#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hxy n THR 39 N 0.00 0.00 0.38 0.52 -2.24 -1.26 -4.39 114.28 107.29 2hxy n THR 39 Ca 0.00 -2.21 0.12 0.00 -2.27 0.00 0.00 64.05 59.69 2hxy n THR 39 Cb 0.00 0.80 0.23 0.00 -2.10 0.00 0.00 70.33 69.27 2hxy n THR 39 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 2hxy h PHE 40 N 1.64 0.00 -0.36 4.78 0.04 -1.96 -3.33 116.94 117.74 2hxy h PHE 40 Ca -0.29 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.48 2hxy h PHE 40 Cb 1.13 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.26 2hxy h PHE 40 CO 0.00 0.00 0.24 -0.44 -0.60 0.00 0.00 178.31 177.51 2hxy h ASP 41 N 0.00 0.41 0.00 2.17 3.32 -1.97 -2.74 116.42 117.61 2hxy h ASP 41 Ca 0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2hxy h ASP 41 Cb 0.89 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.34 2hxy h ASP 41 CO 0.00 0.29 0.00 0.35 -1.72 0.00 0.00 179.24 178.16 2hxy n THR 42 N -4.84 0.00 1.23 0.35 -2.24 -1.25 -3.44 114.28 104.08 2hxy n THR 42 Ca -0.00 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.91 2hxy n THR 42 Cb 0.03 -0.18 0.29 0.00 -2.10 0.00 0.00 70.33 68.37 2hxy n THR 42 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 2hxy n MET 43 N -0.62 1.93 -3.69 -0.78 2.81 -1.03 -4.96 117.12 110.78 2hxy n MET 43 Ca 0.05 -1.41 -0.23 0.00 -1.81 0.00 0.00 57.70 54.30 2hxy n MET 43 Cb 0.02 -1.47 0.04 0.00 -0.71 0.00 0.00 33.22 31.11 2hxy n MET 43 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2hxy n GLY 44 N 1.28 -0.36 3.87 3.03 0.00 -1.22 -4.97 105.19 106.81 2hxy n GLY 44 Ca 0.16 0.15 -0.32 0.00 0.00 0.00 0.00 46.02 46.00 2hxy n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2hxy s LEU 45 N -6.80 4.19 0.68 0.99 1.43 -1.26 -5.04 118.68 112.87 2hxy s LEU 45 Ca 0.18 0.92 -0.17 0.00 -1.03 0.00 0.00 54.13 54.03 2hxy s LEU 45 Cb -0.09 -3.63 -0.01 0.00 0.03 0.00 0.00 46.19 42.50 2hxy s LEU 45 CO 0.80 -0.05 1.07 -2.11 0.23 0.00 0.00 176.35 176.29 2hxy n ARG 46 N -0.04 0.74 0.31 1.70 1.85 -1.26 -4.79 116.66 115.16 2hxy n ARG 46 Ca -0.00 0.31 -0.14 0.00 -1.00 0.00 0.00 57.85 57.01 2hxy n ARG 46 Cb 0.52 -2.31 -0.07 0.00 -1.05 0.00 0.00 32.46 29.55 2hxy n ARG 46 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 2hxy h GLU 47 N 0.08 -0.83 0.00 2.89 5.08 -1.99 -2.11 114.58 117.69 2hxy h GLU 47 Ca -0.49 0.06 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 2hxy h GLU 47 Cb 1.34 0.19 0.00 0.00 0.50 0.00 0.00 28.75 30.78 2hxy h GLU 47 CO 0.49 -0.56 0.48 0.38 -1.00 0.00 0.00 179.01 178.81 2hxy h ASP 48 N -0.87 0.00 0.01 1.42 2.03 -1.93 0.13 116.42 117.21 2hxy h ASP 48 Ca -0.08 0.00 -0.28 0.00 -0.73 0.00 0.00 57.03 55.94 2hxy h ASP 48 Cb 0.69 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 39.15 2hxy h ASP 48 CO 0.07 0.00 -1.55 -0.11 -1.03 0.00 0.00 179.24 176.62 2hxy n LEU 49 N -2.36 1.94 -0.11 0.15 7.94 -1.08 -3.32 117.00 120.15 2hxy n LEU 49 Ca -0.01 0.39 0.20 0.00 -1.11 0.00 0.00 56.01 55.48 2hxy n LEU 49 Cb 0.50 -0.95 0.62 0.00 0.53 0.00 0.00 43.42 44.13 2hxy n LEU 49 CO 0.07 0.37 1.21 0.25 -1.11 0.00 0.00 177.39 178.18 2hxy h LEU 50 N -0.93 0.17 0.15 -1.96 5.85 -0.15 0.45 115.31 118.90 2hxy h LEU 50 Ca -0.42 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.30 2hxy h LEU 50 Cb 1.41 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.42 2hxy h LEU 50 CO -0.23 0.08 -0.07 -0.09 -0.34 0.00 0.00 178.44 177.78 2hxy h ARG 51 N 0.17 -0.20 -0.83 1.25 2.43 -1.20 -1.91 114.38 114.10 2hxy h ARG 51 Ca 0.35 0.01 0.09 0.00 -0.81 0.00 0.00 59.98 59.62 2hxy h ARG 51 Cb 1.11 0.04 -0.07 0.00 -0.42 0.00 0.00 29.97 30.64 2hxy h ARG 51 CO -0.06 0.12 0.48 0.78 -1.51 0.00 0.00 179.97 179.79 2hxy h GLY 52 N -0.53 1.28 0.54 2.80 0.00 -0.61 0.20 103.07 106.76 2hxy h GLY 52 Ca -0.02 -0.33 0.01 0.00 0.00 0.00 0.00 47.33 46.99 2hxy h GLY 52 CO 0.03 0.15 -0.33 -2.22 0.00 0.00 0.00 176.54 174.17 2hxy h ILE 53 N 0.82 0.30 -0.40 2.60 2.04 -0.11 0.60 117.51 123.36 2hxy h ILE 53 Ca 0.39 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 66.19 2hxy h ILE 53 Cb 0.33 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.69 2hxy h ILE 53 CO -0.23 0.00 -0.02 1.88 0.00 0.00 0.00 178.15 179.77 2hxy h TYR 54 N -0.63 0.68 -0.17 1.37 0.05 -0.82 -2.40 116.97 115.04 2hxy h TYR 54 Ca 0.00 -0.09 -0.11 0.00 0.05 0.00 0.00 58.73 58.58 2hxy h TYR 54 Cb 0.61 -0.19 -0.01 0.00 1.01 0.00 0.00 36.73 38.15 2hxy h TYR 54 CO -0.24 0.66 -0.39 0.00 -1.05 0.00 0.00 178.16 177.14 2hxy h ALA 55 N 1.37 1.01 0.00 3.88 0.00 -0.10 0.81 119.26 126.23 2hxy h ALA 55 Ca 0.12 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2hxy h ALA 55 Cb 0.42 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2hxy h ALA 55 CO 0.02 0.61 0.00 -0.92 0.00 0.00 0.00 179.25 178.96 2hxy h TYR 56 N 0.32 0.00 0.00 0.00 3.20 0.65 -3.46 116.97 117.68 2hxy h TYR 56 Ca 0.03 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.90 2hxy h TYR 56 Cb 0.83 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.10 2hxy h TYR 56 CO 0.02 0.00 0.00 0.41 -1.64 0.00 0.00 178.16 176.95 2hxy n GLY 57 N -0.27 1.46 3.55 1.82 0.00 0.28 -5.02 105.19 107.00 2hxy n GLY 57 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2hxy n GLY 57 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2hxy s PHE 58 N -2.35 1.65 -0.15 1.61 5.36 -0.98 -4.82 117.98 118.30 2hxy s PHE 58 Ca 0.00 0.81 0.22 0.00 -0.96 0.00 0.00 56.93 57.00 2hxy s PHE 58 Cb 0.00 -4.06 -0.15 0.00 -0.34 0.00 0.00 43.02 38.47 2hxy s PHE 58 CO 0.00 -2.26 0.79 0.39 -1.46 0.00 0.00 175.22 172.67 2hxy n GLU 59 N 9.15 0.63 -3.69 10.12 1.02 -1.26 -4.09 120.64 132.52 2hxy n GLU 59 Ca 0.23 0.01 -0.11 0.00 -0.02 0.00 0.00 57.16 57.27 2hxy n GLU 59 Cb 0.52 -1.70 -0.11 0.00 -0.02 0.00 0.00 31.44 30.12 2hxy n GLU 59 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2hxy s LYS 60 N -3.35 0.33 0.38 3.49 2.20 -1.26 -4.78 119.74 116.75 2hxy s LYS 60 Ca -0.04 0.80 -0.21 0.00 -0.36 0.00 0.00 55.97 56.16 2hxy s LYS 60 Cb 0.11 0.03 -0.10 0.00 -1.51 0.00 0.00 37.83 36.36 2hxy s LYS 60 CO 0.84 -0.19 0.91 -1.25 -0.36 0.00 0.00 175.35 175.30 2hxy s PRO 61 N 1.70 4.28 1.33 4.03 0.04 -1.26 -5.06 135.00 140.06 2hxy s PRO 61 Ca -0.07 1.09 -0.18 0.00 0.04 0.00 0.00 61.00 61.88 2hxy s PRO 61 Cb -0.10 -2.38 0.34 0.00 0.04 0.00 0.00 34.50 32.40 2hxy s PRO 61 CO -0.12 0.08 0.96 0.45 0.04 0.00 0.00 177.00 178.42 2hxy s SER 62 N -2.04 -0.32 -0.04 6.66 0.15 -1.26 -4.80 113.70 112.06 2hxy s SER 62 Ca 0.57 1.15 -0.25 0.00 0.70 0.00 0.00 55.95 58.13 2hxy s SER 62 Cb -0.12 -1.72 -0.21 0.00 -1.71 0.00 0.00 66.02 62.26 2hxy s SER 62 CO 0.16 -4.95 1.13 0.00 1.20 0.00 0.00 173.24 170.79 2hxy h ALA 63 N -3.13 0.05 -0.16 5.45 0.00 -1.97 -2.71 119.26 116.79 2hxy h ALA 63 Ca -0.52 -0.38 -0.07 0.00 0.00 0.00 0.00 54.91 53.94 2hxy h ALA 63 Cb 1.34 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.13 2hxy h ALA 63 CO 0.38 -0.03 -0.18 -0.84 0.00 0.00 0.00 179.25 178.58 2hxy h ILE 64 N -0.46 1.35 -0.88 0.00 -0.00 -2.01 -3.09 117.51 112.41 2hxy h ILE 64 Ca -0.01 -1.37 0.14 0.00 -0.00 0.00 0.00 64.86 63.62 2hxy h ILE 64 Cb 0.78 1.87 -0.07 0.00 -0.00 0.00 0.00 36.82 39.41 2hxy h ILE 64 CO 0.03 0.41 0.57 1.56 -0.00 0.00 0.00 178.15 180.71 2hxy h GLN 65 N 0.04 0.68 -0.52 0.16 4.20 -1.93 0.31 115.11 118.06 2hxy h GLN 65 Ca 0.02 -0.04 0.04 0.00 0.06 0.00 0.00 58.65 58.73 2hxy h GLN 65 Cb 0.73 -0.15 -0.04 0.00 0.30 0.00 0.00 27.48 28.32 2hxy h GLN 65 CO 0.04 0.45 0.28 0.37 -0.67 0.00 0.00 178.83 179.30 2hxy h GLN 66 N 0.70 0.52 0.40 1.46 4.15 -1.39 -0.08 115.11 120.87 2hxy h GLN 66 Ca 0.44 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.82 2hxy h GLN 66 Cb 0.69 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 28.25 2hxy h GLN 66 CO -0.20 0.35 -0.29 -0.09 -1.93 0.00 0.00 178.83 176.66 2hxy h ARG 67 N 0.54 -0.66 -0.56 1.69 2.43 -0.45 0.45 114.38 117.82 2hxy h ARG 67 Ca 0.22 0.04 0.08 0.00 -0.81 0.00 0.00 59.98 59.52 2hxy h ARG 67 Cb 0.11 0.15 -0.10 0.00 -0.42 0.00 0.00 29.97 29.71 2hxy h ARG 67 CO -0.14 -0.44 -0.45 0.00 -1.51 0.00 0.00 179.97 177.43 2hxy h ALA 68 N -0.17 -0.38 0.64 2.80 0.00 -0.74 0.64 119.26 122.04 2hxy h ALA 68 Ca -0.04 0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 2hxy h ALA 68 Cb 0.58 0.98 -0.01 0.00 0.00 0.00 0.00 17.79 19.35 2hxy h ALA 68 CO 0.01 -0.85 -0.41 0.82 0.00 0.00 0.00 179.25 178.81 2hxy h ILE 69 N -0.25 0.00 -0.83 0.00 2.04 -0.70 0.11 117.51 117.88 2hxy h ILE 69 Ca 0.17 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.22 2hxy h ILE 69 Cb 0.57 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 36.49 2hxy h ILE 69 CO -0.68 0.00 -0.04 0.50 0.00 0.00 0.00 178.15 177.94 2hxy h LYS 70 N -0.99 0.06 -0.34 2.37 1.63 0.68 -1.16 116.57 118.82 2hxy h LYS 70 Ca -0.08 -0.00 -0.16 0.00 -0.85 0.00 0.00 60.65 59.55 2hxy h LYS 70 Cb 0.80 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.41 2hxy h LYS 70 CO 0.07 0.04 -0.42 1.96 -3.45 0.00 0.00 179.45 177.65 2hxy h GLN 71 N 0.06 0.85 -0.59 1.90 1.08 0.53 -2.48 115.11 116.46 2hxy h GLN 71 Ca 0.46 -0.47 -0.07 0.00 -1.45 0.00 0.00 58.65 57.12 2hxy h GLN 71 Cb 0.82 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 28.25 2hxy h GLN 71 CO -0.77 1.11 0.07 0.82 -0.95 0.00 0.00 178.83 179.11 2hxy h ILE 72 N 0.69 1.25 -0.50 2.54 2.04 0.36 -2.66 117.51 121.23 2hxy h ILE 72 Ca 0.05 -1.00 -0.02 0.00 1.00 0.00 0.00 64.86 64.89 2hxy h ILE 72 Cb 1.00 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 2hxy h ILE 72 CO 0.10 0.37 0.23 0.40 0.00 0.00 0.00 178.15 179.25 2hxy h ILE 73 N 0.91 1.20 -0.50 -0.67 2.04 -1.22 -0.83 117.51 118.43 2hxy h ILE 73 Ca 0.18 -0.57 0.14 0.00 1.00 0.00 0.00 64.86 65.62 2hxy h ILE 73 Cb 0.43 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 2hxy h ILE 73 CO 0.01 0.22 0.44 0.11 0.00 0.00 0.00 178.15 178.94 2hxy h LYS 74 N 0.67 0.00 0.00 2.37 1.79 -1.10 -3.45 116.57 116.85 2hxy h LYS 74 Ca 0.17 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.64 2hxy h LYS 74 Cb 0.13 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.78 2hxy h LYS 74 CO -0.02 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 178.76 2hxy n GLY 75 N -1.56 1.27 3.65 3.86 0.00 -0.32 -5.09 105.19 107.00 2hxy n GLY 75 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 2hxy n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hxy n ARG 76 N -0.86 1.09 -2.51 1.61 5.12 -1.11 -4.86 116.66 115.14 2hxy n ARG 76 Ca 0.00 0.41 -0.41 0.00 -1.93 0.00 0.00 57.85 55.92 2hxy n ARG 76 Cb 0.00 -2.26 -0.04 0.00 -1.16 0.00 0.00 32.46 29.00 2hxy n ARG 76 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2hxy s ASP 77 N -1.16 7.26 0.05 0.55 1.11 -1.26 -4.59 116.67 118.63 2hxy s ASP 77 Ca 0.75 2.09 0.07 0.00 0.18 0.00 0.00 52.55 55.64 2hxy s ASP 77 Cb -0.43 -2.60 -0.03 0.00 1.07 0.00 0.00 42.92 40.94 2hxy s ASP 77 CO 0.48 -0.23 -0.21 -0.69 1.18 0.00 0.00 175.17 175.69 2hxy s VAL 78 N -0.18 1.69 -0.44 -1.27 1.01 -1.14 0.47 120.40 120.53 2hxy s VAL 78 Ca 0.50 -1.24 0.03 0.00 0.00 0.00 0.00 61.98 61.27 2hxy s VAL 78 Cb -0.29 -1.47 0.12 0.00 0.00 0.00 0.00 36.38 34.74 2hxy s VAL 78 CO 0.35 0.19 0.20 -0.63 0.00 0.00 0.00 175.10 175.20 2hxy s ILE 79 N -0.83 2.03 -0.22 2.22 1.01 0.08 -0.01 121.20 125.47 2hxy s ILE 79 Ca 0.07 -2.75 -0.09 0.00 0.00 0.00 0.00 60.65 57.88 2hxy s ILE 79 Cb -0.09 -2.44 -0.04 0.00 0.01 0.00 0.00 42.46 39.90 2hxy s ILE 79 CO 0.02 -0.78 0.12 0.00 0.00 0.00 0.00 174.94 174.30 2hxy s ALA 80 N 0.28 3.49 -0.22 9.38 0.00 -0.68 -0.92 121.76 133.09 2hxy s ALA 80 Ca 0.15 -0.86 -0.25 0.00 0.00 0.00 0.00 51.96 51.00 2hxy s ALA 80 Cb -0.24 -2.16 -0.01 0.00 0.00 0.00 0.00 23.12 20.72 2hxy s ALA 80 CO -0.04 -0.10 0.84 -1.14 0.00 0.00 0.00 175.76 175.32 2hxy s GLN 81 N 0.88 4.21 0.44 0.00 0.74 -0.64 -1.73 119.66 123.56 2hxy s GLN 81 Ca 0.06 0.97 -0.24 0.00 0.05 0.00 0.00 55.36 56.21 2hxy s GLN 81 Cb -0.13 -3.63 -0.08 0.00 1.10 0.00 0.00 33.01 30.27 2hxy s GLN 81 CO 0.03 -0.47 1.17 0.45 -0.55 0.00 0.00 175.29 175.91 2hxy s SER 82 N 1.29 6.29 -0.02 6.67 0.15 -0.64 -4.85 113.70 122.58 2hxy s SER 82 Ca 0.36 2.32 0.00 0.00 0.70 0.00 0.00 55.95 59.33 2hxy s SER 82 Cb -0.16 -2.61 0.02 0.00 -1.71 0.00 0.00 66.02 61.57 2hxy s SER 82 CO 0.08 -0.84 0.01 -1.58 1.20 0.00 0.00 173.24 172.12 2hxy s GLN 83 N -2.58 0.09 -0.42 5.44 0.74 -1.26 -4.35 119.66 117.32 2hxy s GLN 83 Ca 0.61 0.11 -0.38 0.00 0.05 0.00 0.00 55.36 55.75 2hxy s GLN 83 Cb -0.29 -0.29 -0.14 0.00 1.10 0.00 0.00 33.01 33.38 2hxy s GLN 83 CO 0.36 -0.12 2.19 0.43 -0.55 0.00 0.00 175.29 177.59 2hxy n SER 84 N 3.97 1.56 0.00 6.67 7.64 -1.26 -4.71 113.62 127.49 2hxy n SER 84 Ca -0.25 0.49 0.00 0.00 1.01 0.00 0.00 58.87 60.12 2hxy n SER 84 Cb 0.52 -1.12 0.00 0.00 -1.01 0.00 0.00 64.21 62.60 2hxy n SER 84 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2hxy n GLY 85 N 6.90 2.19 3.72 0.23 0.00 -1.26 -5.15 105.19 111.82 2hxy n GLY 85 Ca 0.47 -0.40 