#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 1.98 -3.49 -1.55 -0.00 -1.26 -4.87 117.44 108.25 1xxh n TRP 3 Ca 0.00 0.46 -0.19 0.00 -0.00 0.00 0.00 57.50 57.77 1xxh n TRP 3 Cb 0.00 -2.46 -0.01 0.00 -0.00 0.00 0.00 31.31 28.83 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 2.75 3.01 0.04 5.87 2.02 -1.26 -5.06 117.35 124.72 1xxh s TYR 4 Ca 0.93 -0.27 -0.29 0.00 -0.37 0.00 0.00 57.07 57.07 1xxh s TYR 4 Cb -0.97 -2.01 -0.16 0.00 -0.40 0.00 0.00 41.96 38.43 1xxh s TYR 4 CO 0.58 -0.03 1.31 -1.00 -1.57 0.00 0.00 175.55 174.84 1xxh h PRO 5 N 0.94 -1.00 0.00 -1.71 0.13 -2.04 -2.95 132.00 125.37 1xxh h PRO 5 Ca -0.45 0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 1xxh h PRO 5 Cb 1.26 0.23 0.00 0.00 0.13 0.00 0.00 31.00 32.62 1xxh h PRO 5 CO 0.53 -0.67 0.23 -2.67 -0.23 0.00 0.00 178.00 175.19 1xxh n TRP 6 N -5.08 0.00 0.92 1.56 2.14 -1.26 -0.13 117.44 115.59 1xxh n TRP 6 Ca -0.13 0.00 0.14 0.00 2.07 0.00 0.00 57.50 59.58 1xxh n TRP 6 Cb 0.41 -0.16 0.55 0.00 -0.81 0.00 0.00 31.31 31.30 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 -1.10 0.20 0.09 5.67 4.77 -1.12 -4.06 117.00 121.45 1xxh n LEU 7 Ca 0.00 0.48 -0.22 0.00 -0.03 0.00 0.00 56.01 56.24 1xxh n LEU 7 Cb 0.23 -0.45 -0.15 0.00 -2.33 0.00 0.00 43.42 40.72 1xxh n LEU 7 CO 0.00 -0.03 -0.08 0.08 -1.33 0.00 0.00 177.39 176.03 1xxh h ARG 8 N 0.00 0.42 -0.86 3.23 0.11 -0.72 -2.54 114.38 114.03 1xxh h ARG 8 Ca 0.00 -0.71 0.18 0.00 0.10 0.00 0.00 59.98 59.55 1xxh h ARG 8 Cb 0.55 0.26 -0.06 0.00 1.11 0.00 0.00 29.97 31.83 1xxh h ARG 8 CO 0.00 1.34 0.57 -1.35 0.10 0.00 0.00 179.97 180.62 1xxh h PRO 9 N -0.12 0.42 0.00 0.08 0.11 -1.79 -1.42 132.00 129.28 1xxh h PRO 9 Ca -0.19 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.88 1xxh h PRO 9 Cb 1.88 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.90 1xxh h PRO 9 CO 0.21 0.28 -0.07 -0.44 -0.21 0.00 0.00 178.00 177.77 1xxh h ASP 10 N 0.44 0.00 -0.48 -2.05 5.19 -1.79 -3.33 116.42 114.40 1xxh h ASP 10 Ca 0.44 -0.79 0.14 0.00 -0.62 0.00 0.00 57.03 56.19 1xxh h ASP 10 Cb 1.03 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.52 1xxh h ASP 10 CO -0.16 0.93 0.46 0.15 -3.12 0.00 0.00 179.24 177.50 1xxh h PHE 11 N -1.00 0.00 0.64 4.55 3.04 -1.07 -2.43 116.94 120.68 1xxh h PHE 11 Ca -0.02 0.00 -0.03 0.00 3.98 0.00 0.00 57.97 61.90 1xxh h PHE 11 Cb 0.84 0.00 0.01 0.00 2.56 0.00 0.00 35.95 39.35 1xxh h PHE 11 CO 0.22 0.00 -0.31 1.49 -2.02 0.00 0.00 178.31 177.69 1xxh h GLU 12 N 0.00 -0.83 -0.67 1.11 4.81 -1.38 -2.61 114.58 115.02 1xxh h GLU 12 Ca 0.23 0.06 0.04 0.00 -0.13 0.00 0.00 59.36 59.55 1xxh h GLU 12 Cb 1.14 0.19 -0.04 0.00 0.63 0.00 0.00 28.75 30.67 1xxh h GLU 12 CO -0.00 -0.55 0.44 -0.22 -0.73 0.00 0.00 179.01 177.95 1xxh h LYS 13 N -1.21 0.75 0.00 1.92 3.64 -1.62 0.42 116.57 120.48 1xxh h LYS 13 Ca -0.09 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 1xxh h LYS 13 Cb 0.66 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 1xxh h LYS 13 CO 0.14 0.49 0.00 -0.07 -2.27 0.00 0.00 179.45 177.75 1xxh h LEU 14 N 0.77 0.00 0.00 5.20 3.38 -1.46 -1.44 115.31 121.76 1xxh h LEU 14 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1xxh h LEU 14 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1xxh h LEU 14 CO -0.08 0.00 -1.49 0.52 0.09 0.00 0.00 178.44 177.49 1xxh n VAL 15 N -2.41 0.00 1.26 1.22 0.31 -0.27 -3.79 118.33 114.64 1xxh n VAL 15 Ca 0.01 -0.29 0.14 0.00 -0.01 0.00 0.00 64.34 64.19 1xxh n VAL 15 Cb 0.22 0.42 0.69 0.00 -0.91 0.00 0.00 33.84 34.27 1xxh n VAL 15 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1xxh n ALA 16 N -1.88 2.38 -0.05 3.52 0.00 -0.02 -3.22 120.51 121.23 1xxh n ALA 16 Ca -0.01 -0.13 -0.06 0.00 0.00 0.00 0.00 53.44 53.25 1xxh n ALA 16 Cb 0.42 -1.46 -0.07 0.00 0.00 0.00 0.00 19.45 18.34 1xxh n ALA 16 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1xxh n SER 17 N -1.34 2.79 0.00 0.00 3.41 -1.09 -3.59 113.62 113.81 1xxh n SER 17 Ca 0.12 -0.02 0.08 0.00 -0.26 0.00 0.00 58.87 58.79 1xxh n SER 17 Cb 0.25 0.42 0.49 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 -2.52 0.00 -0.01 7.33 4.01 -1.23 0.50 117.16 125.24 1xxh n TYR 18 Ca -0.17 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.57 1xxh n TYR 18 Cb 0.78 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.81 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 -0.79 5.23 0.00 -0.72 7.27 -1.20 -4.68 117.38 122.51 1xxh n GLN 19 Ca 0.12 -0.01 0.02 0.00 0.07 0.00 0.00 57.00 57.20 1xxh n GLN 19 Cb 0.06 -0.41 -0.02 0.00 2.41 0.00 0.00 30.24 32.28 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 -0.75 2.65 0.00 1.69 0.00 -0.72 -5.02 120.51 118.35 1xxh n ALA 20 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1xxh n ALA 20 Cb 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 19.45 19.27 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 1.05 3.12 0.00 0.00 0.00 0.18 -4.86 105.19 104.68 1xxh n GLY 21 Ca 0.01 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.04 1xxh n GLY 21 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xxh n ARG 22 N -1.07 0.02 -1.67 1.61 5.12 -1.09 -4.77 116.66 114.81 1xxh n ARG 22 Ca 0.00 0.32 -0.46 0.00 -1.93 0.00 0.00 57.85 55.78 1xxh n ARG 22 Cb 0.00 -1.50 -0.04 0.00 -1.16 0.00 0.00 32.46 29.76 1xxh n ARG 22 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1xxh n GLY 23 N -1.15 1.17 3.71 -0.13 0.00 -0.99 -4.97 105.19 102.82 1xxh n GLY 23 Ca 0.01 0.66 -0.38 0.00 0.00 0.00 0.00 46.02 46.30 1xxh n GLY 23 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1xxh s HIS 24 N 1.03 3.49 -1.06 1.61 3.76 -1.26 -4.95 115.29 117.91 1xxh s HIS 24 Ca 0.79 0.91 0.00 0.00 -0.15 0.00 0.00 55.06 56.61 1xxh s HIS 24 Cb -0.67 -2.61 0.00 0.00 1.11 0.00 0.00 32.58 30.41 1xxh s HIS 24 CO 0.38 0.09 0.92 -2.39 -0.85 0.00 0.00 174.74 172.90 1xxh n HIS 25 N 3.95 0.00 -3.80 1.40 1.44 -1.26 -4.45 115.22 112.50 1xxh n HIS 25 Ca -0.06 0.00 -0.15 0.00 -2.01 0.00 0.00 57.72 55.50 1xxh n HIS 25 Cb 0.51 -0.43 -0.16 0.00 0.12 0.00 0.00 29.99 30.04 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 -2.85 0.10 -0.06 1.59 0.00 -1.26 -1.05 121.76 118.23 1xxh s ALA 26 Ca 0.00 0.25 -0.02 0.00 0.00 0.00 0.00 51.96 52.19 1xxh s ALA 26 Cb 0.00 -0.22 0.03 0.00 0.00 0.00 0.00 23.12 22.92 1xxh s ALA 26 CO 0.00 -0.09 0.02 -1.17 0.00 0.00 0.00 175.76 174.52 1xxh s LEU 27 N 0.92 0.44 -0.33 0.00 2.96 -1.21 -3.12 118.68 118.34 1xxh s LEU 27 Ca -0.08 -0.03 -0.10 0.00 -0.22 0.00 0.00 54.13 53.71 1xxh s LEU 27 Cb -0.11 -0.34 0.01 0.00 0.50 0.00 0.00 46.19 46.25 1xxh s LEU 27 CO -0.02 -0.21 0.16 -0.22 -1.32 0.00 0.00 176.35 174.74 1xxh s LEU 28 N 2.04 4.30 -0.25 -0.68 2.96 -1.14 0.47 118.68 126.38 1xxh s LEU 28 Ca 0.05 -0.71 -0.09 0.00 -0.22 0.00 0.00 54.13 53.15 1xxh s LEU 28 Cb -0.12 -2.00 -0.04 0.00 0.50 0.00 0.00 46.19 44.53 1xxh s LEU 28 CO -0.04 -0.26 0.14 -0.63 -1.32 0.00 0.00 176.35 174.23 1xxh s ILE 29 N 1.58 5.01 -0.20 6.68 1.09 0.65 -1.54 121.20 134.47 1xxh s ILE 29 Ca 0.03 0.06 -0.06 0.00 -1.10 0.00 0.00 60.65 59.58 1xxh s ILE 29 Cb -0.18 -3.35 -0.03 0.00 -1.06 0.00 0.00 42.46 37.84 1xxh s ILE 29 CO 0.06 0.32 0.04 -1.58 -0.10 0.00 0.00 174.94 173.68 1xxh s GLN 30 N 1.36 3.76 -0.26 2.79 0.74 -0.85 -2.06 119.66 125.13 1xxh s GLN 30 Ca 0.06 -0.45 -0.26 0.00 0.05 0.00 0.00 55.36 54.77 1xxh s GLN 30 Cb -0.15 -3.18 0.10 0.00 1.10 0.00 0.00 33.01 30.89 1xxh s GLN 30 CO 0.06 0.07 0.91 0.00 -0.55 0.00 0.00 175.29 175.78 1xxh s ALA 31 N 0.89 -1.90 1.10 1.58 0.00 -1.24 -1.49 121.76 120.69 1xxh s ALA 31 Ca 0.02 1.89 -0.20 0.00 0.00 0.00 0.00 51.96 53.67 1xxh s ALA 31 Cb -0.14 -1.25 0.05 0.00 0.00 0.00 0.00 23.12 21.78 1xxh s ALA 31 CO 0.02 -0.28 -0.29 1.28 0.00 0.00 0.00 175.76 176.49 1xxh n LEU 32 N 2.23 -2.44 -4.77 0.00 4.77 -1.26 -4.47 117.00 111.06 1xxh n LEU 32 Ca -0.13 -0.09 -0.29 0.00 -0.03 0.00 0.00 56.01 55.47 1xxh n LEU 32 Cb 0.56 -0.87 0.16 0.00 -2.33 0.00 0.00 43.42 40.93 1xxh n LEU 32 CO 0.04 -3.01 0.71 -2.16 -1.33 0.00 0.00 177.39 171.65 1xxh s PRO 33 N -3.16 0.74 -0.17 3.23 0.04 -1.26 -4.75 135.00 129.67 1xxh s PRO 33 Ca 0.52 0.19 -0.11 0.00 0.04 0.00 0.00 61.00 61.64 1xxh s PRO 33 Cb -0.08 -1.80 0.02 0.00 0.04 0.00 0.00 34.50 32.68 1xxh s PRO 33 CO 0.66 -2.45 0.19 0.41 0.04 0.00 0.00 177.00 175.86 1xxh n GLY 34 N -2.14 -0.54 0.11 0.56 0.00 -1.26 -4.45 105.19 97.47 1xxh n GLY 34 Ca 0.08 0.41 0.01 0.00 0.00 0.00 0.00 46.02 46.52 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 0.78 -0.60 0.43 -0.02 0.00 -1.26 -0.91 105.19 103.60 1xxh n GLY 36 Ca -0.02 -0.08 0.28 0.00 0.00 0.00 0.00 46.02 46.20 1xxh n GLY 36 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1xxh h ASP 37 N 0.51 0.37 0.52 1.61 3.58 -1.93 -0.92 116.42 120.16 1xxh h ASP 37 Ca 0.00 0.10 -0.03 0.00 0.42 0.00 0.00 57.03 57.53 1xxh h ASP 37 Cb 0.18 0.05 0.01 0.00 1.72 0.00 0.00 39.33 41.28 1xxh h ASP 37 CO 0.00 -0.01 -0.25 -0.78 -2.88 0.00 0.00 179.24 175.32 1xxh h ASP 38 N 0.28 -0.59 0.87 2.28 3.58 -1.99 -3.18 116.42 117.66 1xxh h ASP 38 Ca 0.67 0.01 -0.04 0.00 0.42 0.00 0.00 57.03 58.09 1xxh h ASP 38 Cb 1.87 0.15 -0.01 0.00 1.72 0.00 0.00 39.33 43.07 1xxh h ASP 38 CO -0.34 -0.41 -0.20 0.00 -2.88 0.00 0.00 179.24 175.41 1xxh h ALA 39 N -0.25 1.04 -0.18 -0.78 0.00 -1.53 -3.19 119.26 114.37 1xxh h ALA 39 Ca -0.07 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.54 1xxh h ALA 39 Cb 0.55 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1xxh h ALA 39 CO 0.12 0.25 -0.36 1.25 0.00 0.00 0.00 179.25 180.51 1xxh h LEU 40 N 0.00 0.40 0.24 0.00 5.85 -1.35 -1.81 115.31 118.64 1xxh h LEU 40 Ca -0.00 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.55 1xxh h LEU 40 Cb 0.69 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.61 1xxh h LEU 40 CO 0.03 0.74 -0.12 0.40 -0.34 0.00 0.00 178.44 179.15 1xxh h ILE 41 N 0.33 0.74 -1.00 4.05 1.08 -1.58 -3.10 117.51 118.02 1xxh h ILE 41 Ca 0.04 -0.86 0.19 0.00 -0.39 0.00 0.00 64.86 63.84 1xxh h ILE 41 Cb 0.79 1.16 -0.10 0.00 -3.07 0.00 0.00 36.82 35.60 1xxh h ILE 41 CO 0.06 0.16 0.61 0.22 -0.69 0.00 0.00 178.15 178.52 1xxh h TYR 42 N -0.83 1.04 0.00 1.37 3.20 -1.58 -1.43 116.97 118.74 1xxh h TYR 42 Ca -0.03 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 1xxh h TYR 42 Cb 0.51 -0.31 -0.00 0.00 1.54 0.00 0.00 36.73 38.46 1xxh h TYR 42 CO 0.05 0.23 -0.10 0.00 -1.64 0.00 0.00 178.16 176.71 1xxh h ALA 43 N 1.64 1.04 0.00 1.82 0.00 -1.33 -3.10 119.26 119.33 1xxh h ALA 43 Ca 0.58 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.40 1xxh h ALA 43 Cb 0.92 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1xxh h ALA 43 CO -0.37 0.12 -1.14 1.28 0.00 0.00 0.00 179.25 179.14 1xxh n LEU 44 N -3.27 0.59 0.06 0.00 4.77 -0.56 -4.08 117.00 114.51 1xxh n LEU 44 Ca 0.00 -0.07 0.12 0.00 -0.03 0.00 0.00 56.01 56.03 1xxh n LEU 44 Cb 0.34 -0.07 0.15 0.00 -2.33 0.00 0.00 43.42 41.50 1xxh n LEU 44 CO 0.30 0.06 0.30 -1.54 -1.33 0.00 0.00 177.39 175.17 1xxh n SER 45 N -1.95 0.69 0.08 -1.43 3.41 -1.10 -3.32 113.62 110.00 1xxh n SER 45 Ca 0.01 0.08 -0.04 0.00 -0.26 0.00 0.00 58.87 58.67 1xxh n SER 45 Cb 0.44 0.25 -0.07 0.00 -0.26 0.00 0.00 64.21 64.57 1xxh n SER 45 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1xxh h ARG 46 N 0.00 0.00 -0.02 4.33 2.47 -1.70 -2.39 114.38 117.07 1xxh h ARG 46 Ca 0.00 0.00 -0.22 0.00 -1.26 0.00 0.00 59.98 58.50 1xxh h ARG 46 Cb 0.75 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.07 1xxh h ARG 46 CO 0.00 0.79 -0.91 -0.92 0.56 0.00 0.00 179.97 179.49 1xxh h TYR 47 N 0.00 0.66 0.00 3.04 3.20 -1.71 -3.18 116.97 118.98 1xxh h TYR 47 Ca -0.02 -0.35 0.00 0.00 3.14 0.00 0.00 58.73 61.50 1xxh h TYR 47 Cb 1.64 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 39.83 1xxh h TYR 47 CO 0.00 1.16 -0.59 1.28 -1.64 0.00 0.00 178.16 178.37 1xxh n LEU 48 N -3.78 0.68 -1.51 2.82 4.77 -1.21 -3.88 117.00 114.89 1xxh n LEU 48 Ca -0.07 0.22 -0.01 0.00 -0.03 0.00 0.00 56.01 56.13 1xxh n LEU 48 Cb 0.81 -0.19 0.28 0.00 -2.33 0.00 0.00 43.42 41.99 1xxh n LEU 48 CO 0.51 -0.04 0.87 0.18 -1.33 0.00 0.00 177.39 177.58 1xxh n LEU 49 N -2.06 5.06 -4.67 2.23 4.32 -0.90 -4.39 117.00 116.59 1xxh n LEU 49 Ca 0.04 -3.26 -0.35 0.00 -0.02 0.00 0.00 56.01 52.42 1xxh n LEU 49 Cb 0.43 -0.66 -0.09 0.00 -1.62 0.00 0.00 43.42 41.48 1xxh n LEU 49 CO 0.36 0.84 -0.23 0.00 -1.22 0.00 0.00 177.39 177.14 1xxh h GLN 51 N 6.60 0.31 -2.21 0.00 1.08 -1.93 -3.39 115.11 115.57 1xxh h GLN 51 Ca -0.39 -0.43 -0.58 0.00 -1.45 0.00 0.00 58.65 55.80 1xxh h GLN 51 Cb 1.16 0.15 -0.39 0.00 -0.05 0.00 0.00 27.48 28.35 1xxh h GLN 51 CO 0.71 1.16 -0.96 1.04 -0.95 0.00 0.00 178.83 179.83 1xxh n GLN 52 N -3.61 0.89 -1.90 1.46 6.02 -1.26 -5.12 117.38 113.85 1xxh n GLN 52 Ca -0.07 -3.50 -0.38 0.00 -0.01 0.00 0.00 57.00 53.04 1xxh n GLN 52 Cb 0.94 -1.56 0.03 0.00 1.02 0.00 0.00 30.24 30.67 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 -1.02 3.29 -0.04 -1.09 0.04 -1.26 -4.09 135.00 130.82 1xxh s PRO 53 Ca 0.34 2.12 0.17 0.00 0.04 0.00 0.00 61.00 63.67 1xxh s PRO 53 Cb 0.11 -2.29 0.55 0.00 0.04 0.00 0.00 34.50 32.91 1xxh s PRO 53 CO -0.13 -1.04 1.45 1.04 0.04 0.00 0.00 177.00 178.36 1xxh n GLN 54 N -0.90 2.75 0.00 4.56 6.02 0.39 -4.93 117.38 125.27 1xxh n GLN 54 Ca 0.10 -2.21 0.00 0.00 -0.01 0.00 0.00 57.00 54.88 1xxh n GLN 54 Cb 0.46 -1.60 0.00 0.00 1.02 0.00 0.00 30.24 30.11 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 1.23 1.95 0.01 1.08 0.00 -1.26 -4.74 105.19 103.46 1xxh n GLY 55 Ca 0.20 -0.52 0.08 0.00 0.00 0.00 0.00 46.02 45.78 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 -4.17 1.61 8.25 -1.26 -5.03 115.22 114.62 1xxh n HIS 56 Ca 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.36 1xxh n HIS 56 Cb 0.00 -0.41 -0.04 0.00 1.12 0.00 0.00 29.99 30.66 1xxh n HIS 56 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 1xxh n LYS 57 N -2.12 0.41 -2.41 -0.41 3.00 -1.26 -4.97 118.16 110.39 1xxh n LYS 57 Ca -0.04 -1.59 -0.25 0.00 -0.00 0.00 0.00 58.31 56.43 1xxh n LYS 57 Cb 0.47 1.13 0.12 0.00 0.00 0.00 0.00 35.03 36.76 1xxh n LYS 57 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 1xxh s SER 58 N -2.13 4.12 -0.17 3.14 0.01 -1.26 -0.46 113.70 116.95 1xxh s SER 58 Ca 0.15 -0.15 0.12 0.00 1.31 0.00 0.00 55.95 57.38 1xxh s SER 58 Cb 0.01 -0.18 -0.23 0.00 0.21 0.00 0.00 66.02 65.82 1xxh s SER 58 CO 0.11 -2.03 0.19 0.00 0.41 0.00 0.00 173.24 171.92 1xxh n GLY 60 N 1.80 1.26 0.06 0.00 0.00 -1.26 -4.92 105.19 102.13 1xxh n GLY 60 Ca -0.31 0.00 -0.05 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 0.41 -0.40 1.61 8.25 -1.26 -4.25 115.22 117.57 1xxh n HIS 61 Ca 0.00 0.18 -0.13 0.00 -0.26 0.00 0.00 57.72 57.51 1xxh n HIS 61 Cb 0.00 -0.54 0.01 0.00 1.12 0.00 0.00 29.99 30.58 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 -0.10 0.39 0.56 0.00 3.08 -1.96 0.70 114.38 117.06 1xxh h ARG 63 Ca -0.14 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 59.86 1xxh h ARG 63 Cb 0.48 -0.09 0.01 0.00 0.08 0.00 0.00 29.97 30.45 1xxh h ARG 63 CO 0.13 0.26 -0.27 0.78 -1.07 0.00 0.00 179.97 179.80 1xxh h GLY 64 N 0.41 -0.78 0.54 0.04 0.00 -1.86 -1.22 103.07 100.20 1xxh h GLY 64 Ca 0.61 0.29 0.10 0.00 0.00 0.00 0.00 47.33 48.33 1xxh h GLY 64 CO -0.55 -0.28 0.57 0.00 0.00 0.00 0.00 176.54 176.28 1xxh h GLN 66 N 0.94 -0.34 -1.87 0.00 4.15 -0.92 -1.95 115.11 115.12 1xxh h GLN 66 Ca 0.44 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.89 1xxh h GLN 66 Cb 0.38 0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.15 1xxh h GLN 66 CO -0.24 0.01 0.00 1.28 -1.93 0.00 0.00 178.83 177.95 1xxh n LEU 67 N -5.05 0.95 0.00 -2.39 4.77 -0.46 -1.63 117.00 113.19 1xxh n LEU 67 Ca -0.09 -0.45 0.00 0.00 -0.03 0.00 0.00 56.01 55.45 1xxh n LEU 67 Cb 0.26 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1xxh n LEU 67 CO 0.27 0.17 0.00 0.00 -1.33 0.00 0.00 177.39 176.50 1xxh n GLN 69 N 1.33 0.00 0.00 3.23 1.13 -0.73 -2.51 117.38 119.82 1xxh n GLN 69 Ca 0.00 0.00 0.08 0.00 -1.94 0.00 0.00 57.00 55.14 1xxh n GLN 69 Cb 0.12 0.00 0.49 0.00 0.11 0.00 0.00 30.24 30.96 1xxh n GLN 69 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1xxh n ALA 70 N 0.00 2.37 -0.04 -1.58 0.00 -0.65 -4.90 120.51 115.72 1xxh n ALA 70 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1xxh n ALA 70 Cb 0.00 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.18 1xxh n ALA 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xxh n GLY 71 N 0.45 2.06 3.40 0.00 0.00 -1.04 -4.91 105.19 105.14 1xxh n GLY 71 Ca 0.12 0.03 -0.61 0.00 0.00 0.00 0.00 46.02 45.57 1xxh n GLY 71 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1xxh n THR 72 N 0.00 0.03 -3.79 2.61 -1.04 -1.22 -4.93 114.28 105.95 1xxh n THR 72 Ca 0.00 -0.03 -0.13 0.00 -2.04 0.00 0.00 64.05 61.86 1xxh n THR 72 Cb 0.00 -0.65 -0.12 0.00 -1.82 0.00 0.00 70.33 67.74 1xxh n THR 72 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 1xxh s HIS 73 N 5.38 -0.23 -0.28 -1.42 5.04 -1.26 -4.74 115.29 117.79 1xxh s HIS 73 Ca 1.15 0.56 0.26 0.00 -1.54 0.00 0.00 55.06 55.49 1xxh s HIS 73 Cb -1.41 0.05 1.15 0.00 0.04 0.00 0.00 32.58 32.41 1xxh s HIS 73 CO 0.68 -0.13 1.78 -1.35 -2.34 0.00 0.00 174.74 173.38 1xxh h PRO 74 N 6.18 0.00 -0.17 2.88 0.11 -1.94 -3.01 132.00 136.06 1xxh h PRO 74 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1xxh h PRO 74 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1xxh h PRO 74 CO 0.39 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 177.93 1xxh n ASP 75 N -2.42 2.64 -4.10 -2.05 8.00 -1.26 -4.70 116.55 112.66 1xxh n ASP 75 Ca 0.01 -2.23 -0.33 0.00 0.71 0.00 0.00 54.79 52.95 1xxh n ASP 75 Cb 0.20 -0.20 -0.15 0.00 -0.02 0.00 0.00 41.12 40.94 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 -1.41 3.08 -0.23 1.24 6.14 -1.14 -0.78 117.35 124.24 1xxh s TYR 76 Ca 0.18 -2.02 0.01 0.00 0.64 0.00 0.00 57.07 55.88 1xxh s TYR 76 Cb 0.12 -1.94 0.03 0.00 0.42 0.00 0.00 41.96 40.59 1xxh s TYR 76 CO 0.08 -0.84 -0.12 0.71 0.64 0.00 0.00 175.55 176.02 1xxh s TYR 77 N 1.19 3.05 -0.44 4.97 2.02 -0.87 -4.73 117.35 122.54 1xxh s TYR 77 Ca -0.03 -1.82 -0.18 0.00 -0.37 0.00 0.00 57.07 54.67 1xxh s TYR 77 Cb -0.17 -1.98 0.03 0.00 -0.40 0.00 0.00 41.96 39.44 1xxh s TYR 77 CO -0.08 -0.80 0.49 0.99 -1.57 0.00 0.00 175.55 174.58 1xxh s THR 78 N 1.24 5.03 -1.10 -0.71 2.01 -1.26 -1.60 115.64 119.25 1xxh s THR 78 Ca -0.01 -0.38 -0.13 0.00 0.31 0.00 0.00 61.69 61.48 1xxh s THR 78 Cb -0.17 -4.11 0.21 0.00 0.01 0.00 0.00 72.50 68.44 1xxh s THR 78 CO -0.07 -0.52 1.22 -0.76 -0.69 0.00 0.00 174.62 173.80 1xxh s LEU 79 N 2.26 5.64 0.44 4.42 1.02 0.63 -4.98 118.68 128.11 1xxh s LEU 79 Ca 0.13 -3.04 0.01 0.00 0.02 0.00 0.00 54.13 51.25 1xxh s LEU 79 Cb -0.18 -2.32 -0.01 0.00 0.02 0.00 0.00 46.19 43.71 1xxh s LEU 79 CO 0.13 -0.62 0.65 0.00 0.02 0.00 0.00 176.35 176.53 1xxh s ALA 80 N 0.65 3.77 0.18 4.21 0.00 -1.26 -3.21 121.76 126.11 1xxh s ALA 80 Ca 0.35 -1.06 -0.30 0.00 0.00 0.00 0.00 51.96 50.95 1xxh s ALA 80 Cb -0.06 -2.12 -0.09 0.00 0.00 0.00 0.00 23.12 20.86 1xxh s ALA 80 CO -0.05 -0.33 1.31 -1.25 0.00 0.00 0.00 175.76 175.45 1xxh s PRO 81 N -4.52 4.38 -0.21 0.00 0.04 -1.26 -4.88 135.00 128.55 1xxh s PRO 81 Ca 0.47 2.04 -0.36 0.00 0.04 0.00 0.00 61.00 63.19 1xxh s PRO 81 Cb -0.10 -3.21 -0.17 0.00 0.04 0.00 0.00 34.50 31.07 1xxh s PRO 81 CO 0.37 -0.27 1.12 0.39 0.04 0.00 0.00 177.00 178.65 1xxh n GLU 82 N 2.84 0.00 -1.53 4.56 1.02 -1.14 -4.69 120.64 121.70 1xxh n GLU 82 Ca 0.07 0.00 -0.45 0.00 -0.02 0.00 0.00 57.16 56.76 1xxh n GLU 82 Cb 0.43 -1.26 -0.05 0.00 -0.02 0.00 0.00 31.44 30.54 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 2.31 1.51 0.00 3.49 3.00 -1.26 -2.61 118.16 124.59 1xxh n LYS 83 Ca 0.21 0.38 0.00 0.00 -0.00 0.00 0.00 58.31 58.91 1xxh n LYS 83 Cb 0.01 -2.93 0.00 0.00 0.00 0.00 0.00 35.03 32.11 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 6.11 2.70 3.84 3.14 0.00 -1.26 -5.09 105.19 114.63 1xxh n GLY 84 Ca 0.36 -0.68 -0.30 0.00 0.00 0.00 0.00 46.02 45.40 1xxh n GLY 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xxh s LYS 85 N 0.00 0.53 -0.16 1.61 1.02 -1.07 -4.99 119.74 116.67 1xxh s LYS 85 Ca 0.00 -0.16 0.17 0.00 0.02 0.00 0.00 55.97 56.00 1xxh s LYS 85 Cb 0.00 -1.81 0.45 0.00 -0.52 0.00 0.00 37.83 35.95 1xxh s LYS 85 CO 0.00 -2.53 1.33 0.09 -0.92 0.00 0.00 175.35 173.33 1xxh n ASN 86 N -3.90 3.39 -4.24 2.83 3.02 -1.26 -4.69 115.26 110.41 1xxh n ASN 86 Ca 0.12 -2.99 -0.21 0.00 -0.03 0.00 0.00 54.58 51.47 1xxh n ASN 86 Cb 0.60 -0.49 -0.10 0.00 -0.61 0.00 0.00 39.78 39.18 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 -2.76 0.72 -0.06 3.41 -4.23 -1.26 -4.88 115.64 106.58 1xxh s THR 87 Ca 0.38 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.91 1xxh s THR 87 Cb 0.31 -2.59 -0.03 0.00 1.34 0.00 0.00 72.50 71.54 1xxh s THR 87 CO 0.07 0.00 -0.10 -0.22 -0.54 0.00 0.00 174.62 173.83 1xxh s LEU 88 N -3.46 2.96 0.48 4.79 0.20 0.75 -2.88 118.68 121.52 1xxh s LEU 88 Ca 0.33 -0.11 -0.05 0.00 0.69 0.00 0.00 54.13 55.00 1xxh s LEU 88 Cb 0.06 -1.62 -0.04 0.00 -0.43 0.00 0.00 46.19 44.16 1xxh s LEU 88 CO 0.15 0.35 0.78 -0.83 -0.29 0.00 0.00 176.35 176.51 1xxh s GLY 89 N -0.77 1.49 0.00 7.98 0.00 -1.26 -1.61 107.32 113.15 1xxh s GLY 89 Ca 0.12 -0.53 0.14 0.00 0.00 0.00 0.00 44.72 44.45 1xxh s GLY 89 CO 0.01 -0.36 1.49 -0.62 0.00 0.00 0.00 173.10 173.62 1xxh n VAL 90 N -2.25 0.05 -0.05 1.40 0.31 -1.26 -3.87 118.33 112.66 1xxh n VAL 90 Ca 0.00 -0.07 -0.02 0.00 -0.01 0.00 0.00 64.34 64.25 1xxh n VAL 90 Cb 0.55 -0.11 -0.01 0.00 -0.91 0.00 0.00 33.84 33.36 1xxh n VAL 90 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1xxh h ASP 91 N 0.37 0.00 -0.87 4.52 3.32 -1.98 -3.29 116.42 118.50 1xxh h ASP 91 Ca 0.00 0.00 0.22 0.00 0.02 0.00 0.00 57.03 57.27 1xxh h ASP 91 Cb 0.08 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 39.50 1xxh h ASP 91 CO 0.00 0.54 0.27 0.00 -1.72 0.00 0.00 179.24 178.33 1xxh h ALA 92 N -1.11 