#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xxh n TRP 3 N 0.00 1.61 -2.17 -0.14 -0.00 -1.26 -4.91 117.44 110.57 1xxh n TRP 3 Ca 0.00 0.16 -0.26 0.00 -0.00 0.00 0.00 57.50 57.40 1xxh n TRP 3 Cb 0.00 -2.59 0.07 0.00 -0.00 0.00 0.00 31.31 28.79 1xxh n TRP 3 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 177.69 178.40 1xxh s TYR 4 N 8.30 2.88 0.02 5.87 2.02 -1.26 -5.04 117.35 130.13 1xxh s TYR 4 Ca 1.07 0.46 -0.19 0.00 -0.37 0.00 0.00 57.07 58.04 1xxh s TYR 4 Cb -0.66 -3.24 -0.11 0.00 -0.40 0.00 0.00 41.96 37.55 1xxh s TYR 4 CO 0.43 -1.47 1.07 -1.00 -1.57 0.00 0.00 175.55 173.00 1xxh h PRO 5 N -0.66 -0.68 0.00 -1.71 0.13 -2.05 -3.20 132.00 123.84 1xxh h PRO 5 Ca -0.44 0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1xxh h PRO 5 Cb 1.32 0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.60 1xxh h PRO 5 CO 0.60 -0.45 0.67 -2.67 -0.23 0.00 0.00 178.00 175.92 1xxh n TRP 6 N -4.30 0.00 1.34 1.56 2.14 -1.26 -0.75 117.44 116.17 1xxh n TRP 6 Ca -0.09 0.00 0.02 0.00 2.07 0.00 0.00 57.50 59.50 1xxh n TRP 6 Cb 0.28 0.00 0.06 0.00 -0.81 0.00 0.00 31.31 30.83 1xxh n TRP 6 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 1xxh n LEU 7 N -1.58 0.99 -0.10 5.67 4.77 -1.21 -3.96 117.00 121.59 1xxh n LEU 7 Ca 0.00 -0.50 -0.24 0.00 -0.03 0.00 0.00 56.01 55.25 1xxh n LEU 7 Cb 0.67 -0.22 -0.12 0.00 -2.33 0.00 0.00 43.42 41.42 1xxh n LEU 7 CO 0.00 0.21 -0.96 -1.14 -1.33 0.00 0.00 177.39 174.17 1xxh n ARG 8 N -0.07 0.62 -0.27 3.23 3.00 0.08 -2.39 116.66 120.86 1xxh n ARG 8 Ca 0.04 0.37 0.16 0.00 -0.00 0.00 0.00 57.85 58.42 1xxh n ARG 8 Cb 0.19 -1.64 0.44 0.00 0.00 0.00 0.00 32.46 31.45 1xxh n ARG 8 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.63 176.28 1xxh h PRO 9 N -0.67 0.54 0.19 -0.14 0.11 -1.82 0.54 132.00 130.76 1xxh h PRO 9 Ca -0.50 -0.03 -0.33 0.00 0.11 0.00 0.00 66.00 65.25 1xxh h PRO 9 Cb 1.61 -0.12 0.01 0.00 0.11 0.00 0.00 31.00 32.61 1xxh h PRO 9 CO -0.20 0.36 -1.57 -0.44 -0.21 0.00 0.00 178.00 175.93 1xxh h ASP 10 N 0.56 0.62 0.12 -2.05 5.19 -1.77 -3.30 116.42 115.79 1xxh h ASP 10 Ca 0.48 -0.92 -0.02 0.00 -0.62 0.00 0.00 57.03 55.94 1xxh h ASP 10 Cb 0.96 -0.20 -0.00 0.00 0.18 0.00 0.00 39.33 40.27 1xxh h ASP 10 CO -0.22 1.72 -0.10 0.15 -3.12 0.00 0.00 179.24 177.67 1xxh h PHE 11 N 0.01 0.00 0.00 4.55 3.04 -0.83 -2.62 116.94 121.09 1xxh h PHE 11 Ca -0.31 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.64 1xxh h PHE 11 Cb 2.03 0.00 0.00 0.00 2.56 0.00 0.00 35.95 40.54 1xxh h PHE 11 CO 0.12 0.10 0.00 0.39 -2.02 0.00 0.00 178.31 176.90 1xxh n GLU 12 N -4.33 0.00 0.01 1.11 1.02 0.18 -2.60 120.64 116.03 1xxh n GLU 12 Ca -0.03 0.48 -0.10 0.00 -0.02 0.00 0.00 57.16 57.49 1xxh n GLU 12 Cb 0.18 -1.48 -0.04 0.00 -0.02 0.00 0.00 31.44 30.09 1xxh n GLU 12 CO 0.00 0.00 0.00 1.57 1.18 0.00 0.00 177.13 179.88 1xxh h LYS 13 N 0.00 -0.34 -0.94 3.49 2.10 -1.64 -1.36 116.57 117.88 1xxh h LYS 13 Ca 0.00 0.02 0.26 0.00 -2.00 0.00 0.00 60.65 58.93 1xxh h LYS 13 Cb 0.00 0.08 -0.17 0.00 -0.90 0.00 0.00 32.23 31.24 1xxh h LYS 13 CO 0.00 -0.23 0.08 -0.07 -2.00 0.00 0.00 179.45 177.23 1xxh h LEU 14 N -0.36 -0.35 -0.82 7.07 3.38 -1.56 1.64 115.31 124.31 1xxh h LEU 14 Ca 0.10 0.26 -0.12 0.00 0.09 0.00 0.00 57.88 58.20 1xxh h LEU 14 Cb 0.50 0.42 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 1xxh h LEU 14 CO -0.32 -0.31 -0.56 0.58 0.09 0.00 0.00 178.44 177.93 1xxh h VAL 15 N 0.05 1.39 -0.24 1.22 2.07 -1.11 -2.77 116.25 116.86 1xxh h VAL 15 Ca 0.58 -1.89 0.07 0.00 0.82 0.00 0.00 66.70 66.28 1xxh h VAL 15 Cb 1.19 1.98 -0.01 0.00 -1.52 0.00 0.00 31.29 32.94 1xxh h VAL 15 CO -0.84 0.55 0.24 0.00 0.02 0.00 0.00 177.57 177.53 1xxh h ALA 16 N 1.36 1.93 0.00 1.67 0.00 0.35 -0.25 119.26 124.33 1xxh h ALA 16 Ca -0.00 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.75 1xxh h ALA 16 Cb 1.00 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 1xxh h ALA 16 CO 0.08 -0.36 -1.47 -1.13 0.00 0.00 0.00 179.25 176.37 1xxh n SER 17 N -3.91 0.74 0.11 0.00 3.41 -0.87 -2.30 113.62 110.79 1xxh n SER 17 Ca 0.03 0.32 0.13 0.00 -0.26 0.00 0.00 58.87 59.09 1xxh n SER 17 Cb 0.38 0.39 0.39 0.00 -0.26 0.00 0.00 64.21 65.11 1xxh n SER 17 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1xxh n TYR 18 N -2.80 0.97 -0.00 7.33 4.01 -0.25 -1.04 117.16 125.38 1xxh n TYR 18 Ca -0.09 0.28 0.09 0.00 -0.16 0.00 0.00 57.90 58.02 1xxh n TYR 18 Cb 0.80 -0.96 -0.14 0.00 -0.31 0.00 0.00 39.34 38.73 1xxh n TYR 18 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 1xxh n GLN 19 N -2.29 0.57 0.00 -0.72 7.27 -0.37 -4.41 117.38 117.42 1xxh n GLN 19 Ca 0.05 -0.17 0.08 0.00 0.07 0.00 0.00 57.00 57.03 1xxh n GLN 19 Cb 0.43 -1.44 -0.08 0.00 2.41 0.00 0.00 30.24 31.57 1xxh n GLN 19 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1xxh n ALA 20 N -2.14 3.94 0.00 1.69 0.00 -0.97 -5.00 120.51 118.03 1xxh n ALA 20 Ca -0.03 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 52.95 1xxh n ALA 20 Cb 0.48 -0.57 0.00 0.00 0.00 0.00 0.00 19.45 19.36 1xxh n ALA 20 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xxh n GLY 21 N 1.35 1.73 2.41 0.00 0.00 -0.21 -4.97 105.19 105.49 1xxh n GLY 21 Ca 0.03 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 1xxh n GLY 21 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1xxh n ARG 22 N -1.82 2.33 -3.94 1.61 0.00 -0.26 -4.94 116.66 109.64 1xxh n ARG 22 Ca 0.00 -2.29 -0.36 0.00 -0.00 0.00 0.00 57.85 55.20 1xxh n ARG 22 Cb 0.00 -2.07 -0.06 0.00 -0.00 0.00 0.00 32.46 30.33 1xxh n ARG 22 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1xxh s GLY 23 N 0.21 2.13 -0.06 2.89 0.00 -0.99 -4.73 107.32 106.76 1xxh s GLY 23 Ca 0.54 -0.69 -0.16 0.00 0.00 0.00 0.00 44.72 44.42 1xxh s GLY 23 CO -0.19 -0.46 0.41 -1.58 0.00 0.00 0.00 173.10 171.28 1xxh s HIS 24 N -1.07 3.62 -0.75 1.90 2.46 -1.26 -4.94 115.29 115.26 1xxh s HIS 24 Ca 0.17 0.90 0.15 0.00 0.47 0.00 0.00 55.06 56.75 1xxh s HIS 24 Cb -0.12 -2.38 0.67 0.00 -0.13 0.00 0.00 32.58 30.62 1xxh s HIS 24 CO 0.06 0.43 1.47 -2.39 -2.47 0.00 0.00 174.74 171.84 1xxh n HIS 25 N 2.68 0.32 -3.83 3.88 1.44 -1.26 -4.32 115.22 114.14 1xxh n HIS 25 Ca -0.11 0.14 -0.30 0.00 -2.01 0.00 0.00 57.72 55.44 1xxh n HIS 25 Cb 0.52 -0.72 -0.15 0.00 0.12 0.00 0.00 29.99 29.75 1xxh n HIS 25 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1xxh s ALA 26 N -3.16 1.71 -0.32 1.59 0.00 -1.26 0.52 121.76 120.83 1xxh s ALA 26 Ca 0.04 -1.47 -0.02 0.00 0.00 0.00 0.00 51.96 50.50 1xxh s ALA 26 Cb 0.07 -1.51 0.06 0.00 0.00 0.00 0.00 23.12 21.74 1xxh s ALA 26 CO 0.24 -1.42 0.04 -1.17 0.00 0.00 0.00 175.76 173.44 1xxh s LEU 27 N 1.52 4.18 -0.38 0.00 2.96 -1.09 0.00 118.68 125.86 1xxh s LEU 27 Ca 0.03 -1.43 -0.15 0.00 -0.22 0.00 0.00 54.13 52.36 1xxh s LEU 27 Cb -0.18 -1.74 0.01 0.00 0.50 0.00 0.00 46.19 44.78 1xxh s LEU 27 CO -0.14 -0.32 0.34 -0.22 -1.32 0.00 0.00 176.35 174.69 1xxh s LEU 28 N 1.23 4.79 -0.48 -0.68 2.96 -0.49 0.37 118.68 126.37 1xxh s LEU 28 Ca -0.02 -0.60 -0.17 0.00 -0.22 0.00 0.00 54.13 53.11 1xxh s LEU 28 Cb -0.20 -2.25 0.06 0.00 0.50 0.00 0.00 46.19 44.30 1xxh s LEU 28 CO -0.02 -0.42 0.49 -0.63 -1.32 0.00 0.00 176.35 174.46 1xxh s ILE 29 N 1.87 5.07 -0.25 6.68 1.09 0.56 0.15 121.20 136.38 1xxh s ILE 29 Ca 0.08 -0.72 -0.23 0.00 -1.10 0.00 0.00 60.65 58.68 1xxh s ILE 29 Cb -0.18 -4.18 -0.01 0.00 -1.06 0.00 0.00 42.46 37.04 1xxh s ILE 29 CO 0.11 -0.64 0.75 0.00 -0.10 0.00 0.00 174.94 175.06 1xxh s GLN 30 N 2.10 4.14 -0.13 2.79 -2.07 -0.30 -2.68 119.66 123.50 1xxh s GLN 30 Ca 0.10 0.76 -0.29 0.00 -1.82 0.00 0.00 55.36 54.11 1xxh s GLN 30 Cb -0.21 -3.65 0.08 0.00 -1.09 0.00 0.00 33.01 28.14 1xxh s GLN 30 CO 0.10 -0.49 0.75 0.00 -1.32 0.00 0.00 175.29 174.32 1xxh s ALA 31 N 2.72 -1.80 1.45 2.60 0.00 -1.08 -1.73 121.76 123.92 1xxh s ALA 31 Ca 0.31 1.57 -0.23 0.00 0.00 0.00 0.00 51.96 53.61 1xxh s ALA 31 Cb -0.15 -0.47 0.36 0.00 0.00 0.00 0.00 23.12 22.86 1xxh s ALA 31 CO 0.08 -0.35 0.81 1.28 0.00 0.00 0.00 175.76 177.59 1xxh n LEU 32 N 1.43 0.00 -4.88 0.00 4.77 -1.26 -4.40 117.00 112.65 1xxh n LEU 32 Ca -0.16 -0.82 -0.34 0.00 -0.03 0.00 0.00 56.01 54.66 1xxh n LEU 32 Cb 0.57 -0.94 -0.05 0.00 -2.33 0.00 0.00 43.42 40.66 1xxh n LEU 32 CO 0.16 -2.79 0.00 -2.16 -1.33 0.00 0.00 177.39 171.28 1xxh s PRO 33 N -4.93 3.64 -0.45 3.23 0.04 -1.26 -4.66 135.00 130.62 1xxh s PRO 33 Ca 0.63 -0.01 -0.01 0.00 0.04 0.00 0.00 61.00 61.65 1xxh s PRO 33 Cb -0.11 -3.00 0.00 0.00 0.04 0.00 0.00 34.50 31.43 1xxh s PRO 33 CO 0.53 0.58 0.43 0.41 0.04 0.00 0.00 177.00 178.99 1xxh n GLY 34 N 0.79 -0.91 0.00 0.56 0.00 -1.26 -4.36 105.19 100.01 1xxh n GLY 34 Ca -0.08 0.27 0.00 0.00 0.00 0.00 0.00 46.02 46.21 1xxh n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xxh n GLY 36 N -1.38 0.78 0.00 -0.02 0.00 -1.26 -1.80 105.19 101.51 1xxh n GLY 36 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1xxh n GLY 36 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1xxh n ASP 37 N -0.74 0.00 -0.01 1.61 2.03 -1.26 -1.88 116.55 116.30 1xxh n ASP 37 Ca 0.00 0.34 -0.00 0.00 0.52 0.00 0.00 54.79 55.64 1xxh n ASP 37 Cb 0.00 -0.09 -0.00 0.00 -0.72 0.00 0.00 41.12 40.31 1xxh n ASP 37 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1xxh n ASP 38 N -1.40 -0.02 0.16 1.67 2.03 -1.26 -0.98 116.55 116.76 1xxh n ASP 38 Ca 0.00 0.07 0.02 0.00 0.52 0.00 0.00 54.79 55.40 1xxh n ASP 38 Cb 0.00 -0.03 0.36 0.00 -0.72 0.00 0.00 41.12 40.74 1xxh n ASP 38 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1xxh h ALA 39 N -0.04 1.41 0.00 -1.67 0.00 -1.73 -3.02 119.26 114.22 1xxh h ALA 39 Ca 0.00 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 1xxh h ALA 39 Cb 0.01 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1xxh h ALA 39 CO -0.01 0.43 -0.19 1.25 0.00 0.00 0.00 179.25 180.72 1xxh h LEU 40 N 0.08 0.00 0.01 0.00 5.85 -0.86 0.17 115.31 120.55 1xxh h LEU 40 Ca 0.01 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.68 1xxh h LEU 40 Cb 0.58 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.61 1xxh h LEU 40 CO 0.04 0.19 -0.28 0.40 -0.34 0.00 0.00 178.44 178.45 1xxh h ILE 41 N 0.00 1.62 -0.92 4.05 1.08 -1.46 -2.64 117.51 119.24 1xxh h ILE 41 Ca -0.00 -2.33 0.05 0.00 -0.39 0.00 0.00 64.86 62.19 1xxh h ILE 41 Cb 0.75 3.18 -0.06 0.00 -3.07 0.00 0.00 36.82 37.62 1xxh h ILE 41 CO 0.02 0.57 0.60 0.22 -0.69 0.00 0.00 178.15 178.87 1xxh h TYR 42 N -0.95 1.09 0.58 1.37 3.20 -1.45 -1.33 116.97 119.47 1xxh h TYR 42 Ca -0.07 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.80 1xxh h TYR 42 Cb 1.10 -0.36 0.01 0.00 1.54 0.00 0.00 36.73 39.01 1xxh h TYR 42 CO 0.24 0.60 -0.28 0.00 -1.64 0.00 0.00 178.16 177.08 1xxh h ALA 43 N 1.49 -0.78 0.12 1.82 0.00 -0.75 -2.14 119.26 119.02 1xxh h ALA 43 Ca 0.38 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 55.11 1xxh h ALA 43 Cb 0.11 0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1xxh h ALA 43 CO -0.13 -0.86 -0.23 -0.07 0.00 0.00 0.00 179.25 177.96 1xxh h LEU 44 N -0.94 -0.65 -0.80 0.00 3.38 -1.28 -2.41 115.31 112.60 1xxh h LEU 44 Ca -0.08 0.08 0.19 0.00 0.09 0.00 0.00 57.88 58.16 1xxh h LEU 44 Cb 0.65 0.25 -0.13 0.00 0.09 0.00 