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 2hxy n GLY 85 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2hxy s THR 86 N -1.21 5.12 -0.72 2.61 2.01 -1.26 -4.60 115.64 117.59 2hxy s THR 86 Ca 0.00 1.20 -0.12 0.00 0.31 0.00 0.00 61.69 63.07 2hxy s THR 86 Cb 0.00 -3.93 0.02 0.00 0.01 0.00 0.00 72.50 68.60 2hxy s THR 86 CO 0.00 0.28 0.45 0.61 -0.69 0.00 0.00 174.62 175.27 2hxy n GLY 87 N 3.21 -0.77 0.00 4.40 0.00 -1.26 -4.76 105.19 106.01 2hxy n GLY 87 Ca -0.04 0.34 0.11 0.00 0.00 0.00 0.00 46.02 46.43 2hxy n GLY 87 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2hxy n LYS 88 N -2.91 0.46 -0.04 1.61 3.00 -1.26 -2.57 118.16 116.45 2hxy n LYS 88 Ca -0.16 0.05 -0.02 0.00 -0.00 0.00 0.00 58.31 58.18 2hxy n LYS 88 Cb 0.45 -1.50 -0.01 0.00 0.00 0.00 0.00 35.03 33.97 2hxy n LYS 88 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.40 178.55 2hxy h THR 89 N 0.00 0.00 -0.68 3.15 2.02 -1.97 -3.40 112.91 112.03 2hxy h THR 89 Ca 0.00 -0.76 0.13 0.00 0.77 0.00 0.00 66.41 66.55 2hxy h THR 89 Cb 0.14 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 66.42 2hxy h THR 89 CO 0.00 0.00 -0.21 0.00 0.37 0.00 0.00 175.52 175.68 2hxy h ALA 90 N -1.24 0.36 -0.95 6.16 0.00 -1.88 -1.38 119.26 120.32 2hxy h ALA 90 Ca 0.00 0.25 0.13 0.00 0.00 0.00 0.00 54.91 55.30 2hxy h ALA 90 Cb 0.17 0.59 -0.15 0.00 0.00 0.00 0.00 17.79 18.41 2hxy h ALA 90 CO 0.00 -0.47 -0.41 2.41 0.00 0.00 0.00 179.25 180.78 2hxy n THR 91 N -5.46 -0.53 0.06 0.00 -1.04 -1.06 0.13 114.28 106.37 2hxy n THR 91 Ca 0.08 2.25 -0.08 0.00 -2.04 0.00 0.00 64.05 64.27 2hxy n THR 91 Cb 0.36 -2.93 -0.12 0.00 -1.82 0.00 0.00 70.33 65.82 2hxy n THR 91 CO 0.00 0.00 0.00 2.19 -0.64 0.00 0.00 175.07 176.62 2hxy h PHE 92 N 0.00 0.03 -0.34 -1.42 -5.15 -1.61 -3.03 116.94 105.42 2hxy h PHE 92 Ca 0.29 -0.02 0.01 0.00 -0.20 0.00 0.00 57.97 58.05 2hxy h PHE 92 Cb 0.53 -0.00 -0.02 0.00 0.22 0.00 0.00 35.95 36.68 2hxy h PHE 92 CO -0.87 1.02 0.21 0.77 -2.00 0.00 0.00 178.31 177.44 2hxy h SER 93 N 0.00 0.35 -0.84 -0.68 0.02 0.42 0.43 113.55 113.25 2hxy h SER 93 Ca -0.02 -0.00 0.11 0.00 -0.84 0.00 0.00 61.79 61.03 2hxy h SER 93 Cb 1.78 -0.08 -0.08 0.00 0.14 0.00 0.00 62.40 64.17 2hxy h SER 93 CO 0.13 0.25 0.48 0.40 -1.14 0.00 0.00 176.83 176.96 2hxy h ILE 94 N 0.43 0.88 0.87 3.27 2.04 0.11 0.74 117.51 125.85 2hxy h ILE 94 Ca 0.13 -0.27 -0.04 0.00 1.00 0.00 0.00 64.86 65.68 2hxy h ILE 94 Cb -0.02 0.03 0.01 0.00 -0.74 0.00 0.00 36.82 36.10 2hxy h ILE 94 CO -0.05 0.14 -0.42 0.28 0.00 0.00 0.00 178.15 178.10 2hxy h SER 95 N 0.78 -0.99 -0.48 1.72 0.02 -0.91 -1.84 113.55 111.85 2hxy h SER 95 Ca 0.42 0.03 0.07 0.00 -0.84 0.00 0.00 61.79 61.47 2hxy h SER 95 Cb 0.42 0.26 -0.09 0.00 0.14 0.00 0.00 62.40 63.13 2hxy h SER 95 CO -0.27 -0.71 -0.50 0.58 -1.14 0.00 0.00 176.83 174.79 2hxy h VAL 96 N -1.18 0.05 -0.35 2.27 2.07 0.33 -2.06 116.25 117.39 2hxy h VAL 96 Ca -0.12 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.47 2hxy h VAL 96 Cb 0.90 0.05 -0.08 0.00 -1.52 0.00 0.00 31.29 30.63 2hxy h VAL 96 CO 0.20 0.00 -0.29 -0.07 0.02 0.00 0.00 177.57 177.43 2hxy h LEU 97 N -0.32 -0.95 -0.60 2.57 3.38 -0.85 -2.39 115.31 116.15 2hxy h LEU 97 Ca 0.12 0.17 0.12 0.00 0.09 0.00 0.00 57.88 58.38 2hxy h LEU 97 Cb 0.58 0.45 -0.11 0.00 0.09 0.00 0.00 40.66 41.67 2hxy h LEU 97 CO -0.63 -0.30 -0.16 -0.61 0.09 0.00 0.00 178.44 176.82 2hxy h GLN 98 N -0.25 -0.01 -3.43 1.13 5.75 -0.62 -3.01 115.11 114.67 2hxy h GLN 98 Ca 0.16 0.00 -0.71 0.00 -0.15 0.00 0.00 58.65 57.95 2hxy h GLN 98 Cb 0.51 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 29.01 2hxy h GLN 98 CO -0.49 -0.01 3.05 0.00 -2.65 0.00 0.00 178.83 178.74 2hxy s LEU 100 N 0.60 2.24 -0.58 0.00 1.43 -1.14 -4.96 118.68 116.26 2hxy s LEU 100 Ca 0.53 -1.11 0.04 0.00 -1.03 0.00 0.00 54.13 52.57 2hxy s LEU 100 Cb 0.15 0.00 0.16 0.00 0.03 0.00 0.00 46.19 46.53 2hxy s LEU 100 CO -0.06 -0.55 0.39 -0.62 0.23 0.00 0.00 176.35 175.73 2hxy s ASP 101 N -3.09 4.01 0.13 2.29 -1.08 -1.26 -5.00 116.67 112.66 2hxy s ASP 101 Ca 0.18 -3.39 -0.25 0.00 -0.52 0.00 0.00 52.55 48.57 2hxy s ASP 101 Cb 0.06 -1.35 -0.06 0.00 -1.46 0.00 0.00 42.92 40.11 2hxy s ASP 101 CO -0.00 -0.15 1.44 0.40 0.52 0.00 0.00 175.17 177.37 2hxy h ILE 102 N 4.75 0.00 0.00 4.11 1.08 -1.97 0.38 117.51 125.87 2hxy h ILE 102 Ca 0.10 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.57 2hxy h ILE 102 Cb 0.83 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.58 2hxy h ILE 102 CO 0.62 0.00 0.38 0.00 -0.69 0.00 0.00 178.15 178.46 2hxy n GLN 103 N -4.82 0.02 -3.75 2.37 1.13 -1.26 -3.39 117.38 107.68 2hxy n GLN 103 Ca 0.01 0.32 -0.34 0.00 -1.94 0.00 0.00 57.00 55.05 2hxy n GLN 103 Cb 0.21 -1.96 -0.10 0.00 0.11 0.00 0.00 30.24 28.51 2hxy n GLN 103 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2hxy s VAL 104 N -2.70 3.65 -0.86 5.09 1.01 0.12 -5.03 120.40 121.68 2hxy s VAL 104 Ca -0.00 -3.44 -0.25 0.00 0.00 0.00 0.00 61.98 58.29 2hxy s VAL 104 Cb 0.01 -3.35 -0.04 0.00 0.00 0.00 0.00 36.38 33.00 2hxy s VAL 104 CO 0.03 -0.94 1.91 -0.13 0.00 0.00 0.00 175.10 175.97 2hxy s ARG 105 N -0.65 2.61 -0.22 2.72 0.52 -1.22 -4.85 118.95 117.87 2hxy s ARG 105 Ca 0.21 -0.18 -0.27 0.00 -0.52 0.00 0.00 55.73 54.96 2hxy s ARG 105 Cb -0.15 -4.96 0.12 0.00 0.52 0.00 0.00 34.95 30.47 2hxy s ARG 105 CO -0.07 -3.23 0.99 -2.00 0.02 0.00 0.00 175.30 171.01 2hxy s GLU 106 N 6.93 0.58 -0.37 3.54 2.12 -1.26 -4.71 118.70 125.52 2hxy s GLU 106 Ca 0.68 0.42 -0.37 0.00 0.36 0.00 0.00 54.97 56.06 2hxy s GLU 106 Cb -0.07 0.28 -0.13 0.00 0.26 0.00 0.00 34.13 34.46 2hxy s GLU 106 CO 0.02 -0.12 2.14 2.41 -0.54 0.00 0.00 175.26 179.17 2hxy n THR 107 N 1.58 0.16 -0.01 -1.70 -1.04 -0.89 -4.46 114.28 107.92 2hxy n THR 107 Ca -0.12 -0.19 0.05 0.00 -2.04 0.00 0.00 64.05 61.75 2hxy n THR 107 Cb 0.57 -1.38 -0.10 0.00 -1.82 0.00 0.00 70.33 67.60 2hxy n THR 107 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2hxy n GLN 108 N 7.84 0.64 -3.92 -2.82 6.02 -0.66 -2.96 117.38 121.52 2hxy n GLN 108 Ca 0.43 -0.10 -0.14 0.00 -0.01 0.00 0.00 57.00 57.17 2hxy n GLN 108 Cb 0.17 -1.30 -0.15 0.00 1.02 0.00 0.00 30.24 29.97 2hxy n GLN 108 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2hxy s ALA 109 N -2.80 0.17 -0.12 -1.58 0.00 -1.17 -0.29 121.76 115.98 2hxy s ALA 109 Ca -0.05 0.06 0.02 0.00 0.00 0.00 0.00 51.96 51.99 2hxy s ALA 109 Cb 0.07 -0.14 0.01 0.00 0.00 0.00 0.00 23.12 23.06 2hxy s ALA 109 CO 0.52 -0.02 -0.18 -1.17 0.00 0.00 0.00 175.76 174.92 2hxy s LEU 110 N 0.42 1.85 -0.12 0.00 2.96 0.11 -1.76 118.68 122.15 2hxy s LEU 110 Ca -0.04 -0.48 0.01 0.00 -0.22 0.00 0.00 54.13 53.40 2hxy s LEU 110 Cb -0.06 -1.20 -0.01 0.00 0.50 0.00 0.00 46.19 45.42 2hxy s LEU 110 CO -0.01 0.04 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.29 2hxy s ILE 111 N 0.89 2.94 -0.06 6.68 1.01 0.11 -0.54 121.20 132.22 2hxy s ILE 111 Ca -0.08 -0.71 0.02 0.00 0.00 0.00 0.00 60.65 59.89 2hxy s ILE 111 Cb -0.15 -2.22 -0.03 0.00 0.01 0.00 0.00 42.46 40.07 2hxy s ILE 111 CO -0.01 0.53 -0.12 -0.76 0.00 0.00 0.00 174.94 174.58 2hxy s LEU 112 N 0.29 2.85 0.12 2.97 1.43 -0.11 -2.25 118.68 123.98 2hxy s LEU 112 Ca -0.11 -0.17 0.03 0.00 -1.03 0.00 0.00 54.13 52.86 2hxy s LEU 112 Cb -0.16 -1.60 -0.04 0.00 0.03 0.00 0.00 46.19 44.42 2hxy s LEU 112 CO 0.06 0.33 -0.08 0.00 0.23 0.00 0.00 176.35 176.88 2hxy s ALA 113 N -0.62 1.17 -0.35 4.21 0.00 -1.02 -1.90 121.76 123.25 2hxy s ALA 113 Ca 0.09 -1.39 0.26 0.00 0.00 0.00 0.00 51.96 50.93 2hxy s ALA 113 Cb -0.11 0.10 1.05 0.00 0.00 0.00 0.00 23.12 24.16 2hxy s ALA 113 CO 0.01 -0.16 1.78 -1.00 0.00 0.00 0.00 175.76 176.39 2hxy h PRO 114 N 2.95 0.00 -3.54 0.00 0.13 -1.83 -3.35 132.00 126.36 2hxy h PRO 114 Ca -0.36 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.62 2hxy h PRO 114 Cb 1.18 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 32.09 2hxy h PRO 114 CO 0.63 0.00 -0.52 0.95 -0.23 0.00 0.00 178.00 178.83 2hxy s THR 115 N -3.39 0.07 0.11 1.56 -4.23 -1.26 -4.97 115.64 103.54 2hxy s THR 115 Ca 0.04 -0.60 -0.30 0.00 -1.18 0.00 0.00 61.69 59.65 2hxy s THR 115 Cb 0.09 -0.38 -0.09 0.00 1.34 0.00 0.00 72.50 73.47 2hxy s THR 115 CO 0.45 -0.33 1.60 0.03 -0.54 0.00 0.00 174.62 175.83 2hxy h ARG 116 N 4.59 -0.57 -0.58 3.99 3.08 -1.94 0.25 114.38 123.19 2hxy h ARG 116 Ca -0.30 0.04 0.07 0.00 0.07 0.00 0.00 59.98 59.86 2hxy h ARG 116 Cb 1.20 0.13 -0.10 0.00 0.08 0.00 0.00 29.97 31.28 2hxy h ARG 116 CO 0.41 -0.38 -0.53 0.93 -1.07 0.00 0.00 179.97 179.32 2hxy h GLU 117 N -0.60 -0.26 -0.96 0.04 3.07 -1.99 -0.10 114.58 113.78 2hxy h GLU 117 Ca 0.03 0.02 0.02 0.00 -0.50 0.00 0.00 59.36 58.93 2hxy h GLU 117 Cb 0.63 0.06 -0.05 0.00 -0.84 0.00 0.00 28.75 28.55 2hxy h GLU 117 CO -0.23 -0.17 0.63 1.25 -1.40 0.00 0.00 179.01 179.09 2hxy h LEU 118 N -0.27 1.08 -0.63 1.33 5.85 -1.87 -1.79 115.31 119.01 2hxy h LEU 118 Ca 0.12 -0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.91 2hxy h LEU 118 Cb 0.55 -0.26 -0.07 0.00 0.37 0.00 0.00 40.66 41.25 2hxy h LEU 118 CO -0.69 0.76 0.26 0.00 -0.34 0.00 0.00 178.44 178.43 2hxy h ALA 119 N 1.42 0.82 0.27 1.25 0.00 0.13 -1.40 119.26 121.74 2hxy h ALA 119 Ca 0.37 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.33 2hxy h ALA 119 Cb -0.08 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2hxy h ALA 119 CO -0.09 -0.15 -0.13 0.28 0.00 0.00 0.00 179.25 179.15 2hxy h VAL 120 N 0.46 0.77 -0.74 0.00 2.07 -0.62 -2.79 116.25 115.39 2hxy h VAL 120 Ca 0.31 -0.23 0.11 0.00 0.82 0.00 0.00 66.70 67.71 2hxy h VAL 120 Cb 0.36 0.90 -0.12 0.00 -1.52 0.00 0.00 31.29 30.91 2hxy h VAL 120 CO -0.29 0.05 -0.44 1.56 0.02 0.00 0.00 177.57 178.48 2hxy h GLN 121 N -0.48 -0.13 -0.96 1.57 4.20 -0.60 0.96 115.11 119.68 2hxy h GLN 121 Ca -0.04 0.01 0.27 0.00 0.06 0.00 0.00 58.65 58.95 2hxy h GLN 121 Cb 0.36 0.03 -0.14 0.00 0.30 0.00 0.00 27.48 28.03 2hxy h GLN 121 CO 0.06 -0.09 0.48 0.82 -0.67 0.00 0.00 178.83 179.43 2hxy h ILE 122 N -0.14 0.40 0.48 2.54 2.04 -1.18 0.31 117.51 121.97 2hxy h ILE 122 Ca 0.22 -0.13 -0.02 0.00 1.00 0.00 0.00 64.86 65.93 2hxy h ILE 122 Cb 0.55 -0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.62 2hxy h ILE 122 CO -0.80 0.07 -0.23 -0.61 0.00 0.00 0.00 178.15 176.58 2hxy h GLN 123 N 0.38 -0.63 -1.21 2.37 4.15 0.10 0.57 115.11 120.85 2hxy h GLN 123 Ca 0.64 0.04 0.35 0.00 0.77 0.00 0.00 58.65 60.45 2hxy h GLN 123 Cb 1.33 0.14 -0.09 0.00 0.21 0.00 0.00 27.48 29.07 2hxy h GLN 123 CO -0.57 -0.42 0.80 0.87 -1.93 0.00 0.00 178.83 177.59 2hxy h LYS 124 N -0.99 0.19 -0.00 1.69 1.57 0.55 0.22 116.57 119.80 2hxy h LYS 124 Ca -0.07 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 2hxy h LYS 124 Cb 0.50 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.77 2hxy h LYS 124 CO 0.11 0.12 -0.03 0.78 -0.57 0.00 0.00 179.45 179.87 2hxy h GLY 125 N 0.19 0.03 0.42 3.86 0.00 -0.37 -1.74 103.07 105.46 2hxy h GLY 125 Ca 0.67 -0.04 0.09 0.00 0.00 0.00 0.00 47.33 48.05 2hxy h GLY 125 CO -0.25 0.03 0.25 1.41 0.00 0.00 0.00 176.54 177.98 2hxy h LEU 126 N -0.67 0.26 -0.66 3.11 3.38 0.17 0.97 115.31 121.86 2hxy h LEU 126 Ca -0.00 0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 2hxy h LEU 126 Cb 0.73 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.50 2hxy h LEU 126 CO 0.01 0.16 0.29 -0.07 0.09 0.00 0.00 178.44 178.91 2hxy h LEU 127 N 0.44 0.89 -1.34 1.67 3.38 -0.92 -0.95 115.31 118.47 2hxy h LEU 127 Ca 0.31 -0.15 -0.07 0.00 0.09 0.00 0.00 57.88 58.06 2hxy h LEU 127 Cb 0.36 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2hxy h LEU 127 CO -0.29 0.80 -0.33 0.00 0.09 0.00 0.00 178.44 178.70 2hxy h ALA 128 N 1.13 1.46 0.01 1.53 0.00 -0.35 -0.42 119.26 122.62 2hxy h ALA 128 Ca 0.22 -0.30 -0.22 0.00 0.00 0.00 0.00 54.91 54.62 2hxy h ALA 128 Cb 0.17 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 2hxy h ALA 128 CO -0.02 0.41 -1.03 -0.07 0.00 0.00 0.00 179.25 178.54 2hxy h LEU 129 N 0.00 0.03 -3.23 0.00 3.38 -0.10 -3.31 115.31 112.09 2hxy h LEU 129 Ca -0.00 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2hxy h LEU 129 Cb 0.58 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.32 2hxy h LEU 129 CO 0.04 1.03 0.00 0.61 0.09 0.00 0.00 178.44 180.21 2hxy n GLY 130 N 1.37 3.61 0.58 0.83 0.00 -0.43 -4.00 105.19 107.14 2hxy n GLY 130 Ca -0.01 -0.91 0.42 0.00 0.00 0.00 0.00 46.02 45.52 2hxy n GLY 130 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2hxy h ASP 131 N 2.28 0.10 -0.47 1.61 -0.00 -1.16 1.99 116.42 120.76 2hxy h ASP 131 Ca 0.00 0.05 0.00 0.00 -0.00 0.00 0.00 57.03 57.08 2hxy h ASP 131 Cb 1.40 0.04 0.00 0.00 -0.00 0.00 0.00 39.33 40.77 2hxy h ASP 131 CO 0.22 -0.05 0.00 -1.22 -0.00 0.00 0.00 179.24 178.19 2hxy n TYR 132 N -4.27 0.88 0.19 0.28 4.01 -1.26 -3.66 117.16 113.32 2hxy n TYR 132 Ca 0.36 -0.38 0.03 0.00 -0.16 0.00 0.00 57.90 57.76 2hxy n TYR 132 Cb 1.58 -0.10 0.04 0.00 -0.31 0.00 0.00 39.34 40.54 