1.28 0.29 3.45 0.00 -1.99 -1.23 119.26 119.96 1xxh h ALA 92 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1xxh h ALA 92 Cb 0.19 0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1xxh h ALA 92 CO 0.00 -0.43 -0.46 0.28 0.00 0.00 0.00 179.25 178.64 1xxh h VAL 93 N 0.26 0.09 -0.88 0.00 2.07 -1.73 -2.18 116.25 113.88 1xxh h VAL 93 Ca 0.54 0.00 0.09 0.00 0.82 0.00 0.00 66.70 68.15 1xxh h VAL 93 Cb 1.06 0.09 -0.06 0.00 -1.52 0.00 0.00 31.29 30.86 1xxh h VAL 93 CO -0.61 0.00 0.57 0.03 0.02 0.00 0.00 177.57 177.58 1xxh h ARG 94 N -0.82 0.86 0.00 1.57 2.47 -1.32 0.70 114.38 117.84 1xxh h ARG 94 Ca -0.02 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.65 1xxh h ARG 94 Cb 0.77 -0.19 0.00 0.00 -1.65 0.00 0.00 29.97 28.90 1xxh h ARG 94 CO -0.16 0.57 0.00 0.39 0.56 0.00 0.00 179.97 181.32 1xxh n GLU 95 N -4.52 0.03 -0.00 0.04 1.02 -0.72 -2.15 120.64 114.34 1xxh n GLU 95 Ca 0.15 0.17 0.06 0.00 -0.02 0.00 0.00 57.16 57.52 1xxh n GLU 95 Cb 0.30 -1.55 -0.08 0.00 -0.02 0.00 0.00 31.44 30.08 1xxh n GLU 95 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1xxh n VAL 96 N -1.61 0.00 0.10 2.62 0.31 -0.43 -3.83 118.33 115.49 1xxh n VAL 96 Ca 0.05 -0.25 -0.23 0.00 -0.01 0.00 0.00 64.34 63.90 1xxh n VAL 96 Cb 0.25 0.55 -0.14 0.00 -0.91 0.00 0.00 33.84 33.59 1xxh n VAL 96 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 1xxh h THR 97 N 0.00 1.33 -0.00 2.52 2.02 -0.63 -3.06 112.91 115.09 1xxh h THR 97 Ca 0.00 -2.55 0.00 0.00 0.77 0.00 0.00 66.41 64.63 1xxh h THR 97 Cb 0.43 2.92 0.00 0.00 -1.74 0.00 0.00 68.15 69.75 1xxh h THR 97 CO 0.00 0.76 -0.11 -1.84 0.37 0.00 0.00 175.52 174.70 1xxh n GLU 98 N -3.85 0.75 0.05 6.66 0.28 -0.91 -2.94 120.64 120.68 1xxh n GLU 98 Ca -0.15 -0.27 0.12 0.00 -0.16 0.00 0.00 57.16 56.70 1xxh n GLU 98 Cb 0.99 -1.49 0.15 0.00 1.43 0.00 0.00 31.44 32.52 1xxh n GLU 98 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 1xxh n LYS 99 N -0.89 0.27 0.00 3.44 4.81 -1.19 -3.75 118.16 120.86 1xxh n LYS 99 Ca 0.15 0.07 0.07 0.00 -0.87 0.00 0.00 58.31 57.73 1xxh n LYS 99 Cb 0.28 -1.66 0.00 0.00 0.02 0.00 0.00 35.03 33.67 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 -2.05 1.57 -0.00 3.14 4.77 -1.15 -4.28 117.00 119.00 1xxh n LEU 100 Ca 0.03 -0.78 0.14 0.00 -0.03 0.00 0.00 56.01 55.37 1xxh n LEU 100 Cb 0.43 0.00 0.70 0.00 -2.33 0.00 0.00 43.42 42.22 1xxh n LEU 100 CO 0.37 0.30 0.99 0.59 -1.33 0.00 0.00 177.39 178.31 1xxh n ASN 101 N -0.08 0.02 -4.34 -1.43 5.03 -1.21 -4.74 115.26 108.51 1xxh n ASN 101 Ca 0.06 0.09 -0.32 0.00 0.87 0.00 0.00 54.58 55.28 1xxh n ASN 101 Cb 0.31 -0.36 -0.15 0.00 -1.02 0.00 0.00 39.78 38.56 1xxh n ASN 101 CO 0.00 0.00 0.00 -1.83 -1.83 0.00 0.00 177.26 173.60 1xxh s GLU 102 N -2.74 2.97 0.13 3.52 -1.05 -1.26 -5.09 118.70 115.18 1xxh s GLU 102 Ca 0.23 -0.78 -0.11 0.00 -0.15 0.00 0.00 54.97 54.16 1xxh s GLU 102 Cb 0.20 -2.41 -0.07 0.00 -0.44 0.00 0.00 34.13 31.40 1xxh s GLU 102 CO 0.49 0.32 0.15 0.72 0.95 0.00 0.00 175.26 177.89 1xxh n HIS 103 N 3.17 -0.53 -2.20 4.83 8.25 -1.26 -4.82 115.22 122.66 1xxh n HIS 103 Ca -0.18 0.37 -0.42 0.00 -0.26 0.00 0.00 57.72 57.23 1xxh n HIS 103 Cb 0.52 -0.84 -0.03 0.00 1.12 0.00 0.00 29.99 30.77 1xxh n HIS 103 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1xxh s ALA 104 N -0.58 3.57 0.31 -1.41 0.00 -1.26 -4.92 121.76 117.47 1xxh s ALA 104 Ca 0.28 1.06 0.07 0.00 0.00 0.00 0.00 51.96 53.37 1xxh s ALA 104 Cb -0.36 -3.54 0.82 0.00 0.00 0.00 0.00 23.12 20.04 1xxh s ALA 104 CO 0.26 -0.64 1.72 -0.09 0.00 0.00 0.00 175.76 177.01 1xxh h ARG 105 N 6.96 0.53 -1.32 0.00 9.65 -1.87 0.13 114.38 128.45 1xxh h ARG 105 Ca -0.42 -0.03 -0.68 0.00 -1.10 0.00 0.00 59.98 57.76 1xxh h ARG 105 Cb 1.21 -0.12 -0.32 0.00 -1.39 0.00 0.00 29.97 29.35 1xxh h ARG 105 CO 0.87 0.35 0.50 1.28 2.80 0.00 0.00 179.97 185.76 1xxh n LEU 106 N -4.92 6.91 -2.46 3.80 4.32 -1.26 -4.96 117.00 118.42 1xxh n LEU 106 Ca 0.25 -4.63 -0.01 0.00 -0.02 0.00 0.00 56.01 51.60 1xxh n LEU 106 Cb 0.70 -0.85 0.00 0.00 -1.62 0.00 0.00 43.42 41.64 1xxh n LEU 106 CO 0.16 1.74 -0.01 0.61 -1.22 0.00 0.00 177.39 178.67 1xxh n GLY 107 N -0.72 -0.06 0.00 -0.72 0.00 0.46 -4.72 105.19 99.42 1xxh n GLY 107 Ca 0.55 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.60 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 -0.52 2.44 3.84 -0.02 0.00 -1.26 -5.05 105.19 104.62 1xxh n GLY 108 Ca -0.01 0.09 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 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 3.79 -0.05 4.61 0.00 -1.26 -4.82 121.76 123.03 1xxh s ALA 109 Ca 0.00 -0.52 0.01 0.00 0.00 0.00 0.00 51.96 51.45 1xxh s ALA 109 Cb 0.00 -2.13 -0.03 0.00 0.00 0.00 0.00 23.12 20.96 1xxh s ALA 109 CO 0.00 0.50 -0.04 0.15 0.00 0.00 0.00 175.76 176.36 1xxh s LYS 110 N -0.79 2.77 0.02 0.00 3.01 -1.25 -4.84 119.74 118.66 1xxh s LYS 110 Ca 0.17 -0.56 0.03 0.00 -1.01 0.00 0.00 55.97 54.60 1xxh s LYS 110 Cb -0.13 -2.63 -0.02 0.00 -1.01 0.00 0.00 37.83 34.04 1xxh s LYS 110 CO 0.06 0.66 -0.10 0.14 0.51 0.00 0.00 175.35 176.62 1xxh s VAL 111 N -0.90 0.73 -0.03 3.17 -7.23 0.04 0.88 120.40 117.06 1xxh s VAL 111 Ca 0.14 -0.77 0.05 0.00 -1.81 0.00 0.00 61.98 59.60 1xxh s VAL 111 Cb -0.11 -0.69 -0.01 0.00 0.56 0.00 0.00 36.38 36.13 1xxh s VAL 111 CO 0.04 -0.06 -0.18 -0.69 -0.31 0.00 0.00 175.10 173.91 1xxh s VAL 112 N -0.76 1.44 0.01 1.32 1.01 0.08 -2.05 120.40 121.46 1xxh s VAL 112 Ca -0.01 -0.75 0.06 0.00 0.00 0.00 0.00 61.98 61.27 1xxh s VAL 112 Cb -0.07 -1.21 -0.02 0.00 0.00 0.00 0.00 36.38 35.08 1xxh s VAL 112 CO 0.00 0.41 -0.18 0.86 0.00 0.00 0.00 175.10 176.19 1xxh s TRP 113 N -0.21 1.63 -0.09 5.22 -0.00 -0.63 0.77 118.94 125.63 1xxh s TRP 113 Ca 0.02 -0.33 0.03 0.00 -0.00 0.00 0.00 56.10 55.81 1xxh s TRP 113 Cb -0.09 -1.02 0.01 0.00 -0.00 0.00 0.00 33.47 32.37 1xxh s TRP 113 CO 0.01 0.01 -0.17 0.08 -0.00 0.00 0.00 176.95 176.88 1xxh s VAL 114 N -0.57 1.58 0.00 5.86 1.01 -0.00 -0.27 120.40 128.01 1xxh s VAL 114 Ca 0.07 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 61.33 1xxh s VAL 114 Cb -0.08 -1.41 0.00 0.00 0.00 0.00 0.00 36.38 34.90 1xxh s VAL 114 CO 0.00 0.45 0.66 0.41 0.00 0.00 0.00 175.10 176.63 1xxh n THR 115 N 3.88 0.00 -3.57 3.92 -1.04 -1.20 -2.81 114.28 113.47 1xxh n THR 115 Ca -0.20 1.16 -0.29 0.00 -2.04 0.00 0.00 64.05 62.68 1xxh n THR 115 Cb 0.52 -1.91 -0.15 0.00 -1.82 0.00 0.00 70.33 66.97 1xxh n THR 115 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1xxh s ASP 116 N -2.50 3.56 0.45 8.00 -1.08 -1.15 -4.31 116.67 119.63 1xxh s ASP 116 Ca 0.00 -1.31 0.29 0.00 -0.52 0.00 0.00 52.55 51.02 1xxh s ASP 116 Cb 0.00 -0.41 1.38 0.00 -1.46 0.00 0.00 42.92 42.43 1xxh s ASP 116 CO 0.00 -0.43 1.68 0.00 0.52 0.00 0.00 175.17 176.94 1xxh h ALA 117 N 8.37 2.74 0.00 3.66 0.00 -1.58 0.24 119.26 132.69 1xxh h ALA 117 Ca -0.19 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1xxh h ALA 117 Cb 1.02 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1xxh h ALA 117 CO 0.44 -1.27 0.00 0.00 0.00 0.00 0.00 179.25 178.41 1xxh n ALA 118 N -2.57 2.28 -1.63 0.00 0.00 -1.26 -3.21 120.51 114.12 1xxh n ALA 118 Ca 0.33 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.83 1xxh n ALA 118 Cb 1.31 -1.00 0.12 0.00 0.00 0.00 0.00 19.45 19.88 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 0.04 1.88 -4.57 0.00 4.77 0.84 -5.06 117.00 114.89 1xxh n LEU 119 Ca 0.00 -2.85 -0.24 0.00 -0.03 0.00 0.00 56.01 52.88 1xxh n LEU 119 Cb 0.20 -0.33 -0.09 0.00 -2.33 0.00 0.00 43.42 40.88 1xxh n LEU 119 CO 0.00 0.84 -0.40 -1.48 -1.33 0.00 0.00 177.39 175.02 1xxh s LEU 120 N -2.08 2.94 0.69 2.23 2.34 -1.20 -0.18 118.68 123.42 1xxh s LEU 120 Ca 0.29 -0.74 -0.16 0.00 0.06 0.00 0.00 54.13 53.58 1xxh s LEU 120 Cb 0.28 -1.51 0.01 0.00 -0.56 0.00 0.00 46.19 44.42 1xxh s LEU 120 CO -0.04 0.04 1.21 -0.89 -1.06 0.00 0.00 176.35 175.61 1xxh s THR 121 N -2.19 2.44 0.34 5.48 2.01 -0.63 -4.76 115.64 118.33 1xxh s THR 121 Ca 0.29 0.23 0.05 0.00 0.31 0.00 0.00 61.69 62.57 1xxh s THR 121 Cb -0.07 -2.88 0.29 0.00 0.01 0.00 0.00 72.50 69.86 1xxh s THR 121 CO 0.17 -0.10 1.93 0.44 -0.69 0.00 0.00 174.62 176.37 1xxh h ASP 122 N 0.08 0.73 0.39 3.53 5.19 -2.00 0.71 116.42 125.05 1xxh h ASP 122 Ca -0.48 0.01 -0.23 0.00 -0.62 0.00 0.00 57.03 55.70 1xxh h ASP 122 Cb 1.30 -0.14 0.00 0.00 0.18 0.00 0.00 39.33 40.66 1xxh h ASP 122 CO 0.52 0.45 -0.99 0.00 -3.12 0.00 0.00 179.24 176.10 1xxh h ALA 123 N 1.58 0.33 -0.02 3.45 0.00 -1.96 -3.04 119.26 119.60 1xxh h ALA 123 Ca 0.36 -0.74 -0.06 0.00 0.00 0.00 0.00 54.91 54.47 1xxh h ALA 123 Cb 0.32 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1xxh h ALA 123 CO -0.13 0.84 -0.27 0.00 0.00 0.00 0.00 179.25 179.69 1xxh h ALA 124 N 0.72 1.53 0.37 0.00 0.00 -1.52 -0.56 119.26 119.80 1xxh h ALA 124 Ca -0.09 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 1xxh h ALA 124 Cb 1.64 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.38 1xxh h ALA 124 CO 0.17 0.35 -0.18 0.00 0.00 0.00 0.00 179.25 179.59 1xxh h ALA 125 N 1.71 -1.05 -0.90 0.00 0.00 -0.82 -2.92 119.26 115.28 1xxh h ALA 125 Ca 0.00 -0.11 0.17 0.00 0.00 0.00 0.00 54.91 54.97 1xxh h ALA 125 Cb 0.49 0.19 -0.10 0.00 0.00 0.00 0.00 17.79 18.37 1xxh h ALA 125 CO 0.04 -1.02 0.48 -0.91 0.00 0.00 0.00 179.25 177.84 1xxh h ASN 126 N -0.53 0.59 0.04 0.00 2.35 -1.42 0.42 115.58 117.02 1xxh h ASN 126 Ca -0.05 0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1xxh h ASN 126 Cb 0.38 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.76 1xxh h ASN 126 CO 0.08 0.22 0.00 0.00 -1.65 0.00 0.00 177.43 176.08 1xxh n ALA 127 N -2.40 1.06 -0.12 -0.83 0.00 -0.23 -2.53 120.51 115.45 1xxh n ALA 127 Ca 0.19 -0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.40 1xxh n ALA 127 Cb 0.49 -1.02 -0.09 0.00 0.00 0.00 0.00 19.45 18.84 1xxh n ALA 127 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1xxh n LEU 128 N -1.49 1.92 -0.31 0.00 7.94 0.15 -4.55 117.00 120.65 1xxh n LEU 128 Ca 0.00 0.38 0.00 0.00 -1.11 0.00 0.00 56.01 55.29 1xxh n LEU 128 Cb 0.01 -0.85 0.05 0.00 0.53 0.00 0.00 43.42 43.16 1xxh n LEU 128 CO 0.01 0.28 0.49 0.18 -1.11 0.00 0.00 177.39 177.24 1xxh n LEU 129 N -4.36 -0.49 -0.05 -1.96 4.32 -1.04 0.45 117.00 113.87 1xxh n LEU 129 Ca -0.39 1.41 0.24 0.00 -0.02 0.00 0.00 56.01 57.26 1xxh n LEU 129 Cb 0.73 -0.34 0.61 0.00 -1.62 0.00 0.00 43.42 42.80 1xxh n LEU 129 CO 0.10 -1.28 1.22 0.11 -1.22 0.00 0.00 177.39 176.32 1xxh h LYS 130 N 0.00 0.00 0.00 3.23 1.79 -1.80 0.34 116.57 120.13 1xxh h LYS 130 Ca 0.30 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.61 1xxh h LYS 130 Cb 0.50 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.13 1xxh h LYS 130 CO -0.81 0.00 -1.13 1.15 -1.08 0.00 0.00 179.45 177.58 1xxh h THR 131 N 0.00 0.73 0.00 -0.16 2.02 -0.26 -3.16 112.91 112.08 1xxh h THR 131 Ca 0.33 -2.23 0.00 0.00 0.77 0.00 0.00 66.41 65.28 1xxh h THR 131 Cb 1.94 2.24 0.00 0.00 -1.74 0.00 0.00 68.15 70.59 1xxh h THR 131 