0.00 40.66 41.52 1xxh h LEU 44 CO 0.13 -0.32 0.16 0.77 0.09 0.00 0.00 178.44 179.27 1xxh h SER 45 N -0.43 -0.07 -0.77 -0.43 4.64 -1.28 0.32 113.55 115.53 1xxh h SER 45 Ca 0.03 0.18 0.05 0.00 -0.47 0.00 0.00 61.79 61.58 1xxh h SER 45 Cb 0.45 0.26 -0.05 0.00 -0.31 0.00 0.00 62.40 62.76 1xxh h SER 45 CO -0.13 -0.12 0.50 -0.09 -0.87 0.00 0.00 176.83 176.13 1xxh h ARG 46 N 0.21 0.85 -0.36 4.77 9.65 -0.88 -0.28 114.38 128.34 1xxh h ARG 46 Ca 0.47 -0.05 -0.03 0.00 -1.10 0.00 0.00 59.98 59.27 1xxh h ARG 46 Cb 0.88 -0.19 -0.02 0.00 -1.39 0.00 0.00 29.97 29.25 1xxh h ARG 46 CO -0.61 0.56 0.11 -0.92 2.80 0.00 0.00 179.97 181.91 1xxh h TYR 47 N 0.88 0.58 0.00 2.20 3.20 -0.13 -2.85 116.97 120.85 1xxh h TYR 47 Ca 0.32 -0.06 -0.05 0.00 3.14 0.00 0.00 58.73 62.08 1xxh h TYR 47 Cb 0.15 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 1xxh h TYR 47 CO -0.00 0.57 -0.24 -0.07 -1.64 0.00 0.00 178.16 176.78 1xxh h LEU 48 N 0.43 0.00 -3.41 2.82 3.38 -0.78 -2.88 115.31 114.87 1xxh h LEU 48 Ca 0.12 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.89 1xxh h LEU 48 Cb 0.26 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 40.90 1xxh h LEU 48 CO -0.00 0.24 0.25 0.18 0.09 0.00 0.00 178.44 179.19 1xxh n LEU 49 N -3.58 5.56 -4.68 1.67 4.32 -0.18 -4.69 117.00 115.41 1xxh n LEU 49 Ca -0.01 -2.89 -0.38 0.00 -0.02 0.00 0.00 56.01 52.72 1xxh n LEU 49 Cb 0.38 -0.72 -0.08 0.00 -1.62 0.00 0.00 43.42 41.38 1xxh n LEU 49 CO 0.33 0.75 0.03 0.00 -1.22 0.00 0.00 177.39 177.28 1xxh h GLN 51 N 7.28 0.37 -2.22 0.00 1.08 -1.91 -3.38 115.11 116.32 1xxh h GLN 51 Ca -0.37 -0.45 -0.58 0.00 -1.45 0.00 0.00 58.65 55.80 1xxh h GLN 51 Cb 1.16 0.14 -0.39 0.00 -0.05 0.00 0.00 27.48 28.34 1xxh h GLN 51 CO 0.71 1.14 -0.97 1.04 -0.95 0.00 0.00 178.83 179.80 1xxh n GLN 52 N -3.69 0.83 -1.99 1.46 6.02 -1.26 -5.12 117.38 113.63 1xxh n GLN 52 Ca -0.07 -3.47 -0.37 0.00 -0.01 0.00 0.00 57.00 53.08 1xxh n GLN 52 Cb 0.89 -1.57 0.03 0.00 1.02 0.00 0.00 30.24 30.61 1xxh n GLN 52 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1xxh s PRO 53 N -0.94 3.20 -0.12 -1.09 0.04 -1.26 -4.13 135.00 130.70 1xxh s PRO 53 Ca 0.34 1.95 0.18 0.00 0.04 0.00 0.00 61.00 63.52 1xxh s PRO 53 Cb 0.11 -2.15 0.74 0.00 0.04 0.00 0.00 34.50 33.24 1xxh s PRO 53 CO -0.13 -1.06 1.65 1.04 0.04 0.00 0.00 177.00 178.54 1xxh n GLN 54 N -1.15 3.85 0.00 4.56 6.02 -0.05 -4.93 117.38 125.68 1xxh n GLN 54 Ca 0.11 -2.93 0.00 0.00 -0.01 0.00 0.00 57.00 54.17 1xxh n GLN 54 Cb 0.48 -1.93 0.00 0.00 1.02 0.00 0.00 30.24 29.81 1xxh n GLN 54 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1xxh n GLY 55 N 1.13 2.07 0.02 1.08 0.00 -1.26 -4.72 105.19 103.51 1xxh n GLY 55 Ca 0.26 -0.56 0.01 0.00 0.00 0.00 0.00 46.02 45.73 1xxh n GLY 55 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1xxh n HIS 56 N 0.00 0.00 -4.36 1.61 8.25 -1.26 -5.04 115.22 114.42 1xxh n HIS 56 Ca 0.00 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.27 1xxh n HIS 56 Cb 0.00 -0.34 -0.09 0.00 1.12 0.00 0.00 29.99 30.68 1xxh n HIS 56 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 1xxh s LYS 57 N -2.51 1.61 1.13 -0.41 2.47 -1.26 -4.98 119.74 115.78 1xxh s LYS 57 Ca -0.04 -1.92 -0.18 0.00 -1.56 0.00 0.00 55.97 52.26 1xxh s LYS 57 Cb 0.05 -0.23 0.26 0.00 -1.46 0.00 0.00 37.83 36.45 1xxh s LYS 57 CO 0.41 -0.41 1.19 -1.12 0.16 0.00 0.00 175.35 175.58 1xxh s SER 58 N -3.40 1.63 -0.18 1.43 0.01 -1.26 -0.87 113.70 111.06 1xxh s SER 58 Ca 0.35 0.47 0.15 0.00 1.31 0.00 0.00 55.95 58.23 1xxh s SER 58 Cb 0.05 -0.62 -0.22 0.00 0.21 0.00 0.00 66.02 65.44 1xxh s SER 58 CO 0.16 -3.67 0.05 0.00 0.41 0.00 0.00 173.24 170.19 1xxh n GLY 60 N 1.91 1.68 0.07 0.00 0.00 -1.26 -4.91 105.19 102.69 1xxh n GLY 60 Ca -0.30 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.66 1xxh n GLY 60 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1xxh n HIS 61 N -2.00 0.47 -0.53 1.61 8.25 -1.26 -4.27 115.22 117.49 1xxh n HIS 61 Ca 0.00 0.20 -0.17 0.00 -0.26 0.00 0.00 57.72 57.49 1xxh n HIS 61 Cb 0.00 -0.60 0.01 0.00 1.12 0.00 0.00 29.99 30.52 1xxh n HIS 61 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1xxh h ARG 63 N -0.07 0.06 0.55 0.00 3.08 -1.96 0.28 114.38 116.33 1xxh h ARG 63 Ca -0.18 -0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.84 1xxh h ARG 63 Cb 0.63 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.67 1xxh h ARG 63 CO 0.17 0.04 -0.28 0.78 -1.07 0.00 0.00 179.97 179.61 1xxh h GLY 64 N 0.06 -0.83 -0.16 0.04 0.00 -1.86 0.37 103.07 100.68 1xxh h GLY 64 Ca 0.47 0.31 0.24 0.00 0.00 0.00 0.00 47.33 48.36 1xxh h GLY 64 CO -0.78 -0.30 0.54 0.00 0.00 0.00 0.00 176.54 176.01 1xxh h GLN 66 N 0.53 -0.15 -1.31 0.00 4.15 -0.29 -2.34 115.11 115.71 1xxh h GLN 66 Ca 0.62 0.01 0.00 0.00 0.77 0.00 0.00 58.65 60.05 1xxh h GLN 66 Cb 1.19 0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.91 1xxh h GLN 66 CO -0.49 0.33 0.00 1.28 -1.93 0.00 0.00 178.83 178.02 1xxh n LEU 67 N -4.91 0.00 0.00 -2.39 4.77 0.13 0.14 117.00 114.74 1xxh n LEU 67 Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 1xxh n LEU 67 Cb 0.27 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 1xxh n LEU 67 CO 0.29 0.00 0.00 1.67 -1.33 0.00 0.00 177.39 178.02 1xxh n GLN 69 N 0.80 0.00 0.03 3.23 0.00 -0.88 -0.30 117.38 120.26 1xxh n GLN 69 Ca 0.00 0.00 0.07 0.00 -0.00 0.00 0.00 57.00 57.07 1xxh n GLN 69 Cb 0.00 0.00 0.50 0.00 0.00 0.00 0.00 30.24 30.74 1xxh n GLN 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1xxh h ALA 70 N 0.00 1.88 0.00 1.69 0.00 -0.55 -3.46 119.26 118.81 1xxh h ALA 70 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1xxh h ALA 70 Cb 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1xxh h ALA 70 CO 0.00 0.07 0.00 0.41 0.00 0.00 0.00 179.25 179.73 1xxh n GLY 71 N -1.51 2.15 3.72 0.00 0.00 0.59 -5.03 105.19 105.11 1xxh n GLY 71 Ca 0.04 -0.71 -0.42 0.00 0.00 0.00 0.00 46.02 44.93 1xxh n GLY 71 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xxh s THR 72 N 0.00 3.32 0.15 2.61 2.01 -1.17 -5.00 115.64 117.56 1xxh s THR 72 Ca 0.00 0.99 -0.03 0.00 0.31 0.00 0.00 61.69 62.96 1xxh s THR 72 Cb 0.00 -3.64 -0.03 0.00 0.01 0.00 0.00 72.50 68.84 1xxh s THR 72 CO 0.00 0.10 0.12 -2.28 -0.69 0.00 0.00 174.62 171.88 1xxh s HIS 73 N 0.76 0.76 -2.14 4.92 2.46 -1.26 -4.69 115.29 116.09 1xxh s HIS 73 Ca 0.61 -1.12 0.28 0.00 0.47 0.00 0.00 55.06 55.30 1xxh s HIS 73 Cb -0.36 -0.37 1.04 0.00 -0.13 0.00 0.00 32.58 32.75 1xxh s HIS 73 CO 0.33 -0.59 1.74 -2.30 -2.47 0.00 0.00 174.74 171.45 1xxh n PRO 74 N -0.14 1.26 0.00 2.88 -0.02 -1.26 -4.33 135.00 133.39 1xxh n PRO 74 Ca -0.05 -0.68 0.00 0.00 -2.02 0.00 0.00 63.50 60.75 1xxh n PRO 74 Cb 0.64 -1.49 0.00 0.00 -0.02 0.00 0.00 33.50 32.63 1xxh n PRO 74 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1xxh n ASP 75 N -0.28 0.46 -4.19 2.55 8.00 -1.26 -4.62 116.55 117.21 1xxh n ASP 75 Ca 0.17 -1.21 -0.39 0.00 0.71 0.00 0.00 54.79 54.06 1xxh n ASP 75 Cb 0.33 0.00 -0.09 0.00 -0.02 0.00 0.00 41.12 41.33 1xxh n ASP 75 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1xxh s TYR 76 N -0.21 3.46 -0.18 1.24 6.14 -1.26 0.23 117.35 126.77 1xxh s TYR 76 Ca 0.00 -1.98 -0.07 0.00 0.64 0.00 0.00 57.07 55.66 1xxh s TYR 76 Cb 0.00 -3.35 -0.04 0.00 0.42 0.00 0.00 41.96 38.99 1xxh s TYR 76 CO 0.00 -0.97 0.05 0.71 0.64 0.00 0.00 175.55 175.98 1xxh s TYR 77 N 1.31 3.23 -0.44 4.97 2.02 -0.47 -4.80 117.35 123.17 1xxh s TYR 77 Ca 0.06 0.04 -0.06 0.00 -0.37 0.00 0.00 57.07 56.74 1xxh s TYR 77 Cb -0.25 -2.05 0.11 0.00 -0.40 0.00 0.00 41.96 39.37 1xxh s TYR 77 CO -0.01 0.15 0.28 0.99 -1.57 0.00 0.00 175.55 175.39 1xxh s THR 78 N 0.31 3.80 -1.29 -0.71 2.01 -1.26 -1.73 115.64 116.76 1xxh s THR 78 Ca 0.03 -1.89 -0.08 0.00 0.31 0.00 0.00 61.69 60.05 1xxh s THR 78 Cb -0.12 -3.54 0.15 0.00 0.01 0.00 0.00 72.50 69.00 1xxh s THR 78 CO 0.00 -0.73 2.04 0.18 -0.69 0.00 0.00 174.62 175.42 1xxh n LEU 79 N 4.77 7.11 -4.72 4.42 4.32 -0.51 -4.99 117.00 127.40 1xxh n LEU 79 Ca -0.05 -4.73 -0.30 0.00 -0.02 0.00 0.00 56.01 50.90 1xxh n LEU 79 Cb 0.41 -1.44 0.22 0.00 -1.62 0.00 0.00 43.42 40.99 1xxh n LEU 79 CO 0.38 1.61 0.72 0.00 -1.22 0.00 0.00 177.39 178.88 1xxh s ALA 80 N -0.14 1.22 0.20 -1.18 0.00 -1.26 -4.06 121.76 116.53 1xxh s ALA 80 Ca 0.44 -1.05 -0.29 0.00 0.00 0.00 0.00 51.96 51.06 1xxh s ALA 80 Cb 0.12 -2.84 -0.08 0.00 0.00 0.00 0.00 23.12 20.32 1xxh s ALA 80 CO -0.02 -3.16 0.92 -1.25 0.00 0.00 0.00 175.76 172.24 1xxh s PRO 81 N -5.59 4.77 -0.28 0.00 0.04 -1.26 -4.87 135.00 127.81 1xxh s PRO 81 Ca 0.72 1.42 -0.34 0.00 0.04 0.00 0.00 61.00 62.84 1xxh s PRO 81 Cb -0.07 -3.30 -0.15 0.00 0.04 0.00 0.00 34.50 31.01 1xxh s PRO 81 CO 0.55 0.45 1.11 0.39 0.04 0.00 0.00 177.00 179.54 1xxh n GLU 82 N 1.83 0.00 -1.54 4.56 1.02 -0.95 -4.61 120.64 120.95 1xxh n GLU 82 Ca -0.02 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 56.82 1xxh n GLU 82 Cb 0.48 -1.14 -0.06 0.00 -0.02 0.00 0.00 31.44 30.69 1xxh n GLU 82 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1xxh n LYS 83 N 2.52 0.74 0.00 3.49 3.00 -1.26 -3.15 118.16 123.50 1xxh n LYS 83 Ca 0.21 -0.20 0.00 0.00 -0.00 0.00 0.00 58.31 58.33 1xxh n LYS 83 Cb -0.02 -3.13 0.00 0.00 0.00 0.00 0.00 35.03 31.89 1xxh n LYS 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1xxh n GLY 84 N 6.23 1.74 0.08 3.14 0.00 -1.26 -5.10 105.19 110.02 1xxh n GLY 84 Ca 0.45 -0.39 -0.01 0.00 0.00 0.00 0.00 46.02 46.07 1xxh n GLY 84 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xxh n LYS 85 N 0.00 -2.00 -2.49 1.61 5.02 -1.19 -4.96 118.16 114.16 1xxh n LYS 85 Ca 0.00 -0.04 -0.16 0.00 -2.02 0.00 0.00 58.31 56.10 1xxh n LYS 85 Cb 0.00 -0.05 0.02 0.00 -0.02 0.00 0.00 35.03 34.99 1xxh n LYS 85 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1xxh n ASN 86 N -3.07 3.25 -3.78 4.39 3.02 -1.26 -4.80 115.26 113.01 1xxh n ASN 86 Ca 0.00 -3.09 -0.10 0.00 -0.03 0.00 0.00 54.58 51.37 1xxh n ASN 86 Cb 0.01 -0.45 -0.05 0.00 -0.61 0.00 0.00 39.78 38.68 1xxh n ASN 86 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1xxh s THR 87 N -4.31 0.06 -0.10 3.41 -4.23 -1.26 -4.99 115.64 104.22 1xxh s THR 87 Ca 0.39 -0.92 -0.03 0.00 -1.18 0.00 0.00 61.69 59.95 1xxh s THR 87 Cb 0.40 -1.53 -0.03 0.00 1.34 0.00 0.00 72.50 72.68 1xxh s THR 87 CO -0.04 -0.26 0.01 -0.22 -0.54 0.00 0.00 174.62 173.57 1xxh s LEU 88 N -2.88 3.59 0.28 4.79 0.20 0.14 -2.23 118.68 122.57 1xxh s LEU 88 Ca 0.09 0.12 -0.02 0.00 0.69 0.00 0.00 54.13 55.02 1xxh s LEU 88 Cb 0.01 -1.83 -0.04 0.00 -0.43 0.00 0.00 46.19 43.90 1xxh s LEU 88 CO -0.05 0.35 0.51 -0.83 -0.29 0.00 0.00 176.35 176.03 1xxh s GLY 89 N -0.68 1.69 0.42 7.98 0.00 -1.26 -2.96 107.32 112.51 1xxh s GLY 89 Ca 0.11 -0.73 0.09 0.00 0.00 0.00 0.00 44.72 44.18 1xxh s GLY 89 CO 0.02 -0.66 2.04 -2.08 0.00 0.00 0.00 173.10 172.43 1xxh h VAL 90 N 1.23 1.06 0.00 1.40 2.07 -1.90 -3.21 116.25 116.91 1xxh h VAL 90 Ca -0.48 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 66.86 1xxh h VAL 90 Cb 1.20 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 31.46 1xxh h VAL 90 CO 0.65 0.09 0.00 -0.90 0.02 0.00 0.00 177.57 177.44 1xxh n ASP 91 N -4.48 0.00 -0.15 0.57 