2hxy n TYR 132 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 2hxy n MET 133 N 0.83 0.41 -3.99 -0.72 2.81 0.67 -4.79 117.12 112.35 2hxy n MET 133 Ca 0.17 -1.04 -0.41 0.00 -1.81 0.00 0.00 57.70 54.62 2hxy n MET 133 Cb 0.55 -1.12 0.02 0.00 -0.71 0.00 0.00 33.22 31.95 2hxy n MET 133 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 2hxy n ASN 134 N 0.30 -3.88 -4.87 7.83 5.15 -1.17 -4.91 115.26 113.70 2hxy n ASN 134 Ca 0.04 -1.21 -0.34 0.00 -0.60 0.00 0.00 54.58 52.47 2hxy n ASN 134 Cb 0.19 -2.19 -0.06 0.00 -0.53 0.00 0.00 39.78 37.20 2hxy n ASN 134 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2hxy s VAL 135 N -3.60 5.28 -0.23 3.44 0.11 -1.26 -5.10 120.40 119.04 2hxy s VAL 135 Ca 0.43 -0.14 -0.09 0.00 -2.93 0.00 0.00 61.98 59.25 2hxy s VAL 135 Cb -0.21 -3.42 -0.04 0.00 -1.53 0.00 0.00 36.38 31.18 2hxy s VAL 135 CO 0.94 0.39 0.11 -1.10 -3.33 0.00 0.00 175.10 172.11 2hxy s GLN 136 N -1.70 3.92 -0.06 1.54 -1.52 -1.26 -5.00 119.66 115.59 2hxy s GLN 136 Ca 0.24 -0.35 -0.03 0.00 -1.95 0.00 0.00 55.36 53.27 2hxy s GLN 136 Cb -0.12 -3.39 0.03 0.00 -0.22 0.00 0.00 33.01 29.30 2hxy s GLN 136 CO 0.14 0.04 0.13 0.00 -0.25 0.00 0.00 175.29 175.35 2hxy s HIS 138 N 0.90 1.15 -0.13 0.00 2.46 -0.65 -4.98 115.29 114.03 2hxy s HIS 138 Ca -0.07 -0.55 -0.01 0.00 0.47 0.00 0.00 55.06 54.91 2hxy s HIS 138 Cb -0.09 -0.63 -0.02 0.00 -0.13 0.00 0.00 32.58 31.71 2hxy s HIS 138 CO -0.04 0.04 -0.12 0.00 -2.47 0.00 0.00 174.74 172.15 2hxy s ALA 139 N -1.86 2.68 0.03 1.58 0.00 -1.26 -1.33 121.76 121.60 2hxy s ALA 139 Ca 0.02 -0.88 -0.07 0.00 0.00 0.00 0.00 51.96 51.03 2hxy s ALA 139 Cb -0.07 -1.25 -0.05 0.00 0.00 0.00 0.00 23.12 21.75 2hxy s ALA 139 CO 0.01 0.26 0.31 0.00 0.00 0.00 0.00 175.76 176.34 2hxy n ILE 141 N 1.04 0.00 0.00 0.00 5.41 -1.26 -4.38 119.36 120.16 2hxy n ILE 141 Ca -0.10 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.65 2hxy n ILE 141 Cb 0.53 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.46 2hxy n ILE 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2hxy n GLY 142 N -1.82 1.77 0.00 7.39 0.00 -1.26 -4.70 105.19 106.58 2hxy n GLY 142 Ca 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.55 2hxy n GLY 142 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hxy n GLY 143 N 0.00 3.17 0.00 -0.02 0.00 -1.26 -4.64 105.19 102.44 2hxy n GLY 143 Ca 0.00 -0.88 0.11 0.00 0.00 0.00 0.00 46.02 45.24 2hxy n GLY 143 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2hxy n THR 144 N 0.00 0.50 0.42 2.61 -1.04 -1.26 -2.82 114.28 112.69 2hxy n THR 144 Ca 0.00 0.12 0.04 0.00 -2.04 0.00 0.00 64.05 62.17 2hxy n THR 144 Cb 0.00 -0.75 -0.04 0.00 -1.82 0.00 0.00 70.33 67.72 2hxy n THR 144 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 2hxy n ASN 145 N -1.53 0.64 -0.66 8.00 2.85 -1.26 -4.71 115.26 118.59 2hxy n ASN 145 Ca 0.05 -0.82 0.50 0.00 -0.11 0.00 0.00 54.58 54.20 2hxy n ASN 145 Cb 0.26 0.84 0.77 0.00 1.24 0.00 0.00 39.78 42.89 2hxy n ASN 145 CO 0.00 0.00 0.00 1.33 -2.11 0.00 0.00 177.26 176.48 2hxy n VAL 146 N -0.93 -0.02 -0.04 3.44 0.24 -1.13 0.77 118.33 120.67 2hxy n VAL 146 Ca 0.02 1.45 -0.14 0.00 -2.04 0.00 0.00 64.34 63.63 2hxy n VAL 146 Cb 0.16 -2.41 -0.09 0.00 -1.47 0.00 0.00 33.84 30.02 2hxy n VAL 146 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2hxy h GLY 147 N 0.00 0.33 1.55 7.63 0.00 -1.84 -1.09 103.07 109.65 2hxy h GLY 147 Ca 0.89 -0.43 -0.10 0.00 0.00 0.00 0.00 47.33 47.69 2hxy h GLY 147 CO -0.05 0.38 -0.27 -2.09 0.00 0.00 0.00 176.54 174.51 2hxy h GLU 148 N -0.18 0.52 0.35 4.80 4.57 0.02 0.16 114.58 124.81 2hxy h GLU 148 Ca -0.01 -0.21 -0.01 0.00 -1.18 0.00 0.00 59.36 57.96 2hxy h GLU 148 Cb 0.86 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 29.40 2hxy h GLU 148 CO 0.05 0.74 -0.46 -0.44 -1.18 0.00 0.00 179.01 177.72 2hxy h ASP 149 N 0.46 -1.30 -0.28 1.04 5.19 -0.06 -1.25 116.42 120.21 2hxy h ASP 149 Ca 0.06 0.11 -0.06 0.00 -0.62 0.00 0.00 57.03 56.53 2hxy h ASP 149 Cb 0.71 0.44 -0.02 0.00 0.18 0.00 0.00 39.33 40.64 2hxy h ASP 149 CO 0.05 -0.57 -0.01 0.40 -3.12 0.00 0.00 179.24 176.00 2hxy h ILE 150 N -0.84 1.22 -0.31 0.35 2.04 -1.09 -2.25 117.51 116.62 2hxy h ILE 150 Ca -0.04 -0.87 0.07 0.00 1.00 0.00 0.00 64.86 65.01 2hxy h ILE 150 Cb 0.75 0.93 -0.07 0.00 -0.74 0.00 0.00 36.82 37.70 2hxy h ILE 150 CO -0.11 0.30 -0.15 -0.09 0.00 0.00 0.00 178.15 178.10 2hxy h ARG 151 N 0.58 -0.10 -0.19 2.37 2.43 -0.27 -2.77 114.38 116.42 2hxy h ARG 151 Ca 0.12 0.01 -0.13 0.00 -0.81 0.00 0.00 59.98 59.16 2hxy h ARG 151 Cb 0.38 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 2hxy h ARG 151 CO 0.01 -0.07 -0.40 0.87 -1.51 0.00 0.00 179.97 178.88 2hxy h LYS 152 N -0.10 0.61 -1.16 0.20 1.57 -1.01 -3.10 116.57 113.58 2hxy h LYS 152 Ca 0.16 -0.40 0.33 0.00 -1.87 0.00 0.00 60.65 58.87 2hxy h LYS 152 Cb 0.34 0.05 -0.06 0.00 0.08 0.00 0.00 32.23 32.65 2hxy h LYS 152 CO -0.37 1.01 0.82 -0.07 -0.57 0.00 0.00 179.45 180.27 2hxy h LEU 153 N 0.28 0.09 0.10 2.94 3.38 -1.15 0.22 115.31 121.17 2hxy h LEU 153 Ca 0.00 0.02 -0.26 0.00 0.09 0.00 0.00 57.88 57.73 2hxy h LEU 153 Cb 1.00 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.75 2hxy h LEU 153 CO 0.09 0.01 -1.22 0.44 0.09 0.00 0.00 178.44 177.85 2hxy h ASP 154 N 0.08 0.34 0.03 -0.43 3.32 -1.42 -3.01 116.42 115.32 2hxy h ASP 154 Ca 0.58 -0.37 0.00 0.00 0.02 0.00 0.00 57.03 57.26 2hxy h ASP 154 Cb 2.14 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 41.58 2hxy h ASP 154 CO -0.07 1.29 0.00 0.22 -1.72 0.00 0.00 179.24 178.96 2hxy h TYR 155 N 0.06 0.00 -0.51 4.55 3.20 -0.53 -3.46 116.97 120.28 2hxy h TYR 155 Ca -0.12 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.75 2hxy h TYR 155 Cb 1.94 0.00 0.00 0.00 1.54 0.00 0.00 36.73 40.21 2hxy h TYR 155 CO 0.05 0.00 0.00 0.41 -1.64 0.00 0.00 178.16 176.98 2hxy n GLY 156 N -1.16 -0.61 3.52 1.82 0.00 -1.02 -4.97 105.19 102.77 2hxy n GLY 156 Ca -0.02 -0.68 -0.42 0.00 0.00 0.00 0.00 46.02 44.90 2hxy n GLY 156 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2hxy s GLN 157 N -0.03 3.34 0.49 1.61 -1.52 -1.25 -4.57 119.66 117.73 2hxy s GLN 157 Ca 0.00 -0.42 0.22 0.00 -1.95 0.00 0.00 55.36 53.22 2hxy s GLN 157 Cb 0.00 -3.91 1.28 0.00 -0.22 0.00 0.00 33.01 30.16 2hxy s GLN 157 CO 0.00 -0.84 1.96 0.45 -0.25 0.00 0.00 175.29 176.60 2hxy h HIS 158 N 8.70 0.18 -3.25 0.91 3.86 -1.16 -2.35 115.15 122.03 2hxy h HIS 158 Ca -0.26 0.01 -0.19 0.00 -1.16 0.00 0.00 60.37 58.76 2hxy h HIS 158 Cb 1.11 -0.06 -0.27 0.00 1.06 0.00 0.00 27.41 29.25 2hxy h HIS 158 CO 0.69 0.07 -0.51 0.08 0.86 0.00 0.00 177.93 179.12 2hxy s VAL 159 N -5.16 -0.01 0.04 2.45 1.01 -1.16 -1.65 120.40 115.92 2hxy s VAL 159 Ca -0.06 0.04 0.07 0.00 0.00 0.00 0.00 61.98 62.03 2hxy s VAL 159 Cb 0.20 -0.28 -0.02 0.00 0.00 0.00 0.00 36.38 36.28 2hxy s VAL 159 CO 0.75 0.02 -0.19 -0.69 0.00 0.00 0.00 175.10 174.99 2hxy s VAL 160 N 0.40 1.53 0.06 2.92 1.01 -0.72 -1.64 120.40 123.95 2hxy s VAL 160 Ca -0.02 -1.14 0.03 0.00 0.00 0.00 0.00 61.98 60.84 2hxy s VAL 160 Cb -0.04 -1.34 -0.03 0.00 0.00 0.00 0.00 36.38 34.98 2hxy s VAL 160 CO -0.02 0.16 -0.09 0.00 0.00 0.00 0.00 175.10 175.15 2hxy s ALA 161 N -0.80 0.79 0.00 5.51 0.00 -0.44 0.04 121.76 126.85 2hxy s ALA 161 Ca 0.06 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 51.09 2hxy s ALA 161 Cb -0.09 0.04 0.00 0.00 0.00 0.00 0.00 23.12 23.07 2hxy s ALA 161 CO 0.02 -0.02 0.00 0.41 0.00 0.00 0.00 175.76 176.16 2hxy n GLY 162 N 1.12 1.38 3.76 0.00 0.00 -0.95 -0.00 105.19 110.48 2hxy n GLY 162 Ca -0.20 -0.90 -0.33 0.00 0.00 0.00 0.00 46.02 44.59 2hxy n GLY 162 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2hxy s THR 163 N -2.00 2.96 0.35 2.61 -4.23 -1.25 -2.44 115.64 111.64 2hxy s THR 163 Ca 0.00 0.46 0.10 0.00 -1.18 0.00 0.00 61.69 61.07 2hxy s THR 163 Cb 0.00 -3.00 0.33 0.00 1.34 0.00 0.00 72.50 71.18 2hxy s THR 163 CO 0.00 -0.26 1.84 -0.65 -0.54 0.00 0.00 174.62 175.01 2hxy h PRO 164 N 0.00 0.63 0.13 3.99 0.11 -1.94 -0.59 132.00 134.34 2hxy h PRO 164 Ca -0.47 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 2hxy h PRO 164 Cb 1.26 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2hxy h PRO 164 CO 0.53 0.42 -0.06 0.78 -0.21 0.00 0.00 178.00 179.45 2hxy h GLY 165 N 0.65 -0.19 0.05 -0.55 0.00 -1.92 -1.59 103.07 99.53 2hxy h GLY 165 Ca 0.49 0.07 0.13 0.00 0.00 0.00 0.00 47.33 48.02 2hxy h GLY 165 CO -0.25 -0.07 0.11 -0.09 0.00 0.00 0.00 176.54 176.25 2hxy h ARG 166 N -0.18 0.22 -0.99 4.80 9.65 -1.88 -0.27 114.38 125.73 2hxy h ARG 166 Ca -0.02 -0.01 0.06 0.00 -1.10 0.00 0.00 59.98 58.91 2hxy h ARG 166 Cb 0.14 -0.05 -0.07 0.00 -1.39 0.00 0.00 29.97 28.60 2hxy h ARG 166 CO 0.03 0.15 0.64 0.28 2.80 0.00 0.00 179.97 183.87 2hxy h VAL 167 N 0.23 1.10 -0.69 0.20 2.07 -1.12 -1.20 116.25 116.84 2hxy h VAL 167 Ca 0.35 -0.40 -0.05 0.00 0.82 0.00 0.00 66.70 67.41 2hxy h VAL 167 Cb 0.55 -0.18 -0.03 0.00 -1.52 0.00 0.00 31.29 30.12 2hxy h VAL 167 CO -0.47 0.21 0.23 0.15 0.02 0.00 0.00 177.57 177.72 2hxy h PHE 168 N 1.18 1.09 0.54 1.57 3.57 -0.03 -2.60 116.94 122.26 2hxy h PHE 168 Ca 0.42 -0.10 -0.02 0.00 3.53 0.00 0.00 57.97 61.80 2hxy h PHE 168 Cb 0.14 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 38.54 2hxy h PHE 168 CO -0.00 0.87 -0.49 0.22 -2.23 0.00 0.00 178.31 176.67 2hxy h ASP 169 N 1.00 -1.34 -0.17 0.41 -0.00 -0.28 0.18 116.42 116.22 2hxy h ASP 169 Ca 0.22 0.10 0.05 0.00 -0.00 0.00 0.00 57.03 57.41 2hxy h ASP 169 Cb 0.28 0.43 -0.01 0.00 -0.00 0.00 0.00 39.33 40.03 2hxy h ASP 169 CO -0.01 -0.67 0.39 0.24 -0.00 0.00 0.00 179.24 179.19 2hxy h MET 170 N -1.03 0.00 0.20 0.28 2.86 -1.25 0.32 114.93 116.31 2hxy h MET 170 Ca -0.07 0.00 -0.34 0.00 -2.06 0.00 0.00 59.70 57.24 2hxy h MET 170 Cb 0.88 0.00 0.02 0.00 0.06 0.00 0.00 31.60 32.56 2hxy h MET 170 CO -0.04 0.00 -1.63 0.82 1.06 0.00 0.00 176.91 177.13 2hxy h ILE 171 N 0.00 1.05 -0.32 -1.22 2.04 -0.79 0.45 117.51 118.72 2hxy h ILE 171 Ca 0.08 -2.55 -0.03 0.00 1.00 0.00 0.00 64.86 63.36 2hxy h ILE 171 Cb 0.86 2.85 -0.01 0.00 -0.74 0.00 0.00 36.82 39.78 2hxy h ILE 171 CO -0.00 0.83 0.08 -0.09 0.00 0.00 0.00 178.15 178.96 2hxy h ARG 172 N 0.07 0.51 -0.01 2.37 2.43 0.16 -2.22 114.38 117.69 2hxy h ARG 172 Ca -0.31 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 58.73 2hxy h ARG 172 Cb 2.08 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 31.56 2hxy h ARG 172 CO 0.19 0.58 0.00 0.54 -1.51 0.00 0.00 179.97 179.77 2hxy n ARG 173 N -4.65 0.45 -1.41 0.20 1.74 0.89 -4.79 116.66 109.09 2hxy n ARG 173 Ca -0.02 0.00 -0.15 0.00 -0.77 0.00 0.00 57.85 56.91 2hxy n ARG 173 Cb 0.19 -1.00 -0.06 0.00 -1.02 0.00 0.00 32.46 30.56 2hxy n ARG 173 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2hxy n ARG 174 N -0.49 -1.52 0.04 5.56 3.00 -0.83 -4.81 116.66 117.62 2hxy n ARG 174 Ca 0.00 0.97 -0.18 0.00 -0.01 0.00 0.00 57.85 58.63 2hxy n ARG 174 Cb 0.00 -5.30 -0.14 0.00 0.00 0.00 0.00 32.46 27.02 2hxy n ARG 174 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.63 178.40 2hxy h SER 175 N 0.00 0.39 -3.64 0.55 0.02 -1.45 -3.45 113.55 105.97 2hxy h SER 175 Ca -0.31 -0.63 -0.62 0.00 -0.84 0.00 0.00 61.79 59.40 2hxy h SER 175 Cb 1.14 -0.13 -0.14 0.00 0.14 0.00 0.00 62.40 63.42 2hxy h SER 175 CO 0.45 1.54 -0.17 -0.22 -1.14 0.00 0.00 176.83 177.28 2hxy s LEU 176 N -6.94 4.06 -0.70 5.07 2.96 0.15 -4.67 118.68 118.61 2hxy s LEU 176 Ca -0.12 0.39 -0.22 0.00 -0.22 0.00 0.00 54.13 53.95 2hxy s LEU 176 Cb 0.07 -2.50 0.08 0.00 0.50 0.00 0.00 46.19 44.33 2hxy s LEU 176 CO 0.83 -0.19 1.00 -0.13 -1.32 0.00 0.00 176.35 176.54 2hxy s ARG 177 N 2.00 3.18 0.12 1.98 1.81 -1.26 -4.65 118.95 122.12 2hxy s ARG 177 Ca 0.17 -0.94 -0.12 0.00 -1.72 0.00 0.00 55.73 53.12 2hxy s ARG 177 Cb -0.16 -4.33 -0.09 0.00 -0.45 0.00 0.00 34.95 29.92 2hxy s ARG 177 CO 0.09 -1.82 1.40 1.79 -0.68 0.00 0.00 175.30 176.08 2hxy h THR 178 N 5.98 1.28 0.00 0.02 1.35 -1.88 -3.37 112.91 116.28 2hxy h THR 178 Ca -0.23 -1.67 0.00 0.00 -0.55 0.00 0.00 66.41 63.96 2hxy h THR 178 Cb 1.06 1.63 0.00 0.00 -1.73 0.00 0.00 68.15 69.11 2hxy h THR 178 CO 1.18 0.54 0.00 -1.14 -0.25 0.00 0.00 175.52 175.85 2hxy n ARG 179 N -4.07 0.00 -0.44 4.72 0.63 -1.26 0.20 116.66 116.44 2hxy n ARG 179 Ca -0.04 0.00 0.07 0.00 -0.92 0.00 0.00 57.85 56.96 2hxy n ARG 179 Cb 0.59 0.00 0.27 0.00 0.45 0.00 0.00 32.46 33.77 2hxy n ARG 179 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2hxy n ALA 180 N -2.43 2.89 -2.24 5.13 0.00 -1.26 -4.86 120.51 117.75 2hxy n ALA 180 Ca 0.00 -1.15 -0.42 0.00 0.00 0.00 0.00 53.44 51.88 2hxy n ALA 180 Cb 0.00 -1.02 -0.03 0.00 0.00 0.00 0.00 19.45 18.40 2hxy n ALA 180 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2hxy s ILE 181 N -1.71 3.82 -0.02 0.00 1.01 0.55 -4.33 121.20 120.51 2hxy s ILE 181 Ca 0.38 1.40 0.02 0.00 0.00 0.00 0.00 60.65 62.46 2hxy s ILE 181 Cb 0.24 -3.90 0.03 0.00 0.01 0.00 0.00 42.46 