CO -0.00 0.42 -0.22 0.18 0.37 0.00 0.00 175.52 176.27 1xxh n LEU 132 N -3.04 0.74 0.02 2.58 4.77 0.12 -2.47 117.00 119.72 1xxh n LEU 132 Ca -0.06 0.45 -0.00 0.00 -0.03 0.00 0.00 56.01 56.36 1xxh n LEU 132 Cb 0.83 -0.28 -0.09 0.00 -2.33 0.00 0.00 43.42 41.56 1xxh n LEU 132 CO 0.43 -0.13 -0.34 -0.62 -1.33 0.00 0.00 177.39 175.40 1xxh n GLU 133 N -2.17 0.62 -3.24 3.23 1.02 -1.01 -4.31 120.64 114.78 1xxh n GLU 133 Ca 0.05 0.21 -0.26 0.00 -0.02 0.00 0.00 57.16 57.14 1xxh n GLU 133 Cb 0.43 -1.79 -0.06 0.00 -0.02 0.00 0.00 31.44 29.99 1xxh n GLU 133 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1xxh n GLU 134 N -2.88 2.43 -2.03 3.49 -0.58 -1.18 -5.09 120.64 114.81 1xxh n GLU 134 Ca -0.11 -4.48 -0.43 0.00 -0.42 0.00 0.00 57.16 51.73 1xxh n GLU 134 Cb 0.85 -2.09 -0.03 0.00 -0.57 0.00 0.00 31.44 29.60 1xxh n GLU 134 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 1xxh s PRO 135 N -2.63 3.53 -0.85 3.49 0.04 -1.03 -4.77 135.00 132.79 1xxh s PRO 135 Ca 0.42 1.56 -0.25 0.00 0.04 0.00 0.00 61.00 62.76 1xxh s PRO 135 Cb 0.20 -4.14 -0.16 0.00 0.04 0.00 0.00 34.50 30.44 1xxh s PRO 135 CO -0.06 -1.62 2.35 -2.30 0.04 0.00 0.00 177.00 175.40 1xxh n PRO 136 N 8.12 0.45 0.00 0.56 -0.02 -1.26 -4.76 135.00 138.10 1xxh n PRO 136 Ca 0.21 -0.98 0.00 0.00 -2.02 0.00 0.00 63.50 60.71 1xxh n PRO 136 Cb 0.46 -3.65 0.00 0.00 -0.02 0.00 0.00 33.50 30.29 1xxh n PRO 136 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xxh n ALA 137 N 18.52 -0.05 -2.44 3.55 0.00 -1.26 -2.98 120.51 135.85 1xxh n ALA 137 Ca 0.46 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.70 1xxh n ALA 137 Cb 0.43 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.87 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 0.02 -1.92 -3.67 0.00 1.02 -1.26 -4.98 120.64 109.84 1xxh n GLU 138 Ca 0.00 0.96 -0.20 0.00 -0.02 0.00 0.00 57.16 57.90 1xxh n GLU 138 Cb 0.00 -5.59 -0.03 0.00 -0.02 0.00 0.00 31.44 25.80 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 -3.01 3.57 -0.01 2.62 2.01 -1.16 -3.94 115.64 115.72 1xxh s THR 139 Ca 0.03 -1.26 -0.01 0.00 0.31 0.00 0.00 61.69 60.76 1xxh s THR 139 Cb -0.01 -3.22 0.00 0.00 0.01 0.00 0.00 72.50 69.28 1xxh s THR 139 CO 0.04 -0.15 0.03 0.26 -0.69 0.00 0.00 174.62 174.11 1xxh s TRP 140 N -2.29 -0.03 0.29 4.92 0.52 0.25 -4.77 118.94 117.83 1xxh s TRP 140 Ca 0.43 0.08 0.11 0.00 0.02 0.00 0.00 56.10 56.74 1xxh s TRP 140 Cb -0.07 0.01 -0.05 0.00 -1.15 0.00 0.00 33.47 32.21 1xxh s TRP 140 CO 0.28 -0.02 -0.18 -0.06 0.02 0.00 0.00 176.95 176.99 1xxh s PHE 141 N -0.00 2.28 -0.23 -1.98 0.40 -0.21 -0.74 117.98 117.50 1xxh s PHE 141 Ca -0.00 -0.36 -0.03 0.00 -0.60 0.00 0.00 56.93 55.93 1xxh s PHE 141 Cb -0.00 -1.04 0.12 0.00 0.51 0.00 0.00 43.02 42.61 1xxh s PHE 141 CO 0.00 0.69 0.32 -0.06 0.70 0.00 0.00 175.22 176.87 1xxh s PHE 142 N -2.54 -0.64 -0.08 0.36 0.08 0.23 -3.34 117.98 112.05 1xxh s PHE 142 Ca 0.30 0.62 -0.04 0.00 0.12 0.00 0.00 56.93 57.94 1xxh s PHE 142 Cb -0.04 -0.11 -0.04 0.00 -0.57 0.00 0.00 43.02 42.26 1xxh s PHE 142 CO 0.15 -0.68 0.08 -0.51 -0.10 0.00 0.00 175.22 174.16 1xxh s LEU 143 N 2.47 4.02 -0.07 -0.37 2.01 0.18 -0.82 118.68 126.09 1xxh s LEU 143 Ca 0.11 0.30 -0.01 0.00 0.01 0.00 0.00 54.13 54.53 1xxh s LEU 143 Cb -0.16 -2.03 0.03 0.00 0.01 0.00 0.00 46.19 44.04 1xxh s LEU 143 CO -0.14 0.37 -0.01 0.00 1.01 0.00 0.00 176.35 177.57 1xxh s ALA 144 N -1.01 0.79 -0.11 4.21 0.00 -1.12 -0.25 121.76 124.25 1xxh s ALA 144 Ca 0.16 -0.18 -0.07 0.00 0.00 0.00 0.00 51.96 51.87 1xxh s ALA 144 Cb -0.12 -0.73 0.04 0.00 0.00 0.00 0.00 23.12 22.31 1xxh s ALA 144 CO 0.06 -0.41 0.28 0.99 0.00 0.00 0.00 175.76 176.68 1xxh s THR 145 N 1.82 -0.02 0.39 0.00 2.01 -0.88 -1.67 115.64 117.29 1xxh s THR 145 Ca 0.03 0.09 0.18 0.00 0.31 0.00 0.00 61.69 62.31 1xxh s THR 145 Cb -0.12 -0.41 0.19 0.00 0.01 0.00 0.00 72.50 72.16 1xxh s THR 145 CO -0.05 0.04 1.94 0.08 -0.69 0.00 0.00 174.62 175.94 1xxh h ARG 146 N 6.66 0.00 -3.33 4.92 0.11 -1.84 -3.31 114.38 117.58 1xxh h ARG 146 Ca -0.35 0.00 -0.54 0.00 0.10 0.00 0.00 59.98 59.19 1xxh h ARG 146 Cb 1.17 0.00 -0.40 0.00 1.11 0.00 0.00 29.97 31.85 1xxh h ARG 146 CO 0.35 0.24 -0.76 -2.00 0.10 0.00 0.00 179.97 177.89 1xxh s GLU 147 N -4.26 0.52 0.00 0.08 2.12 -1.26 -4.55 118.70 111.35 1xxh s GLU 147 Ca -0.03 -0.65 0.24 0.00 0.36 0.00 0.00 54.97 54.89 1xxh s GLU 147 Cb 0.14 -1.82 1.17 0.00 0.26 0.00 0.00 34.13 33.88 1xxh s GLU 147 CO 0.67 -0.86 1.79 -0.35 -0.54 0.00 0.00 175.26 175.98 1xxh n PRO 148 N 5.04 0.26 -0.02 4.30 -0.04 -1.26 -3.57 135.00 139.71 1xxh n PRO 148 Ca -0.06 0.07 -0.16 0.00 -0.04 0.00 0.00 63.50 63.31 1xxh n PRO 148 Cb 0.44 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.29 1xxh n PRO 148 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1xxh h GLU 149 N 0.00 0.21 -1.47 0.54 4.22 -1.97 -3.19 114.58 112.93 1xxh h GLU 149 Ca 0.00 -0.23 0.00 0.00 0.08 0.00 0.00 59.36 59.21 1xxh h GLU 149 Cb 0.27 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1xxh h GLU 149 CO 0.00 0.96 0.00 0.54 -2.18 0.00 0.00 179.01 178.33 1xxh n ARG 150 N -4.45 0.49 -4.06 1.92 1.74 -1.23 -4.58 116.66 106.47 1xxh n ARG 150 Ca -0.10 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.69 1xxh n ARG 150 Cb 0.54 -1.26 -0.17 0.00 -1.02 0.00 0.00 32.46 30.55 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 0.00 1.58 -0.12 0.55 2.96 -1.21 -4.74 118.68 117.70 1xxh s LEU 151 Ca 0.00 -0.44 -0.17 0.00 -0.22 0.00 0.00 54.13 53.30 1xxh s LEU 151 Cb 0.00 -1.09 -0.08 0.00 0.50 0.00 0.00 46.19 45.52 1xxh s LEU 151 CO 0.00 -0.06 0.54 0.18 -1.32 0.00 0.00 176.35 175.69 1xxh n LEU 152 N 4.72 0.30 0.20 -0.68 4.77 -1.26 -4.59 117.00 120.45 1xxh n LEU 152 Ca -0.16 0.45 0.13 0.00 -0.03 0.00 0.00 56.01 56.40 1xxh n LEU 152 Cb 0.50 -0.34 0.73 0.00 -2.33 0.00 0.00 43.42 41.97 1xxh n LEU 152 CO 0.21 -0.47 1.12 0.00 -1.33 0.00 0.00 177.39 176.92 1xxh h ALA 153 N 1.64 2.01 -0.02 -1.18 0.00 -1.94 -0.89 119.26 118.88 1xxh h ALA 153 Ca -0.18 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.53 1xxh h ALA 153 Cb 0.53 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1xxh h ALA 153 CO 0.33 -0.20 -0.83 0.00 0.00 0.00 0.00 179.25 178.55 1xxh h THR 154 N 0.00 1.44 0.01 0.00 1.03 -2.00 -3.09 112.91 110.30 1xxh h THR 154 Ca 0.07 -2.42 -0.00 0.00 -0.01 0.00 0.00 66.41 64.05 1xxh h THR 154 Cb 0.31 2.34 0.00 0.00 -1.07 0.00 0.00 68.15 69.73 1xxh h THR 154 CO -0.00 0.71 -0.01 0.25 -0.01 0.00 0.00 175.52 176.47 1xxh h LEU 155 N 0.17 -0.01 0.00 0.00 7.12 -1.57 -3.08 115.31 117.94 1xxh h LEU 155 Ca -0.04 -0.79 0.00 0.00 0.13 0.00 0.00 57.88 57.18 1xxh h LEU 155 Cb 1.43 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 41.57 1xxh h LEU 155 CO 0.13 0.82 0.00 -2.11 -0.13 0.00 0.00 178.44 177.15 1xxh n ARG 156 N -4.69 0.04 0.05 1.25 1.85 -0.46 -1.72 116.66 112.98 1xxh n ARG 156 Ca -0.09 0.22 -0.07 0.00 -1.00 0.00 0.00 57.85 56.91 1xxh n ARG 156 Cb 0.39 -1.50 -0.05 0.00 -1.05 0.00 0.00 32.46 30.25 1xxh n ARG 156 CO 0.00 0.00 0.00 0.77 -0.01 0.00 0.00 177.63 178.39 1xxh h SER 157 N 0.00 -0.20 0.02 2.89 0.02 -1.44 -3.26 113.55 111.58 1xxh h SER 157 Ca 0.00 -0.19 0.00 0.00 -0.84 0.00 0.00 61.79 60.76 1xxh h SER 157 Cb 0.02 0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.61 1xxh h SER 157 CO 0.00 0.34 0.00 0.54 -1.14 0.00 0.00 176.83 176.57 1xxh n ARG 158 N -4.92 0.03 -4.24 3.45 5.12 -0.70 -4.71 116.66 110.69 1xxh n ARG 158 Ca -0.05 0.22 -0.25 0.00 -1.93 0.00 0.00 57.85 55.84 1xxh n ARG 158 Cb 0.19 -1.50 -0.08 0.00 -1.16 0.00 0.00 32.46 29.91 1xxh n ARG 158 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1xxh s ARG 160 N -3.23 2.98 -0.28 0.00 3.52 -1.18 -4.94 118.95 115.82 1xxh s ARG 160 Ca 0.29 -1.04 -0.29 0.00 -0.13 0.00 0.00 55.73 54.56 1xxh s ARG 160 Cb -0.08 -3.99 -0.00 0.00 -1.56 0.00 0.00 34.95 29.31 1xxh s ARG 160 CO 0.19 -0.78 1.31 -0.51 -0.81 0.00 0.00 175.30 174.69 1xxh s LEU 161 N 1.70 3.92 -0.22 -0.88 1.02 -1.26 -2.89 118.68 120.06 1xxh s LEU 161 Ca 0.05 1.28 -0.05 0.00 0.02 0.00 0.00 54.13 55.43 1xxh s LEU 161 Cb -0.19 -3.54 -0.02 0.00 0.02 0.00 0.00 46.19 42.45 1xxh s LEU 161 CO 0.10 -1.05 0.01 -2.28 0.02 0.00 0.00 176.35 173.15 1xxh s HIS 162 N 4.30 3.03 -0.38 0.29 2.46 -0.59 -5.01 115.29 119.40 1xxh s HIS 162 Ca 0.57 -0.55 -0.16 0.00 0.47 0.00 0.00 55.06 55.38 1xxh s HIS 162 Cb -0.17 -2.13 0.00 0.00 -0.13 0.00 0.00 32.58 30.15 1xxh s HIS 162 CO 0.22 -0.34 0.39 -0.47 -2.47 0.00 0.00 174.74 172.07 1xxh s TYR 163 N 1.27 3.20 -1.46 3.88 5.04 -1.26 -2.00 117.35 126.01 1xxh s TYR 163 Ca 0.04 -0.19 -0.14 0.00 -2.44 0.00 0.00 57.07 54.34 1xxh s TYR 163 Cb -0.15 -2.75 0.04 0.00 0.35 0.00 0.00 41.96 39.45 1xxh s TYR 163 CO 0.01 -0.54 2.25 -0.11 -1.34 0.00 0.00 175.55 175.82 1xxh n LEU 164 N 5.45 6.95 -4.25 6.97 7.94 -0.56 -4.95 117.00 134.55 1xxh n LEU 164 Ca -0.08 -4.17 -0.42 0.00 -1.11 0.00 0.00 56.01 50.22 1xxh n LEU 164 Cb 0.48 -1.65 -0.01 0.00 0.53 0.00 0.00 43.42 42.78 1xxh n LEU 164 CO 0.43 1.16 -0.38 0.00 -1.11 0.00 0.00 177.39 177.49 1xxh n ALA 165 N 5.89 -2.96 -2.42 1.96 0.00 -1.26 -4.70 120.51 117.02 1xxh n ALA 165 Ca 0.53 0.15 -0.43 0.00 0.00 0.00 0.00 53.44 53.69 1xxh n ALA 165 Cb 0.38 -1.47 -0.02 0.00 0.00 0.00 0.00 19.45 18.34 1xxh n ALA 165 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1xxh s PRO 166 N -0.99 4.27 0.21 0.00 0.04 -1.26 -4.98 135.00 132.29 1xxh s PRO 166 Ca 0.59 1.69 -0.32 0.00 0.04 0.00 0.00 61.00 62.99 1xxh s PRO 166 Cb -0.66 -3.70 -0.13 0.00 0.04 0.00 0.00 34.50 30.04 1xxh s PRO 166 CO 0.61 -0.63 1.56 -2.30 0.04 0.00 0.00 177.00 176.28 1xxh n PRO 167 N 6.17 2.32 -1.34 0.56 -0.02 -1.26 -4.87 135.00 136.56 1xxh n PRO 167 Ca 0.13 0.83 -0.44 0.00 -2.02 0.00 0.00 63.50 62.00 1xxh n PRO 167 Cb 0.45 -2.59 -0.01 0.00 -0.02 0.00 0.00 33.50 31.33 1xxh n PRO 167 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1xxh n PRO 168 N 2.95 0.00 0.05 0.52 -0.02 -1.26 -4.64 135.00 132.61 1xxh n PRO 168 Ca 0.14 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.60 1xxh n PRO 168 Cb 0.32 -1.00 0.25 0.00 -0.02 0.00 0.00 33.50 33.05 1xxh n PRO 168 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 1xxh h GLU 169 N 0.61 0.38 0.00 -0.52 4.11 -1.95 -1.95 114.58 115.26 1xxh h GLU 169 Ca -0.33 -0.13 -0.01 0.00 0.07 0.00 0.00 59.36 58.96 1xxh h GLU 169 Cb 1.44 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.66 1xxh h GLU 169 CO 0.51 0.61 -0.03 1.96 0.07 0.00 0.00 179.01 182.13 1xxh h GLN 170 N 0.34 0.00 0.07 1.06 4.20 -2.00 -0.80 115.11 117.97 1xxh h GLN 170 Ca 0.05 0.00 -0.30 0.00 0.06 0.00 0.00 58.65 58.47 1xxh h GLN 170 Cb 0.63 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.39 1xxh h GLN 170 CO 0.05 0.03 -1.60 1.88 -0.67 0.00 0.00 178.83 178.52 1xxh h TYR 171 N 0.00 0.27 -0.70 2.96 0.99 -1.88 -3.24 116.97 115.37 1xxh h TYR 171 Ca -0.00 -0.19 0.15 0.00 2.00 0.00 0.00 58.73 60.69 1xxh h TYR 171 Cb 0.06 -0.01 -0.12 0.00 1.00 0.00 0.00 36.73 37.66 1xxh h TYR 171 