5.75 -1.26 -2.15 116.55 114.83 1xxh n ASP 91 Ca 0.04 0.90 0.05 0.00 -0.01 0.00 0.00 54.79 55.77 1xxh n ASP 91 Cb 0.12 -0.41 0.10 0.00 -1.03 0.00 0.00 41.12 39.90 1xxh n ASP 91 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1xxh n ALA 92 N -1.73 0.17 0.18 2.12 0.00 -1.21 0.47 120.51 120.50 1xxh n ALA 92 Ca 0.00 0.46 -0.13 0.00 0.00 0.00 0.00 53.44 53.78 1xxh n ALA 92 Cb 0.00 -0.31 -0.08 0.00 0.00 0.00 0.00 19.45 19.06 1xxh n ALA 92 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1xxh h VAL 93 N 0.00 0.56 -0.62 0.00 2.07 -1.61 -2.92 116.25 113.72 1xxh h VAL 93 Ca 0.24 -0.61 0.18 0.00 0.82 0.00 0.00 66.70 67.33 1xxh h VAL 93 Cb 0.44 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 1xxh h VAL 93 CO -0.42 0.10 0.57 0.03 0.02 0.00 0.00 177.57 177.87 1xxh h ARG 94 N -0.87 0.00 0.00 1.57 3.08 0.54 0.72 114.38 119.43 1xxh h ARG 94 Ca -0.05 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.76 1xxh h ARG 94 Cb 0.53 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.55 1xxh h ARG 94 CO 0.08 0.00 -1.29 1.05 -1.07 0.00 0.00 179.97 178.74 1xxh h GLU 95 N 0.00 0.00 0.00 0.04 4.11 -1.43 -3.19 114.58 114.11 1xxh h GLU 95 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.72 1xxh h GLU 95 Cb 1.44 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.69 1xxh h GLU 95 CO -0.00 0.74 -0.28 0.28 0.07 0.00 0.00 179.01 179.81 1xxh h VAL 96 N 0.00 0.00 0.14 -1.06 2.07 -0.18 -2.73 116.25 114.49 1xxh h VAL 96 Ca -0.13 -0.71 -0.01 0.00 0.82 0.00 0.00 66.70 66.67 1xxh h VAL 96 Cb 1.85 1.54 0.00 0.00 -1.52 0.00 0.00 31.29 33.16 1xxh h VAL 96 CO 0.10 0.00 -0.07 0.74 0.02 0.00 0.00 177.57 178.36 1xxh h THR 97 N 0.00 0.00 -0.64 2.57 2.02 0.21 -3.23 112.91 113.84 1xxh h THR 97 Ca 0.00 -0.12 0.08 0.00 0.77 0.00 0.00 66.41 67.15 1xxh h THR 97 Cb 0.85 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.22 1xxh h THR 97 CO 0.00 0.00 0.43 -0.33 0.37 0.00 0.00 175.52 175.99 1xxh h GLU 98 N -0.31 0.53 0.00 6.66 4.39 -1.69 -0.85 114.58 123.30 1xxh h GLU 98 Ca -0.02 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.65 1xxh h GLU 98 Cb 0.15 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 1xxh h GLU 98 CO 0.03 0.35 0.07 1.17 -1.16 0.00 0.00 179.01 179.47 1xxh n LYS 99 N -4.48 0.00 -0.05 2.33 4.81 -1.03 0.34 118.16 120.09 1xxh n LYS 99 Ca 0.10 0.18 -0.05 0.00 -0.87 0.00 0.00 58.31 57.68 1xxh n LYS 99 Cb 0.31 -1.57 -0.08 0.00 0.02 0.00 0.00 35.03 33.71 1xxh n LYS 99 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1xxh n LEU 100 N -1.11 0.00 0.24 3.14 4.77 -0.33 -4.53 117.00 119.18 1xxh n LEU 100 Ca 0.00 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.08 1xxh n LEU 100 Cb 0.07 0.23 0.53 0.00 -2.33 0.00 0.00 43.42 41.92 1xxh n LEU 100 CO 0.00 0.23 0.94 0.78 -1.33 0.00 0.00 177.39 178.01 1xxh h ASN 101 N 0.00 0.00 -2.78 -1.43 -0.26 -0.14 -3.38 115.58 107.59 1xxh h ASN 101 Ca -0.25 0.00 -0.65 0.00 -0.56 0.00 0.00 56.30 54.84 1xxh h ASN 101 Cb 1.57 0.00 -0.06 0.00 -1.06 0.00 0.00 38.32 38.77 1xxh h ASN 101 CO 0.01 0.00 -0.44 -1.61 -1.06 0.00 0.00 177.43 174.33 1xxh s GLU 102 N -3.66 3.50 0.94 0.81 0.41 -1.24 -5.07 118.70 114.38 1xxh s GLU 102 Ca -0.02 -0.14 -0.13 0.00 -0.41 0.00 0.00 54.97 54.27 1xxh s GLU 102 Cb 0.06 -3.14 0.03 0.00 -1.78 0.00 0.00 34.13 29.30 1xxh s GLU 102 CO 0.18 0.71 0.42 -2.39 -0.49 0.00 0.00 175.26 173.68 1xxh n HIS 103 N 1.45 -1.41 -1.84 1.61 1.44 -1.26 -4.87 115.22 110.33 1xxh n HIS 103 Ca -0.15 0.24 -0.42 0.00 -2.01 0.00 0.00 57.72 55.38 1xxh n HIS 103 Cb 0.54 -1.79 -0.03 0.00 0.12 0.00 0.00 29.99 28.82 1xxh n HIS 103 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1xxh s ALA 104 N -2.36 3.69 0.52 1.59 0.00 -1.26 -4.88 121.76 119.06 1xxh s ALA 104 Ca 0.57 1.27 0.23 0.00 0.00 0.00 0.00 51.96 54.03 1xxh s ALA 104 Cb -0.22 -3.74 1.35 0.00 0.00 0.00 0.00 23.12 20.52 1xxh s ALA 104 CO 0.67 -1.21 2.03 0.00 0.00 0.00 0.00 175.76 177.25 1xxh h ARG 105 N 8.73 0.02 -0.14 0.00 3.08 -1.90 0.66 114.38 124.83 1xxh h ARG 105 Ca -0.44 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.61 1xxh h ARG 105 Cb 1.21 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.25 1xxh h ARG 105 CO 0.94 0.01 0.00 1.28 -1.07 0.00 0.00 179.97 181.13 1xxh n LEU 106 N -4.42 3.06 -2.91 3.04 4.32 -1.26 -5.02 117.00 113.80 1xxh n LEU 106 Ca 0.07 -1.17 -0.05 0.00 -0.02 0.00 0.00 56.01 54.84 1xxh n LEU 106 Cb 0.47 -0.08 0.01 0.00 -1.62 0.00 0.00 43.42 42.20 1xxh n LEU 106 CO 0.36 0.57 -0.37 0.61 -1.22 0.00 0.00 177.39 177.33 1xxh n GLY 107 N 1.32 -2.44 0.00 -0.72 0.00 0.23 -4.94 105.19 98.64 1xxh n GLY 107 Ca 0.15 0.58 0.00 0.00 0.00 0.00 0.00 46.02 46.75 1xxh n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xxh n GLY 108 N 0.56 -0.82 3.23 -0.02 0.00 -1.26 -5.03 105.19 101.85 1xxh n GLY 108 Ca 0.02 0.65 -0.29 0.00 0.00 0.00 0.00 46.02 46.40 1xxh n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xxh s ALA 109 N -1.00 1.93 0.22 4.61 0.00 -1.26 -4.83 121.76 121.43 1xxh s ALA 109 Ca 0.00 -0.94 0.03 0.00 0.00 0.00 0.00 51.96 51.05 1xxh s ALA 109 Cb 0.00 -0.58 -0.03 0.00 0.00 0.00 0.00 23.12 22.51 1xxh s ALA 109 CO 0.00 0.40 0.36 0.15 0.00 0.00 0.00 175.76 176.67 1xxh s LYS 110 N -0.22 3.46 -0.07 0.00 3.01 -1.21 -4.87 119.74 119.85 1xxh s LYS 110 Ca -0.00 -0.61 -0.05 0.00 -1.01 0.00 0.00 55.97 54.29 1xxh s LYS 110 Cb -0.12 -2.88 0.02 0.00 -1.01 0.00 0.00 37.83 33.84 1xxh s LYS 110 CO 0.02 0.42 0.17 0.14 0.51 0.00 0.00 175.35 176.61 1xxh s VAL 111 N -1.93 -0.01 0.05 3.17 -7.23 0.14 -0.57 120.40 114.01 1xxh s VAL 111 Ca 0.35 0.04 0.09 0.00 -1.81 0.00 0.00 61.98 60.65 1xxh s VAL 111 Cb -0.10 -0.25 -0.03 0.00 0.56 0.00 0.00 36.38 36.56 1xxh s VAL 111 CO 0.30 0.02 -0.25 -0.69 -0.31 0.00 0.00 175.10 174.17 1xxh s VAL 112 N 0.34 1.98 -0.03 1.32 1.01 -0.09 -1.36 120.40 123.57 1xxh s VAL 112 Ca -0.02 -1.33 0.01 0.00 0.00 0.00 0.00 61.98 60.63 1xxh s VAL 112 Cb -0.03 -1.71 0.03 0.00 0.00 0.00 0.00 36.38 34.67 1xxh s VAL 112 CO -0.01 0.31 -0.01 0.86 0.00 0.00 0.00 175.10 176.25 1xxh s TRP 113 N -0.80 0.37 -0.14 5.22 -0.00 -0.71 -2.13 118.94 120.76 1xxh s TRP 113 Ca 0.10 -0.03 -0.03 0.00 -0.00 0.00 0.00 56.10 56.15 1xxh s TRP 113 Cb -0.10 -0.44 -0.03 0.00 -0.00 0.00 0.00 33.47 32.91 1xxh s TRP 113 CO 0.02 -0.14 -0.05 0.08 -0.00 0.00 0.00 176.95 176.86 1xxh s VAL 114 N 0.99 3.78 0.07 5.86 1.01 -0.90 -1.42 120.40 129.80 1xxh s VAL 114 Ca -0.10 -0.41 -0.30 0.00 0.00 0.00 0.00 61.98 61.17 1xxh s VAL 114 Cb -0.14 -2.63 -0.14 0.00 0.00 0.00 0.00 36.38 33.47 1xxh s VAL 114 CO -0.01 0.52 1.47 0.74 0.00 0.00 0.00 175.10 177.81 1xxh h THR 115 N 5.01 0.00 -0.53 3.92 2.02 -1.89 -3.34 112.91 118.10 1xxh h THR 115 Ca -0.34 0.00 -0.30 0.00 0.77 0.00 0.00 66.41 66.54 1xxh h THR 115 Cb 1.19 0.00 -0.20 0.00 -1.74 0.00 0.00 68.15 67.40 1xxh h THR 115 CO 0.60 0.00 -0.64 -0.67 0.37 0.00 0.00 175.52 175.19 1xxh n ASP 116 N -5.03 -2.20 -0.09 4.18 2.03 -1.25 -4.63 116.55 109.56 1xxh n ASP 116 Ca -0.10 -3.14 0.07 0.00 0.52 0.00 0.00 54.79 52.14 1xxh n ASP 116 Cb 0.39 1.24 0.11 0.00 -0.72 0.00 0.00 41.12 42.14 1xxh n ASP 116 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1xxh n ALA 117 N 1.67 0.25 0.79 -1.67 0.00 -0.91 0.63 120.51 121.26 1xxh n ALA 117 Ca 0.12 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.65 1xxh n ALA 117 Cb 0.60 -0.15 0.00 0.00 0.00 0.00 0.00 19.45 19.90 1xxh n ALA 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xxh n ALA 118 N -1.93 2.18 -1.71 0.00 0.00 -1.26 -2.96 120.51 114.83 1xxh n ALA 118 Ca 0.06 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.55 1xxh n ALA 118 Cb 0.29 -1.00 0.10 0.00 0.00 0.00 0.00 19.45 18.84 1xxh n ALA 118 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1xxh n LEU 119 N 0.12 1.59 -4.59 0.00 4.77 0.20 -5.07 117.00 114.03 1xxh n LEU 119 Ca 0.00 -2.56 -0.24 0.00 -0.03 0.00 0.00 56.01 53.18 1xxh n LEU 119 Cb 0.20 -0.26 -0.08 0.00 -2.33 0.00 0.00 43.42 40.95 1xxh n LEU 119 CO 0.00 0.73 -0.38 -1.48 -1.33 0.00 0.00 177.39 174.93 1xxh s LEU 120 N -1.68 3.01 0.37 2.23 2.34 -1.15 0.29 118.68 124.08 1xxh s LEU 120 Ca 0.26 -0.71 -0.25 0.00 0.06 0.00 0.00 54.13 53.49 1xxh s LEU 120 Cb 0.25 -1.57 -0.09 0.00 -0.56 0.00 0.00 46.19 44.22 1xxh s LEU 120 CO -0.04 0.03 1.01 -0.89 -1.06 0.00 0.00 176.35 175.40 1xxh s THR 121 N -2.23 3.91 0.52 5.48 2.01 -1.15 -4.79 115.64 119.39 1xxh s THR 121 Ca 0.30 1.51 0.41 0.00 0.31 0.00 0.00 61.69 64.22 1xxh s THR 121 Cb -0.07 -3.81 0.62 0.00 0.01 0.00 0.00 72.50 69.26 1xxh s THR 121 CO 0.18 0.06 1.64 0.44 -0.69 0.00 0.00 174.62 176.25 1xxh h ASP 122 N 2.78 0.08 0.13 3.53 3.32 -1.99 1.39 116.42 125.65 1xxh h ASP 122 Ca -0.48 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 56.61 1xxh h ASP 122 Cb 1.20 0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.79 1xxh h ASP 122 CO 0.63 -0.05 -0.06 0.00 -1.72 0.00 0.00 179.24 178.04 1xxh h ALA 123 N 1.29 -0.17 -0.66 3.45 0.00 -1.97 -3.00 119.26 118.20 1xxh h ALA 123 Ca 0.81 -0.24 0.19 0.00 0.00 0.00 0.00 54.91 55.68 1xxh h ALA 123 Cb 3.04 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 20.87 1xxh h ALA 123 CO -0.14 -0.24 0.56 0.00 0.00 0.00 0.00 179.25 179.44 1xxh h ALA 124 N -0.32 2.50 -2.44 0.00 0.00 0.13 -2.01 119.26 117.12 1xxh h ALA 124 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1xxh h ALA 124 Cb 0.53 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1xxh h ALA 124 CO 0.03 -0.90 0.00 0.00 0.00 0.00 0.00 179.25 178.38 1xxh n ALA 125 N -2.52 -0.04 -0.26 0.00 0.00 0.10 -3.44 120.51 114.36 1xxh n ALA 125 Ca 0.13 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.68 1xxh n ALA 125 Cb 0.81 0.00 0.22 0.00 0.00 0.00 0.00 19.45 20.48 1xxh n ALA 125 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1xxh n ASN 126 N -0.78 -0.10 -0.36 0.00 4.13 -1.12 0.46 115.26 117.49 1xxh n ASN 126 Ca 0.00 1.30 0.27 0.00 1.68 0.00 0.00 54.58 57.83 1xxh n ASN 126 Cb 0.00 -0.47 0.56 0.00 -1.54 0.00 0.00 39.78 38.33 1xxh n ASN 126 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1xxh h ALA 127 N 1.52 2.39 0.17 5.41 0.00 -1.49 -2.22 119.26 125.05 1xxh h ALA 127 Ca 0.46 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.44 1xxh h ALA 127 Cb 0.93 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1xxh h ALA 127 CO -0.72 -0.88 -0.08 1.25 0.00 0.00 0.00 179.25 178.82 1xxh h LEU 128 N 0.28 -0.19 -0.62 0.00 5.85 0.98 -3.36 115.31 118.25 1xxh h LEU 128 Ca 0.67 0.01 0.12 0.00 0.84 0.00 0.00 57.88 59.52 1xxh h LEU 128 Cb 1.87 0.05 -0.11 0.00 0.37 0.00 0.00 40.66 42.83 1xxh h LEU 128 CO -0.35 -0.05 -0.17 -0.11 -0.34 0.00 0.00 178.44 177.42 1xxh n LEU 129 N -3.09 -0.26 0.27 2.25 7.94 -0.85 0.23 117.00 123.49 1xxh n LEU 129 Ca -0.03 1.07 0.17 0.00 -1.11 0.00 0.00 56.01 56.11 1xxh n LEU 129 Cb 0.09 -0.31 0.80 0.00 0.53 0.00 0.00 43.42 44.53 1xxh n LEU 129 CO 0.07 -1.01 1.14 0.11 -1.11 0.00 0.00 177.39 176.58 1xxh h LYS 130 N 0.00 0.00 0.24 1.96 1.79 -1.68 1.15 116.57 120.04 1xxh h LYS 130 Ca 0.28 0.00 -0.34 0.00 -2.18 0.00 0.00 60.65 58.41 1xxh h LYS 130 Cb 0.44 0.00 0.03 0.00 -1.58 0.00 0.00 32.23 31.12 1xxh h LYS 130 CO -0.64 0.00 -1.54 1.15 -1.08 0.00 0.00 179.45 177.34 