 0.00 0.00 177.10 174.43 1xhc h PHE 295 N 10.51 0.00 0.21 0.43 -1.00 -1.99 -3.34 116.94 121.76 1xhc h PHE 295 Ca -0.27 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.50 1xhc h PHE 295 Cb 1.06 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.63 1xhc h PHE 295 CO 1.11 0.31 -0.10 0.87 -1.61 0.00 0.00 178.31 178.89 1xhc h LYS 296 N 0.00 -0.27 -6.46 1.51 1.57 -1.98 -3.46 116.57 107.48 1xhc h LYS 296 Ca -0.00 0.02 -0.53 0.00 -1.87 0.00 0.00 60.65 58.27 1xhc h LYS 296 Cb 0.85 0.06 0.03 0.00 0.08 0.00 0.00 32.23 33.24 1xhc h LYS 296 CO 0.04 0.02 1.09 0.12 -0.57 0.00 0.00 179.45 180.15 1xhc s PHE 297 N -2.95 2.12 0.01 -1.35 2.19 -1.26 -5.02 117.98 111.72 1xhc s PHE 297 Ca -0.09 0.05 0.07 0.00 0.33 0.00 0.00 56.93 57.29 1xhc s PHE 297 Cb 0.00 -4.10 -0.03 0.00 -1.31 0.00 0.00 43.02 37.59 1xhc s PHE 297 CO 0.31 -4.56 -0.21 1.03 1.83 0.00 0.00 175.22 173.63 1xhc s ARG 298 N 3.00 2.12 -0.14 10.12 1.81 -1.26 -5.00 118.95 129.60 1xhc s ARG 298 Ca 0.79 -0.93 -0.04 0.00 -1.72 0.00 0.00 55.73 53.83 1xhc s ARG 298 Cb -0.43 -2.16 0.07 0.00 -0.45 0.00 0.00 34.95 31.99 1xhc s ARG 298 CO 0.35 0.56 0.25 0.45 -0.68 0.00 0.00 175.30 176.23 1xhc s SER 299 N -1.06 0.54 -0.01 0.23 0.15 -1.26 -0.71 113.70 111.58 1xhc s SER 299 Ca 0.12 0.43 -0.21 0.00 0.70 0.00 0.00 55.95 57.00 1xhc s SER 299 Cb -0.10 0.62 0.04 0.00 -1.71 0.00 0.00 66.02 64.87 1xhc s SER 299 CO 0.02 -0.26 0.45 0.28 1.20 0.00 0.00 173.24 174.94 1xhc s THR 300 N 2.40 0.04 -0.12 6.45 -1.32 -0.92 -4.97 115.64 117.20 1xhc s THR 300 Ca 0.03 -0.31 0.01 0.00 -1.21 0.00 0.00 61.69 60.21 1xhc s THR 300 Cb -0.13 -0.81 -0.01 0.00 -1.51 0.00 0.00 72.50 70.04 1xhc s THR 300 CO -0.09 -0.17 -0.16 0.54 -2.21 0.00 0.00 174.62 172.53 1xhc s VAL 301 N -1.54 2.76 0.16 5.08 0.11 -1.26 -1.20 120.40 124.51 1xhc s VAL 301 Ca -0.11 -0.77 0.09 0.00 -2.93 0.00 0.00 61.98 58.26 1xhc s VAL 301 Cb -0.03 -2.13 -0.04 0.00 -1.53 0.00 0.00 36.38 32.65 1xhc s VAL 301 CO 0.05 0.54 -0.11 -0.36 -3.33 0.00 0.00 175.10 171.88 1xhc s PHE 302 N 0.34 2.62 -0.19 1.54 0.08 -0.36 -4.95 117.98 117.07 1xhc s PHE 302 Ca -0.13 -0.22 -0.00 0.00 0.12 0.00 0.00 56.93 56.69 1xhc s PHE 302 Cb -0.17 -1.31 0.05 0.00 -0.57 0.00 0.00 43.02 41.02 1xhc s PHE 302 CO 0.07 0.48 -0.06 0.21 -0.10 0.00 0.00 175.22 175.82 1xhc s LYS 303 N -2.63 1.56 -0.57 0.44 2.47 -1.26 -0.42 119.74 119.33 1xhc s LYS 303 Ca 0.23 -0.69 -0.02 0.00 -1.56 0.00 0.00 55.97 53.94 1xhc s LYS 303 Cb -0.09 -2.23 0.15 0.00 -1.46 0.00 0.00 37.83 34.19 1xhc s LYS 303 CO 0.14 -0.48 0.37 -0.06 0.16 0.00 0.00 175.35 175.48 1xhc s PHE 304 N 1.54 3.42 0.00 4.03 2.99 1.00 -4.73 117.98 126.22 1xhc s PHE 304 Ca -0.01 -2.74 0.00 0.00 0.00 0.00 0.00 56.93 54.17 1xhc s PHE 304 Cb -0.16 -3.14 0.00 0.00 0.00 0.00 0.00 43.02 39.71 1xhc s PHE 304 CO -0.07 -0.85 0.00 0.41 -0.00 0.00 0.00 175.22 174.70 1xhc n GLY 305 N 3.63 2.91 0.25 4.36 0.00 -1.26 -2.51 105.19 112.57 1xhc n GLY 305 Ca 0.06 -0.29 0.13 0.00 0.00 0.00 0.00 46.02 45.92 1xhc n GLY 305 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xhc h LYS 306 N 0.00 0.00 -6.43 1.61 6.56 -1.94 -3.44 116.57 112.93 1xhc h LYS 306 Ca 0.00 0.00 -0.57 0.00 -1.06 0.00 0.00 60.65 59.02 1xhc h LYS 306 Cb 0.00 0.00 -0.04 0.00 -0.57 0.00 0.00 32.23 31.62 1xhc h LYS 306 CO 0.00 0.11 1.15 -1.17 -2.06 0.00 0.00 179.45 177.48 1xhc s LEU 307 N -6.49 3.56 -0.13 2.94 2.96 -1.04 -5.00 118.68 115.47 1xhc s LEU 307 Ca 0.01 1.03 -0.11 0.00 -0.22 0.00 0.00 54.13 54.84 1xhc s LEU 307 Cb 0.09 -3.53 -0.05 0.00 0.50 0.00 0.00 46.19 43.20 1xhc s LEU 307 CO 0.60 -1.54 0.22 -1.58 -1.32 0.00 0.00 176.35 172.73 1xhc s GLN 308 N 5.21 3.92 -0.07 1.98 0.74 -1.26 -0.00 119.66 130.18 1xhc s GLN 308 Ca 0.69 -0.01 -0.01 0.00 0.05 0.00 0.00 55.36 56.07 1xhc s GLN 308 Cb -0.17 -3.32 0.03 0.00 1.10 0.00 0.00 33.01 30.65 1xhc s GLN 308 CO 0.33 0.50 0.00 -1.50 -0.55 0.00 0.00 175.29 174.07 1xhc s ILE 309 N -0.27 0.36 -0.20 -2.34 2.07 0.44 -0.82 121.20 120.43 1xhc s ILE 309 Ca 0.15 0.13 -0.14 0.00 -1.41 0.00 0.00 60.65 59.38 1xhc s ILE 309 Cb -0.13 -0.52 -0.04 0.00 0.13 0.00 0.00 42.46 41.90 1xhc s ILE 309 CO 0.04 0.26 0.29 0.00 -1.91 0.00 0.00 174.94 173.62 1xhc s ALA 310 N 1.95 3.59 -0.21 1.50 0.00 0.08 -1.23 121.76 127.43 1xhc s ALA 310 Ca 0.05 -0.61 -0.02 0.00 0.00 0.00 0.00 51.96 51.38 1xhc s ALA 310 Cb -0.12 -2.47 0.01 0.00 0.00 0.00 0.00 23.12 20.54 1xhc s ALA 310 CO -0.05 -0.15 -0.10 0.42 0.00 0.00 0.00 175.76 175.87 1xhc s ILE 311 N 0.99 2.78 -0.11 0.00 1.01 -0.34 -1.23 121.20 124.30 1xhc s ILE 311 Ca 0.15 -0.78 0.01 0.00 0.00 0.00 0.00 60.65 60.03 1xhc s ILE 311 Cb -0.14 -2.27 0.02 0.00 0.01 0.00 0.00 42.46 40.08 1xhc s ILE 311 CO 0.05 