CO 0.00 1.63 0.03 0.00 -0.00 0.00 0.00 178.16 179.82 1xxh h ALA 172 N -0.19 0.74 -0.29 3.88 0.00 -0.99 0.16 119.26 122.57 1xxh h ALA 172 Ca -0.38 0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 1xxh h ALA 172 Cb 1.68 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 19.81 1xxh h ALA 172 CO -0.05 -0.40 0.08 0.28 0.00 0.00 0.00 179.25 179.17 1xxh h VAL 173 N 0.14 1.21 -0.08 0.00 2.07 -1.32 -1.87 116.25 116.40 1xxh h VAL 173 Ca 0.38 -0.67 0.03 0.00 0.82 0.00 0.00 66.70 67.25 1xxh h VAL 173 Cb 0.64 1.10 -0.06 0.00 -1.52 0.00 0.00 31.29 31.45 1xxh h VAL 173 CO -0.58 0.22 -0.51 0.74 0.02 0.00 0.00 177.57 177.45 1xxh h THR 174 N 0.31 0.00 -0.98 2.57 2.02 -0.82 0.14 112.91 116.15 1xxh h THR 174 Ca 0.09 0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.44 1xxh h THR 174 Cb 0.26 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 66.58 1xxh h THR 174 CO -0.00 0.00 0.61 -0.25 0.37 0.00 0.00 175.52 176.25 1xxh h TRP 175 N -0.58 1.00 -0.52 3.16 2.91 -0.86 -1.33 115.95 119.73 1xxh h TRP 175 Ca 0.02 0.03 -0.05 0.00 1.13 0.00 0.00 58.89 60.03 1xxh h TRP 175 Cb 0.66 -0.31 -0.02 0.00 -0.51 0.00 0.00 29.16 28.98 1xxh h TRP 175 CO -0.56 0.30 0.13 -0.07 -1.03 0.00 0.00 178.44 177.22 1xxh h LEU 176 N 0.78 0.78 0.00 0.65 3.38 -0.25 -2.63 115.31 118.02 1xxh h LEU 176 Ca 0.53 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 58.27 1xxh h LEU 176 Cb 0.79 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1xxh h LEU 176 CO -0.30 0.80 0.00 -1.54 0.09 0.00 0.00 178.44 177.49 1xxh n SER 177 N -4.45 0.00 -0.02 -0.43 3.41 0.33 -0.16 113.62 112.30 1xxh n SER 177 Ca 0.02 0.02 0.03 0.00 -0.26 0.00 0.00 58.87 58.68 1xxh n SER 177 Cb 0.22 -0.02 -0.10 0.00 -0.26 0.00 0.00 64.21 64.05 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 -0.97 0.84 0.07 4.33 1.74 -0.99 -4.58 116.66 117.10 1xxh n ARG 178 Ca 0.00 -0.09 -0.16 0.00 -0.77 0.00 0.00 57.85 56.83 1xxh n ARG 178 Cb 0.00 -1.30 -0.14 0.00 -1.02 0.00 0.00 32.46 30.00 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 0.00 0.26 -2.62 5.56 4.39 -0.60 -3.47 114.58 118.10 1xxh h GLU 179 Ca -0.09 -0.44 -0.11 0.00 0.34 0.00 0.00 59.36 59.07 1xxh h GLU 179 Cb 0.89 0.16 -0.23 0.00 -0.10 0.00 0.00 28.75 29.47 1xxh h GLU 179 CO 0.00 1.14 -0.17 0.14 -1.16 0.00 0.00 179.01 178.97 1xxh s VAL 180 N -2.63 0.00 -0.14 3.13 -7.23 -1.08 -5.13 120.40 107.33 1xxh s VAL 180 Ca -0.07 -0.01 -0.19 0.00 -1.81 0.00 0.00 61.98 59.89 1xxh s VAL 180 Cb 0.07 -0.65 -0.04 0.00 0.56 0.00 0.00 36.38 36.32 1xxh s VAL 180 CO 0.86 -0.01 0.51 0.42 -0.31 0.00 0.00 175.10 176.57 1xxh s THR 181 N 0.18 5.16 0.40 5.32 -4.23 -1.26 -4.46 115.64 116.74 1xxh s THR 181 Ca -0.01 0.99 -0.22 0.00 -1.18 0.00 0.00 61.69 61.27 1xxh s THR 181 Cb -0.03 -3.84 -0.11 0.00 1.34 0.00 0.00 72.50 69.86 1xxh s THR 181 CO 0.01 0.28 0.94 -0.94 -0.54 0.00 0.00 174.62 174.37 1xxh s SER 183 N 0.77 7.06 0.40 3.99 1.04 -1.26 -5.19 113.70 120.50 1xxh s SER 183 Ca 0.26 1.73 0.11 0.00 0.48 0.00 0.00 55.95 58.54 1xxh s SER 183 Cb -0.15 -2.55 0.82 0.00 0.10 0.00 0.00 66.02 64.24 1xxh s SER 183 CO 0.11 -0.27 1.91 -0.61 0.98 0.00 0.00 173.24 175.36 1xxh h GLN 184 N 2.29 0.12 -0.52 4.02 4.15 -2.01 -1.84 115.11 121.33 1xxh h GLN 184 Ca -0.48 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 58.89 1xxh h GLN 184 Cb 1.18 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.83 1xxh h GLN 184 CO 0.62 0.33 0.26 -0.44 -1.93 0.00 0.00 178.83 177.67 1xxh h ASP 185 N 0.11 0.68 -0.22 -0.69 3.45 -1.98 0.15 116.42 117.91 1xxh h ASP 185 Ca 0.02 -0.12 -0.01 0.00 0.43 0.00 0.00 57.03 57.35 1xxh h ASP 185 Cb 0.43 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 39.02 1xxh h ASP 185 CO 0.03 0.61 0.11 0.00 -1.57 0.00 0.00 179.24 178.42 1xxh h ALA 186 N 1.09 0.28 -0.10 3.45 0.00 -1.80 -2.02 119.26 120.17 1xxh h ALA 186 Ca 0.18 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.03 1xxh h ALA 186 Cb 0.11 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1xxh h ALA 186 CO -0.02 -0.17 -0.03 -0.07 0.00 0.00 0.00 179.25 178.96 1xxh h LEU 187 N 0.23 -0.11 -1.91 0.00 3.38 -1.00 -0.47 115.31 115.43 1xxh h LEU 187 Ca 0.08 0.03 0.15 0.00 0.09 0.00 0.00 57.88 58.23 1xxh h LEU 187 Cb 0.10 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 1xxh h LEU 187 CO -0.01 -0.04 0.40 0.25 0.09 0.00 0.00 178.44 179.13 1xxh h LEU 188 N -0.01 0.08 0.35 1.67 5.85 -0.54 -2.21 115.31 120.51 1xxh h LEU 188 Ca 0.05 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 1xxh h LEU 188 Cb 0.08 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.10 1xxh h LEU 188 CO -0.11 0.04 -0.17 0.00 -0.34 0.00 0.00 178.44 177.87 1xxh h ALA 189 N 1.72 -0.55 -0.39 1.25 0.00 -0.39 -2.71 119.26 118.19 1xxh h ALA 189 Ca 0.27 -0.10 0.11 0.00 0.00 0.00 0.00 54.91 55.19 1xxh h ALA 189 Cb 0.95 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 1xxh h ALA 189 CO -0.03 -0.52 0.70 0.00 0.00 0.00 0.00 179.25 179.41 1xxh h ALA 190 N -1.32 2.11 0.13 0.00 0.00 -0.82 0.52 119.26 119.88 1xxh h ALA 190 Ca -0.05 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1xxh h ALA 190 Cb 0.36 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1xxh h ALA 190 CO 0.08 -0.90 -0.06 1.25 0.00 0.00 0.00 179.25 179.61 1xxh h LEU 191 N 0.00 -0.15 -2.40 0.00 5.85 -1.41 -3.29 115.31 113.92 1xxh h LEU 191 Ca 0.18 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.93 1xxh h LEU 191 Cb 1.59 0.04 -0.00 0.00 0.37 0.00 0.00 40.66 42.65 1xxh h LEU 191 CO -0.00 0.18 0.07 0.03 -0.34 0.00 0.00 178.44 178.38 1xxh h ARG 192 N -0.75 0.00 -0.99 1.25 3.08 -0.76 0.75 114.38 116.96 1xxh h ARG 192 Ca -0.02 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.97 1xxh h ARG 192 Cb 0.13 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.15 1xxh h ARG 192 CO 0.03 0.00 0.08 1.28 -1.07 0.00 0.00 179.97 180.29 1xxh n LEU 193 N -3.81 3.23 -0.04 3.04 4.77 0.16 -2.53 117.00 121.83 1xxh n LEU 193 Ca -0.02 -1.65 0.00 0.00 -0.03 0.00 0.00 56.01 54.32 1xxh n LEU 193 Cb 0.16 -0.55 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 1xxh n LEU 193 CO 0.27 0.53 0.03 -1.20 -1.33 0.00 0.00 177.39 175.70 1xxh n SER 194 N 0.23 0.00 -0.28 -1.43 7.64 0.13 -4.92 113.62 114.99 1xxh n SER 194 Ca 0.08 -1.00 -0.04 0.00 1.01 0.00 0.00 58.87 58.92 1xxh n SER 194 Cb 0.63 -0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.81 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 0.00 -0.06 0.00 -0.43 0.00 -1.05 -3.21 120.51 115.76 1xxh n ALA 195 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1xxh n ALA 195 Cb 0.50 -0.75 0.00 0.00 0.00 0.00 0.00 19.45 19.21 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 -2.08 0.51 3.58 0.00 0.00 -0.47 -4.96 105.19 101.77 1xxh n GLY 196 Ca -0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 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 -1.92 5.64 0.39 1.61 0.15 -1.20 -4.71 113.70 113.67 1xxh s SER 197 Ca 0.00 0.83 0.13 0.00 0.70 0.00 0.00 55.95 57.61 1xxh s SER 197 Cb 0.00 -2.53 0.94 0.00 -1.71 0.00 0.00 66.02 62.72 1xxh s SER 197 CO 0.00 -1.99 1.89 -0.65 1.20 0.00 0.00 173.24 173.69 1xxh h PRO 198 N 13.67 0.53 0.00 5.44 0.11 -1.89 -2.33 132.00 147.54 1xxh h PRO 198 Ca -0.30 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1xxh h PRO 198 Cb 1.16 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1xxh h PRO 198 CO 1.12 0.35 0.00 0.41 -0.21 0.00 0.00 178.00 179.67 1xxh n GLY 199 N -1.48 -2.81 0.23 -0.55 0.00 -0.09 -0.39 105.19 100.10 1xxh n GLY 199 Ca 0.16 0.22 -0.00 0.00 0.00 0.00 0.00 46.02 46.40 1xxh n GLY 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xxh h ALA 200 N -1.74 0.49 -0.89 4.61 0.00 -1.63 0.42 119.26 120.52 1xxh h ALA 200 Ca 0.00 0.21 0.24 0.00 0.00 0.00 0.00 54.91 55.36 1xxh h ALA 200 Cb 0.00 0.39 -0.14 0.00 0.00 0.00 0.00 17.79 18.04 1xxh h ALA 200 CO 0.00 -0.42 0.31 0.00 0.00 0.00 0.00 179.25 179.14 1xxh h ALA 201 N 1.58 1.38 -0.33 0.00 0.00 -1.22 1.01 119.26 121.68 1xxh h ALA 201 Ca 0.30 0.21 -0.02 0.00 0.00 0.00 0.00 54.91 55.40 1xxh h ALA 201 Cb 0.48 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1xxh h ALA 201 CO -0.57 -0.45 0.13 1.25 0.00 0.00 0.00 179.25 179.61 1xxh h LEU 202 N 0.26 0.45 -1.26 0.00 7.12 0.26 -2.53 115.31 119.63 1xxh h LEU 202 Ca 0.57 -0.17 0.08 0.00 0.13 0.00 0.00 57.88 58.49 1xxh h LEU 202 Cb 1.16 -0.12 -0.06 0.00 -0.53 0.00 0.00 40.66 41.12 1xxh h LEU 202 CO -0.62 0.50 0.54 0.00 -0.13 0.00 0.00 178.44 178.73 1xxh h ALA 203 N 0.97 1.65 0.00 1.25 0.00 0.23 -1.39 119.26 121.97 1xxh h ALA 203 Ca 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1xxh h ALA 203 Cb 0.19 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1xxh h ALA 203 CO -0.01 0.20 0.26 -0.07 0.00 0.00 0.00 179.25 179.64 1xxh h LEU 204 N 0.86 0.00 0.00 0.00 4.07 -0.11 -2.74 115.31 117.39 1xxh h LEU 204 Ca 0.37 0.00 -0.36 0.00 0.08 0.00 0.00 57.88 57.97 1xxh h LEU 204 Cb 0.32 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 42.01 1xxh h LEU 204 CO -0.14 0.00 -2.19 0.49 -1.08 0.00 0.00 178.44 175.51 1xxh n PHE 205 N -2.39 0.00 -0.20 1.13 3.72 -0.54 -2.91 117.46 116.26 1xxh n PHE 205 Ca -0.01 0.00 0.24 0.00 -0.05 0.00 0.00 57.45 57.63 1xxh n PHE 205 Cb 0.29 -0.79 0.37 0.00 -0.94 0.00 0.00 39.48 38.41 1xxh n PHE 205 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1xxh n GLN 206 N -4.02 0.01 0.00 -1.08 10.64 -1.03 -4.11 117.38 117.79 1xxh n GLN 206 Ca -0.43 0.82 0.00 0.00 -1.83 0.00 0.00 57.00 55.56 1xxh n GLN 206 Cb 0.80 -2.02 0.00 0.00 -0.86 0.00 0.00 30.24 28.15 1xxh n GLN 206 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1xxh n GLY 207 N -1.54 1.43 0.00 2.61 0.00 -1.25 -4.99 105.19 101.45 1xxh n GLY 207 Ca 0.20 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.85 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 0.00 0.98 -0.20 1.61 5.75 -1.26 -4.82 116.55 118.61 1xxh n ASP 208 Ca 0.00 -1.17 -0.01 0.00 -0.01 0.00 0.00 54.79 53.60 1xxh n ASP 208 Cb 0.00 0.00 0.06 0.00 -1.03 0.00 0.00 41.12 40.15 1xxh n ASP 208 CO 0.00 0.00 0.00 0.78 -0.11 0.00 0.00 177.20 177.87 1xxh h ASN 209 N 0.00 -0.60 -0.04 -1.12 2.35 -1.81 -1.02 115.58 113.34 1xxh h ASN 209 Ca 0.00 0.19 0.01 0.00 -0.55 0.00 0.00 56.30 55.95 1xxh h ASN 209 Cb 0.20 0.39 -0.00 0.00 0.05 0.00 0.00 38.32 38.96 1xxh h ASN 209 CO 0.00 -0.21 0.04 -0.25 -1.65 0.00 0.00 177.43 175.36 1xxh h TRP 210 N -0.01 0.00 0.00 1.19 2.91 -1.81 0.99 115.95 119.21 1xxh h TRP 210 Ca 0.29 0.00 -0.15 0.00 1.13 0.00 0.00 58.89 60.16 1xxh h TRP 210 Cb 0.45 0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 29.08 1xxh h TRP 210 CO -0.51 0.00 -0.79 1.96 -1.03 0.00 0.00 178.44 178.08 1xxh h GLN 211 N 0.00 0.00 0.00 2.65 1.08 -1.56 -2.55 115.11 114.74 1xxh h GLN 211 Ca 0.02 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.21 1xxh h GLN 211 Cb 0.10 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.53 1xxh h GLN 211 CO -0.00 0.60 -0.03 0.00 -0.95 0.00 0.00 178.83 178.44 1xxh h ALA 212 N 1.35 0.98 0.00 