1xxh h THR 131 N 0.00 1.21 0.00 -0.16 2.02 0.26 -2.96 112.91 113.28 1xxh h THR 131 Ca 0.05 -2.67 -0.02 0.00 0.77 0.00 0.00 66.41 64.54 1xxh h THR 131 Cb 0.77 2.99 -0.00 0.00 -1.74 0.00 0.00 68.15 70.17 1xxh h THR 131 CO -0.00 0.82 -0.10 -0.07 0.37 0.00 0.00 175.52 176.54 1xxh h LEU 132 N 0.14 0.00 0.04 2.58 3.38 0.12 -2.75 115.31 118.82 1xxh h LEU 132 Ca -0.28 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.44 1xxh h LEU 132 Cb 2.16 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.93 1xxh h LEU 132 CO 0.26 0.10 -1.00 -0.33 0.09 0.00 0.00 178.44 177.55 1xxh h GLU 133 N 0.00 0.61 -3.36 1.13 5.08 -0.27 -3.35 114.58 114.42 1xxh h GLU 133 Ca -0.00 -0.71 -0.72 0.00 -1.00 0.00 0.00 59.36 56.93 1xxh h GLU 133 Cb 0.86 0.21 -0.34 0.00 0.50 0.00 0.00 28.75 29.98 1xxh h GLU 133 CO 0.01 1.30 -0.01 -1.21 -1.00 0.00 0.00 179.01 178.10 1xxh s GLU 134 N -3.18 3.42 -0.06 2.33 0.41 -1.06 -5.07 118.70 115.49 1xxh s GLU 134 Ca -0.11 -3.26 -0.30 0.00 -0.41 0.00 0.00 54.97 50.90 1xxh s GLU 134 Cb 0.06 -4.05 -0.05 0.00 -1.78 0.00 0.00 34.13 28.31 1xxh s GLU 134 CO 0.90 -1.26 1.53 -1.25 -0.49 0.00 0.00 175.26 174.69 1xxh s PRO 135 N -1.31 4.21 -0.96 0.39 0.04 -1.07 -4.69 135.00 131.62 1xxh s PRO 135 Ca 0.28 2.05 -0.24 0.00 0.04 0.00 0.00 61.00 63.12 1xxh s PRO 135 Cb -0.08 -3.84 -0.08 0.00 0.04 0.00 0.00 34.50 30.54 1xxh s PRO 135 CO -0.12 -0.76 2.02 -2.14 0.04 0.00 0.00 177.00 176.04 1xxh s PRO 136 N 3.55 2.33 0.00 0.56 0.02 -1.26 -4.89 135.00 135.31 1xxh s PRO 136 Ca 0.68 -0.38 0.00 0.00 0.02 0.00 0.00 61.00 61.32 1xxh s PRO 136 Cb -0.31 -5.06 0.00 0.00 0.02 0.00 0.00 34.50 29.15 1xxh s PRO 136 CO 0.26 -3.78 0.00 0.00 -0.33 0.00 0.00 177.00 173.15 1xxh n ALA 137 N 15.06 -0.13 -2.96 -1.55 0.00 -1.26 -3.28 120.51 126.39 1xxh n ALA 137 Ca 0.42 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.78 1xxh n ALA 137 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 1xxh n ALA 137 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1xxh n GLU 138 N 0.00 -0.53 -4.12 0.00 1.02 -1.26 -4.86 120.64 110.89 1xxh n GLU 138 Ca 0.00 0.24 -0.09 0.00 -0.02 0.00 0.00 57.16 57.29 1xxh n GLU 138 Cb 0.00 -0.74 -0.10 0.00 -0.02 0.00 0.00 31.44 30.58 1xxh n GLU 138 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1xxh s THR 139 N -2.37 0.41 -0.03 2.62 2.01 -1.20 -3.28 115.64 113.79 1xxh s THR 139 Ca 0.00 -1.86 -0.00 0.00 0.31 0.00 0.00 61.69 60.14 1xxh s THR 139 Cb -0.00 -1.60 0.03 0.00 0.01 0.00 0.00 72.50 70.94 1xxh s THR 139 CO 0.31 -0.94 0.02 0.26 -0.69 0.00 0.00 174.62 173.58 1xxh s TRP 140 N -3.80 0.16 0.15 4.92 0.52 0.27 -4.76 118.94 116.40 1xxh s TRP 140 Ca 0.09 0.09 0.05 0.00 0.02 0.00 0.00 56.10 56.36 1xxh s TRP 140 Cb 0.07 -0.36 -0.04 0.00 -1.15 0.00 0.00 33.47 31.99 1xxh s TRP 140 CO -0.08 -0.13 0.10 -0.06 0.02 0.00 0.00 176.95 176.80 1xxh s PHE 141 N 1.25 3.09 -0.20 -1.98 0.40 0.18 -0.91 117.98 119.81 1xxh s PHE 141 Ca -0.07 -0.03 -0.04 0.00 -0.60 0.00 0.00 56.93 56.19 1xxh s PHE 141 Cb -0.13 -1.50 0.10 0.00 0.51 0.00 0.00 43.02 42.00 1xxh s PHE 141 CO -0.03 0.52 0.28 -0.06 0.70 0.00 0.00 175.22 176.63 1xxh s PHE 142 N -1.69 -0.48 0.06 0.36 0.08 -0.90 -2.66 117.98 112.74 1xxh s PHE 142 Ca 0.30 0.61 0.05 0.00 0.12 0.00 0.00 56.93 58.01 1xxh s PHE 142 Cb -0.10 -0.16 -0.04 0.00 -0.57 0.00 0.00 43.02 42.15 1xxh s PHE 142 CO 0.22 -0.58 -0.08 -0.51 -0.10 0.00 0.00 175.22 174.17 1xxh s LEU 143 N 2.42 3.11 0.00 -0.37 2.01 0.16 -2.12 118.68 123.89 1xxh s LEU 143 Ca 0.07 -0.27 0.00 0.00 0.01 0.00 0.00 54.13 53.95 1xxh s LEU 143 Cb -0.15 -1.85 -0.00 0.00 0.01 0.00 0.00 46.19 44.20 1xxh s LEU 143 CO -0.12 0.23 -0.01 0.00 1.01 0.00 0.00 176.35 177.45 1xxh s ALA 144 N -1.12 0.11 0.11 4.21 0.00 -1.25 -0.32 121.76 123.49 1xxh s ALA 144 Ca 0.20 -0.08 -0.06 0.00 0.00 0.00 0.00 51.96 52.01 1xxh s ALA 144 Cb -0.11 -0.02 -0.02 0.00 0.00 0.00 0.00 23.12 22.98 1xxh s ALA 144 CO 0.11 0.02 0.16 0.99 0.00 0.00 0.00 175.76 177.04 1xxh s THR 145 N -0.11 0.13 -0.07 0.00 2.01 -1.09 -2.14 115.64 114.36 1xxh s THR 145 Ca -0.00 -1.44 -0.15 0.00 0.31 0.00 0.00 61.69 60.40 1xxh s THR 145 Cb -0.01 -1.61 -0.29 0.00 0.01 0.00 0.00 72.50 70.60 1xxh s THR 145 CO -0.00 -0.58 0.66 -0.09 -0.69 0.00 0.00 174.62 173.91 1xxh h ARG 146 N 2.77 0.31 -4.51 4.92 2.43 -1.87 -2.85 114.38 115.58 1xxh h ARG 146 Ca -0.34 -0.53 -0.64 0.00 -0.81 0.00 0.00 59.98 57.66 1xxh h ARG 146 Cb 1.20 0.20 -0.39 0.00 -0.42 0.00 0.00 29.97 30.55 1xxh h ARG 146 CO 0.56 1.26 -0.75 -2.00 -1.51 0.00 0.00 179.97 177.53 1xxh s GLU 147 N -2.51 1.50 0.43 0.20 2.56 -1.26 -4.29 118.70 115.33 1xxh s GLU 147 Ca -0.17 -1.57 0.30 0.00 0.00 0.00 0.00 54.97 53.53 1xxh s GLU 147 Cb 0.04 -2.90 1.43 0.00 2.00 0.00 0.00 34.13 34.70 1xxh s GLU 147 CO 0.81 -0.85 1.91 -1.00 -0.56 0.00 0.00 175.26 175.56 1xxh h PRO 148 N 7.75 0.00 -0.01 4.30 0.13 -1.97 -3.08 132.00 139.12 1xxh h PRO 148 Ca -0.09 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.04 1xxh h PRO 148 Cb 1.03 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.16 1xxh h PRO 148 CO 0.49 0.00 0.00 1.49 -0.23 0.00 0.00 178.00 179.75 1xxh h GLU 149 N 0.00 0.01 -0.24 0.86 4.81 -2.00 -2.72 114.58 115.30 1xxh h GLU 149 Ca 0.00 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1xxh h GLU 149 Cb 0.24 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.62 1xxh h GLU 149 CO 0.00 0.25 0.00 0.54 -0.73 0.00 0.00 179.01 179.07 1xxh n ARG 150 N -4.97 0.29 -4.77 1.92 1.74 -1.16 -4.61 116.66 105.10 1xxh n ARG 150 Ca -0.08 0.00 -0.33 0.00 -0.77 0.00 0.00 57.85 56.68 1xxh n ARG 150 Cb 0.14 -1.12 -0.15 0.00 -1.02 0.00 0.00 32.46 30.31 1xxh n ARG 150 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1xxh s LEU 151 N -0.16 2.62 -0.49 0.55 2.96 -1.03 -4.89 118.68 118.24 1xxh s LEU 151 Ca 0.00 -0.37 -0.45 0.00 -0.22 0.00 0.00 54.13 53.09 1xxh s LEU 151 Cb 0.00 -1.59 -0.19 0.00 0.50 0.00 0.00 46.19 44.91 1xxh s LEU 151 CO 0.00 0.15 1.84 0.18 -1.32 0.00 0.00 176.35 177.20 1xxh n LEU 152 N 3.62 0.98 -0.28 -0.68 4.77 -1.26 -4.68 117.00 119.47 1xxh n LEU 152 Ca -0.18 0.93 -0.10 0.00 -0.03 0.00 0.00 56.01 56.63 1xxh n LEU 152 Cb 0.53 -0.88 -0.06 0.00 -2.33 0.00 0.00 43.42 40.67 1xxh n LEU 152 CO 0.30 -0.80 0.53 0.00 -1.33 0.00 0.00 177.39 176.09 1xxh h ALA 153 N 6.86 -0.46 -1.00 -1.18 0.00 -1.94 0.78 119.26 122.32 1xxh h ALA 153 Ca -0.27 0.10 0.23 0.00 0.00 0.00 0.00 54.91 54.97 1xxh h ALA 153 Cb 1.38 1.14 -0.10 0.00 0.00 0.00 0.00 17.79 20.21 1xxh h ALA 153 CO 1.02 -0.91 0.63 0.00 0.00 0.00 0.00 179.25 179.99 1xxh h THR 154 N -0.17 0.61 0.00 0.00 1.03 -1.99 -2.00 112.91 110.38 1xxh h THR 154 Ca 0.17 -0.19 0.00 0.00 -0.01 0.00 0.00 66.41 66.38 1xxh h THR 154 Cb 0.53 0.02 0.00 0.00 -1.07 0.00 0.00 68.15 67.63 1xxh h THR 154 CO -0.78 0.10 0.00 -0.11 -0.01 0.00 0.00 175.52 174.72 1xxh n LEU 155 N -4.69 0.05 0.00 0.00 0.00 0.26 -3.14 117.00 109.48 1xxh n LEU 155 Ca 0.24 0.79 0.00 0.00 0.00 0.00 0.00 56.01 57.04 1xxh n LEU 155 Cb 0.73 -0.48 0.00 0.00 0.00 0.00 0.00 43.42 43.68 1xxh n LEU 155 CO 0.24 -0.48 0.25 -1.14 0.00 0.00 0.00 177.39 176.26 1xxh n ARG 156 N -1.93 0.00 -0.02 1.96 0.63 -0.30 0.16 116.66 117.16 1xxh n ARG 156 Ca 0.00 0.08 0.13 0.00 -0.92 0.00 0.00 57.85 57.14 1xxh n ARG 156 Cb 0.00 -1.59 0.29 0.00 0.45 0.00 0.00 32.46 31.61 1xxh n ARG 156 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 1xxh n SER 157 N -0.91 2.36 -0.57 6.15 3.41 -0.77 -3.79 113.62 119.51 1xxh n SER 157 Ca 0.00 -1.79 0.06 0.00 -0.26 0.00 0.00 58.87 56.88 1xxh n SER 157 Cb 0.09 -0.03 0.11 0.00 -0.26 0.00 0.00 64.21 64.12 1xxh n SER 157 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1xxh n ARG 158 N 0.83 1.82 -4.23 4.33 3.00 0.41 -5.02 116.66 117.81 1xxh n ARG 158 Ca 0.17 -1.66 -0.13 0.00 -0.00 0.00 0.00 57.85 56.22 1xxh n ARG 158 Cb 0.49 -1.25 -0.10 0.00 0.00 0.00 0.00 32.46 31.60 1xxh n ARG 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1xxh s ARG 160 N -4.11 4.00 -0.11 0.00 3.52 0.10 -4.91 118.95 117.45 1xxh s ARG 160 Ca 0.37 0.04 -0.30 0.00 -0.13 0.00 0.00 55.73 55.71 1xxh s ARG 160 Cb 0.07 -3.66 -0.02 0.00 -1.56 0.00 0.00 34.95 29.78 1xxh s ARG 160 CO 0.11 -0.30 1.09 -0.51 -0.81 0.00 0.00 175.30 174.89 1xxh s LEU 161 N 2.09 4.24 -0.28 -0.88 1.02 -1.26 -1.40 118.68 122.21 1xxh s LEU 161 Ca 0.15 1.62 0.03 0.00 0.02 0.00 0.00 54.13 55.95 1xxh s LEU 161 Cb -0.16 -3.55 0.07 0.00 0.02 0.00 0.00 46.19 42.57 1xxh s LEU 161 CO 0.10 -0.54 -0.06 -2.28 0.02 0.00 0.00 176.35 173.58 1xxh s HIS 162 N 2.33 3.34 -0.80 0.29 2.46 0.40 -4.94 115.29 118.37 1xxh s HIS 162 Ca 0.51 -2.47 -0.25 0.00 0.47 0.00 0.00 55.06 53.31 1xxh s HIS 162 Cb -0.20 -2.17 0.04 0.00 -0.13 0.00 0.00 32.58 30.12 1xxh s HIS 162 CO 0.18 -0.89 1.27 -0.47 -2.47 0.00 0.00 174.74 172.35 1xxh s TYR 163 N 1.07 2.43 -1.01 3.88 5.04 -1.26 -1.15 117.35 126.34 1xxh s TYR 163 Ca -0.03 -0.35 -0.20 0.00 -2.44 0.00 0.00 57.07 54.04 1xxh s TYR 163 Cb -0.20 -4.58 -0.09 0.00 0.35 0.00 0.00 41.96 37.44 1xxh s TYR 163 CO -0.06 -1.96 1.99 -0.11 -1.34 0.00 0.00 175.55 174.07 1xxh n LEU 164 N 8.91 4.73 -4.76 6.97 7.94 -0.70 -4.91 117.00 135.18 1xxh n LEU 164 Ca 0.10 -3.29 -0.38 0.00 -1.11 0.00 0.00 56.01 51.33 1xxh n LEU 164 Cb 0.49 -1.35 0.03 0.00 0.53 0.00 0.00 43.42 43.12 1xxh n LEU 164 CO 0.68 -0.12 0.95 0.00 -1.11 0.00 0.00 177.39 177.79 1xxh s ALA 165 N 5.13 2.89 0.82 1.96 0.00 -1.26 -4.63 121.76 126.66 1xxh s ALA 165 Ca 0.56 1.23 -0.11 0.00 0.00 0.00 0.00 51.96 53.64 1xxh s ALA 165 Cb 0.12 -3.52 0.08 0.00 0.00 0.00 0.00 23.12 19.81 1xxh s ALA 165 CO 0.07 -1.16 1.10 -2.14 0.00 0.00 0.00 175.76 173.62 1xxh s PRO 166 N -2.81 1.88 0.64 0.00 0.02 -1.26 -5.05 135.00 128.43 1xxh s PRO 166 Ca 0.68 0.68 -0.11 0.00 0.02 0.00 0.00 61.00 62.27 1xxh s PRO 166 Cb -0.37 -1.89 -0.03 0.00 0.02 0.00 0.00 34.50 32.23 1xxh s PRO 166 CO 0.45 -1.77 1.04 -1.25 -0.33 0.00 0.00 177.00 175.14 1xxh s PRO 167 N -5.11 3.39 0.86 5.54 0.04 -1.26 -5.03 135.00 133.44 1xxh s PRO 167 Ca 0.61 0.81 -0.15 0.00 0.04 0.00 0.00 61.00 62.31 1xxh s PRO 167 Cb -0.15 -2.05 -0.06 0.00 0.04 0.00 0.00 34.50 32.28 1xxh s PRO 167 CO 0.55 -0.73 0.02 -2.30 0.04 0.00 0.00 177.00 174.58 1xxh n PRO 168 N -2.87 -0.02 0.21 0.56 -0.02 -1.26 -4.68 135.00 126.93 1xxh n PRO 168 Ca 0.06 0.02 -0.15 0.00 -2.02 0.00 0.00 63.50 61.42 1xxh n PRO 168 Cb 0.54 -1.51 -0.08 0.00 -0.02 0.00 0.00 33.50 32.43 1xxh n PRO 168 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1xxh h GLU 169 N -0.92 -0.51 -0.69 -0.52 5.08 -1.98 -2.13 114.58 112.92 1xxh h GLU 169 Ca -0.44 0.03 0.15 0.00 -1.00 0.00 0.00 59.36 58.10 1xxh h GLU 169 Cb 1.32 0.12 -0.11 0.00 0.50 0.00 0.00 28.75 30.58 1xxh h GLU 169 CO 0.34 -0.24 0.09 -0.56 -1.00 0.00 0.00 179.01 177.63 1xxh h GLN 170 N -0.71 0.18 0.37 2.33 -0.00 -1.99 0.63 115.11 115.92 1xxh h GLN 170 Ca -0.05 -0.01 -0.00 0.00 -0.00 0.00 0.00 58.65 58.58 1xxh h GLN 170 Cb 0.50 -0.04 -0.02 0.00 -0.00 0.00 0.00 27.48 27.92 1xxh h GLN 170 CO 0.09 0.12 -0.37 -0.92 -0.00 0.00 0.00 178.83 177.75 1xxh h TYR 171 N 0.19 -0.99 -0.53 0.06 -0.00 -1.88 -0.55 116.97 113.27 1xxh h TYR 171 Ca 0.37 0.01 0.08 0.00 -0.00 0.00 0.00 58.73 59.19 1xxh h TYR 