0.41 -0.11 -0.63 0.00 0.00 0.00 174.94 174.67 1xhc s ILE 312 N 1.37 1.22 0.00 2.92 1.01 0.51 -2.15 121.20 126.08 1xhc s ILE 312 Ca 0.04 -0.45 0.00 0.00 0.00 0.00 0.00 60.65 60.24 1xhc s ILE 312 Cb -0.14 -1.17 0.00 0.00 0.01 0.00 0.00 42.46 41.16 1xhc s ILE 312 CO -0.07 0.39 0.00 0.61 0.00 0.00 0.00 174.94 175.87 1xhc n GLY 313 N 4.52 2.20 3.50 6.18 0.00 0.11 -1.00 105.19 120.69 1xhc n GLY 313 Ca -0.17 -0.53 -0.43 0.00 0.00 0.00 0.00 46.02 44.89 1xhc n GLY 313 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1xhc s ASN 314 N -4.00 6.29 0.00 1.61 2.47 -0.48 -4.78 114.94 116.05 1xhc s ASN 314 Ca 0.00 -0.51 0.19 0.00 0.42 0.00 0.00 52.86 52.97 1xhc s ASN 314 Cb 0.00 -2.31 0.50 0.00 -1.45 0.00 0.00 41.25 37.99 1xhc s ASN 314 CO 0.00 -0.80 1.41 0.35 -3.72 0.00 0.00 177.10 174.34 1xhc n THR 315 N 5.77 0.87 1.45 -5.21 -2.24 -1.26 -3.32 114.28 110.33 1xhc n THR 315 Ca -0.03 -0.93 0.14 0.00 -2.27 0.00 0.00 64.05 60.96 1xhc n THR 315 Cb 0.47 0.62 0.66 0.00 -2.10 0.00 0.00 70.33 69.98 1xhc n THR 315 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1xhc n LYS 316 N 1.29 0.66 -0.16 -0.78 4.01 -1.26 -4.72 118.16 117.21 1xhc n LYS 316 Ca 0.20 -0.18 -0.00 0.00 -0.51 0.00 0.00 58.31 57.81 1xhc n LYS 316 Cb 0.56 -1.50 0.00 0.00 -0.51 0.00 0.00 35.03 33.58 1xhc n LYS 316 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1xhc n GLY 317 N 1.26 -0.75 3.70 0.72 0.00 -1.26 -5.05 105.19 103.82 1xhc n GLY 317 Ca 0.15 -1.73 -0.40 0.00 0.00 0.00 0.00 46.02 44.05 1xhc n GLY 317 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xhc s GLU 318 N -2.92 4.34 0.30 1.61 2.02 -1.26 -5.03 118.70 117.76 1xhc s GLU 318 Ca 0.01 0.72 0.07 0.00 0.02 0.00 0.00 54.97 55.79 1xhc s GLU 318 Cb -0.00 -3.49 -0.03 0.00 0.10 0.00 0.00 34.13 30.71 1xhc s GLU 318 CO 0.01 -0.04 0.30 0.20 0.02 0.00 0.00 175.26 175.75 1xhc s GLY 319 N 0.91 1.59 -0.10 -1.39 0.00 -1.26 -4.07 107.32 102.99 1xhc s GLY 319 Ca 0.32 -1.51 -0.07 0.00 0.00 0.00 0.00 44.72 43.46 1xhc s GLY 319 CO 0.14 -1.48 0.25 1.25 0.00 0.00 0.00 173.10 173.26 1xhc s LYS 320 N -3.98 0.25 -0.08 2.90 2.20 0.01 -4.94 119.74 116.10 1xhc s LYS 320 Ca 0.38 0.46 -0.30 0.00 -0.36 0.00 0.00 55.97 56.16 1xhc s LYS 320 Cb -0.07 -0.01 -0.03 0.00 -1.51 0.00 0.00 37.83 36.21 1xhc s LYS 320 CO 0.27 -0.11 1.16 -1.58 -0.36 0.00 0.00 175.35 174.73 