3.87 0.00 -0.24 -2.48 119.26 122.74 1xxh h ALA 212 Ca -0.04 -0.03 -0.25 0.00 0.00 0.00 0.00 54.91 54.60 1xxh h ALA 212 Cb 1.53 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 19.27 1xxh h ALA 212 CO 0.08 0.04 -1.38 -0.09 0.00 0.00 0.00 179.25 177.90 1xxh h ARG 213 N 0.00 0.00 0.00 0.00 1.12 -0.92 -3.18 114.38 111.40 1xxh h ARG 213 Ca -0.00 0.00 -0.11 0.00 -1.11 0.00 0.00 59.98 58.76 1xxh h ARG 213 Cb 0.89 0.00 -0.02 0.00 -0.01 0.00 0.00 29.97 30.83 1xxh h ARG 213 CO 0.00 0.66 -0.53 1.49 -3.11 0.00 0.00 179.97 178.48 1xxh h GLU 214 N 0.00 0.00 -0.86 0.20 4.81 -1.29 -2.14 114.58 115.29 1xxh h GLU 214 Ca -0.17 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.05 1xxh h GLU 214 Cb 1.87 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 31.21 1xxh h GLU 214 CO 0.09 0.53 0.50 1.15 -0.73 0.00 0.00 179.01 180.55 1xxh h THR 215 N 0.00 1.25 -0.29 0.32 2.02 -1.44 -2.32 112.91 112.45 1xxh h THR 215 Ca -0.01 -0.58 -0.11 0.00 0.77 0.00 0.00 66.41 66.49 1xxh h THR 215 Cb 0.95 0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 1xxh h THR 215 CO 0.07 0.27 -0.24 0.25 0.37 0.00 0.00 175.52 176.23 1xxh h LEU 216 N 1.19 0.72 -0.07 2.58 6.46 -1.42 -2.30 115.31 122.47 1xxh h LEU 216 Ca 0.31 -0.45 0.00 0.00 -0.12 0.00 0.00 57.88 57.61 1xxh h LEU 216 Cb -0.01 -0.20 0.00 0.00 -0.73 0.00 0.00 40.66 39.72 1xxh h LEU 216 CO -0.05 1.02 0.00 0.00 -0.62 0.00 0.00 178.44 178.79 1xxh n GLN 218 N -1.56 0.63 0.20 0.00 6.02 -0.90 -3.37 117.38 118.40 1xxh n GLN 218 Ca 0.02 0.29 0.14 0.00 -0.01 0.00 0.00 57.00 57.44 1xxh n GLN 218 Cb 0.11 -1.59 0.42 0.00 1.02 0.00 0.00 30.24 30.21 1xxh n GLN 218 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1xxh h ALA 219 N -0.41 1.00 0.07 -1.58 0.00 -1.27 -3.12 119.26 113.94 1xxh h ALA 219 Ca -0.55 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.05 1xxh h ALA 219 Cb 1.72 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.48 1xxh h ALA 219 CO -0.19 0.00 -1.71 1.25 0.00 0.00 0.00 179.25 178.60 1xxh h LEU 220 N 0.00 0.23 -0.45 0.00 7.12 -1.42 -2.73 115.31 118.05 1xxh h LEU 220 Ca 0.00 -0.42 0.00 0.00 0.13 0.00 0.00 57.88 57.59 1xxh h LEU 220 Cb 0.70 -0.07 0.00 0.00 -0.53 0.00 0.00 40.66 40.75 1xxh h LEU 220 CO 0.00 1.37 0.00 0.00 -0.13 0.00 0.00 178.44 179.68 1xxh n ALA 221 N -2.70 1.51 -0.09 1.25 0.00 -1.18 -0.84 120.51 118.46 1xxh n ALA 221 Ca -0.20 0.04 -0.10 0.00 0.00 0.00 0.00 53.44 53.18 1xxh n ALA 221 Cb 1.04 -1.28 -0.16 0.00 0.00 0.00 0.00 19.45 19.06 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 -1.89 0.13 -0.01 0.00 9.36 -1.20 -4.40 117.16 119.17 1xxh n TYR 222 Ca 0.02 0.05 -0.17 0.00 3.32 0.00 0.00 57.90 61.12 1xxh n TYR 222 Cb 0.16 -1.02 -0.12 0.00 -0.63 0.00 0.00 39.34 37.73 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 0.00 0.37 -0.10 2.98 0.02 -0.91 -2.90 113.55 113.01 1xxh h SER 223 Ca -0.52 -0.81 0.04 0.00 -0.84 0.00 0.00 61.79 59.67 1xxh h SER 223 Cb 2.21 -0.11 -0.06 0.00 0.14 0.00 0.00 62.40 64.58 1xxh h SER 223 CO 0.03 1.13 -0.41 0.58 -1.14 0.00 0.00 176.83 177.03 1xxh h VAL 224 N -0.35 0.16 -0.19 2.27 2.07 -1.22 2.26 116.25 121.26 1xxh h VAL 224 Ca -0.06 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.41 1xxh h VAL 224 Cb 1.22 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 1xxh h VAL 224 CO 0.09 0.00 -0.06 1.55 0.02 0.00 0.00 177.57 179.17 1xxh h PRO 225 N -0.50 0.37 -0.17 1.57 0.13 -1.77 -3.14 132.00 128.49 1xxh h PRO 225 Ca 0.07 -0.15 -0.09 0.00 -0.87 0.00 0.00 66.00 64.97 1xxh h PRO 225 Cb 0.63 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.72 1xxh h PRO 225 CO -0.37 0.64 -0.27 0.66 -0.23 0.00 0.00 178.00 178.43 1xxh h SER 226 N 0.07 0.32 0.00 1.44 4.64 -1.33 -3.46 113.55 115.23 1xxh h SER 226 Ca 0.05 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 1xxh h SER 226 Cb 0.51 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 1xxh h SER 226 CO 0.02 0.60 0.00 0.61 -0.87 0.00 0.00 176.83 177.19 1xxh n GLY 227 N -0.45 1.89 3.53 -0.77 0.00 0.76 -4.99 105.19 105.16 1xxh n GLY 227 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.22 6.21 0.00 1.61 -1.08 -1.11 -4.78 116.67 115.29 1xxh s ASP 228 Ca 0.00 -0.69 0.25 0.00 -0.52 0.00 0.00 52.55 51.59 1xxh s ASP 228 Cb 0.00 -2.53 0.46 0.00 -1.46 0.00 0.00 42.92 39.39 1xxh s ASP 228 CO 0.00 -1.71 1.40 0.79 0.52 0.00 0.00 175.17 176.17 1xxh n TRP 229 N 8.95 0.00 1.74 -5.34 7.02 -1.26 -3.92 117.44 124.63 1xxh n TRP 229 Ca 0.05 0.00 0.15 0.00 -1.02 0.00 0.00 57.50 56.68 1xxh n TRP 229 Cb 0.49 -0.01 0.85 0.00 -2.42 0.00 0.00 31.31 30.21 1xxh n TRP 229 CO 0.00 0.00 0.00 0.98 -2.02 0.00 0.00 177.69 176.65 1xxh n TYR 230 N 0.56 0.00 0.10 -5.99 9.36 -1.26 -2.55 117.16 117.39 1xxh n TYR 230 Ca 0.14 0.00 -0.19 0.00 3.32 0.00 0.00 57.90 61.18 1xxh n TYR 230 Cb 0.48 -0.07 -0.12 0.00 -0.63 0.00 0.00 39.34 39.00 1xxh n TYR 230 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 1xxh h SER 231 N 0.00 0.64 0.00 2.98 4.64 -1.92 -3.19 113.55 116.70 1xxh h SER 231 Ca 0.00 -0.63 0.00 0.00 -0.47 0.00 0.00 61.79 60.69 1xxh h SER 231 Cb 0.07 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 61.95 1xxh h SER 231 CO 0.00 1.46 0.00 0.18 -0.87 0.00 0.00 176.83 177.60 1xxh n LEU 232 N -3.68 0.00 0.19 5.97 4.77 -1.06 -2.28 117.00 120.92 1xxh n LEU 232 Ca -0.11 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 55.92 1xxh n LEU 232 Cb 0.99 0.00 0.38 0.00 -2.33 0.00 0.00 43.42 42.46 1xxh n LEU 232 CO 0.56 0.00 0.71 0.25 -1.33 0.00 0.00 177.39 177.58 1xxh h LEU 233 N 0.00 0.00 0.05 2.23 5.85 -1.74 -2.38 115.31 119.33 1xxh h LEU 233 Ca 0.00 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 1xxh h LEU 233 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 1xxh h LEU 233 CO 0.00 0.37 -0.03 0.00 -0.34 0.00 0.00 178.44 178.44 1xxh h ALA 234 N 1.63 -0.07 0.00 1.25 0.00 -1.73 -0.82 119.26 119.52 1xxh h ALA 234 Ca -0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1xxh h ALA 234 Cb 0.77 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1xxh h ALA 234 CO 0.05 -0.15 0.00 0.00 0.00 0.00 0.00 179.25 179.15 1xxh n ALA 235 N -2.56 2.17 0.08 0.00 0.00 -1.20 -4.00 120.51 114.99 1xxh n ALA 235 Ca -0.08 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1xxh n ALA 235 Cb 0.32 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.75 1xxh n ALA 235 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1xxh n LEU 236 N -0.53 0.49 -4.39 0.00 4.77 -0.90 -4.74 117.00 111.69 1xxh n LEU 236 Ca 0.01 0.26 -0.51 0.00 -0.03 0.00 0.00 56.01 55.74 1xxh n LEU 236 Cb 0.00 -0.01 -0.10 0.00 -2.33 0.00 0.00 43.42 40.98 1xxh n LEU 236 CO 0.01 -0.74 1.88 -3.20 -1.33 0.00 0.00 177.39 174.00 1xxh n ASN 237 N -3.38 1.27 -2.43 -1.43 2.85 -0.31 -4.47 115.26 107.36 1xxh n ASN 237 Ca 0.00 0.39 -0.01 0.00 -0.11 0.00 0.00 54.58 54.85 1xxh n ASN 237 Cb 0.00 -1.09 0.01 0.00 1.24 0.00 0.00 39.78 39.94 1xxh n ASN 237 CO 0.00 0.00 0.00 1.57 -2.11 0.00 0.00 177.26 176.72 1xxh n HIS 238 N 9.61 -0.84 0.02 1.20 -0.00 -1.26 -4.90 115.22 119.05 1xxh n HIS 238 Ca 0.51 -0.66 -0.07 0.00 0.46 0.00 0.00 57.72 57.96 1xxh n HIS 238 Cb 0.12 0.32 -0.12 0.00 -0.12 0.00 0.00 29.99 30.18 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 0.00 -0.95 1.57 4.22 -2.03 -3.30 114.58 114.10 1xxh h GLU 239 Ca -0.15 0.00 -0.08 0.00 0.08 0.00 0.00 59.36 59.21 1xxh h GLU 239 Cb 0.70 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.90 1xxh h GLU 239 CO 0.21 0.65 0.10 1.04 -2.18 0.00 0.00 179.01 178.82 1xxh n GLN 240 N -3.14 1.69 0.00 1.92 1.13 -1.26 -4.52 117.38 113.20 1xxh n GLN 240 Ca -0.10 -0.85 0.00 0.00 -1.94 0.00 0.00 57.00 54.11 1xxh n GLN 240 Cb 0.99 -1.51 0.00 0.00 0.11 0.00 0.00 30.24 29.83 1xxh n GLN 240 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1xxh n ALA 241 N 0.11 -0.24 -0.07 -1.58 0.00 -1.24 -1.20 120.51 116.28 1xxh n ALA 241 Ca 0.12 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.55 1xxh n ALA 241 Cb 0.68 0.26 -0.02 0.00 0.00 0.00 0.00 19.45 20.37 1xxh n ALA 241 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1xxh n PRO 242 N -2.51 -0.07 -0.32 0.00 -0.04 -1.26 0.21 135.00 131.01 1xxh n PRO 242 Ca 0.00 0.63 0.09 0.00 -0.04 0.00 0.00 63.50 64.17 1xxh n PRO 242 Cb 0.00 -0.93 0.29 0.00 -0.04 0.00 0.00 33.50 32.82 1xxh n PRO 242 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1xxh h ALA 243 N -0.29 1.63 -0.21 0.55 0.00 -1.91 -0.45 119.26 118.59 1xxh h ALA 243 Ca 0.03 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 1xxh h ALA 243 Cb 0.07 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1xxh h ALA 243 CO -0.16 0.13 -0.25 0.00 0.00 0.00 0.00 179.25 178.98 1xxh h ARG 244 N 0.89 0.54 -0.23 0.00 3.08 0.40 -2.48 114.38 116.57 1xxh h ARG 244 Ca 0.47 -0.30 0.04 0.00 0.07 0.00 0.00 59.98 60.26 1xxh h ARG 244 Cb 0.54 0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.57 1xxh h ARG 244 CO -0.23 0.89 -0.01 -0.07 -1.07 0.00 0.00 179.97 179.48 1xxh h LEU 245 N 0.21 -0.10 -0.78 3.04 -0.00 0.14 -1.23 115.31 116.59 1xxh h LEU 245 Ca 0.03 0.05 0.18 0.00 -0.00 0.00 0.00 57.88 58.14 1xxh h LEU 245 Cb 0.81 0.10 -0.14 0.00 -0.00 0.00 0.00 40.66 41.43 1xxh h LEU 245 CO 0.06 -0.02 0.00 -0.74 -0.00 0.00 0.00 178.44 177.74 1xxh h HIS 246 N 0.07 -0.06 -0.45 1.13 2.76 -0.95 0.55 115.15 118.19 1xxh h HIS 246 Ca 0.11 0.06 0.07 0.00 -2.20 0.00 0.00 60.37 58.41 1xxh h HIS 246 Cb 0.14 0.15 -0.06 0.00 1.55 0.00 0.00 27.41 29.19 1xxh h HIS 246 CO -0.20 -0.26 0.09 -1.49 -1.30 0.00 0.00 177.93 174.78 1xxh h TRP 247 N 0.10 0.15 -0.46 5.26 6.55 -0.77 0.27 115.95 127.05 1xxh h TRP 247 Ca 0.43 0.03 0.10 0.00 0.95 0.00 0.00 58.89 60.40 1xxh h TRP 247 Cb 0.77 -0.00 -0.02 0.00 -0.86 0.00 0.00 29.16 29.04 1xxh h TRP 247 CO -0.44 0.01 0.32 1.25 -1.05 0.00 0.00 178.44 178.53 1xxh h LEU 248 N 0.23 0.13 0.11 -4.49 5.85 0.57 -2.19 115.31 115.52 1xxh h LEU 248 Ca 0.22 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.94 1xxh h LEU 248 Cb 0.28 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.28 1xxh h LEU 248 CO -0.28 0.08 -0.05 0.00 -0.34 0.00 0.00 178.44 177.85 1xxh h ALA 249 N 1.77 -0.14 -0.59 1.25 0.00 0.12 -2.86 119.26 118.81 1xxh h ALA 249 Ca 0.21 -0.19 0.12 0.00 0.00 0.00 0.00 54.91 55.05 1xxh h ALA 249 Cb 0.65 0.06 -0.10 0.00 0.00 0.00 0.00 17.79 18.39 1xxh h ALA 249 CO -0.03 -0.38 -0.05 1.79 0.00 0.00 0.00 179.25 180.58 1xxh h THR 250 N -0.53 0.48 0.37 0.00 1.35 -0.69 -2.05 112.91 111.84 1xxh h THR 250 Ca -0.01 -0.03 -0.00 0.00 -0.55 0.00 0.00 66.41 65.82 1xxh h THR 250 Cb 0.43 0.40 -0.03 0.00 -1.73 0.00 0.00 68.15 67.22 1xxh h THR 250 CO 0.02 0.01 -0.49 -0.07 -0.25 0.00 0.00 175.52 174.74 1xxh h LEU 251 N 0.07 -1.40 -0.95 3.87 3.38 -1.52 0.06 115.31 118.83 1xxh h LEU 251 Ca 0.30 0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.39 1xxh h LEU 251 Cb 0.47 0.48 0.00 0.00 0.09 0.00 0.00 40.66 41.71 1xxh h LEU 251 CO -0.54 -0.62 0.00 -0.11 0.09 0.00 0.00 178.44 177.27 1xxh n LEU 252 N -5.53 0.00 0.00 1.67 7.94 -0.77 -0.66 