38.85 2hxy s ILE 181 CO 0.19 0.16 0.87 2.29 0.00 0.00 0.00 174.94 178.46 2hxy n LYS 182 N 3.25 1.75 -3.63 2.79 2.85 0.60 -4.72 118.16 121.05 2hxy n LYS 182 Ca 0.07 -1.31 -0.04 0.00 -1.05 0.00 0.00 58.31 55.99 2hxy n LYS 182 Cb 0.46 -0.88 -0.06 0.00 -0.65 0.00 0.00 35.03 33.90 2hxy n LYS 182 CO 0.00 0.00 0.00 1.41 -0.05 0.00 0.00 177.40 178.76 2hxy s MET 183 N -0.87 0.61 -0.16 -1.58 0.00 -1.15 -3.40 119.30 112.75 2hxy s MET 183 Ca 0.04 1.25 -0.01 0.00 0.00 0.00 0.00 55.69 56.97 2hxy s MET 183 Cb 0.03 0.47 -0.01 0.00 0.00 0.00 0.00 34.83 35.32 2hxy s MET 183 CO 0.00 -0.16 -0.12 -1.17 0.00 0.00 0.00 175.02 173.57 2hxy s LEU 184 N 2.20 2.68 -0.17 4.11 2.96 0.93 -0.71 118.68 130.69 2hxy s LEU 184 Ca -0.08 -0.40 0.00 0.00 -0.22 0.00 0.00 54.13 53.44 2hxy s LEU 184 Cb -0.08 -1.63 0.00 0.00 0.50 0.00 0.00 46.19 44.99 2hxy s LEU 184 CO -0.19 0.09 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.08 2hxy s VAL 185 N 0.81 2.59 -0.80 1.68 1.01 0.30 -0.98 120.40 125.00 2hxy s VAL 185 Ca -0.04 -0.79 -0.05 0.00 0.00 0.00 0.00 61.98 61.10 2hxy s VAL 185 Cb -0.15 -2.10 0.20 0.00 0.00 0.00 0.00 36.38 34.34 2hxy s VAL 185 CO 0.01 0.51 0.69 -0.76 0.00 0.00 0.00 175.10 175.54 2hxy s LEU 186 N 0.98 5.77 0.51 3.92 1.43 -0.67 -0.93 118.68 129.69 2hxy s LEU 186 Ca -0.02 -3.18 -0.21 0.00 -1.03 0.00 0.00 54.13 49.69 2hxy s LEU 186 Cb -0.15 -1.98 -0.07 0.00 0.03 0.00 0.00 46.19 44.02 2hxy s LEU 186 CO -0.03 -0.34 1.13 -0.62 0.23 0.00 0.00 176.35 176.72 2hxy s ASP 187 N 0.78 5.93 -1.57 2.29 -1.08 -0.80 -1.59 116.67 120.64 2hxy s ASP 187 Ca 0.22 2.20 -0.08 0.00 -0.52 0.00 0.00 52.55 54.37 2hxy s ASP 187 Cb -0.13 -2.59 0.08 0.00 -1.46 0.00 0.00 42.92 38.83 2hxy s ASP 187 CO -0.08 -1.08 0.21 -0.62 0.52 0.00 0.00 175.17 174.13 2hxy n GLU 188 N -0.98 -0.86 -0.05 4.34 1.02 -0.87 -4.47 120.64 118.76 2hxy n GLU 188 Ca 0.10 0.10 -0.08 0.00 -0.02 0.00 0.00 57.16 57.26 2hxy n GLU 188 Cb 0.50 -3.75 -0.02 0.00 -0.02 0.00 0.00 31.44 28.15 2hxy n GLU 188 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2hxy h ALA 189 N 0.90 0.13 -0.97 0.62 0.00 -1.33 -1.14 119.26 117.47 2hxy h ALA 189 Ca -0.60 0.09 0.29 0.00 0.00 0.00 0.00 54.91 54.69 2hxy h ALA 189 Cb 1.30 0.19 -0.14 0.00 0.00 0.00 0.00 17.79 19.14 2hxy h ALA 189 CO 0.73 -0.49 0.48 0.38 0.00 0.00 0.00 179.25 180.36 2hxy h ASP 190 N -0.02 0.39 -0.10 0.00 2.03 -1.82 0.42 116.42 117.32 2hxy h ASP 190 Ca 0.11 0.19 -0.03 0.00 -0.73 0.00 0.00 57.03 56.56 2hxy h ASP 190 Cb 0.19 0.16 -0.00 0.00 -0.83 0.00 0.00 39.33 38.84 2hxy h ASP 190 CO -0.24 -0.12 -0.07 -0.08 -1.03 0.00 0.00 179.24 177.71 2hxy h GLU 191 N 0.32 0.23 -1.21 4.15 4.57 -1.60 -2.82 114.58 118.23 2hxy h GLU 191 Ca 0.68 -0.11 0.40 0.00 -1.18 0.00 0.00 59.36 59.15 2hxy h GLU 191 Cb 1.48 -0.00 -0.14 0.00 -0.16 0.00 0.00 28.75 29.93 2hxy h GLU 191 CO -0.61 0.61 0.75 0.52 -1.18 0.00 0.00 179.01 179.11 2hxy h MET 192 N -0.15 0.13 -0.01 1.92 2.86 0.71 0.28 114.93 120.67 2hxy h MET 192 Ca 0.02 -0.01 -0.20 0.00 -2.06 0.00 0.00 59.70 57.45 2hxy h MET 192 Cb 0.55 -0.03 0.02 0.00 0.06 0.00 0.00 31.60 32.20 2hxy h MET 192 CO 0.02 0.08 -0.79 -0.07 1.06 0.00 0.00 176.91 177.21 2hxy h LEU 193 N 0.13 0.71 -2.44 1.22 3.38 -1.13 -2.41 115.31 114.77 2hxy h LEU 193 Ca 0.80 -0.74 0.02 0.00 0.09 0.00 0.00 57.88 58.04 2hxy h LEU 193 Cb 2.32 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 42.85 2hxy h LEU 193 CO -0.49 1.36 0.11 0.78 0.09 0.00 0.00 178.44 180.29 2hxy h ASN 194 N 0.13 0.00 -0.62 -0.43 4.21 -0.28 0.76 115.58 119.36 2hxy h ASN 194 Ca -0.10 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.41 2hxy h ASN 194 Cb 1.47 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.67 2hxy h ASN 194 CO 0.16 0.00 0.00 0.29 -1.29 0.00 0.00 177.43 176.59 2hxy n LYS 195 N -3.59 3.39 -3.56 0.81 5.02 -0.70 -4.99 118.16 114.54 2hxy n LYS 195 Ca -0.01 -2.62 -0.24 0.00 -2.02 0.00 0.00 58.31 53.42 2hxy n LYS 195 Cb 0.20 -1.80 0.03 0.00 -0.02 0.00 0.00 35.03 33.44 2hxy n LYS 195 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2hxy n GLY 196 N 1.17 -1.11 0.51 0.72 0.00 0.27 -4.92 105.19 101.83 2hxy n GLY 196 Ca 0.24 0.49 0.05 0.00 0.00 0.00 0.00 46.02 46.80 2hxy n GLY 196 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2hxy n PHE 197 N -3.39 0.28 0.00 1.61 3.01 -0.92 -4.81 117.46 113.23 2hxy n PHE 197 Ca -0.12 -0.34 0.00 0.00 1.01 0.00 0.00 57.45 58.01 2hxy n PHE 197 Cb 0.59 -0.02 0.00 0.00 -0.01 0.00 0.00 39.48 40.04 2hxy n PHE 197 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 2hxy n LYS 198 N 0.45 0.00 0.05 -1.08 4.81 -1.26 -1.50 118.16 119.63 2hxy n LYS 198 Ca 0.09 0.62 -0.11 0.00 -0.87 0.00 0.00 58.31 58.04 2hxy n LYS 198 Cb 0.35 -0.93 -0.04 0.00 0.02 0.00 0.00 35.03 34.43 2hxy n LYS 198 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 2hxy h GLU 199 N 0.00 -0.38 -0.78 1.64 4.39 -2.00 -2.51 114.58 114.94 2hxy h GLU 199 Ca 0.00 0.03 0.18 0.00 0.34 0.00 0.00 59.36 59.91 2hxy h GLU 199 Cb 0.00 0.09 -0.12 0.00 -0.10 0.00 0.00 28.75 28.61 2hxy h GLU 199 CO 0.00 -0.25 0.16 1.96 -1.16 0.00 0.00 179.01 179.72 2hxy h GLN 200 N -0.39 0.21 0.49 2.33 7.50 -1.62 0.12 115.11 123.75 2hxy h GLN 200 Ca 0.07 -0.01 -0.01 0.00 0.50 0.00 0.00 58.65 59.19 2hxy h GLN 200 Cb 0.49 -0.05 -0.02 0.00 0.05 0.00 0.00 27.48 27.95 2hxy h GLN 200 CO -0.25 0.14 -0.48 0.82 -1.50 0.00 0.00 178.83 177.56 2hxy h ILE 201 N 0.22 0.00 -0.71 2.54 1.08 -0.87 -0.29 117.51 119.47 2hxy h ILE 201 Ca 0.45 0.00 0.15 0.00 -0.39 0.00 0.00 64.86 65.07 2hxy h ILE 201 Cb 0.82 0.00 -0.13 0.00 -3.07 0.00 0.00 36.82 34.44 2hxy h ILE 201 CO -0.58 0.00 -0.14 1.88 -0.69 0.00 0.00 178.15 178.62 2hxy h TYR 202 N -0.96 -0.31 -0.52 1.37 -1.99 -0.67 0.12 116.97 114.01 2hxy h TYR 202 Ca -0.06 0.06 0.07 0.00 2.00 0.00 0.00 58.73 60.80 2hxy h TYR 202 Cb 0.83 0.25 -0.06 0.00 2.00 0.00 0.00 36.73 39.75 2hxy h TYR 202 CO -0.24 -0.29 0.20 -0.44 -0.00 0.00 0.00 178.16 177.39 2hxy h ASP 203 N 0.02 0.22 -0.32 3.88 3.45 -0.40 -1.92 116.42 121.35 2hxy h ASP 203 Ca 0.35 0.06 -0.03 0.00 0.43 0.00 0.00 57.03 57.84 2hxy h ASP 203 Cb 0.56 0.03 -0.02 0.00 -0.56 0.00 0.00 39.33 39.34 2hxy h ASP 203 CO -0.71 0.15 0.13 0.58 -1.57 0.00 0.00 179.24 177.82 2hxy h VAL 204 N 0.39 1.16 -0.25 -1.35 2.07 0.10 -1.96 116.25 116.41 2hxy h VAL 204 Ca 0.25 -0.52 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 2hxy h VAL 204 Cb 0.25 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 2hxy h VAL 204 CO -0.24 0.20 0.14 0.22 0.02 0.00 0.00 177.57 177.90 2hxy h TYR 205 N 0.54 0.34 -0.58 1.57 3.20 -0.54 -2.79 116.97 118.72 2hxy h TYR 205 Ca 0.13 -0.01 0.12 0.00 3.14 0.00 0.00 58.73 62.11 2hxy h TYR 205 Cb 0.15 -0.11 -0.10 0.00 1.54 0.00 0.00 36.73 38.21 2hxy h TYR 205 CO 0.01 0.30 -0.05 0.00 -1.64 0.00 0.00 178.16 176.78 2hxy h ARG 206 N 0.29 0.07 0.00 1.82 3.08 -0.97 0.28 114.38 118.95 2hxy h ARG 206 Ca 0.09 -0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.13 2hxy h ARG 206 Cb 0.07 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.10 2hxy h ARG 206 CO -0.01 0.05 -0.01 1.88 -1.07 0.00 0.00 179.97 180.80 2hxy h TYR 207 N 0.08 0.00 -4.12 3.04 0.05 -1.31 -3.42 116.97 111.28 2hxy h TYR 207 Ca 0.30 0.00 -0.48 0.00 0.05 0.00 0.00 58.73 58.59 2hxy h TYR 207 Cb 0.47 0.00 0.05 0.00 1.01 0.00 0.00 36.73 38.26 2hxy h TYR 207 CO -0.39 0.01 0.39 -0.51 -1.05 0.00 0.00 178.16 176.61 2hxy s LEU 208 N -6.25 3.71 1.04 3.88 1.43 0.97 -4.80 118.68 118.66 2hxy s LEU 208 Ca -0.01 1.92 -0.15 0.00 -1.03 0.00 0.00 54.13 54.85 2hxy s LEU 208 Cb 0.11 -4.55 0.09 0.00 0.03 0.00 0.00 46.19 41.86 2hxy s LEU 208 CO 0.50 -0.98 0.31 -2.65 0.23 0.00 0.00 176.35 173.77 2hxy n PRO 209 N -1.40 -1.00 0.00 1.29 -0.01 -1.26 -4.98 135.00 127.63 2hxy n PRO 209 Ca 0.09 -0.26 0.00 0.00 -0.01 0.00 0.00 63.50 63.32 2hxy n PRO 209 Cb 0.52 -1.84 0.00 0.00 -0.01 0.00 0.00 33.50 32.18 2hxy n PRO 209 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 175.50 173.19 2hxy n PRO 210 N -2.20 0.00 -2.73 0.52 -0.02 -1.26 -4.03 135.00 125.28 2hxy n PRO 210 Ca 0.04 0.50 -0.42 0.00 -2.02 0.00 0.00 63.50 61.60 2hxy n PRO 210 Cb 0.57 -1.37 -0.03 0.00 -0.02 0.00 0.00 33.50 32.65 2hxy n PRO 210 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2hxy s ALA 211 N -3.00 2.98 -0.07 3.55 0.00 -1.26 -4.99 121.76 118.97 2hxy s ALA 211 Ca 0.00 -1.79 0.05 0.00 0.00 0.00 0.00 51.96 50.21 2hxy s ALA 211 Cb 0.00 -4.07 -0.01 0.00 0.00 0.00 0.00 23.12 19.04 2hxy s ALA 211 CO 0.00 -3.04 -0.22 0.99 0.00 0.00 0.00 175.76 173.49 2hxy s THR 212 N 4.60 2.36 0.06 0.00 2.01 -1.26 -5.00 115.64 118.41 2hxy s THR 212 Ca 0.29 -0.95 -0.31 0.00 0.31 0.00 0.00 61.69 61.04 2hxy s THR 212 Cb -0.11 -1.89 -0.06 0.00 0.01 0.00 0.00 72.50 70.45 2hxy s THR 212 CO 0.08 0.57 1.26 -1.58 -0.69 0.00 0.00 174.62 174.26 2hxy s GLN 213 N -0.16 4.39 -0.18 4.92 0.74 -1.22 -4.90 119.66 123.25 2hxy s GLN 213 Ca -0.03 1.86 0.00 0.00 0.05 0.00 0.00 55.36 57.24 2hxy s GLN 213 Cb -0.14 -3.36 0.04 0.00 1.10 0.00 0.00 33.01 30.66 2hxy s GLN 213 CO 0.04 -0.34 -0.08 0.08 -0.55 0.00 0.00 175.29 174.44 2hxy s VAL 214 N 1.26 1.39 -0.36 1.34 1.01 -1.26 -0.04 120.40 123.73 2hxy s VAL 214 Ca 0.60 -0.82 -0.12 0.00 0.00 0.00 0.00 61.98 61.64 2hxy s VAL 214 Cb -0.31 -1.51 0.01 0.00 0.00 0.00 0.00 36.38 34.57 2hxy s VAL 214 CO 0.29 0.16 0.23 -0.69 0.00 0.00 0.00 175.10 175.09 2hxy s VAL 215 N 1.51 4.96 -0.21 2.92 1.01 -0.15 -2.89 120.40 127.55 2hxy s VAL 215 Ca -0.00 -0.54 -0.09 0.00 0.00 0.00 0.00 61.98 61.35 2hxy s VAL 215 Cb -0.16 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 2hxy s VAL 215 CO -0.08 -0.14 0.11 -0.22 0.00 0.00 0.00 175.10 174.77 2hxy s LEU 216 N 1.65 3.95 -0.13 3.92 0.20 0.99 -1.68 118.68 127.58 2hxy s LEU 216 Ca 0.04 0.09 -0.03 0.00 0.69 0.00 0.00 54.13 54.93 2hxy s LEU 216 Cb -0.18 -2.03 -0.03 0.00 -0.43 0.00 0.00 46.19 43.52 2hxy s LEU 216 CO 0.09 0.12 -0.01 -0.63 -0.29 0.00 0.00 176.35 175.63 2hxy s ILE 217 N 0.70 4.16 -0.29 6.68 -1.09 -0.62 -1.69 121.20 129.05 2hxy s ILE 217 Ca 0.06 -0.28 -0.18 0.00 -2.23 0.00 0.00 60.65 58.01 2hxy s ILE 217 Cb -0.13 -2.79 0.14 0.00 -1.58 0.00 0.00 42.46 38.10 2hxy s ILE 217 CO 0.01 0.54 0.99 -0.55 -1.23 0.00 0.00 174.94 174.70 2hxy s SER 218 N -0.19 -0.50 0.23 3.58 0.15 -0.70 -1.58 113.70 114.68 2hxy s SER 218 Ca 0.05 0.83 -0.08 0.00 0.70 0.00 0.00 55.95 57.45 2hxy s SER 218 Cb -0.13 1.11 0.22 0.00 -1.71 0.00 0.00 66.02 65.52 2hxy s SER 218 CO 0.02 -0.13 1.90 0.00 1.20 0.00 0.00 173.24 176.23 2hxy h ALA 219 N 5.60 1.13 -2.07 5.45 0.00 -1.87 -1.71 119.26 125.78 2hxy h ALA 219 Ca -0.28 -0.05 -0.61 0.00 0.00 0.00 0.00 54.91 53.97 2hxy h ALA 219 Cb 1.19 -0.34 -0.14 0.00 0.00 0.00 0.00 17.79 18.50 2hxy h ALA 219 CO 0.17 0.49 -0.72 0.95 0.00 0.00 0.00 179.25 180.15 2hxy s THR 220 N -6.12 2.31 -0.42 0.00 -4.23 -1.26 -4.57 115.64 101.35 2hxy s THR 220 Ca -0.13 -2.29 0.02 0.00 -1.18 0.00 0.00 61.69 58.11 2hxy s THR 220 Cb 0.17 -2.47 0.15 0.00 1.34 0.00 0.00 72.50 71.68 2hxy s THR 220 CO 0.80 -0.30 0.27 -0.76 -0.54 0.00 0.00 174.62 174.09 2hxy s LEU 221 N -3.55 1.89 0.85 4.79 1.43 -1.26 -4.64 118.68 118.19 2hxy s LEU 221 Ca 0.31 -2.67 -0.11 0.00 -1.03 0.00 0.00 54.13 50.63 2hxy s LEU 221 Cb -0.01 -0.69 0.10 0.00 0.03 0.00 0.00 46.19 45.62 2hxy s LEU 221 CO 0.15 -0.24 1.10 -2.84 0.23 0.00 0.00 176.35 174.75 2hxy s PRO 222 N 0.40 1.62 0.00 1.29 0.02 -1.26 -4.90 135.00 132.18 2hxy s PRO 222 Ca 0.22 1.07 0.05 0.00 0.02 0.00 0.00 61.00 62.36 2hxy s PRO 222 Cb -0.15 -1.83 0.28 0.00 0.02 0.00 0.00 34.50 32.82 2hxy s PRO 222 CO -0.06 -2.06 0.66 0.72 -0.33 0.00 0.00 177.00 175.94 2hxy n HIS 223 N -3.79 0.00 0.00 6.54 8.25 -1.26 -1.96 115.22 123.00 2hxy n HIS 223 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 2hxy n HIS 223 Cb 0.54 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.65 2hxy n HIS 223 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 2hxy n GLU 224 N -0.72 2.67 0.13 -0.41 2.13 -1.26 -4.04 120.64 119.14 2hxy n GLU 224 Ca 0.04 0.00 0.01 0.00 0.66 0.00 0.00 57.16 57.87 2hxy n GLU 224 Cb 0.02 -0.79 0.02 0.00 0.27 0.00 0.00 31.44 30.96 2hxy n GLU 224 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 2hxy h ILE 225 N 0.00 0.97 -0.07 6.31 1.08 -1.75 -2.78 117.51 121.28 2hxy h ILE 225 Ca 0.00 -2.34 -0.18 0.00 -0.39 0.00 0.00 64.86 61.95 2hxy h ILE 225 Cb 0.00 2.45 0.01 0.00 -3.07 0.00 0.00 36.82 36.22 2hxy h ILE 225 CO 0.00 0.55 -0.66 -0.07 -0.69 0.00 0.00 178.15 177.28 2hxy h LEU 226 N 0.00 0.70 -2.16 1.44 3.38 -1.76 0.15 115.31 117.05 2hxy h LEU 226 Ca -0.01 -0.69 0.06 0.00 0.09 0.00 0.00 57.88 57.34 2hxy h LEU 226 Cb 1.41 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 2hxy h LEU 226 CO 0.07 1.28 0.28 -0.08 0.09 0.00 0.00 178.44 180.08 2hxy h GLU 227 N 0.17 0.00 0.06 1.13 4.57 -1.65 -0.91 114.58 117.95 2hxy h GLU 227 Ca -0.06 0.00 -0.31 0.00 -1.18 0.00 0.00 59.36 57.80 2hxy h GLU 227 