1xhc s TRP 321 N 0.80 3.24 -0.04 4.03 0.52 -1.26 -0.76 118.94 125.46 1xhc s TRP 321 Ca -0.05 1.29 0.08 0.00 0.02 0.00 0.00 56.10 57.44 1xhc s TRP 321 Cb -0.07 -3.37 -0.13 0.00 -1.15 0.00 0.00 33.47 28.75 1xhc s TRP 321 CO -0.05 -1.08 0.13 0.44 0.02 0.00 0.00 176.95 176.41 1xhc n ILE 322 N 4.67 0.22 -4.12 2.03 -5.35 -1.05 -4.98 119.36 110.79 1xhc n ILE 322 Ca 0.11 -0.26 -0.13 0.00 -0.27 0.00 0.00 62.75 62.19 1xhc n ILE 322 Cb 0.47 -0.12 -0.06 0.00 -1.74 0.00 0.00 39.64 38.18 1xhc n ILE 322 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 1xhc s GLU 323 N -2.46 1.63 0.29 6.28 2.02 -1.25 -5.08 118.70 120.12 1xhc s GLU 323 Ca -0.04 -1.63 -0.29 0.00 0.02 0.00 0.00 54.97 53.03 1xhc s GLU 323 Cb 0.05 0.39 -0.13 0.00 0.10 0.00 0.00 34.13 34.54 1xhc s GLU 323 CO 0.36 -0.64 1.26 -0.25 0.02 0.00 0.00 175.26 176.01 1xhc n ASP 324 N -0.89 2.35 -0.46 -0.19 8.00 -1.26 -2.60 116.55 121.50 1xhc n ASP 324 Ca 0.01 1.18 -0.06 0.00 0.71 0.00 0.00 54.79 56.63 1xhc n ASP 324 Cb 0.63 -1.41 -0.03 0.00 -0.02 0.00 0.00 41.12 40.30 1xhc n ASP 324 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1xhc n ASN 325 N 1.38 -5.52 -3.66 -2.24 3.02 -1.26 -4.95 115.26 102.02 1xhc n ASN 325 Ca 0.09 0.15 -0.24 0.00 -0.03 0.00 0.00 54.58 54.55 1xhc n ASN 325 Cb 0.33 -3.55 -0.17 0.00 -0.61 0.00 0.00 39.78 35.77 1xhc n ASN 325 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1xhc s THR 326 N -1.62 0.03 -0.24 3.41 -1.32 -1.07 -0.93 115.64 113.90 1xhc s THR 326 Ca 0.00 0.03 -0.05 0.00 -1.21 0.00 0.00 61.69 60.45 1xhc s THR 326 Cb 0.00 -0.48 -0.02 0.00 -1.51 0.00 0.00 72.50 70.50 1xhc s THR 326 CO 0.00 -0.06 0.01 -0.75 -2.21 0.00 0.00 174.62 171.61 1xhc s LYS 327 N 2.10 3.49 0.23 7.08 2.20 -0.76 -2.51 119.74 131.56 1xhc s LYS 327 Ca 0.03 -0.57 0.08 0.00 -0.36 0.00 0.00 55.97 55.15 1xhc s LYS 327 Cb -0.14 -3.16 -0.04 0.00 -1.51 0.00 0.00 37.83 32.98 1xhc s LYS 327 CO -0.06 -0.20 0.02 0.14 -0.36 0.00 0.00 175.35 174.88 1xhc s VAL 328 N 1.54 3.66 0.01 4.02 -7.23 0.06 -1.16 120.40 121.31 1xhc s VAL 328 Ca 0.06 -1.66 0.06 0.00 -1.81 0.00 0.00 61.98 58.63 1xhc s VAL 328 Cb -0.15 -2.91 -0.02 0.00 0.56 0.00 0.00 36.38 33.86 1xhc s VAL 328 CO -0.00 -0.26 -0.17 -0.36 -0.31 0.00 0.00 175.10 173.99 1xhc s PHE 329 N -2.05 1.54 -0.52 2.82 0.08 -0.24 -0.81 117.98 118.79 1xhc s PHE 329 Ca 0.30 -0.32 