171 Cb 0.63 0.39 -0.07 0.00 -0.00 0.00 0.00 36.73 37.68 1xxh h TYR 171 CO -0.32 -0.51 0.15 0.00 -0.00 0.00 0.00 178.16 177.48 1xxh h ALA 172 N -0.31 0.63 0.32 1.82 0.00 -0.62 0.15 119.26 121.26 1xxh h ALA 172 Ca -0.03 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1xxh h ALA 172 Cb 0.68 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 1xxh h ALA 172 CO -0.06 -0.26 -0.33 0.28 0.00 0.00 0.00 179.25 178.88 1xxh h VAL 173 N 0.31 0.31 -0.08 0.00 2.07 -0.61 -0.68 116.25 117.56 1xxh h VAL 173 Ca 0.26 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.81 1xxh h VAL 173 Cb 0.33 0.31 -0.06 0.00 -1.52 0.00 0.00 31.29 30.35 1xxh h VAL 173 CO -0.30 0.00 -0.53 0.74 0.02 0.00 0.00 177.57 177.50 1xxh h THR 174 N -0.68 0.00 -0.73 2.57 2.02 -0.39 0.95 112.91 116.64 1xxh h THR 174 Ca -0.02 0.00 0.21 0.00 0.77 0.00 0.00 66.41 67.38 1xxh h THR 174 Cb 0.63 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.01 1xxh h THR 174 CO -0.07 0.00 0.85 -0.25 0.37 0.00 0.00 175.52 176.42 1xxh h TRP 175 N -0.60 0.00 0.00 3.16 2.91 -0.39 0.69 115.95 121.72 1xxh h TRP 175 Ca 0.02 0.00 -0.19 0.00 1.13 0.00 0.00 58.89 59.85 1xxh h TRP 175 Cb 0.68 0.00 -0.04 0.00 -0.51 0.00 0.00 29.16 29.30 1xxh h TRP 175 CO -0.56 0.00 -1.92 1.28 -1.03 0.00 0.00 178.44 176.22 1xxh n LEU 176 N -3.44 0.33 0.05 0.65 4.77 0.25 -3.62 117.00 115.98 1xxh n LEU 176 Ca 0.16 0.14 0.06 0.00 -0.03 0.00 0.00 56.01 56.34 1xxh n LEU 176 Cb 1.10 0.21 0.28 0.00 -2.33 0.00 0.00 43.42 42.67 1xxh n LEU 176 CO 0.25 0.23 0.69 -1.54 -1.33 0.00 0.00 177.39 175.69 1xxh n SER 177 N -2.67 0.21 -0.10 -1.43 3.41 0.26 -2.08 113.62 111.22 1xxh n SER 177 Ca -0.16 0.57 -0.24 0.00 -0.26 0.00 0.00 58.87 58.78 1xxh n SER 177 Cb 0.88 -0.61 -0.11 0.00 -0.26 0.00 0.00 64.21 64.11 1xxh n SER 177 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1xxh n ARG 178 N -1.76 0.61 0.21 4.33 1.74 -1.01 -4.38 116.66 116.40 1xxh n ARG 178 Ca 0.01 0.38 0.15 0.00 -0.77 0.00 0.00 57.85 57.62 1xxh n ARG 178 Cb 0.10 -1.63 0.67 0.00 -1.02 0.00 0.00 32.46 30.58 1xxh n ARG 178 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1xxh h GLU 179 N -0.75 0.00 -1.44 5.56 4.39 -1.49 -3.43 114.58 117.42 1xxh h GLU 179 Ca -0.51 0.00 0.13 0.00 0.34 0.00 0.00 59.36 59.32 1xxh h GLU 179 Cb 1.57 0.00 -0.28 0.00 -0.10 0.00 0.00 28.75 29.94 1xxh h GLU 179 CO -0.23 0.00 0.48 0.08 -1.16 0.00 0.00 179.01 178.18 1xxh s VAL 180 N -3.58 0.00 0.24 3.13 1.01 -0.88 -5.11 120.40 115.21 1xxh s VAL 180 Ca 0.01 0.00 -0.14 0.00 0.00 0.00 0.00 61.98 61.84 1xxh s VAL 180 Cb 0.09 -1.00 -0.08 0.00 0.00 0.00 0.00 36.38 35.39 1xxh s VAL 180 CO 0.39 0.00 0.65 0.42 0.00 0.00 0.00 175.10 176.56 1xxh s THR 181 N 1.08 4.75 -0.05 3.92 -4.23 -1.26 -4.36 115.64 115.49 1xxh s THR 181 Ca -0.06 0.88 -0.30 0.00 -1.18 0.00 0.00 61.69 61.02 1xxh s THR 181 Cb -0.04 -3.69 -0.04 0.00 1.34 0.00 0.00 72.50 70.08 1xxh s THR 181 CO -0.13 0.01 1.24 -0.94 -0.54 0.00 0.00 174.62 174.26 1xxh s SER 183 N -2.06 7.01 0.66 3.99 1.04 -1.26 -5.16 113.70 117.92 1xxh s SER 183 Ca 0.47 1.86 0.19 0.00 0.48 0.00 0.00 55.95 58.95 1xxh s SER 183 Cb -0.13 -2.56 1.02 0.00 0.10 0.00 0.00 66.02 64.46 1xxh s SER 183 CO 0.19 -0.62 1.57 1.56 0.98 0.00 0.00 173.24 176.93 1xxh h GLN 184 N 7.56 0.00 0.00 4.02 4.20 -2.00 0.92 115.11 129.81 1xxh h GLN 184 Ca -0.34 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.37 1xxh h GLN 184 Cb 1.16 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.94 1xxh h GLN 184 CO 0.89 0.00 -0.36 -0.44 -0.67 0.00 0.00 178.83 178.24 1xxh h ASP 185 N 0.00 0.00 0.59 1.46 3.32 -1.96 -0.86 116.42 118.97 1xxh h ASP 185 Ca 0.00 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.03 1xxh h ASP 185 Cb 1.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.70 1xxh h ASP 185 CO 0.00 0.01 -0.51 0.00 -1.72 0.00 0.00 179.24 177.01 1xxh n ALA 186 N -2.08 3.37 -0.03 3.45 0.00 0.31 -1.75 120.51 123.80 1xxh n ALA 186 Ca 0.03 -0.32 -0.11 0.00 0.00 0.00 0.00 53.44 53.04 1xxh n ALA 186 Cb 0.52 -1.14 -0.14 0.00 0.00 0.00 0.00 19.45 18.69 1xxh n ALA 186 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1xxh n LEU 187 N -1.62 1.10 0.16 0.00 4.77 -0.85 -2.92 117.00 117.64 1xxh n LEU 187 Ca 0.05 0.33 -0.08 0.00 -0.03 0.00 0.00 56.01 56.28 1xxh n LEU 187 Cb 0.36 -0.02 -0.04 0.00 -2.33 0.00 0.00 43.42 41.39 1xxh n LEU 187 CO 0.35 0.49 0.21 0.25 -1.33 0.00 0.00 177.39 177.36 1xxh h LEU 188 N 0.01 -0.40 -0.94 2.23 5.85 -1.08 -2.85 115.31 118.14 1xxh h LEU 188 Ca -0.34 -0.01 0.23 0.00 0.84 0.00 0.00 57.88 58.60 1xxh h LEU 188 Cb 2.04 0.10 -0.13 0.00 0.37 0.00 0.00 40.66 43.05 1xxh h LEU 188 CO 0.07 0.04 0.46 0.00 -0.34 0.00 0.00 178.44 178.68 1xxh h ALA 189 N -1.07 1.57 0.00 1.25 0.00 -1.53 1.36 119.26 120.85 1xxh h ALA 189 Ca -0.05 0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1xxh h ALA 189 Cb 0.39 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 1xxh h ALA 189 CO 0.08 -0.33 -0.01 0.00 0.00 0.00 0.00 179.25 178.99 1xxh h ALA 190 N 1.73 1.12 0.01 0.00 0.00 -1.54 0.12 119.26 120.70 1xxh h ALA 190 Ca 0.60 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 55.25 1xxh h ALA 190 Cb 1.15 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 1xxh h ALA 190 CO -0.52 0.01 -1.38 -0.11 0.00 0.00 0.00 179.25 177.25 1xxh n LEU 191 N -3.27 1.92 -0.29 0.00 7.94 0.44 -4.06 117.00 119.68 1xxh n LEU 191 Ca -0.03 0.40 -0.03 0.00 -1.11 0.00 0.00 56.01 55.24 1xxh n LEU 191 Cb 0.10 -0.97 0.12 0.00 0.53 0.00 0.00 43.42 43.20 1xxh n LEU 191 CO 0.23 0.33 1.15 0.03 -1.11 0.00 0.00 177.39 178.02 1xxh h ARG 192 N -0.93 1.17 0.00 1.96 3.08 -0.42 0.19 114.38 119.43 1xxh h ARG 192 Ca -0.38 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 59.53 1xxh h ARG 192 Cb 1.37 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 31.20 1xxh h ARG 192 CO -0.20 0.87 0.00 1.28 -1.07 0.00 0.00 179.97 180.84 1xxh n LEU 193 N -4.33 0.00 -0.24 3.04 4.77 0.39 -1.99 117.00 118.63 1xxh n LEU 193 Ca 0.09 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 56.10 1xxh n LEU 193 Cb 0.11 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.25 1xxh n LEU 193 CO 0.39 0.00 0.39 -1.20 -1.33 0.00 0.00 177.39 175.64 1xxh n SER 194 N -0.58 1.04 0.00 -1.43 7.64 0.56 -4.95 113.62 115.90 1xxh n SER 194 Ca 0.02 -2.29 0.00 0.00 1.01 0.00 0.00 58.87 57.61 1xxh n SER 194 Cb 0.01 -0.24 0.00 0.00 -1.01 0.00 0.00 64.21 62.96 1xxh n SER 194 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xxh n ALA 195 N -0.57 0.00 -0.02 -0.43 0.00 -0.84 -2.56 120.51 116.08 1xxh n ALA 195 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1xxh n ALA 195 Cb 0.62 -0.26 0.00 0.00 0.00 0.00 0.00 19.45 19.80 1xxh n ALA 195 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xxh n GLY 196 N -2.00 0.94 3.59 0.00 0.00 -0.55 -4.99 105.19 102.18 1xxh n GLY 196 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1xxh n GLY 196 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1xxh s SER 197 N -2.11 6.59 0.11 1.61 0.15 -1.06 -4.65 113.70 114.34 1xxh s SER 197 Ca 0.00 0.36 -0.26 0.00 0.70 0.00 0.00 55.95 56.75 1xxh s SER 197 Cb 0.00 -2.45 -0.07 0.00 -1.71 0.00 0.00 66.02 61.79 1xxh s SER 197 CO 0.00 -0.91 1.65 -0.65 1.20 0.00 0.00 173.24 174.53 1xxh h PRO 198 N 8.71 -0.39 -0.83 5.44 0.11 -1.91 -2.05 132.00 141.08 1xxh h PRO 198 Ca -0.24 0.03 0.20 0.00 0.11 0.00 0.00 66.00 66.10 1xxh h PRO 198 Cb 1.08 0.09 -0.14 0.00 0.11 0.00 0.00 31.00 32.13 1xxh h PRO 198 CO 0.99 -0.26 0.05 0.78 -0.21 0.00 0.00 178.00 179.35 1xxh h GLY 199 N -0.40 1.02 0.77 -0.55 0.00 -1.69 0.15 103.07 102.37 1xxh h GLY 199 Ca 0.04 0.09 -0.01 0.00 0.00 0.00 0.00 47.33 47.45 1xxh h GLY 199 CO -0.16 -0.34 -0.29 0.00 0.00 0.00 0.00 176.54 175.74 1xxh h ALA 200 N 1.78 -0.66 -0.99 3.60 0.00 -1.43 -1.81 119.26 119.75 1xxh h ALA 200 Ca 0.48 -0.12 0.24 0.00 0.00 0.00 0.00 54.91 55.51 1xxh h ALA 200 Cb 0.89 0.39 -0.08 0.00 0.00 0.00 0.00 17.79 18.98 1xxh h ALA 200 CO -0.71 -0.90 0.64 0.00 0.00 0.00 0.00 179.25 178.28 1xxh h ALA 201 N -0.12 2.19 0.25 0.00 0.00 -0.11 -2.22 119.26 119.25 1xxh h ALA 201 Ca -0.03 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1xxh h ALA 201 Cb 0.57 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1xxh h ALA 201 CO -0.01 -0.54 -0.12 1.25 0.00 0.00 0.00 179.25 179.83 1xxh h LEU 202 N 0.43 -0.28 0.00 0.00 7.12 -0.10 -2.71 115.31 119.76 1xxh h LEU 202 Ca 0.54 0.01 0.00 0.00 0.13 0.00 0.00 57.88 58.56 1xxh h LEU 202 Cb 1.33 0.07 0.00 0.00 -0.53 0.00 0.00 40.66 41.54 1xxh h LEU 202 CO -0.25 -0.20 0.00 0.00 -0.13 0.00 0.00 178.44 177.86 1xxh n ALA 203 N -2.24 2.10 0.03 1.25 0.00 -0.84 -1.96 120.51 118.86 1xxh n ALA 203 Ca -0.09 -0.10 -0.09 0.00 0.00 0.00 0.00 53.44 53.15 1xxh n ALA 203 Cb 0.16 -1.30 -0.07 0.00 0.00 0.00 0.00 19.45 18.23 1xxh n ALA 203 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1xxh h LEU 204 N 0.00 -0.16 0.35 0.00 3.38 -1.39 -3.31 115.31 114.19 1xxh h LEU 204 Ca 0.00 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 57.61 1xxh h LEU 204 Cb 0.08 0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 1xxh h LEU 204 CO 0.00 0.44 -0.21 -0.26 0.09 0.00 0.00 178.44 178.50 1xxh h PHE 205 N -0.93 -0.53 0.00 1.13 0.04 -1.57 -2.96 116.94 112.12 1xxh h PHE 205 Ca -0.02 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.74 1xxh h PHE 205 Cb 0.50 0.19 0.00 0.00 2.20 0.00 0.00 35.95 38.84 1xxh h PHE 205 CO 0.09 -0.32 0.00 0.94 -0.60 0.00 0.00 178.31 178.42 1xxh n GLN 206 N -5.33 0.00 -1.45 1.51 -0.06 -0.83 -4.38 117.38 106.84 1xxh n GLN 206 Ca -0.10 0.00 -0.01 0.00 -2.00 0.00 0.00 57.00 54.89 1xxh n GLN 206 Cb 0.24 -0.59 -0.00 0.00 -4.06 0.00 0.00 30.24 25.83 1xxh n GLN 206 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1xxh n GLY 207 N 0.00 2.58 0.07 1.69 0.00 -1.24 -4.98 105.19 103.30 1xxh n GLY 207 Ca 0.00 -1.23 0.15 0.00 0.00 0.00 0.00 46.02 44.95 1xxh n GLY 207 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1xxh n ASP 208 N -1.62 0.22 0.00 1.61 5.75 -1.26 -4.38 116.55 116.87 1xxh n ASP 208 Ca -0.00 -0.82 0.00 0.00 -0.01 0.00 0.00 54.79 53.96 1xxh n ASP 208 Cb 0.03 -0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.05 1xxh n ASP 208 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1xxh n ASN 209 N -0.93 0.00 0.18 -1.12 3.02 -1.26 -1.40 115.26 113.75 1xxh n ASN 209 Ca 0.20 0.78 0.06 0.00 -0.03 0.00 0.00 54.58 55.60 1xxh n ASN 209 Cb 0.18 -0.30 0.35 0.00 -0.61 0.00 0.00 39.78 39.40 1xxh n ASN 209 CO 0.00 0.00 0.00 -0.25 -2.62 0.00 0.00 177.26 174.39 1xxh h TRP 210 N 0.00 0.00 0.00 3.10 2.91 -1.72 2.88 115.95 123.12 1xxh h TRP 210 Ca 0.00 0.00 -0.22 0.00 1.13 0.00 0.00 58.89 59.80 1xxh h TRP 210 Cb 0.00 0.00 -0.04 0.00 -0.51 0.00 0.00 29.16 28.61 1xxh h TRP 210 CO -0.56 0.00 -1.86 1.04 -1.03 0.00 0.00 178.44 176.03 1xxh n GLN 211 N -2.09 0.65 0.04 2.65 1.13 -0.72 -3.53 117.38 115.51 1xxh n GLN 211 Ca -0.01 0.09 0.01 0.00 -1.94 0.00 0.00 57.00 55.15 1xxh n GLN 211 Cb 0.38 -1.67 0.34 0.00 0.11 0.00 0.00 30.24 29.41 1xxh n GLN 211 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1xxh h ALA 212 N 1.34 1.44 0.63 -1.58 0.00 0.63 -1.56 119.26 120.16 1xxh h ALA 212 Ca -0.27 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.41 1xxh h ALA 212 Cb 1.75 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 19.42 1xxh h ALA 212 CO 0.04 0.39 -0.30 -0.09 0.00 0.00 0.00 179.25 179.29 1xxh h ARG 213 N 0.40 -0.81 -0.96 0.00 2.43 -1.24 -2.75 114.38 111.46 1xxh h ARG 213 Ca 0.09 0.06 0.18 0.00 -0.81 0.00 0.00 59.98 59.50 1xxh h ARG 213 Cb 0.32 0.18 -0.18 0.00 -0.42 0.00 0.00 29.97 29.88 1xxh h ARG 213 CO 0.01 -0.54 -0.27 -1.91 -1.51 0.00 0.00 179.97 175.75 1xxh n GLU 214 N -4.44 -0.11 -0.14 0.20 2.13 -0.98 0.88 120.64 118.18 1xxh n GLU 214 Ca -0.10 1.49 -0.06 0.00 0.66 0.00 0.00 57.16 59.15 1xxh n GLU 214 Cb 0.33 -2.23 0.00 0.00 0.27 0.00 0.00 31.44 29.82 1xxh n GLU 214 CO 0.00 0.00 0.00 1.15 -0.41 0.00 0.00 177.13 177.87 1xxh h THR 215 N 0.00 0.29 0.94 6.31 2.02 -1.17 -0.08 112.91 121.21 1xxh h THR 215 Ca 0.44 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.57 1xxh h THR 215 Cb 0.68 0.29 0.01 0.00 -1.74 0.00 0.00 68.15 67.38 1xxh h THR 215 CO -0.98 0.00 -0.45 0.25 0.37 0.00 0.00 175.52 174.71 1xxh h LEU 216 N -0.18 -1.07 -0.92 2.58 6.46 0.79 -2.66 115.31 120.31 1xxh h LEU 216 Ca 0.20 0.03 0.19 0.00 -0.12 0.00 0.00 57.88 58.18 1xxh h LEU 216 Cb 0.50 0.28 -0.17 0.00 -0.73 0.00 0.00 40.66 40.53 1xxh h LEU 216 CO -0.55 -0.74 -0.22 0.00 -0.62 0.00 0.00 178.44 176.31 1xxh h GLN 218 N 0.00 -0.36 0.00 0.00 4.20 -0.94 -1.31 115.11 116.70 1xxh h GLN 218 Ca 0.44 0.02 0.00 0.00 0.06 0.00 0.00 58.65 59.18 1xxh h GLN 218 Cb 0.68 0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.54 1xxh h GLN 218 CO -0.95 -0.24 0.00 0.00 -0.67 0.00 0.00 178.83 176.98 1xxh n ALA 219 N -2.68 -0.01 -0.32 3.87 0.00 0.26 -0.16 120.51 121.48 1xxh n ALA 219 Ca -0.04 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.45 1xxh n ALA 219 Cb 0.28 0.42 0.12 0.00 0.00 0.00 0.00 19.45 20.27 1xxh n ALA 219 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1xxh n LEU 220 N -2.42 -0.33 -0.30 0.00 4.77 -0.85 0.22 117.00 118.08 1xxh n LEU 220 Ca 0.00 1.51 0.29 0.00 -0.03 0.00 0.00 56.01 57.78 1xxh n LEU 220 Cb 0.00 -0.45 0.53 0.00 -2.33 0.00 0.00 43.42 41.17 1xxh n LEU 220 CO 0.00 -1.44 0.95 0.00 -1.33 0.00 0.00 177.39 175.57 1xxh n ALA 221 N -3.67 0.94 -0.12 -1.18 0.00 0.78 0.14 120.51 117.40 1xxh n ALA 221 Ca 0.14 0.87 -0.25 0.00 0.00 0.00 0.00 53.44 54.20 1xxh n ALA 221 Cb 0.43 -0.90 -0.10 0.00 0.00 0.00 0.00 19.45 18.88 1xxh n ALA 221 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1xxh n TYR 222 N -4.90 0.46 -0.39 0.00 9.36 0.13 -4.38 117.16 117.45 1xxh n TYR 222 Ca 0.33 0.20 0.31 0.00 3.32 0.00 0.00 57.90 62.06 1xxh n TYR 222 Cb 1.16 -1.03 0.58 0.00 -0.63 0.00 0.00 39.34 39.43 1xxh n TYR 222 CO 0.00 0.00 0.00 0.77 0.22 0.00 0.00 176.86 177.85 1xxh h SER 223 N -1.00 0.34 0.56 2.98 0.02 0.26 -0.95 113.55 115.76 1xxh h SER 223 Ca -0.52 0.13 -0.03 0.00 -0.84 0.00 0.00 61.79 60.53 1xxh h SER 223 Cb 1.44 0.09 0.01 0.00 0.14 0.00 0.00 62.40 64.08 1xxh h SER 223 CO -0.31 -0.09 -0.27 0.58 -1.14 0.00 0.00 176.83 175.60 1xxh h VAL 224 N 0.21 0.22 -0.08 2.27 2.07 0.10 -1.81 116.25 119.23 1xxh h VAL 224 Ca 0.73 -0.42 -0.19 0.00 0.82 0.00 0.00 66.70 67.64 1xxh h VAL 224 Cb 2.11 0.31 -0.00 0.00 -1.52 0.00 0.00 31.29 32.19 1xxh h VAL 224 CO -0.40 0.04 -0.76 1.55 0.02 0.00 0.00 177.57 178.02 1xxh h PRO 225 N -1.09 0.46 -0.69 1.57 0.13 -1.73 -3.17 132.00 127.48 1xxh h PRO 225 Ca -0.08 -0.39 -0.03 0.00 -0.87 0.00 0.00 66.00 64.63 1xxh h PRO 225 Cb 0.63 0.09 -0.03 0.00 0.13 0.00 0.00 31.00 31.81 1xxh h PRO 225 CO 0.13 1.03 0.32 0.66 -0.23 0.00 0.00 178.00 179.90 1xxh h SER 226 N 0.31 0.92 0.00 1.44 4.64 -1.30 -3.46 113.55 116.10 1xxh h SER 226 Ca -0.04 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 1xxh h SER 226 Cb 1.35 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 1xxh h SER 226 CO 0.13 0.80 0.00 0.61 -0.87 0.00 0.00 176.83 177.51 1xxh n GLY 227 N -0.94 0.45 3.45 -0.77 0.00 -0.70 -5.02 105.19 101.66 1xxh n GLY 227 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 1xxh n GLY 227 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xxh s ASP 228 N -2.56 6.22 0.06 1.61 -1.08 -1.12 -4.80 116.67 115.00 1xxh s ASP 228 Ca 0.00 -1.13 0.22 0.00 -0.52 0.00 0.00 52.55 51.13 1xxh s ASP 228 Cb 0.00 -2.41 -0.14 0.00 -1.46 0.00 0.00 42.92 38.91 1xxh s ASP 228 CO 0.00 -1.39 0.80 0.79 0.52 0.00 0.00 175.17 175.89 1xxh n TRP 229 N 7.54 0.35 -0.12 -5.34 7.02 -1.26 -4.05 117.44 121.58 1xxh n TRP 229 Ca -0.01 0.10 0.16 0.00 -1.02 0.00 0.00 57.50 56.73 1xxh n TRP 229 Cb 0.46 -0.59 0.55 0.00 -2.42 0.00 0.00 31.31 29.30 1xxh n TRP 229 CO 0.00 0.00 0.00 -0.92 -2.02 0.00 0.00 177.69 174.75 1xxh h TYR 230 N 0.00 0.37 -0.17 -5.99 3.20 -1.87 0.79 116.97 113.31 1xxh h TYR 230 Ca 0.00 0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.93 1xxh h TYR 230 Cb 0.91 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 39.05 1xxh h TYR 230 CO 0.00 0.15 0.21 0.66 -1.64 0.00 0.00 178.16 177.53 1xxh h SER 231 N 0.32 0.00 0.05 -2.11 4.64 -1.99 0.34 113.55 114.80 1xxh h SER 231 Ca 0.33 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.64 1xxh h SER 231 Cb 0.85 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.94 1xxh h SER 231 CO -0.09 0.00 -0.05 -0.07 -0.87 0.00 0.00 176.83 175.76 1xxh h LEU 232 N 0.00 0.00 -0.63 5.97 3.38 -1.09 -2.79 115.31 120.16 1xxh h LEU 232 Ca 0.08 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.12 1xxh h LEU 232 Cb 0.49 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.15 1xxh h LEU 232 CO -0.00 0.05 -0.33 -0.11 0.09 0.00 0.00 178.44 178.14 1xxh n LEU 233 N -4.41 -0.58 0.00 1.67 7.94 0.11 0.05 117.00 121.78 1xxh n LEU 233 Ca -0.03 1.11 0.00 0.00 -1.11 0.00 0.00 56.01 55.98 1xxh n LEU 233 Cb 0.13 -0.18 0.00 0.00 0.53 0.00 0.00 43.42 43.90 1xxh n LEU 233 CO 0.34 -0.93 0.29 0.00 -1.11 0.00 0.00 177.39 175.97 1xxh n ALA 234 N -3.58 0.00 0.23 1.96 0.00 -1.05 -0.00 120.51 118.06 1xxh n ALA 234 Ca 0.03 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.54 1xxh n ALA 234 Cb 0.19 0.29 0.53 0.00 0.00 0.00 0.00 19.45 20.47 1xxh n ALA 234 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xxh h ALA 235 N -0.84 1.46 0.00 0.00 0.00 -0.59 -3.19 119.26 116.10 1xxh h ALA 235 Ca 0.00 -0.19 -0.27 0.00 0.00 0.00 0.00 54.91 54.44 1xxh h ALA 235 Cb 0.00 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.71 1xxh h ALA 235 CO 0.00 0.27 -1.67 1.28 0.00 0.00 0.00 179.25 179.12 1xxh n LEU 236 N -4.02 0.85 -4.69 0.00 4.77 -0.74 -4.83 117.00 108.34 1xxh n LEU 236 Ca -0.02 0.40 -0.42 0.00 -0.03 0.00 0.00 56.01 55.94 1xxh n LEU 236 Cb 0.29 0.16 -0.03 0.00 -2.33 0.00 0.00 43.42 41.51 1xxh n LEU 236 CO 0.35 0.35 1.11 0.21 -1.33 0.00 0.00 177.39 178.07 1xxh s ASN 237 N -6.02 6.86 0.00 -1.43 3.04 0.99 -4.31 114.94 114.07 1xxh s ASN 237 Ca -0.04 2.13 0.00 0.00 0.04 0.00 0.00 52.86 54.98 1xxh s ASN 237 Cb 0.08 -2.56 0.00 0.00 -1.54 0.00 0.00 41.25 37.23 1xxh s ASN 237 CO 0.82 -0.70 0.00 1.57 -3.04 0.00 0.00 177.10 175.75 1xxh n HIS 238 N 5.19 0.00 -0.31 0.43 -0.00 -1.26 -4.92 115.22 114.36 1xxh n HIS 238 Ca 0.13 0.00 0.15 0.00 0.46 0.00 0.00 57.72 58.46 1xxh n HIS 238 Cb 0.44 0.00 0.32 0.00 -0.12 0.00 0.00 29.99 30.63 1xxh n HIS 238 CO 0.00 0.00 0.00 1.49 0.46 0.00 0.00 176.34 178.29 1xxh h GLU 239 N 0.00 0.22 -0.99 1.57 4.57 -2.00 0.61 114.58 118.56 1xxh h GLU 239 Ca 0.00 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.14 1xxh h GLU 239 Cb 0.00 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.53 1xxh h GLU 239 CO 0.00 0.15 0.03 1.04 -1.18 0.00 0.00 179.01 179.04 1xxh n GLN 240 N -5.20 1.19 -0.16 1.92 3.00 -1.26 -4.50 117.38 112.37 1xxh n GLN 240 Ca 0.23 -0.24 -0.10 0.00 -0.01 0.00 0.00 57.00 56.88 1xxh n GLN 240 Cb 0.74 -1.30 -0.05 0.00 0.00 0.00 0.00 30.24 29.62 1xxh n GLN 240 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1xxh h ALA 241 N 2.03 -0.46 0.09 -1.58 0.00 -1.06 0.30 119.26 118.58 1xxh h ALA 241 Ca 0.03 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.01 1xxh h ALA 241 Cb 0.91 0.97 -0.02 0.00 0.00 0.00 0.00 17.79 19.64 1xxh h ALA 241 CO 0.07 -0.89 -0.29 -1.00 0.00 0.00 0.00 179.25 177.13 1xxh h PRO 242 N -0.30 -0.42 -0.95 0.00 0.13 -1.86 1.06 132.00 129.66 1xxh h PRO 242 Ca 0.14 0.03 0.16 0.00 -0.87 0.00 0.00 66.00 65.46 1xxh h PRO 242 Cb 0.58 0.10 -0.16 0.00 0.13 0.00 0.00 31.00 31.64 1xxh h PRO 242 CO -0.63 -0.28 -0.34 0.00 -0.23 0.00 0.00 178.00 176.52 1xxh n ALA 243 N -2.70 -0.04 -0.10 -0.56 0.00 -0.84 -0.14 120.51 116.13 1xxh n ALA 243 Ca -0.05 0.97 -0.12 0.00 0.00 0.00 0.00 53.44 54.24 1xxh n ALA 243 Cb 0.23 -0.47 -0.04 0.00 0.00 0.00 0.00 19.45 19.18 1xxh n ALA 243 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xxh h ARG 244 N 0.00 0.60 -0.53 0.00 3.08 0.24 -3.00 114.38 114.76 1xxh h ARG 244 Ca 0.36 -0.24 0.11 0.00 0.07 0.00 0.00 59.98 60.28 1xxh h ARG 244 Cb 0.60 -0.03 -0.10 0.00 0.08 0.00 0.00 29.97 30.52 1xxh h ARG 244 CO -0.95 0.80 -0.10 -0.07 -1.07 0.00 0.00 179.97 178.58 1xxh h LEU 245 N 0.36 -0.43 -1.43 3.04 -0.00 0.46 0.74 115.31 118.06 1xxh h LEU 245 Ca 0.07 0.15 0.23 0.00 -0.00 0.00 0.00 57.88 58.34 1xxh h LEU 245 Cb 0.59 0.30 -0.08 0.00 -0.00 0.00 0.00 40.66 41.48 1xxh h LEU 245 CO 0.03 -0.15 0.64 -0.74 -0.00 0.00 0.00 178.44 178.22 1xxh h HIS 246 N 0.03 0.61 0.59 1.13 2.76 -0.58 -1.29 115.15 118.40 1xxh h HIS 246 Ca 0.26 0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.42 1xxh h HIS 246 Cb 0.40 -0.18 0.01 0.00 1.55 0.00 0.00 27.41 29.18 1xxh h HIS 246 CO -0.42 0.11 -0.28 -1.49 -1.30 0.00 0.00 177.93 174.56 1xxh h TRP 247 N 0.42 -0.73 -1.32 5.26 6.55 0.58 -2.32 115.95 124.38 1xxh h TRP 247 Ca 0.53 -0.02 0.39 0.00 0.95 0.00 0.00 58.89 60.74 1xxh h TRP 247 Cb 1.33 0.24 -0.08 0.00 -0.86 0.00 0.00 29.16 29.79 1xxh h TRP 247 CO -0.00 -0.43 0.92 1.25 -1.05 0.00 0.00 178.44 179.13 1xxh h LEU 248 N -1.16 0.13 0.04 -4.49 5.85 -0.34 -1.03 115.31 114.30 1xxh h LEU 248 Ca -0.08 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.68 1xxh h LEU 248 Cb 0.64 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.69 1xxh h LEU 248 CO 0.13 -0.02 -0.02 0.00 -0.34 0.00 0.00 178.44 178.20 1xxh h ALA 249 N 1.41 -0.72 -0.25 1.25 0.00 -1.04 -2.00 119.26 117.91 1xxh h ALA 249 Ca 0.68 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.60 1xxh h ALA 249 Cb 2.44 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 20.22 1xxh h ALA 249 CO -0.14 -0.72 -0.15 0.25 0.00 0.00 0.00 179.25 178.50 1xxh n THR 250 N -2.17 -0.17 -0.10 0.00 -2.24 -0.42 0.24 114.28 109.42 1xxh n THR 250 Ca -0.01 0.90 -0.09 0.00 -2.27 0.00 0.00 64.05 62.58 1xxh n THR 250 Cb 0.02 -1.14 -0.06 0.00 -2.10 0.00 0.00 70.33 67.05 1xxh n THR 250 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1xxh h LEU 251 N 0.00 -1.19 -0.68 3.22 3.38 -1.57 0.23 115.31 118.71 1xxh h LEU 251 Ca 0.04 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1xxh h LEU 251 Cb 0.10 0.49 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1xxh h LEU 251 CO -0.23 -0.25 0.00 0.18 0.09 0.00 0.00 178.44 178.23 1xxh n LEU 252 N -4.38 0.00 0.00 1.67 4.32 0.65 -1.54 117.00 117.72 1xxh n LEU 252 Ca -0.02 