Cb 1.32 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.88 2hxy h GLU 227 CO 0.13 0.00 -1.72 -0.12 -1.18 0.00 0.00 179.01 176.12 2hxy n MET 228 N -3.65 0.67 0.32 1.92 1.56 -1.04 -3.53 117.12 113.36 2hxy n MET 228 Ca 0.03 0.39 -0.19 0.00 -0.27 0.00 0.00 57.70 57.66 2hxy n MET 228 Cb 0.40 -1.71 -0.10 0.00 2.15 0.00 0.00 33.22 33.96 2hxy n MET 228 CO 0.00 0.00 0.00 1.79 -0.73 0.00 0.00 175.97 177.03 2hxy h THR 229 N -0.43 0.00 0.00 1.12 1.35 0.59 -1.23 112.91 114.31 2hxy h THR 229 Ca -0.41 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.45 2hxy h THR 229 Cb 1.70 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 68.12 2hxy h THR 229 CO -0.07 0.00 0.00 -0.46 -0.25 0.00 0.00 175.52 174.74 2hxy n ASN 230 N -5.57 0.60 0.24 5.36 0.23 -0.61 -2.12 115.26 113.40 2hxy n ASN 230 Ca -0.13 0.69 0.15 0.00 -0.53 0.00 0.00 54.58 54.76 2hxy n ASN 230 Cb 0.47 -0.80 0.43 0.00 -2.08 0.00 0.00 39.78 37.80 2hxy n ASN 230 CO 0.00 0.00 0.00 0.50 -0.93 0.00 0.00 177.26 176.83 2hxy h LYS 231 N 0.00 0.00 -0.31 -3.83 3.64 -1.27 -3.37 116.57 111.43 2hxy h LYS 231 Ca 0.00 0.00 -0.26 0.00 -1.27 0.00 0.00 60.65 59.12 2hxy h LYS 231 Cb 0.24 0.00 -0.22 0.00 -0.41 0.00 0.00 32.23 31.84 2hxy h LYS 231 CO 0.00 0.00 -0.60 1.97 -2.27 0.00 0.00 179.45 178.55 2hxy n PHE 232 N -3.06 -1.45 -3.36 1.91 -0.00 -0.99 -5.07 117.46 105.44 2hxy n PHE 232 Ca 0.02 -2.20 -0.01 0.00 -0.00 0.00 0.00 57.45 55.27 2hxy n PHE 232 Cb 0.42 1.03 -0.04 0.00 -0.00 0.00 0.00 39.48 40.88 2hxy n PHE 232 CO 0.00 0.00 0.00 1.41 -0.00 0.00 0.00 176.76 178.17 2hxy s MET 233 N -0.76 0.50 -0.09 3.97 1.75 -0.90 -4.81 119.30 118.97 2hxy s MET 233 Ca 0.24 1.03 -0.15 0.00 -1.25 0.00 0.00 55.69 55.56 2hxy s MET 233 Cb 0.41 0.41 -0.05 0.00 2.84 0.00 0.00 34.83 38.44 2hxy s MET 233 CO -0.05 -0.48 0.37 0.95 -0.65 0.00 0.00 175.02 175.15 2hxy s THR 234 N 2.78 5.19 -0.40 10.11 -4.23 -1.26 -4.57 115.64 123.27 2hxy s THR 234 Ca 0.11 0.73 -0.17 0.00 -1.18 0.00 0.00 61.69 61.18 2hxy s THR 234 Cb -0.14 -3.69 0.03 0.00 1.34 0.00 0.00 72.50 70.03 2hxy s THR 234 CO -0.19 0.45 0.44 -0.67 -0.54 0.00 0.00 174.62 174.11 2hxy n ASP 235 N 2.88 -3.52 -4.89 3.99 4.64 -1.26 -4.63 116.55 113.75 2hxy n ASP 235 Ca -0.12 -0.31 -0.29 0.00 -1.38 0.00 0.00 54.79 52.69 2hxy n ASP 235 Cb 0.52 -1.07 -0.01 0.00 -1.04 0.00 0.00 41.12 39.52 2hxy n ASP 235 CO 0.00 0.00 0.00 -2.16 -0.82 0.00 0.00 177.20 174.22 2hxy s PRO 236 N -2.50 3.62 -0.17 -0.67 0.04 -1.26 -4.52 135.00 129.54 2hxy s PRO 236 Ca 0.17 0.43 -0.16 0.00 0.04 0.00 0.00 61.00 61.48 2hxy s PRO 236 Cb -0.02 -2.29 -0.04 0.00 0.04 0.00 0.00 34.50 32.19 2hxy s PRO 236 CO 0.60 -0.27 0.38 0.42 0.04 0.00 0.00 177.00 178.17 2hxy s ILE 237 N -2.78 5.23 -0.18 0.56 -1.09 0.18 -4.97 121.20 118.16 2hxy s ILE 237 Ca 0.51 0.71 -0.07 0.00 -2.23 0.00 0.00 60.65 59.56 2hxy s ILE 237 Cb -0.10 -3.72 -0.04 0.00 -1.58 0.00 0.00 42.46 37.02 2hxy s ILE 237 CO 0.44 0.31 0.05 -0.13 -1.23 0.00 0.00 174.94 174.37 2hxy s ARG 238 N 0.93 3.91 -0.41 2.79 0.52 -1.26 -0.74 118.95 124.68 2hxy s ARG 238 Ca 0.20 -0.37 0.04 0.00 -0.52 0.00 0.00 55.73 55.08 2hxy s ARG 238 Cb -0.14 -3.16 0.11 0.00 0.52 0.00 0.00 34.95 32.28 2hxy s ARG 238 CO 0.07 0.29 0.13 0.42 0.02 0.00 0.00 175.30 176.23 2hxy s ILE 239 N 0.32 2.39 0.46 1.52 1.01 -0.10 -4.95 121.20 121.85 2hxy s ILE 239 Ca 0.02 -2.71 0.06 0.00 0.00 0.00 0.00 60.65 58.02 2hxy s ILE 239 Cb -0.13 -2.73 0.06 0.00 0.01 0.00 0.00 42.46 39.68 2hxy s ILE 239 CO 0.01 -0.67 0.52 0.18 0.00 0.00 0.00 174.94 174.97 2hxy n LEU 240 N 3.82 0.00 -0.12 2.97 4.77 -1.26 -1.62 117.00 125.56 2hxy n LEU 240 Ca 0.04 -2.18 -0.22 0.00 -0.03 0.00 0.00 56.01 53.63 2hxy n LEU 240 Cb 0.38 -0.22 -0.12 0.00 -2.33 0.00 0.00 43.42 41.14 2hxy n LEU 240 CO 0.26 -0.61 -1.29 0.52 -1.33 0.00 0.00 177.39 174.95 2hxy n VAL 241 N -1.83 1.53 -3.54 4.08 0.31 -1.26 -4.93 118.33 112.69 2hxy n VAL 241 Ca 0.07 -0.50 -0.34 0.00 -0.01 0.00 0.00 64.34 63.55 2hxy n VAL 241 Cb 0.50 -1.61 -0.05 0.00 -0.91 0.00 0.00 33.84 31.77 2hxy n VAL 241 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2hxy s LYS 242 N -2.51 3.78 0.05 5.55 1.02 -1.26 -5.01 119.74 121.36 2hxy s LYS 242 Ca -0.35 0.21 -0.31 0.00 0.02 0.00 0.00 55.97 55.54 2hxy s LYS 242 Cb 0.10 -2.95 -0.10 0.00 -0.52 0.00 0.00 37.83 34.36 2hxy s LYS 242 CO 0.59 0.52 1.90 -2.13 -0.92 0.00 0.00 175.35 175.31 2hxy n ARG 243 N 0.75 2.72 -4.42 1.68 0.63 -1.26 -4.95 116.66 111.81 2hxy n ARG 243 Ca -0.07 0.99 -0.34 0.00 -0.92 0.00 0.00 57.85 57.52 2hxy n ARG 243 Cb 0.52 -2.91 -0.12 0.00 0.45 0.00 0.00 32.46 30.40 2hxy n ARG 243 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 2hxy s ASP 244 N 3.68 4.77 0.06 6.15 2.15 -1.26 -5.10 116.67 127.11 2hxy s ASP 244 Ca 0.87 -0.13 0.05 0.00 0.43 0.00 0.00 52.55 53.77 2hxy s ASP 244 Cb -0.50 -1.77 -0.03 0.00 -0.30 0.00 0.00 42.92 40.33 2hxy s ASP 244 CO 0.42 0.17 -0.15 -1.83 -0.17 0.00 0.00 175.17 173.62 2hxy s GLU 245 N 0.33 0.90 0.34 4.34 -1.05 -1.26 -5.05 118.70 117.25 2hxy s GLU 245 Ca -0.04 -0.87 -0.28 0.00 -0.15 0.00 0.00 54.97 53.63 2hxy s GLU 245 Cb -0.14 -0.93 -0.12 0.00 -0.44 0.00 0.00 34.13 32.50 2hxy s GLU 245 CO 0.03 0.22 1.25 1.28 0.95 0.00 0.00 175.26 178.99 2hxy n LEU 246 N 1.58 3.31 -3.64 1.83 4.32 -1.25 -4.55 117.00 118.61 2hxy n LEU 246 Ca -0.19 1.20 -0.09 0.00 -0.02 0.00 0.00 56.01 56.91 2hxy n LEU 246 Cb 0.54 -1.46 -0.07 0.00 -1.62 0.00 0.00 43.42 40.82 2hxy n LEU 246 CO 0.22 -0.63 0.41 0.42 -1.22 0.00 0.00 177.39 176.59 2hxy s THR 247 N -1.09 0.00 -0.51 -5.08 -4.23 -0.97 -4.93 115.64 98.83 2hxy s THR 247 Ca 0.56 0.00 0.03 0.00 -1.18 0.00 0.00 61.69 61.10 2hxy s THR 247 Cb -0.58 -1.00 0.22 0.00 1.34 0.00 0.00 72.50 72.47 2hxy s THR 247 CO 0.62 0.00 1.03 0.00 -0.54 0.00 0.00 174.62 175.72 2hxy n LEU 248 N 3.73 3.07 -4.75 4.79 -0.00 -1.26 -3.10 117.00 119.48 2hxy n LEU 248 Ca -0.18 -1.57 -0.41 0.00 -0.00 0.00 0.00 56.01 53.85 2hxy n LEU 248 Cb 0.58 -0.57 -0.02 0.00 -0.00 0.00 0.00 43.42 43.41 2hxy n LEU 248 CO -0.00 0.48 1.14 -0.70 -0.00 0.00 0.00 177.39 178.31 2hxy s GLU 249 N -1.27 4.22 0.00 1.47 -6.30 -1.26 -2.01 118.70 113.55 2hxy s GLU 249 Ca 0.16 2.40 0.00 0.00 -2.50 0.00 0.00 54.97 55.03 2hxy s GLU 249 Cb 0.13 -3.07 0.00 0.00 0.00 0.00 0.00 34.13 31.19 2hxy s GLU 249 CO 0.04 -0.47 0.00 0.41 0.02 0.00 0.00 175.26 175.26 2hxy n GLY 250 N 1.88 1.88 3.71 -1.50 0.00 -1.26 -4.90 105.19 105.00 2hxy n GLY 250 Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 2hxy n GLY 250 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2hxy s ILE 251 N -2.37 5.33 -0.24 -0.61 1.01 -0.85 -3.28 121.20 120.19 2hxy s ILE 251 Ca 0.00 0.40 -0.27 0.00 0.00 0.00 0.00 60.65 60.78 2hxy s ILE 251 Cb 0.00 -3.58 0.01 0.00 0.01 0.00 0.00 42.46 38.90 2hxy s ILE 251 CO 0.00 0.38 0.97 -0.54 0.00 0.00 0.00 174.94 175.75 2hxy s LYS 252 N 0.65 4.22 -0.11 2.79 -0.14 -0.89 -5.00 119.74 121.25 2hxy s LYS 252 Ca 0.13 1.19 0.00 0.00 -1.36 0.00 0.00 55.97 55.93 2hxy s LYS 252 Cb -0.13 -3.65 -0.02 0.00 -1.68 0.00 0.00 37.83 32.35 2hxy s LYS 252 CO 0.03 -0.61 -0.11 -0.65 -0.76 0.00 0.00 175.35 173.25 2hxy s GLN 253 N 3.11 3.18 0.21 1.68 -0.21 -1.26 -1.77 119.66 124.60 2hxy s GLN 253 Ca 0.41 -0.64 -0.00 0.00 0.02 0.00 0.00 55.36 55.15 2hxy s GLN 253 Cb -0.15 -2.63 -0.04 0.00 1.00 0.00 0.00 33.01 31.19 2hxy s GLN 253 CO 0.07 0.36 0.13 -0.06 -2.12 0.00 0.00 175.29 173.67 2hxy s PHE 254 N -0.02 1.25 -0.03 0.91 2.99 -0.37 -1.73 117.98 120.98 2hxy s PHE 254 Ca -0.02 -1.35 -0.04 0.00 0.00 0.00 0.00 56.93 55.51 2hxy s PHE 254 Cb -0.14 -0.63 0.01 0.00 0.00 0.00 0.00 43.02 42.26 2hxy s PHE 254 CO 0.04 -0.59 0.11 -0.59 -0.00 0.00 0.00 175.22 174.18 2hxy s PHE 255 N -4.07 -0.05 -0.27 0.36 -0.12 0.11 0.20 117.98 114.14 2hxy s PHE 255 Ca 0.39 0.13 -0.05 0.00 -0.05 0.00 0.00 56.93 57.35 2hxy s PHE 255 Cb 0.07 0.00 0.01 0.00 -0.63 0.00 0.00 43.02 42.47 2hxy s PHE 255 CO 0.13 -0.12 0.02 0.08 -0.05 0.00 0.00 175.22 175.28 2hxy s VAL 256 N -0.40 3.57 -1.16 -2.49 1.01 0.13 -2.00 120.40 119.06 2hxy s VAL 256 Ca -0.05 -0.78 -0.21 0.00 0.00 0.00 0.00 61.98 60.94 2hxy s VAL 256 Cb -0.03 -2.81 -0.07 0.00 0.00 0.00 0.00 36.38 33.47 2hxy s VAL 256 CO 0.00 0.15 1.91 0.00 0.00 0.00 0.00 175.10 177.16 2hxy n ALA 257 N 4.80 2.45 -1.12 5.51 0.00 -1.26 -3.36 120.51 127.52 2hxy n ALA 257 Ca -0.15 -3.24 -0.07 0.00 0.00 0.00 0.00 53.44 49.98 2hxy n ALA 257 Cb 0.48 -3.53 0.08 0.00 0.00 0.00 0.00 19.45 16.48 2hxy n ALA 257 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2hxy n VAL 258 N 7.22 0.00 0.00 0.00 0.24 -1.23 -5.04 118.33 119.51 2hxy n VAL 258 Ca 0.47 -0.22 0.00 0.00 -2.04 0.00 0.00 64.34 62.54 2hxy n VAL 258 Cb 0.45 -1.34 0.00 0.00 -1.47 0.00 0.00 33.84 31.49 2hxy n VAL 258 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2hxy n GLU 259 N -2.40 0.00 -4.28 7.34 1.02 -1.26 -4.39 120.64 116.66 2hxy n GLU 259 Ca 0.05 0.00 -0.15 0.00 -0.02 0.00 0.00 57.16 57.04 2hxy n GLU 259 Cb 0.20 -0.46 -0.10 0.00 -0.02 0.00 0.00 31.44 31.06 2hxy n GLU 259 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 2hxy s ARG 260 N -2.00 1.20 0.25 3.49 1.70 -1.26 -2.84 118.95 119.49 2hxy s ARG 260 Ca 0.00 -1.57 -0.03 0.00 -0.47 0.00 0.00 55.73 53.65 2hxy s ARG 260 Cb 0.00 -0.53 0.46 0.00 -0.57 0.00 0.00 34.95 34.31 2hxy s ARG 260 CO 0.00 -0.05 1.77 0.93 -1.08 0.00 0.00 175.30 176.86 2hxy h GLU 261 N 2.62 0.60 0.00 3.89 4.39 -2.01 -2.31 114.58 121.75 2hxy h GLU 261 Ca -0.37 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.29 2hxy h GLU 261 Cb 1.21 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.72 2hxy h GLU 261 CO 0.64 0.39 0.00 0.93 -1.16 0.00 0.00 179.01 179.81 2hxy h GLU 262 N 0.61 0.00 0.00 2.33 3.07 -2.04 0.63 114.58 119.18 2hxy h GLU 262 Ca 0.42 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.28 2hxy h GLU 262 Cb 0.54 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.45 2hxy h GLU 262 CO -0.33 0.00 -0.53 -1.49 -1.40 0.00 0.00 179.01 175.26 2hxy h TRP 263 N 0.00 0.00 0.45 4.33 4.06 -1.85 -3.37 115.95 119.58 2hxy h TRP 263 Ca 0.00 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.94 2hxy h TRP 263 Cb 0.28 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.43 2hxy h TRP 263 CO 0.00 0.00 -0.30 0.87 -3.56 0.00 0.00 178.44 175.45 2hxy h LYS 264 N 0.00 -0.70 -0.43 0.49 1.57 -0.88 -2.89 116.57 113.73 2hxy h LYS 264 Ca 0.00 0.05 0.04 0.00 -1.87 0.00 0.00 60.65 58.87 2hxy h LYS 264 Cb 0.76 0.16 -0.06 0.00 0.08 0.00 0.00 32.23 33.17 2hxy h LYS 264 CO 0.00 -0.47 -0.33 0.35 -0.57 0.00 0.00 179.45 178.44 2hxy h PHE 265 N -0.73 -1.03 -0.68 -1.35 3.57 -1.72 0.12 116.94 115.13 2hxy h PHE 265 Ca -0.05 0.06 0.15 0.00 3.53 0.00 0.00 57.97 61.66 2hxy h PHE 265 Cb 0.61 0.50 -0.12 0.00 2.79 0.00 0.00 35.95 39.73 2hxy h PHE 265 CO -0.12 -0.24 -0.05 -0.44 -2.23 0.00 0.00 178.31 175.24 2hxy h ASP 266 N -0.09 -0.40 -0.49 0.41 3.32 -1.78 0.41 116.42 117.80 2hxy h ASP 266 Ca 0.07 0.18 0.12 0.00 0.02 0.00 0.00 57.03 57.42 2hxy h ASP 266 Cb 0.27 0.34 -0.02 0.00 0.22 0.00 0.00 39.33 40.14 2hxy h ASP 266 CO -0.45 -0.17 0.34 0.74 -1.72 0.00 0.00 179.24 177.98 2hxy h THR 267 N 0.08 0.81 0.27 0.35 2.02 -0.63 -0.16 112.91 115.65 2hxy h THR 267 Ca 0.36 -0.04 -0.01 0.00 0.77 0.00 0.00 66.41 67.48 2hxy h THR 267 Cb 0.59 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 67.68 2hxy h THR 267 CO -0.63 0.02 -0.13 0.25 0.37 0.00 0.00 175.52 175.41 2hxy h LEU 268 N 0.12 -0.30 -0.14 2.58 5.85 0.16 -3.09 115.31 120.50 2hxy h LEU 268 Ca 0.23 -0.21 0.03 0.00 0.84 0.00 0.00 57.88 58.78 2hxy h LEU 268 Cb 0.76 0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.80 2hxy h LEU 268 CO -0.03 0.18 -0.52 0.00 -0.34 0.00 0.00 178.44 177.73 2hxy h ASP 270 N -0.57 0.29 0.33 0.00 3.32 -1.14 0.86 116.42 119.52 2hxy h ASP 270 Ca 0.04 0.22 -0.31 0.00 0.02 0.00 0.00 57.03 57.01 2hxy h ASP 270 Cb 0.68 0.23 0.03 0.00 0.22 0.00 0.00 39.33 40.48 2hxy h ASP 270 CO -0.44 -0.36 -1.34 0.25 -1.72 0.00 0.00 179.24 175.63 2hxy h LEU 271 N 0.02 0.74 -0.86 1.55 5.85 -0.79 -3.40 115.31 118.42 2hxy h LEU 271 Ca 0.85 -0.75 0.19 0.00 0.84 0.00 0.00 57.88 59.01 2hxy h LEU 271 Cb 2.40 -0.24 -0.11 0.00 0.37 0.00 0.00 40.66 43.08 2hxy h LEU 271 CO -0.66 1.58 0.38 0.22 -0.34 0.00 0.00 178.44 179.62 2hxy h TYR 272 N 0.16 0.64 0.00 1.25 3.20 0.52 -0.47 116.97 122.28 2hxy h TYR 272 Ca -0.20 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.70 2hxy h TYR 272 Cb 2.04 -0.15 -0.00 0.00 1.54 0.00 0.00 36.73 40.15 2hxy h TYR 272 CO 0.11 0.01 -0.05 -0.44 -1.64 0.00 0.00 178.16 176.15 2hxy h ASP 273 N 0.45 0.00 0.34 -2.11 3.32 -1.77 -1.65 116.42 114.99 2hxy h ASP 273 Ca 0.52 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.57 2hxy h ASP 273 Cb 0.91 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.46 2hxy h ASP 273 CO -0.48 0.05 -0.75 0.41 -1.72 0.00 0.00 179.24 176.75 2hxy n THR 274 N -3.46 0.03 0.09 0.35 -1.04 -0.22 -4.42 114.28 105.62 2hxy n THR 274 Ca -0.02 -0.04 -0.04 0.00 -2.04 0.00 0.00 64.05 61.90 2hxy n THR 274 Cb 0.17 0.47 -0.02 0.00 -1.82 0.00 0.00 70.33 69.13 2hxy n THR 274 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 2hxy h LEU 275 N 0.00 -0.24 -0.56 -4.42 6.46 -0.93 -3.24 115.31 112.38 2hxy h LEU 275 Ca 0.00 0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.77 2hxy h LEU 275 Cb 0.54 0.06 0.00 0.00 -0.73 0.00 0.00 40.66 40.54 2hxy h LEU 275 CO 0.00 0.03 0.36 0.35 -0.62 0.00 0.00 178.44 178.55 2hxy n THR 276 N -3.89 0.59 -0.47 1.05 -2.24 -1.07 -0.05 114.28 108.21 2hxy n THR 276 Ca -0.04 0.69 0.39 0.00 -2.27 0.00 0.00 64.05 62.83 2hxy n THR 276 Cb 0.11 -1.69 0.67 0.00 -2.10 0.00 0.00 70.33 67.32 2hxy n THR 276 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 2hxy h ILE 277 N 0.00 0.05 -4.28 2.28 6.09 -1.79 -3.37 117.51 116.48 2hxy h ILE 277 Ca 0.00 -0.01 -0.46 0.00 -1.37 0.00 0.00 64.86 63.02 2hxy h ILE 277 Cb 0.72 0.01 -0.13 0.00 0.47 0.00 0.00 36.82 37.88 2hxy h ILE 277 CO 0.00 0.01 -0.52 0.28 -3.07 0.00 0.00 178.15 174.85 2hxy s THR 278 N -5.27 0.16 0.38 2.19 -1.32 0.92 -5.15 115.64 107.55 2hxy s THR 278 Ca -0.08 -2.00 -0.06 0.00 -1.21 0.00 0.00 61.69 58.34 2hxy s THR 278 Cb 0.31 -2.47 0.09 0.00 -1.51 0.00 0.00 72.50 68.92 2hxy s THR 278 CO 0.83 0.00 0.44 0.00 -2.21 0.00 0.00 174.62 173.67 2hxy n GLN 279 N -0.65 -0.94 -3.60 7.08 6.02 -1.25 -4.85 117.38 119.19 2hxy n GLN 279 Ca 0.03 -0.68 -0.09 0.00 -0.01 0.00 0.00 57.00 56.25 2hxy n GLN 279 Cb 0.63 -0.52 -0.06 0.00 1.02 0.00 0.00 30.24 31.32 2hxy n GLN 279 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2hxy s ALA 280 N -3.62 -1.98 -0.15 -1.58 0.00 0.24 -4.53 121.76 110.14 2hxy s ALA 280 Ca 0.26 1.69 0.00 0.00 0.00 0.00 0.00 51.96 53.91 2hxy s ALA 280 Cb -0.01 -1.03 -0.01 0.00 0.00 0.00 0.00 23.12 22.07 2hxy s ALA 280 CO 0.19 -0.27 -0.14 0.08 0.00 0.00 0.00 175.76 175.62 2hxy s VAL 281 N -0.72 2.84 -0.19 0.00 1.01 -1.03 -0.72 120.40 121.60 2hxy s VAL 281 Ca 0.01 -0.72 -0.03 0.00 0.00 0.00 0.00 61.98 61.24 2hxy s VAL 281 Cb -0.02 -2.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.15 2hxy s VAL 281 CO -0.02 0.52 -0.08 -0.63 0.00 0.00 0.00 175.10 174.89 2hxy s ILE 282 N 0.64 3.22 0.53 2.22 1.01 0.17 -0.84 121.20 128.14 2hxy s ILE 282 Ca -0.08 -0.56 -0.06 0.00 0.00 0.00 0.00 60.65 59.96 2hxy s ILE 282 Cb -0.16 -2.43 0.12 0.00 0.01 0.00 0.00 42.46 40.00 2hxy s ILE 282 CO 0.03 0.46 0.72 0.49 0.00 0.00 0.00 174.94 176.64 2hxy n PHE 283 N 4.42 -3.60 -3.60 3.97 3.01 -0.00 -0.54 117.46 121.13 2hxy n PHE 283 Ca -0.18 -0.88 -0.04 0.00 1.01 0.00 0.00 57.45 57.35 2hxy n PHE 283 Cb 0.51 -0.55 -0.02 0.00 -0.01 0.00 0.00 39.48 39.42 2hxy n PHE 283 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2hxy n ASN 285 N -0.26 0.01 -4.13 0.00 4.13 -1.26 -4.06 115.26 109.69 2hxy n ASN 285 Ca -0.05 0.01 -0.13 0.00 1.68 0.00 0.00 54.58 56.09 2hxy n ASN 285 Cb 0.60 1.95 -0.11 0.00 -1.54 0.00 0.00 39.78 40.69 2hxy n ASN 285 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 2hxy s THR 286 N -3.50 0.73 0.04 3.41 -4.23 -1.26 -4.94 115.64 105.90 2hxy s THR 286 Ca -0.08 -1.52 -0.16 0.00 -1.18 0.00 0.00 61.69 58.75 2hxy s THR 286 Cb 0.14 -1.18 -0.07 0.00 1.34 0.00 0.00 72.50 72.72 2hxy s THR 286 CO 0.91 -0.58 1.25 0.50 -0.54 0.00 0.00 174.62 176.16 2hxy h LYS 287 N 3.74 -0.41 -1.21 3.99 3.64 -2.00 -1.38 116.57 122.95 2hxy h LYS 287 Ca -0.36 0.03 0.35 0.00 -1.27 0.00 0.00 60.65 59.39 2hxy h LYS 287 Cb 1.19 0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 33.05 2hxy h LYS 287 CO 0.52 -0.28 0.96 0.07 -2.27 0.00 0.00 179.45 178.45 2hxy h ARG 288 N -0.43 0.00 0.00 1.90 0.11 -1.99 0.27 114.38 114.24 2hxy h ARG 288 Ca -0.02 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 60.02 2hxy h ARG 288 Cb 0.38 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.46 2hxy h ARG 288 CO -0.05 0.00 -0.31 -0.22 0.10 0.00 0.00 179.97 179.49 2hxy h LYS 289 N 0.00 0.00 0.00 0.08 3.64 -1.69 -0.39 116.57 118.21 2hxy h LYS 289 Ca 0.57 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.94 2hxy h LYS 289 Cb 2.48 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 34.30 2hxy h LYS 289 CO -0.01 0.17 -0.10 0.28 -2.27 0.00 0.00 179.45 177.52 2hxy h VAL 290 N 0.00 0.37 -0.79 2.00 2.07 0.12 -2.49 116.25 117.52 2hxy h VAL 290 Ca -0.01 -1.29 0.14 0.00 0.82 0.00 0.00 66.70 66.36 2hxy h VAL 290 Cb 1.14 0.71 -0.14 0.00 -1.52 0.00 0.00 31.29 31.48 2hxy h VAL 290 CO 0.02 0.12 -0.31 0.44 0.02 0.00 0.00 177.57 177.86 2hxy h ASP 291 N -1.00 -1.13 0.57 0.57 3.45 -1.43 0.58 116.42 118.02 2hxy h ASP 291 Ca -0.01 0.26 -0.02 0.00 0.43 0.00 0.00 57.03 57.69 2hxy h ASP 291 Cb 0.29 0.62 -0.02 0.00 -0.56 0.00 0.00 39.33 39.66 2hxy h ASP 291 CO -0.01 -0.29 -0.48 -0.25 -1.57 0.00 0.00 179.24 176.64 2hxy h TRP 292 N -0.06 -1.33 -0.89 4.55 7.01 -1.16 -1.34 115.95 122.73 2hxy h TRP 292 Ca 0.32 0.00 0.18 0.00 2.11 0.00 0.00 58.89 61.50 2hxy h TRP 292 Cb 0.58 0.50 -0.11 0.00 -2.10 0.00 0.00 29.16 28.04 2hxy h TRP 292 CO -0.72 -0.66 0.45 1.25 -2.79 0.00 0.00 178.44 175.97 2hxy h LEU 293 N -1.03 0.49 0.27 0.65 5.85 -0.47 0.17 115.31 121.24 2hxy h LEU 293 Ca -0.07 0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 2hxy h LEU 293 Cb 0.87 0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.95 2hxy h LEU 293 CO -0.01 0.14 -0.14 0.74 -0.34 0.00 0.00 178.44 178.83 2hxy h THR 294 N 0.56 0.00 -0.72 1.05 2.02 0.42 -0.32 112.91 115.92 2hxy h THR 294 Ca 0.52 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.84 2hxy h THR 294 Cb 0.85 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 67.12 2hxy h THR 294 CO -0.43 0.00 -0.18 -0.08 0.37 0.00 0.00 175.52 175.20 2hxy h GLU 295 N -0.38 -0.00 0.00 6.66 4.81 -0.77 0.39 114.58 125.29 2hxy h GLU 295 Ca -0.04 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2hxy h GLU 295 Cb 0.29 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.67 2hxy h GLU 295 CO 0.05 -0.00 -0.02 -0.22 -0.73 0.00 0.00 179.01 178.09 2hxy h LYS 296 N -0.00 0.00 0.00 1.92 1.63 -0.57 0.67 116.57 120.21 2hxy h LYS 296 Ca 0.34 0.00 -0.28 0.00 -0.85 0.00 0.00 60.65 59.87 2hxy h LYS 296 Cb 0.53 0.00 -0.05 0.00 -0.60 0.00 0.00 32.23 32.11 2hxy h LYS 296 CO -0.74 0.02 -1.86 -1.33 -3.45 0.00 0.00 179.45 172.09 2hxy n MET 297 N -3.34 0.65 0.09 1.90 2.81 0.11 -4.08 117.12 115.25 2hxy n MET 297 Ca -0.02 0.17 -0.04 0.00 -1.81 0.00 0.00 57.70 56.00 2hxy n MET 297 Cb 0.13 -1.71 -0.07 0.00 -0.71 0.00 0.00 33.22 30.87 2hxy n MET 297 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2hxy h ARG 298 N 0.00 0.00 0.00 0.03 3.08 -0.16 -2.40 114.38 114.93 2hxy h ARG 298 Ca -0.33 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.72 2hxy h ARG 298 Cb 1.95 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.00 2hxy h ARG 298 CO 0.05 0.85 0.00 -0.85 -1.07 0.00 0.00 179.97 178.95 2hxy n GLU 299 N -3.33 0.78 -0.18 0.04 0.28 0.17 -1.94 120.64 116.46 2hxy n GLU 299 Ca 0.00 0.01 0.07 0.00 -0.16 0.00 0.00 57.16 57.09 2hxy n GLU 299 Cb 0.87 -1.50 0.15 0.00 1.43 0.00 0.00 31.44 32.39 2hxy n GLU 299 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2hxy n ALA 300 N -1.06 2.42 -2.90 -1.84 0.00 -1.15 -5.04 120.51 110.94 2hxy n ALA 300 Ca 0.20 -2.12 -0.08 0.00 0.00 0.00 0.00 53.44 51.44 2hxy n ALA 300 Cb 0.12 -0.42 0.01 0.00 0.00 0.00 0.00 19.45 19.16 2hxy n ALA 300 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2hxy n ASN 301 N -0.82 -7.65 -3.62 0.00 4.05 -0.82 -5.04 115.26 101.35 2hxy n ASN 301 Ca 0.14 0.76 -0.10 0.00 0.45 0.00 0.00 54.58 55.83 2hxy n ASN 301 Cb 0.63 -4.75 -0.11 0.00 1.23 0.00 0.00 39.78 36.78 2hxy n ASN 301 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 177.26 173.85 2hxy s PHE 302 N -2.06 -0.67 -0.29 1.20 0.08 -0.92 -4.96 117.98 110.37 2hxy s PHE 302 Ca 0.16 1.25 -0.28 0.00 0.12 0.00 0.00 56.93 58.18 2hxy s PHE 302 Cb -0.04 0.15 -0.03 0.00 -0.57 0.00 0.00 43.02 42.54 2hxy s PHE 302 CO 0.74 -0.47 1.87 -0.08 -0.10 0.00 0.00 175.22 177.17 2hxy s THR 303 N 2.54 3.40 -0.05 0.64 -1.32 -1.26 -4.40 115.64 115.18 2hxy s THR 303 Ca 0.01 0.41 -0.03 0.00 -1.21 0.00 0.00 61.69 60.87 2hxy s THR 303 Cb -0.12 -3.51 0.02 0.00 -1.51 0.00 0.00 72.50 67.38 2hxy s THR 303 CO -0.12 -0.31 0.12 0.68 -2.21 0.00 0.00 174.62 172.79 2hxy s VAL 304 N 6.92 -0.03 0.15 5.08 -7.23 -1.26 -3.84 120.40 120.19 2hxy s VAL 304 Ca 0.83 0.10 0.04 0.00 -1.81 0.00 0.00 61.98 61.14 2hxy s VAL 304 Cb -0.25 -0.19 -0.04 0.00 0.56 0.00 0.00 36.38 36.46 2hxy s VAL 304 CO 0.34 0.04 0.18 -0.44 -0.31 0.00 0.00 175.10 174.91 2hxy s SER 305 N 0.63 5.83 -0.20 4.85 0.01 -0.61 -4.99 113.70 119.21 2hxy s SER 305 Ca -0.05 -0.00 -0.11 0.00 1.31 0.00 0.00 55.95 57.11 2hxy s SER 305 Cb -0.06 -1.62 0.07 0.00 0.21 0.00 0.00 66.02 64.61 2hxy s SER 305 CO -0.03 0.08 0.48 -0.94 0.41 0.00 0.00 173.24 173.24 2hxy s SER 306 N -3.05 -0.61 0.03 2.44 1.04 -1.26 -0.60 113.70 111.70 2hxy s SER 306 Ca 0.32 1.06 0.02 0.00 0.48 0.00 0.00 55.95 57.83 2hxy s SER 306 Cb -0.11 1.00 -0.02 0.00 0.10 0.00 0.00 66.02 67.00 2hxy s SER 306 CO 0.25 -0.21 -0.07 0.00 0.98 0.00 0.00 173.24 174.20 2hxy s MET 307 N 1.61 0.48 0.00 4.02 0.23 -1.13 -5.00 119.30 119.51 2hxy s MET 307 Ca -0.09 -0.67 0.00 0.00 -1.03 0.00 0.00 55.69 53.90 2hxy s MET 307 Cb -0.08 -0.24 0.00 0.00 -1.53 0.00 0.00 34.83 32.98 2hxy s MET 307 CO -0.15 0.04 0.00 -2.39 -2.03 0.00 0.00 175.02 170.50 2hxy n HIS 308 N 1.66 0.00 0.08 3.16 1.44 -1.26 -3.02 115.22 117.27 2hxy n HIS 308 Ca -0.22 0.00 -0.10 0.00 -2.01 0.00 0.00 57.72 55.39 2hxy n HIS 308 Cb 0.55 0.00 -0.10 0.00 0.12 0.00 0.00 29.99 30.56 2hxy n HIS 308 CO 0.00 0.00 0.00 0.78 -2.81 0.00 0.00 176.34 174.31 2hxy h GLY 309 N 0.00 0.14 -1.55 -1.39 0.00 -1.95 -3.33 103.07 94.99 2hxy h GLY 309 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.01 2hxy h GLY 309 CO 0.00 0.28 0.00 1.22 0.00 0.00 0.00 176.54 178.04 2hxy n ASP 310 N -3.48 1.45 -4.47 0.19 8.00 -1.26 -4.83 116.55 112.15 2hxy n ASP 310 Ca -0.03 -1.38 -0.24 0.00 0.71 0.00 0.00 54.79 53.85 2hxy n ASP 310 Cb 0.93 -0.34 -0.10 0.00 -0.02 0.00 0.00 41.12 41.59 2hxy n ASP 310 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2hxy s MET 311 N -0.28 1.66 0.11 -1.24 -1.94 -1.25 -5.13 119.30 111.24 2hxy s MET 311 Ca 0.00 -1.79 -0.31 0.00 -1.71 0.00 0.00 55.69 51.88 2hxy s MET 311 Cb 0.00 -1.62 -0.08 0.00 2.01 0.00 0.00 34.83 35.14 2hxy s MET 311 CO 0.00 0.24 1.48 -1.25 -0.01 0.00 0.00 175.02 175.48 2hxy s PRO 312 N -3.57 4.27 0.00 2.03 0.04 -1.26 -4.87 135.00 131.63 2hxy s PRO 312 Ca 0.30 2.19 0.00 0.00 0.04 0.00 0.00 61.00 63.52 2hxy s PRO 312 Cb -0.02 -3.29 0.00 0.00 0.04 0.00 0.00 34.50 31.23 2hxy s PRO 312 CO 0.14 -0.54 0.30 0.94 0.04 0.00 0.00 177.00 177.88 2hxy n GLN 313 N 4.28 0.00 0.00 4.56 -0.06 -1.26 -0.03 117.38 124.88 2hxy n GLN 313 Ca 0.13 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.13 2hxy n GLN 313 Cb 0.41 -1.49 0.00 0.00 -4.06 0.00 0.00 30.24 25.10 2hxy n GLN 313 CO 0.00 0.00 0.00 1.17 -0.20 0.00 0.00 177.06 178.03 2hxy n LYS 314 N -0.79 3.09 -0.07 3.69 4.81 -1.26 -4.51 118.16 123.12 2hxy n LYS 314 Ca 0.00 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.32 2hxy n LYS 314 Cb 0.00 -0.65 -0.14 0.00 0.02 0.00 0.00 35.03 34.25 2hxy n LYS 314 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 2hxy n GLU 315 N -0.94 0.67 0.46 1.64 2.13 0.96 -3.20 120.64 122.36 2hxy n GLU 315 Ca 0.00 0.15 -0.20 0.00 0.66 0.00 0.00 57.16 57.77 2hxy n GLU 315 Cb 0.00 -1.63 -0.10 0.00 0.27 0.00 0.00 31.44 29.98 2hxy n GLU 315 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2hxy h ARG 316 N 0.01 -1.20 0.00 5.31 3.08 -1.05 -0.70 114.38 119.82 2hxy h ARG 316 Ca -0.45 0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.68 2hxy h ARG 316 Cb 2.09 0.27 0.00 0.00 0.08 0.00 0.00 29.97 32.41 2hxy h ARG 316 CO 0.03 -0.80 0.00 -0.85 -1.07 0.00 0.00 179.97 177.28 2hxy n GLU 317 N -5.64 0.17 0.08 0.04 0.28 -1.26 -1.29 120.64 113.02 2hxy n GLU 317 Ca -0.15 0.50 -0.09 0.00 -0.16 0.00 0.00 57.16 57.26 2hxy n GLU 317 Cb 0.51 -1.90 0.02 0.00 1.43 0.00 0.00 31.44 31.51 2hxy n GLU 317 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 2hxy h SER 318 N 0.00 0.32 -0.01 -1.84 0.87 -1.17 -2.07 113.55 109.65 2hxy h SER 318 Ca 0.00 -0.24 -0.00 0.00 -1.23 0.00 0.00 61.79 60.32 2hxy h SER 318 Cb 0.22 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 62.09 2hxy h SER 318 CO 0.00 1.00 -0.01 0.40 -0.53 0.00 0.00 176.83 177.69 2hxy h ILE 319 N 0.16 1.36 -0.55 2.23 1.08 0.18 -3.11 117.51 118.86 2hxy h ILE 319 Ca -0.04 -1.07 0.11 0.00 -0.39 0.00 0.00 64.86 63.47 2hxy h ILE 319 Cb 1.41 2.06 -0.11 0.00 -3.07 0.00 0.00 36.82 37.11 2hxy h ILE 319 CO 0.13 0.28 -0.23 0.24 -0.69 0.00 0.00 178.15 177.88 2hxy h MET 320 N -0.42 -0.09 -0.94 2.37 2.86 -1.47 0.59 114.93 117.83 2hxy h MET 320 Ca 0.00 0.01 0.10 0.00 -2.06 0.00 0.00 59.70 57.75 