117.00 119.64 1xxh n LEU 252 Ca -0.11 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.79 1xxh n LEU 252 Cb 0.44 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.39 1xxh n LEU 252 CO 0.23 0.00 0.00 0.47 -1.11 0.00 0.00 177.39 176.98 1xxh n ASP 254 N 0.15 0.00 0.23 1.96 8.00 0.01 -0.65 116.55 126.26 1xxh n ASP 254 Ca 0.00 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.35 1xxh n ASP 254 Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.02 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 -0.70 -0.38 2.24 0.00 -1.13 0.27 119.26 119.55 1xxh h ALA 255 Ca 0.00 -0.12 0.08 0.00 0.00 0.00 0.00 54.91 54.86 1xxh h ALA 255 Cb 0.00 0.43 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1xxh h ALA 255 CO 0.00 -0.92 0.26 1.25 0.00 0.00 0.00 179.25 179.84 1xxh h LEU 256 N -0.70 0.16 -0.65 0.00 6.46 -1.13 0.14 115.31 119.58 1xxh h LEU 256 Ca -0.03 0.00 -0.13 0.00 -0.12 0.00 0.00 57.88 57.60 1xxh h LEU 256 Cb 0.61 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 40.50 1xxh h LEU 256 CO -0.02 0.10 -0.35 0.11 -0.62 0.00 0.00 178.44 177.66 1xxh h LYS 257 N 0.18 0.67 0.00 1.25 1.57 -1.42 -2.78 116.57 116.03 1xxh h LYS 257 Ca 0.17 -0.32 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 1xxh h LYS 257 Cb 0.46 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.76 1xxh h LYS 257 CO -0.03 0.92 0.00 -0.09 -0.57 0.00 0.00 179.45 179.68 1xxh h ARG 258 N 0.56 0.00 0.00 3.15 2.43 0.23 -1.54 114.38 119.21 1xxh h ARG 258 Ca 0.06 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.14 1xxh h ARG 258 Cb 0.86 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.40 1xxh h ARG 258 CO 0.07 0.00 -0.40 0.45 -1.51 0.00 0.00 179.97 178.58 1xxh h HIS 259 N 0.00 0.00 -0.49 2.20 3.86 -1.15 -3.10 115.15 116.47 1xxh h HIS 259 Ca 0.00 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1xxh h HIS 259 Cb 0.48 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.95 1xxh h HIS 259 CO 0.00 0.40 0.00 0.72 0.86 0.00 0.00 177.93 179.92 1xxh n HIS 260 N -3.31 1.78 -3.78 2.45 8.25 -0.85 -4.95 115.22 114.81 1xxh n HIS 260 Ca 0.01 -0.78 -0.24 0.00 -0.26 0.00 0.00 57.72 56.45 1xxh n HIS 260 Cb 0.63 -0.46 0.03 0.00 1.12 0.00 0.00 29.99 31.30 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 0.28 -0.34 3.84 -1.41 0.00 -1.17 -4.96 105.19 101.44 1xxh n GLY 261 Ca 0.26 0.15 -0.32 0.00 0.00 0.00 0.00 46.02 46.10 1xxh n GLY 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xxh s ALA 262 N -3.59 3.20 -0.13 4.61 0.00 -0.64 -5.01 121.76 120.20 1xxh s ALA 262 Ca 0.19 0.17 0.18 0.00 0.00 0.00 0.00 51.96 52.50 1xxh s ALA 262 Cb -0.09 -2.93 -0.21 0.00 0.00 0.00 0.00 23.12 19.89 1xxh s ALA 262 CO 0.82 0.19 0.56 0.00 0.00 0.00 0.00 175.76 177.33 1xxh n ALA 263 N -0.62 2.04 -2.73 0.00 0.00 -1.26 -4.76 120.51 113.17 1xxh n ALA 263 Ca 0.05 -0.73 -0.40 0.00 0.00 0.00 0.00 53.44 52.35 1xxh n ALA 263 Cb 0.54 -0.72 -0.11 0.00 0.00 0.00 0.00 19.45 19.16 1xxh n ALA 263 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1xxh s GLN 264 N -2.96 3.08 -0.14 0.00 -1.52 -1.26 -5.07 119.66 111.79 1xxh s GLN 264 Ca -0.06 -0.91 -0.03 0.00 -1.95 0.00 0.00 55.36 52.41 1xxh s GLN 264 Cb 0.09 -3.74 -0.03 0.00 -0.22 0.00 0.00 33.01 29.11 1xxh s GLN 264 CO 0.84 -0.60 -0.05 0.08 -0.25 0.00 0.00 175.29 175.30 1xxh s VAL 265 N 1.62 3.76 -0.01 1.09 1.01 -1.26 -5.02 120.40 121.59 1xxh s VAL 265 Ca 0.04 -0.41 -0.25 0.00 0.00 0.00 0.00 61.98 61.35 1xxh s VAL 265 Cb -0.18 -2.62 -0.19 0.00 0.00 0.00 0.00 36.38 33.38 1xxh s VAL 265 CO 0.08 0.51 1.32 0.74 0.00 0.00 0.00 175.10 177.76 1xxh h THR 266 N 5.04 1.34 -0.87 3.92 2.02 -1.96 -3.34 112.91 119.05 1xxh h THR 266 Ca -0.33 -1.02 -0.72 0.00 0.77 0.00 0.00 66.41 65.10 1xxh h THR 266 Cb 1.19 2.02 -0.09 0.00 -1.74 0.00 0.00 68.15 69.54 1xxh h THR 266 CO 0.60 0.27 2.77 0.59 0.37 0.00 0.00 175.52 180.12 1xxh n ASN 267 N -4.87 8.10 0.01 4.18 3.02 -1.26 -4.65 115.26 119.79 1xxh n ASN 267 Ca -0.08 -3.00 0.01 0.00 -0.03 0.00 0.00 54.58 51.48 1xxh n ASN 267 Cb 0.23 -1.42 0.07 0.00 -0.61 0.00 0.00 39.78 38.05 1xxh n ASN 267 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 1xxh n VAL 268 N 2.26 1.83 -0.12 2.41 0.24 -1.26 -2.46 118.33 121.23 1xxh n VAL 268 Ca 0.66 0.49 0.11 0.00 -2.04 0.00 0.00 64.34 63.56 1xxh n VAL 268 Cb 0.25 -1.46 0.47 0.00 -1.47 0.00 0.00 33.84 31.62 1xxh n VAL 268 CO 0.00 0.00 0.00 -0.78 -2.14 0.00 0.00 176.83 173.91 1xxh h ASP 269 N 0.00 0.44 -1.29 -1.34 3.58 -1.83 -3.31 116.42 112.67 1xxh h ASP 269 Ca 0.00 0.01 -0.42 0.00 0.42 0.00 0.00 57.03 57.04 1xxh h ASP 269 Cb 0.03 -0.08 -0.30 0.00 1.72 0.00 0.00 39.33 40.69 1xxh h ASP 269 CO 0.00 0.26 -0.90 1.33 -2.88 0.00 0.00 179.24 177.05 1xxh n VAL 270 N -4.48 -0.33 -0.12 2.25 0.24 -1.03 -4.94 118.33 109.92 1xxh n VAL 270 Ca 0.11 -3.25 0.27 0.00 -2.04 0.00 0.00 64.34 59.43 1xxh n VAL 270 Cb 0.37 -0.34 0.72 0.00 -1.47 0.00 0.00 33.84 33.11 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 3.65 0.00 0.00 7.34 0.13 -1.70 0.23 132.00 141.64 1xxh h PRO 271 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1xxh h PRO 271 Cb 0.96 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.09 1xxh h PRO 271 CO 0.40 0.00 0.00 0.78 -0.23 0.00 0.00 178.00 178.95 1xxh h GLY 272 N 0.00 0.00 1.04 1.56 0.00 -1.94 -2.62 103.07 101.11 1xxh h GLY 272 Ca 0.38 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.39 1xxh h GLY 272 CO -0.00 0.00 -1.68 -2.00 0.00 0.00 0.00 176.54 172.86 1xxh h LEU 273 N 0.00 0.37 -1.23 3.11 5.85 -0.95 -3.02 115.31 119.43 1xxh h LEU 273 Ca 0.00 -0.60 -0.01 0.00 0.84 0.00 0.00 57.88 58.11 1xxh h LEU 273 Cb 0.44 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.35 1xxh h LEU 273 CO 0.00 1.51 -0.05 -0.37 -0.34 0.00 0.00 178.44 179.19 1xxh h VAL 274 N 0.06 0.13 0.00 1.05 -1.51 -1.50 -1.59 116.25 112.89 1xxh h VAL 274 Ca -0.30 -0.70 0.00 0.00 -1.23 0.00 0.00 66.70 64.47 1xxh h VAL 274 Cb 2.03 1.62 0.00 0.00 -2.13 0.00 0.00 31.29 32.81 1xxh h VAL 274 CO 0.14 0.05 0.00 0.00 -1.23 0.00 0.00 177.57 176.53 1xxh n ALA 275 N -2.12 -0.07 -0.25 5.19 0.00 -1.00 -1.79 120.51 120.46 1xxh n ALA 275 Ca 0.01 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.51 1xxh n ALA 275 Cb 0.36 0.00 0.18 0.00 0.00 0.00 0.00 19.45 19.99 1xxh n ALA 275 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1xxh h GLU 276 N 0.00 0.18 -0.67 0.00 4.81 -1.62 0.55 114.58 117.82 1xxh h GLU 276 Ca 0.00 -0.01 0.09 0.00 -0.13 0.00 0.00 59.36 59.31 1xxh h GLU 276 Cb 0.00 -0.04 -0.07 0.00 0.63 0.00 0.00 28.75 29.27 1xxh h GLU 276 CO 0.00 0.12 0.32 1.25 -0.73 0.00 0.00 179.01 179.96 1xxh h LEU 277 N 0.18 0.39 -1.05 1.64 6.46 -1.42 0.15 115.31 121.67 1xxh h LEU 277 Ca 0.42 0.06 -0.09 0.00 -0.12 0.00 0.00 57.88 58.16 1xxh h LEU 277 Cb 0.75 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.67 1xxh h LEU 277 CO -0.59 0.23 -0.26 0.00 -0.62 0.00 0.00 178.44 177.20 1xxh h ALA 278 N 1.42 1.20 0.15 1.25 0.00 0.76 -3.01 119.26 121.04 1xxh h ALA 278 Ca 0.33 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1xxh h ALA 278 Cb 0.36 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1xxh h ALA 278 CO -0.27 0.52 -0.07 -0.91 0.00 0.00 0.00 179.25 178.51 1xxh h ASN 279 N 0.32 -0.17 0.20 0.00 2.35 0.92 -3.27 115.58 115.93 1xxh h ASN 279 Ca 0.05 -0.37 0.00 0.00 -0.55 0.00 0.00 56.30 55.43 1xxh h ASN 279 Cb 0.63 0.04 0.00 0.00 0.05 0.00 0.00 38.32 39.05 1xxh h ASN 279 CO 0.05 0.37 0.00 1.41 -1.65 0.00 0.00 177.43 177.61 1xxh n HIS 280 N -4.92 0.00 -4.16 1.19 8.25 0.34 -4.71 115.22 111.21 1xxh n HIS 280 Ca -0.08 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.22 1xxh n HIS 280 Cb 0.27 -0.31 -0.13 0.00 1.12 0.00 0.00 29.99 30.94 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 -2.62 2.15 0.42 2.41 1.43 -1.14 -5.09 118.68 116.24 1xxh s LEU 281 Ca 0.09 -0.36 -0.10 0.00 -1.03 0.00 0.00 54.13 52.73 1xxh s LEU 281 Cb 0.07 -0.30 -0.06 0.00 0.03 0.00 0.00 46.19 45.93 1xxh s LEU 281 CO 0.15 -0.05 0.78 -0.44 0.23 0.00 0.00 176.35 177.02 1xxh s SER 282 N -0.95 6.48 0.51 2.29 0.01 -1.26 -4.76 113.70 116.02 1xxh s SER 282 Ca -0.03 1.11 0.27 0.00 1.31 0.00 0.00 55.95 58.61 1xxh s SER 282 Cb -0.07 -2.32 1.38 0.00 0.21 0.00 0.00 66.02 65.22 1xxh s SER 282 CO 0.00 -0.43 1.93 1.55 0.41 0.00 0.00 173.24 176.70 1xxh h PRO 283 N 1.09 0.07 0.00 12.44 0.13 -1.97 0.79 132.00 144.56 1xxh h PRO 283 Ca -0.47 -0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.47 1xxh h PRO 283 Cb 1.19 -0.02 -0.03 0.00 0.13 0.00 0.00 31.00 32.27 1xxh h PRO 283 CO 0.63 0.05 -1.12 0.66 -0.23 0.00 0.00 178.00 177.99 1xxh h SER 284 N 0.07 0.00 -0.12 1.44 4.64 -1.99 -2.94 113.55 114.65 1xxh h SER 284 Ca 0.36 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.62 1xxh h SER 284 Cb 1.33 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.41 1xxh h SER 284 CO -0.03 0.72 -0.15 -0.09 -0.87 0.00 0.00 176.83 176.42 1xxh h ARG 285 N 0.00 0.31 0.41 4.77 2.43 0.01 -2.93 114.38 119.38 1xxh h ARG 285 Ca -0.11 -0.17 -0.02 0.00 -0.81 0.00 0.00 59.98 58.87 1xxh h ARG 285 Cb 1.65 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 31.21 1xxh h ARG 285 CO 0.08 0.73 -0.20 -0.07 -1.51 0.00 0.00 179.97 179.00 1xxh h LEU 286 N -0.10 -0.47 -0.89 3.80 3.38 -0.42 -3.06 115.31 117.56 1xxh h LEU 286 Ca 0.02 0.01 0.15 0.00 0.09 0.00 0.00 57.88 58.15 1xxh h LEU 286 Cb 0.69 0.12 -0.15 0.00 0.09 0.00 0.00 40.66 41.41 1xxh h LEU 286 CO 0.03 -0.33 -0.33 1.56 0.09 0.00 0.00 178.44 179.46 1xxh h GLN 287 N -0.57 -0.03 0.14 1.13 1.08 -1.55 -1.06 115.11 114.26 1xxh h GLN 287 Ca -0.06 0.00 0.01 0.00 -1.45 0.00 0.00 58.65 57.15 1xxh h GLN 287 Cb 0.43 0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 27.83 1xxh h GLN 287 CO 0.09 -0.02 -0.43 0.00 -0.95 0.00 0.00 178.83 177.52 1xxh h ALA 288 N 1.45 -0.94 0.11 3.87 0.00 -1.41 -2.30 119.26 120.04 1xxh h ALA 288 Ca 0.35 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.18 1xxh h ALA 288 Cb 0.61 0.79 -0.05 0.00 0.00 0.00 0.00 17.79 19.15 1xxh h ALA 288 CO -0.91 -1.04 -0.41 0.82 0.00 0.00 0.00 179.25 177.71 1xxh h ILE 289 N -0.65 0.18 -1.00 0.00 2.04 -1.35 -2.21 117.51 114.52 1xxh h ILE 289 Ca -0.01 0.00 0.23 0.00 1.00 0.00 0.00 64.86 66.08 1xxh h ILE 289 Cb 0.63 0.18 -0.19 0.00 -0.74 0.00 0.00 36.82 36.70 1xxh h ILE 289 CO -0.21 0.00 -0.12 -0.11 0.00 0.00 0.00 178.15 177.71 1xxh n LEU 290 N -5.46 -0.25 0.35 1.44 0.00 -0.46 -0.11 117.00 112.51 1xxh n LEU 290 Ca -0.07 1.70 -0.14 0.00 0.00 0.00 0.00 56.01 57.51 1xxh n LEU 290 Cb 0.37 -0.56 -0.06 0.00 0.00 0.00 0.00 43.42 43.16 1xxh n LEU 290 CO 0.19 -1.68 0.53 1.23 0.00 0.00 0.00 177.39 177.66 1xxh h GLY 291 N 0.00 -0.93 0.04 -3.96 0.00 -0.82 -1.16 103.07 96.24 1xxh h GLY 291 Ca 0.54 0.35 0.19 0.00 0.00 0.00 0.00 47.33 48.40 1xxh h GLY 291 CO -0.98 -0.34 0.49 -0.55 0.00 0.00 0.00 176.54 175.15 1xxh h ASP 292 N -0.88 0.55 0.27 0.19 5.19 -0.87 0.47 116.42 121.34 1xxh h ASP 292 Ca -0.09 0.12 -0.00 0.00 -0.62 0.00 0.00 57.03 56.44 1xxh h ASP 292 Cb 