0.04 0.00 0.12 0.00 0.00 56.93 57.06 1xhc s PHE 329 Cb -0.08 -0.95 0.13 0.00 -0.57 0.00 0.00 43.02 41.55 1xhc s PHE 329 CO 0.20 0.02 0.27 0.71 -0.10 0.00 0.00 175.22 176.32 1xhc s TYR 330 N -0.60 3.14 0.00 0.36 2.02 -1.26 -2.71 117.35 118.30 1xhc s TYR 330 Ca 0.06 -3.15 0.00 0.00 -0.37 0.00 0.00 57.07 53.60 1xhc s TYR 330 Cb -0.07 -2.78 0.00 0.00 -0.40 0.00 0.00 41.96 38.71 1xhc s TYR 330 CO 0.00 -0.73 0.00 0.44 -1.57 0.00 0.00 175.55 173.69 1xhc n ILE 336 N 3.07 0.00 -3.88 2.71 -5.35 -1.26 -4.83 119.36 109.82 1xhc n ILE 336 Ca 0.06 0.00 -0.08 0.00 -0.27 0.00 0.00 62.75 62.46 1xhc n ILE 336 Cb 0.32 0.00 -0.03 0.00 -1.74 0.00 0.00 39.64 38.19 1xhc n ILE 336 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1xhc s GLY 337 N -2.04 0.11 -0.07 3.28 0.00 -1.10 -1.38 107.32 106.13 1xhc s GLY 337 Ca 0.00 -0.48 -0.28 0.00 0.00 0.00 0.00 44.72 43.96 1xhc s GLY 337 CO 0.00 -0.29 0.63 0.00 0.00 0.00 0.00 173.10 173.44 1xhc s ALA 338 N -3.94 -1.62 -0.10 3.20 0.00 -0.17 -1.08 121.76 118.04 1xhc s ALA 338 Ca 0.14 1.24 0.04 0.00 0.00 0.00 0.00 51.96 53.38 1xhc s ALA 338 Cb -0.03 -0.10 0.00 0.00 0.00 0.00 0.00 23.12 22.99 1xhc s ALA 338 CO 0.06 -0.35 -0.21 0.08 0.00 0.00 0.00 175.76 175.34 1xhc s VAL 339 N -1.05 1.87 -0.10 0.00 1.01 -0.30 -0.36 120.40 121.46 1xhc s VAL 339 Ca -0.10 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 60.98 1xhc s VAL 339 Cb -0.01 -1.63 0.02 0.00 0.00 0.00 0.00 36.38 34.76 1xhc s VAL 339 CO 0.08 0.52 -0.10 -0.69 0.00 0.00 0.00 175.10 174.91 1xhc s VAL 340 N 0.45 1.15 -0.17 2.92 1.01 -0.37 -1.83 120.40 123.56 1xhc s VAL 340 Ca -0.17 -0.40 -0.18 0.00 0.00 0.00 0.00 61.98 61.23 1xhc s VAL 340 Cb -0.17 -1.12 -0.04 0.00 0.00 0.00 0.00 36.38 35.05 1xhc s VAL 340 CO 0.07 0.38 0.47 -0.36 0.00 0.00 0.00 175.10 175.66 1xhc s PHE 341 N 1.36 3.42 -1.55 5.22 0.08 -0.10 -0.74 117.98 125.67 1xhc s PHE 341 Ca -0.01 0.77 -0.07 0.00 0.12 0.00 0.00 56.93 57.75 1xhc s PHE 341 Cb -0.14 -2.59 0.06 0.00 -0.57 0.00 0.00 43.02 39.79 1xhc s PHE 341 CO -0.05 0.02 0.45 0.09 -0.10 0.00 0.00 175.22 175.63 1xhc n ASN 342 N 4.29 -0.98 -3.17 1.36 3.02 -0.00 -4.81 115.26 114.98 1xhc n ASN 342 Ca -0.07 -1.08 -0.10 0.00 -0.03 0.00 0.00 54.58 53.30 1xhc n ASN 342 Cb 0.51 -2.58 -0.04 0.00 -0.61 0.00 0.00 39.78 37.06 1xhc n ASN 342 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1xhc