2hxy h MET 320 Cb 0.46 0.02 -0.13 0.00 0.06 0.00 0.00 31.60 32.01 2hxy h MET 320 CO 0.00 -0.06 -0.52 0.87 1.06 0.00 0.00 176.91 178.26 2hxy h LYS 321 N -0.10 -0.04 0.15 1.72 1.57 -1.30 0.88 116.57 119.45 2hxy h LYS 321 Ca 0.25 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 59.04 2hxy h LYS 321 Cb 0.49 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.76 2hxy h LYS 321 CO -0.61 -0.03 -0.51 0.93 -0.57 0.00 0.00 179.45 178.67 2hxy h GLU 322 N -0.04 -0.72 -0.17 3.15 5.08 -0.95 -1.03 114.58 119.90 2hxy h GLU 322 Ca 0.21 0.05 0.05 0.00 -1.00 0.00 0.00 59.36 58.67 2hxy h GLU 322 Cb 0.48 0.16 -0.06 0.00 0.50 0.00 0.00 28.75 29.84 2hxy h GLU 322 CO -0.92 -0.48 -0.19 0.35 -1.00 0.00 0.00 179.01 176.77 2hxy h PHE 323 N -0.75 -0.50 0.00 4.33 3.57 0.13 -0.87 116.94 122.85 2hxy h PHE 323 Ca -0.01 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.49 2hxy h PHE 323 Cb 0.74 0.25 -0.00 0.00 2.79 0.00 0.00 35.95 39.73 2hxy h PHE 323 CO -0.43 -0.27 -0.12 0.00 -2.23 0.00 0.00 178.31 175.26 2hxy h ARG 324 N -0.22 0.00 -0.50 1.11 3.08 0.63 -2.97 114.38 115.51 2hxy h ARG 324 Ca 0.11 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.13 2hxy h ARG 324 Cb 0.39 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.42 2hxy h ARG 324 CO -0.30 0.12 0.19 1.03 -1.07 0.00 0.00 179.97 179.94 2hxy h SER 325 N 0.00 0.70 0.00 7.04 0.87 0.20 -3.47 113.55 118.89 2hxy h SER 325 Ca -0.00 -0.18 0.00 0.00 -1.23 0.00 0.00 61.79 60.38 2hxy h SER 325 Cb 0.44 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.22 2hxy h SER 325 CO 0.02 0.68 0.00 0.61 -0.53 0.00 0.00 176.83 177.61 2hxy n GLY 326 N -0.78 1.48 0.01 5.77 0.00 -0.97 -4.98 105.19 105.73 2hxy n GLY 326 Ca 0.02 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.16 2hxy n GLY 326 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hxy n ALA 327 N -0.67 3.36 -3.66 4.61 0.00 -0.80 -4.76 120.51 118.59 2hxy n ALA 327 Ca 0.00 -0.32 -0.09 0.00 0.00 0.00 0.00 53.44 53.03 2hxy n ALA 327 Cb 0.00 -1.14 -0.10 0.00 0.00 0.00 0.00 19.45 18.21 2hxy n ALA 327 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2hxy s SER 328 N -3.28 -0.28 0.12 0.00 1.04 -1.25 -4.89 113.70 105.15 2hxy s SER 328 Ca 0.10 0.97 -0.07 0.00 0.48 0.00 0.00 55.95 57.43 2hxy s SER 328 Cb 0.17 1.24 -0.12 0.00 0.10 0.00 0.00 66.02 67.41 2hxy s SER 328 CO 0.70 -0.23 1.29 0.03 0.98 0.00 0.00 173.24 176.01 2hxy h ARG 329 N 8.00 0.50 -4.51 4.02 2.47 -1.86 -3.42 114.38 119.59 2hxy h ARG 329 Ca -0.19 -0.52 -0.58 0.00 -1.26 0.00 0.00 59.98 57.43 2hxy h ARG 329 Cb 1.12 0.14 -0.36 0.00 -1.65 0.00 0.00 29.97 29.22 2hxy h ARG 329 CO 0.15 1.16 -0.82 0.08 0.56 0.00 0.00 179.97 181.09 2hxy s VAL 330 N -3.34 1.41 -0.17 2.04 1.01 -1.25 0.80 120.40 120.91 2hxy s VAL 330 Ca -0.07 -0.59 -0.02 0.00 0.00 0.00 0.00 61.98 61.30 2hxy s VAL 330 Cb 0.08 -1.38 -0.01 0.00 0.00 0.00 0.00 36.38 35.07 2hxy s VAL 330 CO 0.88 0.38 -0.08 -0.22 0.00 0.00 0.00 175.10 176.06 2hxy s LEU 331 N 1.54 2.87 -0.26 3.92 2.96 0.11 -1.57 118.68 128.25 2hxy s LEU 331 Ca 0.04 -0.31 -0.06 0.00 -0.22 0.00 0.00 54.13 53.58 2hxy s LEU 331 Cb -0.13 -1.68 -0.00 0.00 0.50 0.00 0.00 46.19 44.87 2hxy s LEU 331 CO -0.10 0.10 0.03 -0.63 -1.32 0.00 0.00 176.35 174.43 2hxy s ILE 332 N 0.74 3.77 0.28 6.68 1.01 0.23 0.43 121.20 134.35 2hxy s ILE 332 Ca -0.04 -0.52 -0.02 0.00 0.00 0.00 0.00 60.65 60.07 2hxy s ILE 332 Cb -0.15 -2.82 -0.02 0.00 0.01 0.00 0.00 42.46 39.48 2hxy s ILE 332 CO 0.02 0.27 0.35 -0.94 0.00 0.00 0.00 174.94 174.63 2hxy s SER 333 N 1.51 0.65 0.56 3.58 1.04 0.30 -2.82 113.70 118.52 2hxy s SER 333 Ca 0.04 -1.40 0.05 0.00 0.48 0.00 0.00 55.95 55.12 2hxy s SER 333 Cb -0.16 0.55 0.06 0.00 0.10 0.00 0.00 66.02 66.58 2hxy s SER 333 CO 0.00 -1.10 0.78 0.42 0.98 0.00 0.00 173.24 174.32 2hxy s THR 334 N -3.61 2.50 -0.72 2.02 -4.23 -1.17 -1.63 115.64 108.80 2hxy s THR 334 Ca 0.33 -0.82 -0.26 0.00 -1.18 0.00 0.00 61.69 59.75 2hxy s THR 334 Cb 0.02 -2.67 0.04 0.00 1.34 0.00 0.00 72.50 71.22 2hxy s THR 334 CO 0.17 0.00 1.24 -0.62 -0.54 0.00 0.00 174.62 174.87 2hxy s ASP 335 N -4.54 6.17 -0.22 3.99 -1.08 -1.26 -4.74 116.67 115.00 2hxy s ASP 335 Ca 0.60 -0.50 0.09 0.00 -0.52 0.00 0.00 52.55 52.22 2hxy s ASP 335 Cb -0.08 -2.54 -0.20 0.00 -1.46 0.00 0.00 42.92 38.64 2hxy s ASP 335 CO 0.38 -1.78 -0.08 0.55 0.52 0.00 0.00 175.17 174.77 2hxy n VAL 336 N 6.33 1.37 -1.68 1.11 3.14 -1.26 -4.95 118.33 122.39 2hxy n VAL 336 Ca 0.02 -0.68 -0.45 0.00 -2.96 0.00 0.00 64.34 60.28 2hxy n VAL 336 Cb 0.49 -0.94 -0.04 0.00 -1.06 0.00 0.00 33.84 32.28 2hxy n VAL 336 CO 0.00 0.00 0.00 0.79 -6.46 0.00 0.00 176.83 171.16 2hxy n TRP 337 N -2.97 2.42 -0.04 1.45 8.01 -1.26 -4.92 117.44 120.13 2hxy n TRP 337 Ca -0.38 0.20 -0.07 0.00 -1.31 0.00 0.00 57.50 55.94 2hxy n TRP 337 Cb 1.04 -2.58 -0.06 0.00 -2.01 0.00 0.00 31.31 27.70 2hxy n TRP 337 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2hxy h ALA 338 N 6.21 -0.05 -2.29 6.99 0.00 -1.93 -3.46 119.26 124.74 2hxy h ALA 338 Ca -0.44 -0.23 -0.46 0.00 0.00 0.00 0.00 54.91 53.78 2hxy h ALA 338 Cb 1.24 0.02 0.17 0.00 0.00 0.00 0.00 17.79 19.22 2hxy h ALA 338 CO 0.91 -0.06 0.15 1.03 0.00 0.00 0.00 179.25 181.29 2hxy s ARG 339 N -2.13 0.21 -0.05 0.00 0.52 -1.26 -5.00 118.95 111.24 2hxy s ARG 339 Ca -0.09 0.72 -0.01 0.00 -0.52 0.00 0.00 55.73 55.83 2hxy s ARG 339 Cb -0.01 -1.70 -0.00 0.00 0.52 0.00 0.00 34.95 33.76 2hxy s ARG 339 CO 0.34 -2.93 0.04 0.78 0.02 0.00 0.00 175.30 173.55 2hxy h GLY 340 N -2.04 -0.02 1.58 -3.53 0.00 -1.90 -3.37 103.07 93.78 2hxy h GLY 340 Ca -0.55 0.01 0.05 0.00 0.00 0.00 0.00 47.33 46.84 2hxy h GLY 340 CO 0.54 -0.01 0.16 1.41 0.00 0.00 0.00 176.54 178.65 2hxy h LEU 341 N -0.52 0.00 -1.76 3.11 4.07 -1.94 -3.24 115.31 115.04 2hxy h LEU 341 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2hxy h LEU 341 Cb 0.02 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.76 2hxy h LEU 341 CO 0.00 0.00 0.00 0.47 -1.08 0.00 0.00 178.44 177.83 2hxy n ASP 342 N -3.95 0.57 -4.66 -0.43 8.00 -1.26 -4.74 116.55 110.07 2hxy n ASP 342 Ca 0.01 -0.45 -0.34 0.00 0.71 0.00 0.00 54.79 54.72 2hxy n ASP 342 Cb 0.29 -0.11 -0.10 0.00 -0.02 0.00 0.00 41.12 41.18 2hxy n ASP 342 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2hxy s VAL 343 N 0.34 4.14 -0.09 2.53 -7.23 -1.23 -4.91 120.40 113.95 2hxy s VAL 343 Ca 0.00 -0.41 -0.41 0.00 -1.81 0.00 0.00 61.98 59.35 2hxy s VAL 343 Cb 0.00 -2.77 -0.19 0.00 0.56 0.00 0.00 36.38 33.98 2hxy s VAL 343 CO 0.00 0.52 1.25 -0.81 -0.31 0.00 0.00 175.10 175.76 2hxy n PRO 344 N 1.89 0.27 0.00 4.82 -0.04 -1.26 -4.74 135.00 135.94 2hxy n PRO 344 Ca -0.17 0.10 0.00 0.00 -0.04 0.00 0.00 63.50 63.39 2hxy n PRO 344 Cb 0.53 -1.63 0.00 0.00 -0.04 0.00 0.00 33.50 32.36 2hxy n PRO 344 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2hxy n GLN 345 N 2.36 0.80 -1.00 0.54 6.02 -1.26 -4.90 117.38 119.94 2hxy n GLN 345 Ca 0.22 0.00 -0.34 0.00 -0.01 0.00 0.00 57.00 56.87 2hxy n GLN 345 Cb 0.08 -1.15 0.10 0.00 1.02 0.00 0.00 30.24 30.29 2hxy n GLN 345 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 177.06 177.60 2hxy n VAL 346 N 0.52 0.78 0.95 5.09 3.14 -1.26 -4.90 118.33 122.65 2hxy n VAL 346 Ca 0.00 -0.28 0.12 0.00 -2.96 0.00 0.00 64.34 61.23 2hxy n VAL 346 Cb 0.37 -0.68 0.33 0.00 -1.06 0.00 0.00 33.84 32.80 2hxy n VAL 346 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 2hxy n SER 347 N -0.88 0.41 -3.79 6.55 3.41 -1.26 -4.81 113.62 113.25 2hxy n SER 347 Ca 0.08 -0.03 -0.20 0.00 -0.26 0.00 0.00 58.87 58.46 2hxy n SER 347 Cb 0.52 0.05 -0.17 0.00 -0.26 0.00 0.00 64.21 64.36 2hxy n SER 347 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2hxy s LEU 348 N -3.14 0.83 -0.10 1.04 2.96 -1.25 -0.88 118.68 118.15 2hxy s LEU 348 Ca 0.11 -0.04 0.03 0.00 -0.22 0.00 0.00 54.13 54.01 2hxy s LEU 348 Cb 0.17 -0.31 0.01 0.00 0.50 0.00 0.00 46.19 46.56 2hxy s LEU 348 CO 0.66 -0.15 -0.20 -0.63 -1.32 0.00 0.00 176.35 174.71 2hxy s ILE 349 N 1.50 1.78 -0.32 6.68 -1.09 -0.24 -2.45 121.20 127.06 2hxy s ILE 349 Ca -0.03 -0.85 -0.03 0.00 -2.23 0.00 0.00 60.65 57.51 2hxy s ILE 349 Cb -0.13 -1.57 0.06 0.00 -1.58 0.00 0.00 42.46 39.24 2hxy s ILE 349 CO -0.03 0.50 0.05 -0.63 -1.23 0.00 0.00 174.94 173.60 2hxy s ILE 350 N 0.54 3.21 -0.65 2.92 1.01 -0.02 -1.28 121.20 126.92 2hxy s ILE 350 Ca -0.15 -1.43 -0.27 0.00 0.00 0.00 0.00 60.65 58.80 2hxy s ILE 350 Cb -0.17 -2.89 0.01 0.00 0.01 0.00 0.00 42.46 39.42 2hxy s ILE 350 CO 0.05 -0.21 1.45 0.20 0.00 0.00 0.00 174.94 176.43 2hxy s ASN 351 N 1.37 5.96 0.48 3.58 0.01 -0.72 -0.82 114.94 124.80 2hxy s ASN 351 Ca -0.02 -0.03 0.27 0.00 -0.71 0.00 0.00 52.86 52.37 2hxy s ASN 351 Cb -0.20 -2.55 1.06 0.00 0.41 0.00 0.00 41.25 39.97 2hxy s ASN 351 CO -0.01 -1.91 1.88 0.22 -1.51 0.00 0.00 177.10 175.77 2hxy h TYR 352 N 11.41 0.00 -3.61 2.20 3.20 -1.85 -2.26 116.97 126.06 2hxy h TYR 352 Ca -0.27 0.00 -0.35 0.00 3.14 0.00 0.00 58.73 61.25 2hxy h TYR 352 Cb 1.09 0.00 -0.32 0.00 1.54 0.00 0.00 36.73 39.04 2hxy h TYR 352 CO 1.08 0.13 -0.75 -0.51 -1.64 0.00 0.00 178.16 176.47 2hxy s ASP 353 N -6.01 0.57 0.43 -2.11 -0.00 -1.26 -4.66 116.67 103.63 2hxy s ASP 353 Ca 0.01 -0.07 -0.23 0.00 -0.00 0.00 0.00 52.55 52.26 2hxy s ASP 353 Cb 0.10 -0.23 -0.08 0.00 -0.00 0.00 0.00 42.92 42.71 2hxy s ASP 353 CO 0.60 -0.04 1.12 -0.76 -0.00 0.00 0.00 175.17 176.09 2hxy s LEU 354 N 0.61 4.08 0.34 1.23 1.43 -1.26 -4.80 118.68 120.31 2hxy s LEU 354 Ca -0.07 2.19 -0.24 0.00 -1.03 0.00 0.00 54.13 54.98 2hxy s LEU 354 Cb -0.10 -4.20 -0.10 0.00 0.03 0.00 0.00 46.19 41.82 2hxy s LEU 354 CO -0.01 -0.72 0.92 -2.16 0.23 0.00 0.00 176.35 174.62 2hxy s PRO 355 N -2.59 4.46 -0.92 1.29 0.04 -1.26 -4.97 135.00 131.05 2hxy s PRO 355 Ca 0.61 1.23 -0.03 0.00 0.04 0.00 0.00 61.00 62.84 2hxy s PRO 355 Cb -0.26 -2.66 0.21 0.00 0.04 0.00 0.00 34.50 31.84 2hxy s PRO 355 CO 0.32 0.22 2.25 0.09 0.04 0.00 0.00 177.00 179.91 2hxy n ASN 356 N 0.28 7.36 0.00 6.66 3.02 -1.26 -4.59 115.26 126.73 2hxy n ASN 356 Ca 0.03 -3.47 0.00 0.00 -0.03 0.00 0.00 54.58 51.11 2hxy n ASN 356 Cb 0.51 -1.21 0.00 0.00 -0.61 0.00 0.00 39.78 38.47 2hxy n ASN 356 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2hxy n ASN 357 N 0.50 0.00 -3.03 6.41 6.94 -1.26 -5.06 115.26 119.76 2hxy n ASN 357 Ca 0.53 0.00 -0.04 0.00 -0.02 0.00 0.00 54.58 55.05 2hxy n ASN 357 Cb 0.32 0.00 -0.00 0.00 -2.36 0.00 0.00 39.78 37.74 2hxy n ASN 357 CO 0.00 0.00 0.00 -2.11 -1.03 0.00 0.00 177.26 174.12 2hxy n ARG 358 N 0.00 0.32 0.00 -3.83 0.00 -1.26 -2.64 116.66 109.24 2hxy n ARG 358 Ca 0.00 -0.65 0.00 0.00 -0.00 0.00 0.00 57.85 57.20 2hxy n ARG 358 Cb 0.00 -2.07 0.00 0.00 -0.00 0.00 0.00 32.46 30.39 2hxy n ARG 358 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 2hxy n GLU 359 N 4.90 0.00 0.00 2.89 4.07 -1.26 -4.81 120.64 126.44 2hxy n GLU 359 Ca 0.07 -0.13 0.00 0.00 -0.06 0.00 0.00 57.16 57.04 2hxy n GLU 359 Cb 0.02 -0.19 0.00 0.00 -0.06 0.00 0.00 31.44 31.21 2hxy n GLU 359 CO 0.00 0.00 0.00 1.47 -0.06 0.00 0.00 177.13 178.54 2hxy n LEU 360 N 0.00 0.46 0.06 4.31 -0.00 -1.08 -4.25 117.00 116.50 2hxy n LEU 360 Ca 0.00 -0.46 -0.05 0.00 -0.00 0.00 0.00 56.01 55.50 2hxy n LEU 360 Cb 0.42 0.00 0.14 0.00 -0.00 0.00 0.00 43.42 43.98 2hxy n LEU 360 CO 0.00 0.12 0.56 0.22 -0.00 0.00 0.00 177.39 178.28 2hxy h TYR 361 N 0.00 0.43 0.16 1.47 3.20 -1.87 -0.68 116.97 119.67 2hxy h TYR 361 Ca 0.00 -0.14 -0.29 0.00 3.14 0.00 0.00 58.73 61.44 2hxy h TYR 361 Cb 0.32 -0.09 0.01 0.00 1.54 0.00 0.00 36.73 38.51 2hxy h TYR 361 CO 0.00 0.77 -1.32 0.97 -1.64 0.00 0.00 178.16 176.94 2hxy h ILE 362 N 0.28 1.42 -0.89 1.81 -0.00 -1.93 -2.70 117.51 115.50 2hxy h ILE 362 Ca 0.01 -2.97 0.12 0.00 -0.00 0.00 0.00 64.86 62.02 2hxy h ILE 362 Cb 0.96 2.95 -0.07 0.00 -0.00 0.00 0.00 36.82 40.67 2hxy h ILE 362 CO 0.08 0.87 0.57 -0.74 -0.00 0.00 0.00 178.15 178.94 2hxy h HIS 363 N 0.09 0.91 0.19 2.19 2.76 -1.64 0.38 115.15 120.02 2hxy h HIS 363 Ca -0.17 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.02 2hxy h HIS 363 Cb 2.02 -0.29 0.00 0.00 1.55 0.00 0.00 27.41 30.69 2hxy h HIS 363 CO 0.08 0.38 -0.09 0.00 -1.30 0.00 0.00 177.93 177.00 2hxy h ARG 364 N 0.81 -0.24 0.00 5.26 3.08 -1.09 -3.40 114.38 118.80 2hxy h ARG 364 Ca 0.43 0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.47 2hxy h ARG 364 Cb 0.54 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.64 2hxy h ARG 364 CO -0.19 -0.06 -1.03 -0.84 -1.07 0.00 0.00 179.97 176.77 2hxy h ILE 365 N -1.04 0.10 -3.80 2.04 3.07 -1.41 -3.49 117.51 112.97 2hxy h ILE 365 Ca -0.03 -1.19 -0.56 0.00 1.55 0.00 0.00 64.86 64.64 2hxy h ILE 365 Cb 0.29 1.62 0.17 0.00 -0.27 0.00 0.00 36.82 38.63 2hxy h ILE 365 CO 0.04 0.05 0.23 0.61 -1.05 0.00 0.00 178.15 178.04 2hxy n GLY 366 N 1.22 -0.11 0.00 0.16 0.00 0.13 -4.95 105.19 101.64 2hxy n GLY 366 Ca -0.02 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.79 