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.97 1xxh n LEU 252 Cb 0.21 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.01 1xxh n LEU 252 CO -0.00 0.00 0.00 0.47 -1.22 0.00 0.00 177.39 176.64 1xxh n ASP 254 N 0.00 0.00 -0.09 -1.43 8.00 0.07 -2.34 116.55 120.76 1xxh n ASP 254 Ca 0.00 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.39 1xxh n ASP 254 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.06 1xxh n ASP 254 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xxh h ALA 255 N 0.00 0.36 -0.47 2.24 0.00 -1.53 0.59 119.26 120.45 1xxh h ALA 255 Ca 0.00 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.58 1xxh h ALA 255 Cb 0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1xxh h ALA 255 CO 0.00 0.13 -0.02 -0.07 0.00 0.00 0.00 179.25 179.29 1xxh h LEU 256 N 0.25 0.83 -1.13 0.00 3.38 -1.74 0.14 115.31 117.04 1xxh h LEU 256 Ca 0.07 -0.32 0.12 0.00 0.09 0.00 0.00 57.88 57.84 1xxh h LEU 256 Cb 0.48 -0.22 -0.08 0.00 0.09 0.00 0.00 40.66 40.93 1xxh h LEU 256 CO 0.02 0.94 0.61 0.11 0.09 0.00 0.00 178.44 180.21 1xxh h LYS 257 N 0.69 0.87 -0.02 1.13 1.57 -1.73 -1.73 116.57 117.35 1xxh h LYS 257 Ca 0.13 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.81 1xxh h LYS 257 Cb 0.53 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.65 1xxh h LYS 257 CO 0.03 0.57 -0.17 -0.09 -0.57 0.00 0.00 179.45 179.22 1xxh h ARG 258 N 0.89 0.15 -1.77 3.15 2.43 -0.39 -0.62 114.38 118.22 1xxh h ARG 258 Ca 0.47 -0.14 0.53 0.00 -0.81 0.00 0.00 59.98 60.03 1xxh h ARG 258 Cb 0.53 0.03 -0.09 0.00 -0.42 0.00 0.00 29.97 30.02 1xxh h ARG 258 CO -0.23 0.83 1.25 0.45 -1.51 0.00 0.00 179.97 180.76 1xxh h HIS 259 N -0.48 0.13 0.00 2.20 3.86 0.19 0.84 115.15 121.89 1xxh h HIS 259 Ca -0.02 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 1xxh h HIS 259 Cb 0.88 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 29.32 1xxh h HIS 259 CO 0.16 -0.06 -1.22 0.72 0.86 0.00 0.00 177.93 178.39 1xxh n HIS 260 N -4.15 0.00 -0.26 2.45 8.25 -1.06 -5.00 115.22 115.45 1xxh n HIS 260 Ca 0.42 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.88 1xxh n HIS 260 Cb 1.84 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 32.83 1xxh n HIS 260 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1xxh n GLY 261 N 1.44 1.01 3.69 -1.41 0.00 0.29 -5.06 105.19 105.16 1xxh n GLY 261 Ca 0.02 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 1xxh n GLY 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xxh n ALA 262 N -1.28 1.14 0.56 4.61 0.00 -0.25 -4.89 120.51 120.40 1xxh n ALA 262 Ca 0.00 0.30 0.13 0.00 0.00 0.00 0.00 53.44 53.86 1xxh n ALA 262 Cb 0.02 -2.24 0.38 0.00 0.00 0.00 0.00 19.45 17.61 1xxh n ALA 262 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xxh h ALA 263 N 2.18 1.00 -3.27 0.00 0.00 -1.97 -3.45 119.26 113.75 1xxh h ALA 263 Ca -0.47 0.00 -0.64 0.00 0.00 0.00 0.00 54.91 53.80 1xxh h ALA 263 Cb 1.30 0.00 -0.36 0.00 0.00 0.00 0.00 17.79 18.73 1xxh h ALA 263 CO 0.60 0.00 -0.83 -1.14 0.00 0.00 0.00 179.25 177.88 1xxh s GLN 264 N -3.13 2.49 -0.11 0.00 0.74 -1.26 -5.09 119.66 113.30 1xxh s GLN 264 Ca 0.10 -0.84 -0.03 0.00 0.05 0.00 0.00 55.36 54.64 1xxh s GLN 264 Cb 0.11 -2.46 -0.03 0.00 1.10 0.00 0.00 33.01 31.72 1xxh s GLN 264 CO 0.60 -0.32 0.01 0.08 -0.55 0.00 0.00 175.29 175.11 1xxh s VAL 265 N 1.34 4.38 -0.08 1.34 1.01 -1.26 -5.01 120.40 122.12 1xxh s VAL 265 Ca 0.02 -0.21 -0.22 0.00 0.00 0.00 0.00 61.98 61.56 1xxh s VAL 265 Cb -0.15 -2.87 -0.18 0.00 0.00 0.00 0.00 36.38 33.18 1xxh s VAL 265 CO -0.10 0.58 0.83 0.74 0.00 0.00 0.00 175.10 177.14 1xxh h THR 266 N 4.34 1.14 -1.14 3.92 2.02 -1.96 -3.36 112.91 117.87 1xxh h THR 266 Ca -0.47 -1.48 -0.72 0.00 0.77 0.00 0.00 66.41 64.51 1xxh h THR 266 Cb 1.19 1.99 -0.11 0.00 -1.74 0.00 0.00 68.15 69.48 1xxh h THR 266 CO 0.57 0.33 2.13 0.59 0.37 0.00 0.00 175.52 179.51 1xxh n ASN 267 N -4.81 4.83 0.17 4.18 3.02 -1.26 -4.37 115.26 117.03 1xxh n ASN 267 Ca -0.08 -2.95 0.14 0.00 -0.03 0.00 0.00 54.58 51.65 1xxh n ASN 267 Cb 0.30 -1.64 0.47 0.00 -0.61 0.00 0.00 39.78 38.31 1xxh n ASN 267 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 1xxh h VAL 268 N 4.69 0.00 -0.38 2.41 -1.51 -1.85 -3.16 116.25 116.45 1xxh h VAL 268 Ca 0.43 -0.47 0.08 0.00 -1.23 0.00 0.00 66.70 65.51 1xxh h VAL 268 Cb 0.78 1.37 -0.08 0.00 -2.13 0.00 0.00 31.29 31.23 1xxh h VAL 268 CO 1.51 0.00 -0.19 -0.78 -1.23 0.00 0.00 177.57 176.88 1xxh h ASP 269 N 0.00 -0.66 -2.20 4.19 3.58 -1.80 -3.28 116.42 116.25 1xxh h ASP 269 Ca 0.00 0.15 -0.58 0.00 0.42 0.00 0.00 57.03 57.02 1xxh h ASP 269 Cb 0.58 0.35 -0.42 0.00 1.72 0.00 0.00 39.33 41.57 1xxh h ASP 269 CO 0.00 -0.23 -0.70 1.33 -2.88 0.00 0.00 179.24 176.76 1xxh n VAL 270 N -5.37 2.17 0.08 2.25 0.24 -1.19 -4.90 118.33 111.60 1xxh n VAL 270 Ca 0.02 -5.20 0.21 0.00 -2.04 0.00 0.00 64.34 57.32 1xxh n VAL 270 Cb 0.28 -1.68 0.72 0.00 -1.47 0.00 0.00 33.84 31.70 1xxh n VAL 270 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 1xxh h PRO 271 N 3.61 0.00 -0.22 7.34 0.13 -1.73 -0.18 132.00 140.96 1xxh h PRO 271 Ca 0.15 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.27 1xxh h PRO 271 Cb 0.64 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.76 1xxh h PRO 271 CO 0.77 0.00 0.10 0.78 -0.23 0.00 0.00 178.00 179.42 1xxh h GLY 272 N 0.00 0.34 1.00 1.56 0.00 -1.93 -2.47 103.07 101.57 1xxh h GLY 272 Ca 0.21 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.36 1xxh h GLY 272 CO -0.00 0.17 0.02 -2.00 0.00 0.00 0.00 176.54 174.72 1xxh h LEU 273 N 0.22 0.03 -1.00 3.11 5.85 -1.44 -1.83 115.31 120.26 1xxh h LEU 273 Ca 0.08 -0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.71 1xxh h LEU 273 Cb 0.13 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 1xxh h LEU 273 CO -0.01 0.03 -0.15 -0.37 -0.34 0.00 0.00 178.44 177.60 1xxh h VAL 274 N 0.04 1.24 -0.33 1.05 -1.51 -1.52 -2.31 116.25 112.90 1xxh h VAL 274 Ca 0.01 -1.10 -0.14 0.00 -1.23 0.00 0.00 66.70 64.23 1xxh h VAL 274 Cb -0.00 1.17 -0.01 0.00 -2.13 0.00 0.00 31.29 30.32 1xxh h VAL 274 CO -0.00 0.36 -0.36 0.00 -1.23 0.00 0.00 177.57 176.34 1xxh h ALA 275 N 1.34 0.73 -0.60 5.19 0.00 -1.34 -0.74 119.26 123.85 1xxh h ALA 275 Ca 0.09 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 1xxh h ALA 275 Cb 0.55 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 1xxh h ALA 275 CO 0.04 0.66 0.33 1.49 0.00 0.00 0.00 179.25 181.76 1xxh h GLU 276 N 0.64 0.82 -0.23 0.00 4.81 -1.00 -1.84 114.58 117.77 1xxh h GLU 276 Ca 0.06 -0.08 -0.04 0.00 -0.13 0.00 0.00 59.36 59.17 1xxh h GLU 276 Cb 0.91 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 30.11 1xxh h GLU 276 CO 0.08 0.60 -0.01 -0.07 -0.73 0.00 0.00 179.01 178.88 1xxh h LEU 277 N 0.83 0.41 -1.32 1.64 3.38 -0.98 -2.07 115.31 117.20 1xxh h LEU 277 Ca 0.21 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1xxh h LEU 277 Cb 0.02 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1xxh h LEU 277 CO -0.03 0.63 0.00 0.00 0.09 0.00 0.00 178.44 179.13 1xxh n ALA 278 N -2.35 1.45 -0.58 1.53 0.00 -0.32 -2.54 120.51 117.71 1xxh n ALA 278 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1xxh n ALA 278 Cb 0.25 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.70 1xxh n ALA 278 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1xxh n ASN 279 N 0.55 0.00 -0.19 0.00 3.02 -0.79 -4.77 115.26 113.08 1xxh n ASN 279 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1xxh n ASN 279 Cb 0.07 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.24 1xxh n ASN 279 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1xxh n HIS 280 N -1.64 0.00 -3.43 3.10 8.25 -1.17 -4.15 115.22 116.19 1xxh n HIS 280 Ca 0.00 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.21 1xxh n HIS 280 Cb 0.00 -0.02 -0.11 0.00 1.12 0.00 0.00 29.99 30.99 1xxh n HIS 280 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1xxh s LEU 281 N -0.61 0.63 1.01 2.41 1.43 -1.05 -5.06 118.68 117.43 1xxh s LEU 281 Ca 0.00 -1.99 -0.23 0.00 -1.03 0.00 0.00 54.13 50.89 1xxh s LEU 281 Cb 0.00 -0.08 -0.15 0.00 0.03 0.00 0.00 46.19 45.99 1xxh s LEU 281 CO 0.00 -0.29 -1.09 -1.54 0.23 0.00 0.00 176.35 173.65 1xxh n SER 282 N 4.11 -4.08 0.08 2.29 3.41 -1.26 -4.55 113.62 113.62 1xxh n SER 282 Ca 0.12 0.07 -0.05 0.00 -0.26 0.00 0.00 58.87 58.75 1xxh n SER 282 Cb 0.40 -0.66 -0.03 0.00 -0.26 0.00 0.00 64.21 63.66 1xxh n SER 282 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1xxh h PRO 283 N -1.09 -0.27 0.00 4.33 0.13 -1.96 -2.85 132.00 130.29 1xxh h PRO 283 Ca -0.42 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1xxh h PRO 283 Cb 1.35 0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.54 1xxh h PRO 283 CO 0.23 -0.18 0.70 0.66 -0.23 0.00 0.00 178.00 179.19 1xxh h SER 284 N -0.28 0.00 0.22 1.44 4.64 -2.00 0.24 113.55 117.82 1xxh h SER 284 Ca -0.02 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.01 1xxh h SER 284 Cb 0.24 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.28 1xxh h SER 284 CO -0.01 0.00 -2.05 0.54 -0.87 0.00 0.00 176.83 174.44 1xxh n ARG 285 N -2.07 0.66 0.17 4.77 1.74 -1.08 -3.32 116.66 117.53 1xxh n ARG 285 Ca -0.00 0.09 -0.07 0.00 -0.77 0.00 0.00 57.85 57.10 1xxh n ARG 285 Cb 0.71 -1.63 -0.03 0.00 -1.02 0.00 0.00 32.46 30.49 1xxh n ARG 285 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1xxh h LEU 286 N 0.00 -0.37 0.00 0.55 3.38 -0.42 -2.22 115.31 116.23 1xxh h LEU 286 Ca -0.38 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1xxh h LEU 286 Cb 2.00 0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.84 1xxh h LEU 286 CO 0.04 -0.24 0.00 0.00 0.09 0.00 0.00 178.44 178.34 1xxh n GLN 287 N -3.31 0.00 0.14 1.13 1.13 -0.98 0.25 117.38 115.75 1xxh n GLN 287 Ca -0.05 0.00 -0.14 0.00 -1.94 0.00 0.00 57.00 54.87 1xxh n GLN 287 Cb 0.17 0.00 -0.08 0.00 0.11 0.00 0.00 30.24 30.44 1xxh n GLN 287 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1xxh h ALA 288 N 0.00 -0.33 -0.05 -1.58 0.00 -1.53 0.68 119.26 116.45 1xxh h ALA 288 Ca 0.00 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.82 1xxh h ALA 288 Cb 0.00 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 1xxh h ALA 288 CO 0.00 -0.61 -0.17 0.82 0.00 0.00 0.00 179.25 179.29 1xxh h ILE 289 N -0.48 0.58 -1.01 0.00 2.04 0.41 0.48 117.51 119.53 1xxh h ILE 289 Ca -0.03 0.00 0.24 0.00 1.00 0.00 0.00 64.86 66.06 1xxh h ILE 289 Cb 0.36 0.58 -0.12 0.00 -0.74 0.00 0.00 36.82 36.90 1xxh h ILE 289 CO 0.06 0.00 0.61 0.25 0.00 0.00 0.00 178.15 179.07 1xxh h LEU 290 N -0.25 0.67 0.00 1.44 6.46 -0.86 -0.08 115.31 122.68 1xxh h LEU 290 Ca 0.07 0.12 0.00 0.00 -0.12 0.00 0.00 57.88 57.95 1xxh h LEU 290 Cb 0.35 0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.29 1xxh h LEU 290 CO -0.20 0.14 0.00 0.61 -0.62 0.00 0.00 178.44 178.37 1xxh n GLY 291 N -1.34 -2.72 0.32 3.75 0.00 0.14 -1.15 105.19 104.18 1xxh n GLY 291 Ca 0.26 0.09 0.31 0.00 0.00 0.00 0.00 46.02 46.67 1xxh n GLY 291 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1xxh n ASP 292 N -0.37 0.32 -0.10 1.61 9.92 0.44 -0.17 116.55 128.19 1xxh n ASP 292 Ca 0.00 1.63 -0.10 0.00 -0.53 0.00 0.00 54.79 55.79 1xxh n ASP 292 Cb 0.00 -0.79 -0.03 0.00 -0.64 0.00 0.00 41.12 39.67 1xxh n ASP 292 CO 0.00 0.00 0.00 0.58 0.13 0.00 0.00 177.20 177.91 1xxh h VAL 293 N 0.00 1.20 0.00 2.53 2.07 -1.00 0.47 116.25 121.52 1xxh h VAL 293 Ca 0.82 -0.65 -0.05 0.00 0.82 0.00 0.00 66.70 67.64 1xxh h VAL 293 Cb 2.16 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 32.98 1xxh h VAL 293 CO -0.77 0.22 -0.22 0.00 0.02 0.00 0.00 177.57 176.82 1xxh n HIS 295 N -3.88 0.00 -0.34 0.00 -0.00 -0.73 -3.13 115.22 107.14 1xxh n HIS 295 Ca -0.02 0.00 -0.06 0.00 -0.00 0.00 0.00 57.72 57.64 1xxh n HIS 295 Cb 0.31 -0.33 -0.05 0.00 -0.00 0.00 0.00 29.99 29.93 1xxh n HIS 295 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.34 175.45 1xxh n ILE 296 N -1.49 -0.52 -0.18 1.59 -0.00 0.16 0.12 119.36 119.04 1xxh n ILE 296 Ca 0.00 1.99 -0.05 0.00 -0.00 0.00 0.00 62.75 64.69 1xxh n ILE 296 Cb 0.00 -2.51 -0.04 0.00 -0.00 0.00 0.00 39.64 37.09 1xxh n ILE 296 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.55 175.41 1xxh n ARG 297 N -5.10 -0.19 -0.34 0.38 0.63 -0.87 0.11 116.66 111.28 1xxh n ARG 297 Ca 0.04 1.09 0.22 0.00 -0.92 0.00 0.00 57.85 58.27 1xxh n ARG 297 Cb 0.25 -1.62 0.47 0.00 0.45 0.00 0.00 32.46 32.01 1xxh n ARG 297 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 1xxh h GLU 298 N 0.00 0.43 0.37 -0.14 4.22 1.00 -0.72 114.58 119.74 1xxh h GLU 298 Ca 0.07 -0.03 -0.00 0.00 0.08 0.00 0.00 59.36 59.48 1xxh h GLU 298 Cb 0.18 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 1xxh h GLU 298 CO -0.40 0.29 -0.38 1.96 -2.18 0.00 0.00 179.01 178.30 1xxh h GLN 299 N 0.45 -0.74 -0.67 1.92 4.20 0.19 -1.12 115.11 119.33 1xxh h GLN 299 Ca 0.63 0.05 0.00 0.00 0.06 0.00 0.00 58.65 59.39 1xxh h GLN 299 Cb 1.46 0.17 0.00 0.00 0.30 0.00 0.00 27.48 29.41 1xxh h GLN 299 CO -0.39 -0.49 0.00 1.28 -0.67 0.00 0.00 178.83 178.56 1xxh n LEU 300 N -5.48 0.00 0.00 1.46 4.32 -0.28 -0.43 117.00 116.59 1xxh n LEU 300 Ca -0.10 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.89 1xxh n LEU 300 Cb 0.38 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.18 1xxh n LEU 300 CO 0.28 0.00 0.00 -1.54 -1.22 0.00 0.00 177.39 174.91 1xxh n SER 302 N 0.46 0.00 -4.48 -1.43 3.41 -0.42 -4.64 113.62 106.52 1xxh n SER 302 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.46 1xxh n SER 302 Cb 0.00 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 63.82 1xxh n SER 302 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1xxh n VAL 303 N 0.00 0.00 0.00 -3.33 0.31 0.42 -4.81 118.33 110.92 1xxh n VAL 303 Ca 0.00 -0.44 0.00 0.00 -0.01 0.00 0.00 64.34 63.89 1xxh n VAL 303 Cb 0.00 -1.01 0.00 0.00 -0.91 0.00 0.00 33.84 31.92 1xxh n VAL 303 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1xxh n THR 304 N 7.11 0.00 -3.08 2.52 -1.04 -1.26 -2.79 114.28 115.74 1xxh n THR 304 Ca 0.49 0.00 -0.22 0.00 -2.04 0.00 0.00 64.05 62.28 1xxh n THR 304 Cb 0.33 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 68.80 1xxh n THR 304 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1xxh n GLY 305 N -0.08 4.50 3.53 3.41 0.00 -1.26 -5.09 105.19 110.20 1xxh n GLY 305 Ca 0.00 -2.19 -0.29 0.00 0.00 0.00 0.00 46.02 43.54 1xxh n GLY 305 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xxh s ILE 306 N -3.32 1.72 -1.03 -0.61 1.01 -1.12 -4.88 121.20 112.97 1xxh s ILE 306 Ca 0.44 0.00 -0.05 0.00 0.00 0.00 0.00 60.65 61.04 1xxh s ILE 306 Cb 0.31 -2.32 0.12 0.00 0.01 0.00 0.00 42.46 40.59 1xxh s ILE 306 CO -0.11 0.00 2.45 -3.20 0.00 0.00 0.00 174.94 174.08 1xxh n ASN 307 N -4.83 7.52 0.00 3.58 2.85 -1.26 -4.89 115.26 118.23 1xxh n ASN 307 Ca 0.09 -3.22 0.00 0.00 -0.11 0.00 0.00 54.58 51.33 1xxh n ASN 307 Cb 0.58 -1.30 0.00 0.00 1.24 0.00 0.00 39.78 40.30 1xxh n ASN 307 CO 0.00 0.00 0.00 -1.14 -2.11 0.00 0.00 177.26 174.01 1xxh n ARG 308 N 1.27 0.00 0.11 1.20 0.63 -1.26 0.17 116.66 118.78 1xxh n ARG 308 Ca 0.57 0.00 -0.13 0.00 -0.92 0.00 0.00 57.85 57.37 1xxh n ARG 308 Cb 0.34 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 33.19 1xxh n ARG 308 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 1xxh h GLU 309 N 0.00 -0.53 0.00 -0.14 4.81 -1.99 -1.43 114.58 115.30 1xxh h GLU 309 Ca 0.00 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1xxh h GLU 309 Cb 0.00 0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.50 1xxh h GLU 309 CO 0.00 -0.35 0.00 -0.11 -0.73 0.00 0.00 179.01 177.82 1xxh n LEU 310 N -5.42 0.00 0.00 1.64 0.00 0.45 -0.10 117.00 113.58 1xxh n LEU 310 Ca -0.07 0.99 0.00 0.00 0.00 0.00 0.00 56.01 56.94 1xxh n LEU 310 Cb 0.33 -0.49 0.00 0.00 0.00 0.00 0.00 43.42 43.26 1xxh n LEU 310 CO 0.22 -0.49 0.31 0.18 0.00 0.00 0.00 177.39 177.61 1xxh n LEU 311 N -2.49 0.00 -0.33 -1.96 7.99 -1.16 -0.90 117.00 118.14 1xxh n LEU 311 Ca 0.00 0.61 0.16 0.00 -0.01 0.00 0.00 56.01 56.78 1xxh n LEU 311 Cb 0.00 -0.22 0.39 0.00 -0.11 0.00 0.00 43.42 43.48 1xxh n LEU 311 CO 0.00 -0.22 1.20 0.40 -1.51 0.00 0.00 177.39 177.26 1xxh h ILE 312 N 0.00 0.64 0.00 -0.08 2.04 -1.24 0.47 117.51 119.34 1xxh h ILE 312 Ca 0.00 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.65 1xxh h ILE 312 Cb 0.00 -0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.04 1xxh h ILE 312 CO 0.00 0.11 0.00 0.41 0.00 0.00 0.00 178.15 178.67 1xxh n THR 313 N -4.73 0.75 -0.11 -0.27 -1.04 0.86 -2.18 114.28 107.56 1xxh n THR 313 Ca 0.24 0.19 -0.23 0.00 -2.04 0.00 0.00 64.05 62.21 1xxh n THR 313 Cb 0.67 -0.90 -0.12 0.00 -1.82 0.00 0.00 70.33 68.17 1xxh n THR 313 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1xxh n ASP 314 N -1.45 1.98 0.09 8.00 2.03 0.15 -3.82 116.55 123.53 1xxh n ASP 314 Ca 0.05 0.12 -0.13 0.00 0.52 0.00 0.00 54.79 55.35 1xxh n ASP 314 Cb 0.18 -0.66 -0.06 0.00 -0.72 0.00 0.00 41.12 39.86 1xxh n ASP 314 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 1xxh h LEU 315 N -0.42 -1.16 0.07 -2.67 6.46 -1.09 -0.99 115.31 115.51 1xxh h LEU 315 Ca -0.58 0.14 0.00 0.00 -0.12 0.00 0.00 57.88 57.32 1xxh h LEU 315 Cb 1.77 0.45 -0.02 0.00 -0.73 0.00 0.00 40.66 42.13 1xxh h LEU 315 CO -0.19 -0.45 -0.21 -0.07 -0.62 0.00 0.00 178.44 176.90 1xxh h LEU 316 N -0.58 -0.62 -0.80 2.25 3.38 -1.65 0.17 115.31 117.46 1xxh h LEU 316 Ca 0.04 0.06 0.19 0.00 0.09 0.00 0.00 57.88 58.27 1xxh h LEU 316 Cb 0.64 0.22 -0.13 0.00 0.09 0.00 0.00 40.66 41.48 1xxh h LEU 316 CO -0.27 -0.23 0.15 -0.07 0.09 0.00 0.00 178.44 178.11 1xxh h LEU 317 N -0.31 -0.11 -0.46 1.67 3.38 -1.64 0.16 115.31 118.01 1xxh h LEU 317 Ca -0.01 0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1xxh h LEU 317 Cb 0.31 0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 1xxh h LEU 317 CO -0.10 -0.13 0.30 -0.09 0.09 0.00 0.00 178.44 178.51 1xxh h ARG 318 N 0.19 0.61 -0.49 1.13 2.43 -0.78 -0.88 114.38 116.58 1xxh h ARG 318 Ca 0.47 -0.04 0.10 0.00 -0.81 0.00 0.00 59.98 59.70 1xxh h ARG 318 Cb 0.88 -0.14 -0.10 0.00 -0.42 0.00 0.00 29.97 30.19 1xxh h ARG 318 CO -0.62 0.41 -0.18 0.82 -1.51 0.00 0.00 179.97 178.89 1xxh h ILE 319 N 0.62 0.40 -0.88 1.20 2.04 0.23 1.03 117.51 122.14 1xxh h ILE 319 Ca 0.17 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.22 1xxh h ILE 319 Cb -0.06 0.40 -0.11 0.00 -0.74 0.00 0.00 36.82 36.31 1xxh h ILE 319 CO -0.04 0.00 0.43 -0.33 0.00 0.00 0.00 178.15 178.21 1xxh h GLU 320 N -0.07 0.50 -0.15 2.37 5.08 -0.64 0.31 114.58 121.98 1xxh h GLU 320 Ca 0.24 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.58 1xxh h GLU 320 Cb 0.43 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1xxh h GLU 320 CO -0.54 0.33 0.04 1.25 -1.00 0.00 0.00 179.01 179.08 1xxh h HIS 321 N 0.51 0.07 -0.82 4.33 2.76 0.23 -1.82 115.15 120.41 1xxh h HIS 321 Ca 0.52 0.01 0.17 0.00 -2.20 0.00 0.00 60.37 58.87 1xxh h HIS 321 Cb 0.90 -0.01 -0.11 0.00 1.55 0.00 0.00 27.41 29.74 1xxh h HIS 321 CO -0.11 0.03 0.35 1.88 -1.30 0.00 0.00 177.93 178.78 1xxh h TYR 322 N 0.11 0.59 0.46 5.26 0.05 0.22 -1.05 116.97 122.61 1xxh h TYR 322 Ca 0.06 0.04 -0.01 0.00 0.05 0.00 0.00 58.73 58.87 1xxh h TYR 322 Cb 0.05 -0.14 -0.02 0.00 1.01 0.00 0.00 36.73 37.64 1xxh h TYR 322 CO -0.12 0.04 -0.37 -0.07 -1.05 0.00 0.00 178.16 176.60 1xxh h LEU 323 N 0.46 -0.97 -7.29 3.88 3.38 -0.51 -3.43 115.31 110.82 1xxh h LEU 323 Ca 0.47 0.07 -0.57 0.00 0.09 0.00 0.00 57.88 57.94 1xxh h LEU 323 Cb 0.77 0.31 0.07 0.00 0.09 0.00 0.00 40.66 41.91 1xxh h LEU 323 CO -0.44 -0.54 -0.28 1.67 0.09 0.00 0.00 178.44 178.94 1xxh n GLN 324 N -5.49 0.00 -1.50 1.13 -0.06 -0.40 -4.85 117.38 106.21 1xxh n GLN 324 Ca -0.11 0.00 -0.30 0.00 -2.00 0.00 0.00 57.00 54.59 1xxh n GLN 324 Cb 0.38 -0.93 0.09 0.00 -4.06 0.00 0.00 30.24 25.72 1xxh n GLN 324 CO 0.00 0.00 0.00 -2.14 -0.20 0.00 0.00 177.06 174.72 1xxh s PRO 325 N -0.56 2.07 0.00 3.69 0.02 -1.26 -3.30 135.00 135.66 1xxh s PRO 325 Ca 0.59 0.71 0.00 0.00 0.02 0.00 0.00 61.00 62.32 1xxh s PRO 325 Cb -0.84 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 31.77 1xxh s PRO 325 CO 0.46 -1.65 0.00 0.41 -0.33 0.00 0.00 177.00 175.89 1xxh n GLY 326 N -1.94 1.37 3.50 0.52 0.00 -1.26 -4.97 105.19 102.42 1xxh n GLY 326 Ca 0.07 -0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.54 1xxh n GLY 326 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1xxh n VAL 327 N 0.00 2.12 -4.20 1.61 0.31 -1.21 -4.96 118.33 112.00 1xxh n VAL 327 Ca 0.00 -0.50 -0.36 0.00 -0.01 0.00 0.00 64.34 63.47 1xxh n VAL 327 Cb 0.00 -0.75 -0.08 0.00 -0.91 0.00 0.00 33.84 32.10 1xxh n VAL 327 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1xxh s VAL 328 N -1.45 4.72 -0.02 2.52 0.11 -1.26 -5.04 120.40 119.98 1xxh s VAL 328 Ca 0.65 -0.09 -0.15 0.00 -2.93 0.00 0.00 61.98 59.45 1xxh s VAL 328 Cb -0.56 -3.01 -0.06 0.00 -1.53 0.00 0.00 36.38 31.22 1xxh s VAL 328 CO 0.57 0.61 0.41 -0.76 -3.33 0.00 0.00 175.10 172.59 1xxh s LEU 329 N -0.89 4.45 0.19 2.54 1.43 -1.26 -5.00 118.68 120.13 1xxh s LEU 329 Ca 0.13 0.94 -0.33 0.00 -1.03 0.00 0.00 54.13 53.84 1xxh s LEU 329 Cb -0.12 -2.59 -0.14 0.00 0.03 0.00 0.00 46.19 43.37 1xxh s LEU 329 CO 0.03 0.28 1.46 -2.65 0.23 0.00 0.00 176.35 175.70 1xxh n PRO 330 N 2.07 1.95 -4.48 1.29 -0.02 -1.26 -5.04 135.00 129.50 1xxh n PRO 330 Ca -0.13 0.70 -0.27 0.00 -2.02 0.00 0.00 63.50 61.77 1xxh n PRO 330 Cb 0.52 -2.39 -0.13 0.00 -0.02 0.00 0.00 33.50 31.48 1xxh n PRO 330 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1xxh s VAL 331 N 0.37 2.03 0.64 -1.45 1.01 -1.26 -4.78 120.40 116.96 1xxh s VAL 331 Ca 0.74 -1.57 -0.18 0.00 0.00 0.00 0.00 61.98 60.97 1xxh s VAL 331 Cb -0.70 -1.79 -0.01 0.00 0.00 0.00 0.00 36.38 33.88 1xxh s VAL 331 CO 0.45 0.11 1.25 -2.84 0.00 0.00 0.00 175.10 174.08 1xxh s PRO 332 N -1.77 2.62 0.00 2.72 0.02 -1.26 -4.98 135.00 132.35 1xxh s PRO 332 Ca 0.11 1.95 0.00 0.00 0.02 0.00 0.00 61.00 63.08 1xxh s PRO 332 Cb -0.10 -1.87 0.00 0.00 0.02 0.00 0.00 34.50 32.55 1xxh s PRO 332 CO 0.04 -1.51 0.00 -2.39 -0.33 0.00 0.00 177.00 172.81 1xxh n HIS 333 N -1.93 0.00 0.00 6.54 1.44 -1.26 -5.33 115.22 114.69 1xxh n HIS 333 Ca 0.15 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.86 1xxh n HIS 333 Cb 0.49 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.60 1xxh n HIS 333 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81