0.68 0.03 -0.03 0.00 0.18 0.00 0.00 39.33 40.19 1xxh h ASP 292 CO 0.14 0.16 -0.42 0.58 -3.12 0.00 0.00 179.24 176.58 1xxh h VAL 293 N 0.59 0.00 -0.09 -1.35 2.07 -0.36 0.40 116.25 117.51 1xxh h VAL 293 Ca 0.54 0.00 0.04 0.00 0.82 0.00 0.00 66.70 68.10 1xxh h VAL 293 Cb 0.90 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.62 1xxh h VAL 293 CO -0.43 0.00 -0.24 0.00 0.02 0.00 0.00 177.57 176.92 1xxh h HIS 295 N -0.32 0.99 -0.22 0.00 -0.00 0.16 -0.93 115.15 114.82 1xxh h HIS 295 Ca 0.09 0.03 -0.17 0.00 -0.00 0.00 0.00 60.37 60.32 1xxh h HIS 295 Cb 0.45 -0.32 0.00 0.00 -0.00 0.00 0.00 27.41 27.55 1xxh h HIS 295 CO -0.32 0.45 -0.51 0.82 -0.00 0.00 0.00 177.93 178.37 1xxh h ILE 296 N 0.91 1.30 -0.03 2.45 5.03 0.40 -2.81 117.51 124.75 1xxh h ILE 296 Ca 0.42 -1.72 0.04 0.00 -0.12 0.00 0.00 64.86 63.48 1xxh h ILE 296 Cb 0.41 1.80 -0.05 0.00 -3.03 0.00 0.00 36.82 35.95 1xxh h ILE 296 CO -0.19 0.55 -0.33 -0.09 -0.68 0.00 0.00 178.15 177.41 1xxh h ARG 297 N 0.47 -0.44 -1.00 2.37 2.43 0.01 -1.40 114.38 116.82 1xxh h ARG 297 Ca -0.00 0.03 0.17 0.00 -0.81 0.00 0.00 59.98 59.37 1xxh h ARG 297 Cb 1.12 0.10 -0.10 0.00 -0.42 0.00 0.00 29.97 30.67 1xxh h ARG 297 CO 0.11 -0.29 0.61 1.49 -1.51 0.00 0.00 179.97 180.37 1xxh h GLU 298 N -0.46 0.78 -0.76 0.20 4.22 -1.21 0.14 114.58 117.50 1xxh h GLU 298 Ca 0.07 -0.05 -0.02 0.00 0.08 0.00 0.00 59.36 59.44 1xxh h GLU 298 Cb 0.56 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.60 1xxh h GLU 298 CO -0.29 0.52 0.38 1.96 -2.18 0.00 0.00 179.01 179.40 1xxh h GLN 299 N 0.81 1.08 0.00 1.92 4.20 -1.02 0.35 115.11 122.45 1xxh h GLN 299 Ca 0.56 -0.15 0.00 0.00 0.06 0.00 0.00 58.65 59.12 1xxh h GLN 299 Cb 0.80 -0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.38 1xxh h GLN 299 CO -0.36 0.83 0.00 1.28 -0.67 0.00 0.00 178.83 179.91 1xxh n LEU 300 N -4.41 0.00 0.00 1.46 4.77 0.03 -0.23 117.00 118.63 1xxh n LEU 300 Ca 0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 1xxh n LEU 300 Cb 0.12 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 1xxh n LEU 300 CO 0.39 0.00 0.00 -1.54 -1.33 0.00 0.00 177.39 174.91 1xxh n SER 302 N 0.32 0.00 -4.71 -1.43 3.41 0.11 -4.91 113.62 106.41 1xxh n SER 302 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.19 1xxh n SER 302 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 1xxh n SER 302 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1xxh s VAL 303 N 0.00 3.73 0.00 -3.33 1.01 0.69 -4.98 120.40 117.51 1xxh s VAL 303 Ca 0.00 1.22 0.00 0.00 0.00 0.00 0.00 61.98 63.20 1xxh s VAL 303 Cb 0.00 -3.78 0.00 0.00 0.00 0.00 0.00 36.38 32.60 1xxh s VAL 303 CO 0.00 0.07 0.09 0.41 0.00 0.00 0.00 175.10 175.67 1xxh n THR 304 N 4.11 0.00 -3.79 3.92 -1.04 -1.26 -4.12 114.28 112.10 1xxh n THR 304 Ca 0.11 0.41 -0.28 0.00 -2.04 0.00 0.00 64.05 62.25 1xxh n THR 304 Cb 0.44 -0.74 -0.11 0.00 -1.82 0.00 0.00 70.33 68.10 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 -0.22 3.98 3.90 3.41 0.00 -1.26 -5.09 105.19 109.90 1xxh n GLY 305 Ca 0.00 -2.51 -0.28 0.00 0.00 0.00 0.00 46.02 43.23 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 -1.49 4.86 -0.85 -0.61 1.01 -1.26 -5.00 121.20 117.87 1xxh s ILE 306 Ca 0.28 0.36 -0.20 0.00 0.00 0.00 0.00 60.65 61.09 1xxh s ILE 306 Cb -0.01 -3.84 0.11 0.00 0.01 0.00 0.00 42.46 38.73 1xxh s ILE 306 CO -0.15 -0.83 1.08 0.21 0.00 0.00 0.00 174.94 175.24 1xxh s ASN 307 N -3.96 6.48 0.34 3.58 3.84 -1.26 -4.89 114.94 119.08 1xxh s ASN 307 Ca 0.49 -1.72 0.14 0.00 0.21 0.00 0.00 52.86 51.98 1xxh s ASN 307 Cb -0.10 -2.41 1.10 0.00 -0.55 0.00 0.00 41.25 39.29 1xxh s ASN 307 CO 0.44 -1.18 1.62 0.08 -2.79 0.00 0.00 177.10 175.26 1xxh h ARG 308 N 9.08 0.14 0.28 0.43 0.11 -1.95 -1.28 114.38 121.18 1xxh h ARG 308 Ca 0.02 -0.01 -0.01 0.00 0.10 0.00 0.00 59.98 60.08 1xxh h ARG 308 Cb 1.04 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 32.09 1xxh h ARG 308 CO 1.14 0.09 -0.14 1.49 0.10 0.00 0.00 179.97 182.65 1xxh h GLU 309 N 0.14 -0.37 -0.09 0.08 4.81 -1.96 -2.01 114.58 115.18 1xxh h GLU 309 Ca 0.74 0.03 0.02 0.00 -0.13 0.00 0.00 59.36 60.01 1xxh h GLU 309 Cb 1.77 0.08 -0.04 0.00 0.63 0.00 0.00 28.75 31.20 1xxh h GLU 309 CO -0.72 -0.25 -0.33 1.25 -0.73 0.00 0.00 179.01 178.23 1xxh h LEU 310 N -0.39 -1.06 -1.58 1.64 6.46 -1.81 0.25 115.31 118.82 1xxh h LEU 310 Ca -0.04 0.13 0.14 0.00 -0.12 0.00 0.00 57.88 57.99 1xxh h LEU 310 Cb 0.30 0.42 -0.02 0.00 -0.73 0.00 0.00 40.66 40.63 1xxh h LEU 310 CO 0.06 -0.29 0.68 0.25 -0.62 0.00 0.00 178.44 178.51 1xxh h LEU 311 N -0.35 0.00 0.07 2.25 5.85 -1.33 0.23 115.31 122.02 1xxh h LEU 311 Ca 0.02 0.00 -0.37 0.00 0.84 0.00 0.00 57.88 58.37 1xxh h LEU 311 Cb 0.41 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.41 1xxh h LEU 311 CO -0.27 0.00 -2.11 -0.38 -0.34 0.00 0.00 178.44 175.34 1xxh n ILE 312 N -3.35 1.66 -0.37 4.05 5.41 -0.45 -3.34 119.36 122.97 1xxh n ILE 312 Ca 0.09 -0.56 -0.00 0.00 1.00 0.00 0.00 62.75 63.28 1xxh n ILE 312 Cb 0.86 -1.67 0.13 0.00 -0.71 0.00 0.00 39.64 38.24 1xxh n ILE 312 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 176.55 177.29 1xxh h THR 313 N -0.11 1.20 -0.20 1.39 2.02 0.13 -0.51 112.91 116.83 1xxh h THR 313 Ca -0.48 -0.45 -0.00 0.00 0.77 0.00 0.00 66.41 66.25 1xxh h THR 313 Cb 1.91 -0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 1xxh h THR 313 CO -0.02 0.24 0.11 -0.78 0.37 0.00 0.00 175.52 175.44 1xxh h ASP 314 N 1.30 0.26 0.39 4.18 3.58 -0.80 0.57 116.42 125.89 1xxh h ASP 314 Ca 0.39 -0.08 -0.01 0.00 0.42 0.00 0.00 57.03 57.75 1xxh h ASP 314 Cb -0.05 -0.06 -0.01 0.00 1.72 0.00 0.00 39.33 40.93 1xxh h ASP 314 CO -0.11 0.26 -0.31 0.25 -2.88 0.00 0.00 179.24 176.45 1xxh h LEU 315 N 0.23 -0.84 -0.30 2.28 6.46 -1.37 -0.29 115.31 121.48 1xxh h LEU 315 Ca 0.07 0.06 0.03 0.00 -0.12 0.00 0.00 57.88 57.92 1xxh h LEU 315 Cb 0.06 0.26 -0.05 0.00 -0.73 0.00 0.00 40.66 40.21 1xxh h LEU 315 CO -0.01 -0.44 -0.27 -0.07 -0.62 0.00 0.00 178.44 177.03 1xxh h LEU 316 N -0.68 -0.93 -0.82 2.25 3.38 -1.03 -0.88 115.31 116.60 1xxh h LEU 316 Ca -0.05 0.13 0.10 0.00 0.09 0.00 0.00 57.88 58.15 1xxh h LEU 316 Cb 0.57 0.39 -0.12 0.00 0.09 0.00 0.00 40.66 41.59 1xxh h LEU 316 CO 0.00 -0.16 -0.50 0.25 0.09 0.00 0.00 178.44 178.12 1xxh h LEU 317 N -0.12 -1.80 -1.86 1.67 7.12 -0.83 1.17 115.31 120.66 1xxh h LEU 317 Ca 0.05 0.29 0.06 0.00 0.13 0.00 0.00 57.88 58.41 1xxh h LEU 317 Cb 0.25 0.82 -0.01 0.00 -0.53 0.00 0.00 40.66 41.19 1xxh h LEU 317 CO -0.34 -0.29 0.44 -0.09 -0.13 0.00 0.00 178.44 178.03 1xxh h ARG 318 N -0.11 0.00 0.59 1.25 2.43 0.15 -2.34 114.38 116.35 1xxh h ARG 318 Ca 0.20 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.34 1xxh h ARG 318 Cb 0.51 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.07 1xxh h ARG 318 CO -0.85 0.00 -0.28 0.82 -1.51 0.00 0.00 179.97 178.15 1xxh h ILE 319 N 0.00 0.00 -1.03 1.20 2.04 0.27 -3.10 117.51 116.89 1xxh h ILE 319 Ca 0.09 -0.41 0.27 0.00 1.00 0.00 0.00 64.86 65.82 1xxh h ILE 319 Cb 0.97 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.92 1xxh h ILE 319 CO -0.00 0.00 0.62 -0.33 0.00 0.00 0.00 178.15 178.44 1xxh h GLU 320 N -1.19 0.46 -0.80 2.37 3.07 -1.32 0.31 114.58 117.48 1xxh h GLU 320 Ca -0.08 -0.03 0.04 0.00 -0.50 0.00 0.00 59.36 58.79 1xxh h GLU 320 Cb 0.60 -0.10 -0.05 0.00 -0.84 0.00 0.00 28.75 28.36 1xxh h GLU 320 CO 0.13 0.30 0.50 1.25 -1.40 0.00 0.00 179.01 179.79 1xxh h HIS 321 N 0.47 0.93 -0.60 4.33 2.76 -1.52 -0.64 115.15 120.88 1xxh h HIS 321 Ca 0.66 0.03 -0.05 0.00 -2.20 0.00 0.00 60.37 58.80 1xxh h HIS 321 Cb 1.43 -0.30 -0.03 0.00 1.55 0.00 0.00 27.41 30.06 1xxh h HIS 321 CO -0.01 0.51 0.18 1.88 -1.30 0.00 0.00 177.93 179.19 1xxh h TYR 322 N 0.95 0.93 -0.95 5.26 0.05 -0.87 -2.68 116.97 119.66 1xxh h TYR 322 Ca 0.33 -0.08 0.08 0.00 0.05 0.00 0.00 58.73 59.11 1xxh h TYR 322 Cb 0.07 -0.27 -0.07 0.00 1.01 0.00 0.00 36.73 37.47 1xxh h TYR 322 CO -0.03 0.76 0.60 -0.07 -1.05 0.00 0.00 178.16 178.36 1xxh h LEU 323 N 0.88 0.93 -9.70 3.88 3.38 -0.82 -3.44 115.31 110.41 1xxh h LEU 323 Ca 0.20 0.02 -0.57 0.00 0.09 0.00 0.00 57.88 57.62 1xxh h LEU 323 Cb 0.27 -0.17 0.11 0.00 0.09 0.00 0.00 40.66 40.96 1xxh h LEU 323 CO -0.01 0.56 0.42 0.00 0.09 0.00 0.00 178.44 179.50 1xxh n GLN 324 N -4.58 1.92 -1.97 1.13 6.02 -0.80 -4.90 117.38 114.19 1xxh n GLN 324 Ca 0.15 0.67 -0.41 0.00 -0.01 0.00 0.00 57.00 57.41 1xxh n GLN 324 Cb 0.23 -2.23 -0.01 0.00 1.02 0.00 0.00 30.24 29.24 1xxh n GLN 324 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 177.06 173.91 1xxh s PRO 325 N -1.88 4.24 0.00 -1.09 0.02 -1.26 -3.24 135.00 131.79 1xxh s PRO 325 Ca 0.57 2.37 0.00 0.00 0.02 0.00 0.00 61.00 63.97 1xxh s PRO 325 Cb -0.58 -3.04 0.00 0.00 0.02 0.00 0.00 34.50 30.90 1xxh s PRO 325 CO 0.61 -0.36 0.00 0.41 -0.33 0.00 0.00 177.00 177.33 1xxh n GLY 326 N 0.90 1.58 3.75 0.52 0.00 -1.26 -5.04 105.19 105.64 1xxh n GLY 326 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 1xxh n GLY 326 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xxh s VAL 327 N -2.54 4.91 -0.15 1.61 1.01 -1.20 -5.03 120.40 119.02 1xxh s VAL 327 Ca 0.00 1.30 -0.29 0.00 0.00 0.00 0.00 61.98 62.98 1xxh s VAL 327 Cb 0.00 -3.96 -0.01 0.00 0.00 0.00 0.00 36.38 32.42 1xxh s VAL 327 CO 0.00 0.39 1.05 0.54 0.00 0.00 0.00 175.10 177.08 1xxh s VAL 328 N -0.05 4.68 0.27 2.92 0.11 -1.26 -4.96 120.40 122.12 1xxh s VAL 328 Ca 0.32 1.98 -0.29 0.00 -2.93 0.00 0.00 61.98 61.06 1xxh s VAL 328 Cb -0.18 -4.28 -0.09 0.00 -1.53 0.00 0.00 36.38 30.30 1xxh s VAL 328 CO 0.18 -0.07 1.13 -0.76 -3.33 0.00 0.00 175.10 172.24 1xxh s LEU 329 N 2.52 4.53 1.33 2.54 1.43 -1.26 -5.03 118.68 124.74 1xxh s LEU 329 Ca 0.48 2.29 -0.18 0.00 -1.03 0.00 0.00 54.13 55.68 1xxh s LEU 329 Cb -0.18 -3.63 0.34 0.00 0.03 0.00 0.00 46.19 42.76 1xxh s LEU 329 CO 0.14 -0.20 0.96 -2.16 0.23 0.00 0.00 176.35 175.32 1xxh s PRO 330 N -1.30 -2.19 -0.01 1.29 0.04 -1.26 -5.07 135.00 126.50 1xxh s PRO 330 Ca 0.46 0.45 -0.07 0.00 0.04 0.00 0.00 61.00 61.88 1xxh s PRO 330 Cb -0.33 -1.44 0.00 0.00 0.04 0.00 0.00 34.50 32.78 1xxh s PRO 330 CO 0.41 -4.46 0.14 0.08 0.04 0.00 0.00 177.00 173.21 1xxh s VAL 331 N -2.32 0.07 0.22 -0.36 1.01 -1.26 -4.93 120.40 112.83 1xxh s VAL 331 Ca 0.69 -0.55 -0.32 0.00 0.00 0.00 0.00 61.98 61.80 1xxh s VAL 331 Cb -0.19 -0.39 -0.14 0.00 0.00 0.00 0.00 36.38 35.66 1xxh s VAL 331 CO 0.61 -0.30 1.30 -2.65 0.00 0.00 0.00 175.10 174.06 1xxh n PRO 332 N 1.78 1.69 -2.22 2.72 -0.02 -1.26 -5.00 135.00 132.69 1xxh n PRO 332 Ca -0.21 0.60 -0.17 0.00 -2.02 0.00 0.00 63.50 61.70 1xxh n PRO 332 Cb 0.56 -2.19 0.08 0.00 -0.02 0.00 0.00 33.50 31.94 1xxh n PRO 332 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1xxh n HIS 333 N 1.67 -2.90 0.00 6.00 8.25 -1.26 -5.35 115.22 121.63 1xxh n HIS 333 Ca 0.13 -1.43 0.00 0.00 -0.26 0.00 0.00 57.72 56.16 1xxh n HIS 333 Cb 0.29 -0.53 0.00 0.00 1.12 0.00 0.00 29.99 30.87 1xxh n HIS 333 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26