s ASP 343 N -4.01 -0.19 0.20 6.41 -1.08 -1.26 -5.01 116.67 111.73 1xhc s ASP 343 Ca 0.26 -1.64 -0.09 0.00 -0.52 0.00 0.00 52.55 50.56 1xhc s ASP 343 Cb -0.14 1.14 0.13 0.00 -1.46 0.00 0.00 42.92 42.58 1xhc s ASP 343 CO 0.93 -0.17 1.76 0.40 0.52 0.00 0.00 175.17 178.61 1xhc h ILE 344 N 4.95 1.25 -0.18 4.11 2.04 -1.94 -1.83 117.51 125.91 1xhc h ILE 344 Ca 0.09 -0.80 0.05 0.00 1.00 0.00 0.00 64.86 65.20 1xhc h ILE 344 Cb 1.08 0.40 -0.05 0.00 -0.74 0.00 0.00 36.82 37.51 1xhc h ILE 344 CO 0.15 0.32 -0.15 0.03 0.00 0.00 0.00 178.15 178.50 1xhc h ARG 345 N 1.05 -0.16 -0.04 2.37 3.08 -2.00 -0.99 114.38 117.69 1xhc h ARG 345 Ca 0.24 0.01 -0.08 0.00 0.07 0.00 0.00 59.98 60.23 1xhc h ARG 345 Cb 0.22 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 1xhc h ARG 345 CO -0.02 -0.10 -0.33 -0.22 -1.07 0.00 0.00 179.97 178.23 1xhc h LYS 346 N -0.16 0.08 -0.27 0.04 1.63 -1.95 -2.91 116.57 113.03 1xhc h LYS 346 Ca 0.11 -0.03 -0.06 0.00 -0.85 0.00 0.00 60.65 59.83 1xhc h LYS 346 Cb 0.33 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 31.94 1xhc h LYS 346 CO -0.28 0.40 -0.06 0.00 -3.45 0.00 0.00 179.45 176.06 1xhc h ALA 347 N 1.60 0.37 -0.32 5.00 0.00 -0.77 -2.37 119.26 122.77 1xhc h ALA 347 Ca 0.01 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.66 1xhc h ALA 347 Cb 0.62 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1xhc h ALA 347 CO 0.04 0.17 0.19 1.15 0.00 0.00 0.00 179.25 180.81 1xhc h THR 348 N 0.27 1.04 -0.20 0.00 2.02 -1.09 -1.77 112.91 113.18 1xhc h THR 348 Ca 0.07 -0.13 -0.11 0.00 0.77 0.00 0.00 66.41 67.01 1xhc h THR 348 Cb 0.53 0.61 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 1xhc h THR 348 CO 0.03 0.07 -0.33 0.07 0.37 0.00 0.00 175.52 175.72 1xhc h LYS 349 N 0.39 0.41 -0.01 6.66 -0.00 -1.53 -2.84 116.57 119.65 1xhc h LYS 349 Ca 0.13 -0.18 -0.12 0.00 -0.00 0.00 0.00 60.65 60.48 1xhc h LYS 349 Cb -0.00 -0.01 -0.02 0.00 -0.00 0.00 0.00 32.23 32.20 1xhc h LYS 349 CO -0.06 0.70 -0.57 -0.07 -0.00 0.00 0.00 179.45 179.45 1xhc h LEU 350 N 0.36 0.03 -0.42 7.07 3.38 -1.28 -3.52 115.31 120.92 1xhc h LEU 350 Ca 0.04 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1xhc h LEU 350 Cb 0.76 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.50 1xhc h LEU 350 CO 0.06 0.59 0.00 1.21 0.09 0.00 0.00 178.44 180.39