2hxy n GLY 366 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2hxy n ARG 367 N -1.58 1.79 0.11 1.61 1.85 -1.18 -4.85 116.66 114.42 2hxy n ARG 367 Ca 0.14 0.00 0.12 0.00 -1.00 0.00 0.00 57.85 57.11 2hxy n ARG 367 Cb 0.48 0.00 0.08 0.00 -1.05 0.00 0.00 32.46 31.98 2hxy n ARG 367 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 2hxy h SER 368 N 0.00 0.00 0.00 2.89 0.87 -1.85 -2.58 113.55 112.88 2hxy h SER 368 Ca 0.00 -0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.51 2hxy h SER 368 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 2hxy h SER 368 CO 0.00 0.03 0.00 0.61 -0.53 0.00 0.00 176.83 176.94 2hxy n GLY 369 N 1.21 1.56 0.50 5.77 0.00 -1.26 -3.97 105.19 109.00 2hxy n GLY 369 Ca 0.02 -0.00 0.36 0.00 0.00 0.00 0.00 46.02 46.40 2hxy n GLY 369 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2hxy h ARG 370 N 0.00 0.12 0.00 1.61 2.43 -1.95 -1.81 114.38 114.78 2hxy h ARG 370 Ca 0.00 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 2hxy h ARG 370 Cb 0.00 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.47 2hxy h ARG 370 CO 0.00 0.08 -0.39 0.66 -1.51 0.00 0.00 179.97 178.81 2hxy n TYR 371 N -4.50 0.00 -3.78 2.20 4.01 -1.25 -5.09 117.16 108.75 2hxy n TYR 371 Ca 0.34 -0.60 -0.24 0.00 -0.16 0.00 0.00 57.90 57.24 2hxy n TYR 371 Cb 1.38 -0.12 -0.02 0.00 -0.31 0.00 0.00 39.34 40.26 2hxy n TYR 371 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2hxy s GLY 372 N -2.07 1.49 -0.00 2.72 0.00 -0.68 -4.86 107.32 103.92 2hxy s GLY 372 Ca 0.20 -1.02 -0.20 0.00 0.00 0.00 0.00 44.72 43.71 2hxy s GLY 372 CO -0.02 -1.00 0.56 0.50 0.00 0.00 0.00 173.10 173.14 2hxy s ARG 373 N -3.71 4.27 1.37 2.90 0.52 -1.26 -4.75 118.95 118.28 2hxy s ARG 373 Ca 0.36 0.68 -0.20 0.00 -0.52 0.00 0.00 55.73 56.05 2hxy s ARG 373 Cb -0.10 -3.32 0.35 0.00 0.52 0.00 0.00 34.95 32.40 2hxy s ARG 373 CO 0.30 0.42 0.94 0.15 0.02 0.00 0.00 175.30 177.13 2hxy s LYS 374 N -0.33 -2.53 0.00 3.54 1.02 -1.26 -4.88 119.74 115.30 2hxy s LYS 374 Ca 0.29 0.34 0.00 0.00 0.02 0.00 0.00 55.97 56.63 2hxy s LYS 374 Cb -0.18 -1.41 0.00 0.00 -0.52 0.00 0.00 37.83 35.73 2hxy s LYS 374 CO 0.16 -4.67 0.00 0.41 -0.92 0.00 0.00 175.35 170.34 2hxy n GLY 375 N 1.39 -0.59 3.09 -3.33 0.00 -1.21 -4.90 105.19 99.65 2hxy n GLY 375 Ca 0.10 -0.56 -0.09 0.00 0.00 0.00 0.00 46.02 45.46 2hxy n GLY 375 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2hxy s VAL 376 N -3.12 0.13 -0.22 1.61 1.01 -0.05 -2.09 120.40 117.67 2hxy s VAL 376 Ca 0.00 -1.08 -0.07 0.00 0.00 0.00 0.00 61.98 60.83 2hxy s VAL 376 Cb 0.00 -0.80 0.10 0.00 0.00 0.00 0.00 36.38 35.68 2hxy s VAL 376 CO 0.00 -0.59 0.45 0.00 0.00 0.00 0.00 175.10 174.96 2hxy s ALA 377 N -2.41 -1.30 -0.17 5.51 0.00 -0.73 -1.08 121.76 121.58 2hxy s ALA 377 Ca -0.07 1.57 -0.10 0.00 0.00 0.00 0.00 51.96 53.36 2hxy s ALA 377 Cb -0.02 -1.44 -0.05 0.00 0.00 0.00 0.00 23.12 21.61 2hxy s ALA 377 CO -0.04 -0.84 0.16 0.42 0.00 0.00 0.00 175.76 175.46 2hxy s ILE 378 N 2.65 5.41 -0.06 0.00 1.09 -0.41 -1.23 121.20 128.65 2hxy s ILE 378 Ca -0.00 0.25 -0.00 0.00 -1.10 0.00 0.00 60.65 59.80 2hxy s ILE 378 Cb -0.12 -3.48 -0.03 0.00 -1.06 0.00 0.00 42.46 37.77 2hxy s ILE 378 CO -0.14 0.48 -0.03 0.20 -0.10 0.00 0.00 174.94 175.36 2hxy s ASN 379 N -0.01 4.98 -0.83 3.58 0.01 0.53 -1.76 114.94 121.44 2hxy s ASN 379 Ca 0.11 0.05 -0.09 0.00 -0.71 0.00 0.00 52.86 52.22 2hxy s ASN 379 Cb -0.12 -1.32 0.21 0.00 0.41 0.00 0.00 41.25 40.44 2hxy s ASN 379 CO 0.01 0.35 0.74 -0.36 -1.51 0.00 0.00 177.10 176.32 2hxy s PHE 380 N -0.90 3.76 -0.29 2.20 0.40 -0.85 0.18 117.98 122.48 2hxy s PHE 380 Ca 0.14 -2.38 -0.11 0.00 -0.60 0.00 0.00 56.93 53.98 2hxy s PHE 380 Cb -0.11 -3.61 -0.04 0.00 0.51 0.00 0.00 43.02 39.77 2hxy s PHE 380 CO 0.04 -0.92 0.18 0.14 0.70 0.00 0.00 175.22 175.36 2hxy s VAL 381 N -0.26 5.14 0.59 -0.44 -7.23 -1.21 -4.49 120.40 112.50 2hxy s VAL 381 Ca 0.21 0.01 -0.04 0.00 -1.81 0.00 0.00 61.98 60.35 2hxy s VAL 381 Cb -0.12 -3.50 0.02 0.00 0.56 0.00 0.00 36.38 33.34 2hxy s VAL 381 CO -0.08 0.19 0.87 -1.59 -0.31 0.00 0.00 175.10 174.18 2hxy s LYS 382 N 1.73 2.70 0.32 4.82 -2.85 -1.26 -3.58 119.74 121.61 2hxy s LYS 382 Ca 0.07 -0.29 0.08 0.00 -1.00 0.00 0.00 55.97 54.83 2hxy s LYS 382 Cb -0.16 -2.33 0.90 0.00 -2.06 0.00 0.00 37.83 34.18 2hxy s LYS 382 CO 0.10 -0.76 1.64 -0.91 0.10 0.00 0.00 175.35 175.52 2hxy h ASN 383 N -0.14 0.16 0.48 0.03 2.35 -1.73 1.33 115.58 118.07 2hxy h ASN 383 Ca -0.45 0.21 0.00 0.00 -0.55 0.00 0.00 56.30 55.51 2hxy h ASN 383 Cb 1.28 0.24 0.00 0.00 0.05 0.00 0.00 38.32 39.89 2hxy h ASN 383 CO 0.58 -0.19 0.00 0.47 -1.65 0.00 0.00 177.43 176.64 2hxy n ASP 384 N -5.19 0.39 -0.08 5.81 8.00 -1.26 -2.56 116.55 121.66 2hxy n ASP 384 Ca 0.27 0.62 0.02 0.00 0.71 0.00 0.00 54.79 56.40 2hxy n ASP 384 Cb 0.85 -0.69 -0.00 0.00 -0.02 0.00 0.00 41.12 41.25 2hxy n ASP 384 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2hxy n ASP 385 N -1.95 0.73 0.11 -2.24 8.00 0.43 -4.44 116.55 117.18 2hxy n ASP 385 Ca 0.02 -0.86 0.20 0.00 0.71 0.00 0.00 54.79 54.85 2hxy n ASP 385 Cb 0.16 0.53 0.74 0.00 -0.02 0.00 0.00 41.12 42.53 2hxy n ASP 385 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 2hxy h ILE 386 N 0.39 0.31 0.31 0.53 6.09 -0.41 0.26 117.51 124.99 2hxy h ILE 386 Ca 0.00 0.00 -0.02 0.00 -1.37 0.00 0.00 64.86 63.47 2hxy h ILE 386 Cb 0.13 0.62 0.00 0.00 0.47 0.00 0.00 36.82 38.04 2hxy h ILE 386 CO 0.00 0.00 -0.15 -0.09 -3.07 0.00 0.00 178.15 174.84 2hxy h ARG 387 N 0.00 -0.40 -1.08 2.19 2.43 -1.78 -2.99 114.38 112.75 2hxy h ARG 387 Ca 0.18 0.03 0.31 0.00 -0.81 0.00 0.00 59.98 59.69 2hxy h ARG 387 Cb 1.10 0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 30.70 2hxy h ARG 387 CO -0.00 -0.27 0.85 0.82 -1.51 0.00 0.00 179.97 179.86 2hxy h ILE 388 N -1.08 0.33 -0.19 1.20 2.04 -1.46 1.30 117.51 119.66 2hxy h ILE 388 Ca -0.04 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.80 2hxy h ILE 388 Cb 0.32 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 2hxy h ILE 388 CO 0.07 0.00 0.06 0.25 0.00 0.00 0.00 178.15 178.53 2hxy h LEU 389 N 0.00 0.28 -0.34 1.44 5.85 -1.01 -2.33 115.31 119.21 2hxy h LEU 389 Ca 0.51 -0.21 0.02 0.00 0.84 0.00 0.00 57.88 59.04 2hxy h LEU 389 Cb 2.21 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 43.15 2hxy h LEU 389 CO -0.01 0.41 0.18 0.03 -0.34 0.00 0.00 178.44 178.72 2hxy h ARG 390 N 0.13 0.37 -0.82 1.25 2.47 0.18 -1.14 114.38 116.82 2hxy h ARG 390 Ca 0.06 -0.02 0.11 0.00 -1.26 0.00 0.00 59.98 58.87 2hxy h ARG 390 Cb 0.24 -0.08 -0.06 0.00 -1.65 0.00 0.00 29.97 28.42 2hxy h ARG 390 CO -0.00 0.24 0.53 -0.44 0.56 0.00 0.00 179.97 180.87 2hxy h ASP 391 N 0.38 0.63 -0.17 7.04 3.32 -1.28 0.29 116.42 126.64 2hxy h ASP 391 Ca 0.14 0.02 -0.12 0.00 0.02 0.00 0.00 57.03 57.09 2hxy h ASP 391 Cb 0.02 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.47 2hxy h ASP 391 CO -0.08 0.36 -0.37 0.40 -1.72 0.00 0.00 179.24 177.83 2hxy h ILE 392 N 0.69 1.35 -0.52 0.35 2.04 -0.84 0.11 117.51 120.69 2hxy h ILE 392 Ca 0.39 -1.63 0.01 0.00 1.00 0.00 0.00 64.86 64.64 2hxy h ILE 392 Cb 0.56 1.96 -0.03 0.00 -0.74 0.00 0.00 36.82 38.58 2hxy h ILE 392 CO -0.16 0.50 0.34 -0.08 0.00 0.00 0.00 178.15 178.74 2hxy h GLU 393 N 0.19 0.66 -0.14 2.37 4.81 -0.30 -2.14 114.58 120.04 2hxy h GLU 393 Ca 0.00 -0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 59.07 2hxy h GLU 393 Cb 0.98 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.20 2hxy h GLU 393 CO 0.08 0.44 -0.44 1.96 -0.73 0.00 0.00 179.01 180.32 2hxy h GLN 394 N 0.68 0.33 0.48 1.92 1.08 -0.36 -2.13 115.11 117.10 2hxy h GLN 394 Ca 0.20 -0.17 -0.02 0.00 -1.45 0.00 0.00 58.65 57.21 2hxy h GLN 394 Cb -0.05 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.39 2hxy h GLN 394 CO -0.06 0.71 -0.23 -0.92 -0.95 0.00 0.00 178.83 177.38 2hxy h TYR 395 N 0.27 -0.60 -0.08 2.96 3.20 -0.15 -3.04 116.97 119.54 2hxy h TYR 395 Ca 0.02 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.88 2hxy h TYR 395 Cb 0.89 0.20 0.00 0.00 1.54 0.00 0.00 36.73 39.36 2hxy h TYR 395 CO 0.02 -0.29 0.00 0.66 -1.64 0.00 0.00 178.16 176.91 2hxy n TYR 396 N -5.29 0.10 -3.91 -3.82 4.02 -0.88 -4.89 117.16 102.49 2hxy n TYR 396 Ca -0.11 -0.05 -0.29 0.00 -0.01 0.00 0.00 57.90 57.44 2hxy n TYR 396 Cb 0.31 0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 39.62 2hxy n TYR 396 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 2hxy n SER 397 N -0.28 -1.85 -4.31 7.72 7.64 -0.94 -4.96 113.62 116.63 2hxy n SER 397 Ca 0.14 -1.05 -0.28 0.00 1.01 0.00 0.00 58.87 58.69 2hxy n SER 397 Cb 0.18 -2.95 -0.08 0.00 -1.01 0.00 0.00 64.21 60.35 2hxy n SER 397 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2hxy s THR 398 N -3.82 0.77 -0.09 0.44 -1.32 -0.85 -5.05 115.64 105.72 2hxy s THR 398 Ca 0.17 -2.00 0.04 0.00 -1.21 0.00 0.00 61.69 58.69 2hxy s THR 398 Cb -0.07 -2.27 -0.00 0.00 -1.51 0.00 0.00 72.50 68.65 2hxy s THR 398 CO 0.89 0.00 -0.23 -1.58 -2.21 0.00 0.00 174.62 171.49 2hxy s GLN 399 N -3.75 2.80 -0.29 7.08 0.74 -1.26 -4.68 119.66 120.29 2hxy s GLN 399 Ca 0.17 -0.84 0.03 0.00 0.05 0.00 0.00 55.36 54.77 2hxy s GLN 399 Cb 0.02 -2.18 0.08 0.00 1.10 0.00 0.00 33.01 32.03 2hxy s GLN 399 CO 0.11 0.21 -0.04 0.42 -0.55 0.00 0.00 175.29 175.44 2hxy s ILE 400 N 0.25 2.16 0.67 -2.34 1.01 -1.26 -4.51 121.20 117.18 2hxy s ILE 400 Ca -0.15 -1.89 -0.04 0.00 0.00 0.00 0.00 60.65 58.56 2hxy s ILE 400 Cb -0.17 -2.41 0.06 0.00 0.01 0.00 0.00 42.46 39.96 2hxy s ILE 400 CO 0.07 -0.27 0.96 -1.81 0.00 0.00 0.00 174.94 173.90 2hxy s ASP 401 N 1.04 4.85 0.21 3.58 1.01 -0.71 -4.77 116.67 121.88 2hxy s ASP 401 Ca -0.01 0.27 -0.16 0.00 0.71 0.00 0.00 52.55 53.36 2hxy s ASP 401 Cb -0.20 -0.94 -0.08 0.00 1.01 0.00 0.00 42.92 42.72 2hxy s ASP 401 CO -0.07 -1.53 0.64 -0.70 0.21 0.00 0.00 175.17 173.72 2hxy s GLU 402 N -5.13 4.07 0.08 8.23 2.12 -1.26 0.09 118.70 126.90 2hxy s GLU 402 Ca 0.60 0.64 -0.33 0.00 0.36 0.00 0.00 54.97 56.24 2hxy s GLU 402 Cb -0.10 -2.81 -0.12 0.00 0.26 0.00 0.00 34.13 31.35 2hxy s GLU 402 CO 0.43 0.39 1.76 -1.33 -0.54 0.00 0.00 175.26 175.97 2hxy n MET 403 N 0.52 2.42 -2.86 4.30 2.81 -0.85 -4.80 117.12 118.66 2hxy n MET 403 Ca -0.02 0.88 -0.28 0.00 -1.81 0.00 0.00 57.70 56.47 2hxy n MET 403 Cb 0.52 -2.72 -0.01 0.00 -0.71 0.00 0.00 33.22 30.30 2hxy n MET 403 CO 0.00 0.00 0.00 -2.14 1.51 0.00 0.00 175.97 175.34 2hxy s PRO 404 N 2.43 3.61 0.30 0.03 0.02 -1.26 -4.93 135.00 135.20 2hxy s PRO 404 Ca 0.84 0.19 0.05 0.00 0.02 0.00 0.00 61.00 62.09 2hxy s PRO 404 Cb -0.60 -2.45 0.70 0.00 0.02 0.00 0.00 34.50 32.17 2hxy s PRO 404 CO 0.41 -0.07 1.79 0.52 -0.33 0.00 0.00 177.00 179.32 2hxy h MET 405 N 0.73 0.79 -5.14 5.54 2.86 -2.06 -3.38 114.93 114.28 2hxy h MET 405 Ca -0.47 -0.05 -0.17 0.00 -2.06 0.00 0.00 59.70 56.95 2hxy h MET 405 Cb 1.20 -0.18 -0.06 0.00 0.06 0.00 0.00 31.60 32.63 2hxy h MET 405 CO 0.63 0.52 1.02 0.09 1.06 0.00 0.00 176.91 180.23 2hxy n ASN 406 N -4.73 -0.04 -0.02 1.22 3.02 -1.26 -4.63 115.26 108.82 2hxy n ASN 406 Ca 0.22 -1.12 0.11 0.00 -0.03 0.00 0.00 54.58 53.77 2hxy n ASN 406 Cb 0.52 -1.06 0.05 0.00 -0.61 0.00 0.00 39.78 38.68 2hxy n ASN 406 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 2hxy n VAL 407 N 6.97 0.00 1.08 2.41 0.24 -1.26 -3.81 118.33 123.96 2hxy n VAL 407 Ca 0.53 -0.01 0.04 0.00 -2.04 0.00 0.00 64.34 62.85 2hxy n VAL 407 Cb 0.30 0.68 0.22 0.00 -1.47 0.00 0.00 33.84 33.58 2hxy n VAL 407 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2hxy n ALA 408 N -1.43 2.09 0.95 2.33 0.00 -1.26 -0.69 120.51 122.51 2hxy n ALA 408 Ca 0.05 -0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.57 2hxy n ALA 408 Cb 0.34 -1.12 0.23 0.00 0.00 0.00 0.00 19.45 18.89 2hxy n ALA 408 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2hxy n ASP 409 N -0.72 2.72 -1.22 0.00 8.00 -1.25 -3.64 116.55 120.45 2hxy n ASP 409 Ca 0.06 -1.88 0.06 0.00 0.71 0.00 0.00 54.79 53.74 2hxy n ASP 409 Cb 0.03 -0.07 0.26 0.00 -0.02 0.00 0.00 41.12 41.31 2hxy n ASP 409 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 2hxy n LEU 410 N 1.08 3.55 -0.31 0.64 0.00 0.14 -4.26 117.00 117.85 2hxy n LEU 410 Ca 0.16 -1.79 -0.04 0.00 0.00 0.00 0.00 56.01 54.34 2hxy n LEU 410 Cb 0.53 -0.49 0.07 0.00 0.00 0.00 0.00 43.42 43.54 2hxy n LEU 410 CO 0.15 0.59 1.15 0.40 0.00 0.00 0.00 177.39 179.69 2hxy h ILE 411 N 2.88 1.24 -1.19 1.96 2.04 -1.77 -3.45 117.51 119.22 2hxy h ILE 411 Ca 0.00 -0.59 -0.80 0.00 1.00 0.00 0.00 64.86 64.47 2hxy h ILE 411 Cb 1.13 0.12 0.03 0.00 -0.74 0.00 0.00 36.82 37.35 2hxy h ILE 411 CO 0.18 0.27 0.53 0.00 0.00 0.00 0.00 178.15 179.12 2hxy n LEU 412 N -4.40 1.15 0.00 1.44 -0.00 -1.26 -5.21 117.00 108.72 2hxy n LEU 412 Ca 0.08 1.15 0.00 0.00 -0.00 0.00 0.00 56.01 57.24 2hxy n LEU 412 Cb 0.09 -0.98 0.00 0.00 -0.00 0.00 0.00 43.42 42.53 2hxy n LEU 412 CO 0.38 -1.09 0.00 -0.62 -0.00 0.00 0.00 177.39 176.07