#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cx6 s LEU 48 N 0.00 3.20 -0.49 6.15 2.96 -1.26 -4.57 118.68 124.66 3cx6 s LEU 48 Ca 0.00 -0.20 -0.13 0.00 -0.22 0.00 0.00 54.13 53.58 3cx6 s LEU 48 Cb 0.00 -1.89 0.11 0.00 0.50 0.00 0.00 46.19 44.91 3cx6 s LEU 48 CO 0.00 0.24 0.40 -0.69 -1.32 0.00 0.00 176.35 174.98 3cx6 s VAL 49 N -1.10 4.80 -0.34 1.68 1.01 -0.94 -4.90 120.40 120.60 3cx6 s VAL 49 Ca 0.20 -1.48 -0.15 0.00 0.00 0.00 0.00 61.98 60.55 3cx6 s VAL 49 Cb -0.11 -4.04 -0.01 0.00 0.00 0.00 0.00 36.38 32.22 3cx6 s VAL 49 CO 0.11 -0.74 0.35 -0.75 0.00 0.00 0.00 175.10 174.08 3cx6 s LYS 50 N 1.52 3.56 -0.13 2.72 2.20 -1.26 -1.13 119.74 127.22 3cx6 s LYS 50 Ca 0.04 -0.43 -0.01 0.00 -0.36 0.00 0.00 55.97 55.21 3cx6 s LYS 50 Cb -0.27 -3.80 -0.02 0.00 -1.51 0.00 0.00 37.83 32.23 3cx6 s LYS 50 CO 0.03 -0.52 -0.12 0.42 -0.36 0.00 0.00 175.35 174.80 3cx6 s ILE 51 N 1.99 3.19 -0.14 5.43 1.01 -0.15 -0.92 121.20 131.62 3cx6 s ILE 51 Ca 0.11 -0.62 -0.07 0.00 0.00 0.00 0.00 60.65 60.08 3cx6 s ILE 51 Cb -0.17 -2.34 -0.04 0.00 0.01 0.00 0.00 42.46 39.92 3cx6 s ILE 51 CO 0.12 0.52 0.10 -0.76 0.00 0.00 0.00 174.94 174.92 3cx6 s LEU 52 N 0.29 4.11 -0.39 2.97 1.43 -0.45 -0.82 118.68 125.82 3cx6 s LEU 52 Ca -0.09 0.30 -0.12 0.00 -1.03 0.00 0.00 54.13 53.19 3cx6 s LEU 52 Cb -0.15 -2.01 0.03 0.00 0.03 0.00 0.00 46.19 44.09 3cx6 s LEU 52 CO 0.05 0.33 0.25 -0.76 0.23 0.00 0.00 176.35 176.45 3cx6 s LEU 53 N -0.54 4.92 0.26 1.79 1.43 -0.08 -0.42 118.68 126.03 3cx6 s LEU 53 Ca 0.12 -1.03 0.10 0.00 -1.03 0.00 0.00 54.13 52.29 3cx6 s LEU 53 Cb -0.12 -2.07 -0.05 0.00 0.03 0.00 0.00 46.19 43.99 3cx6 s LEU 53 CO 0.02 -0.43 -0.09 -0.76 0.23 0.00 0.00 176.35 175.31 3cx6 s LEU 54 N 1.58 2.92 0.00 1.79 1.43 -0.68 -4.04 118.68 121.68 3cx6 s LEU 54 Ca 0.03 -0.79 0.00 0.00 -1.03 0.00 0.00 54.13 52.34 3cx6 s LEU 54 Cb -0.20 -1.46 0.00 0.00 0.03 0.00 0.00 46.19 44.56 3cx6 s LEU 54 CO 0.07 0.03 0.00 0.61 0.23 0.00 0.00 176.35 177.29 3cx6 n GLY 55 N -0.66 3.76 3.49 -3.19 0.00 -1.26 -1.00 105.19 106.33 3cx6 n GLY 55 Ca -0.07 -1.10 -0.29 0.00 0.00 0.00 0.00 46.02 44.56 3cx6 n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cx6 s ALA 56 N -2.00 -0.07 0.54 4.61 0.00 -1.26 -4.17 121.76 119.41 3cx6 s ALA 56 Ca 0.00 -0.62 -0.22 0.00 0.00 0.00 0.00 51.96 51.12 3cx6 s ALA 56 Cb 0.00 -3.03 -0.06 0.00 0.00 0.00 0.00 23.12 20.04 3cx6 s ALA 56 CO 0.00 -3.88 1.24 0.41 0.00 0.00 0.00 175.76 173.53 3cx6 n GLY 57 N 0.20 0.44 3.34 0.00 0.00 -0.57 -3.12 105.19 105.47 3cx6 n GLY 57 Ca 0.09 0.01 -0.24 0.00 0.00 0.00 0.00 46.02 45.88 3cx6 n GLY 57 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3cx6 n GLU 58 N -0.84 -5.64 0.02 1.61 1.02 -1.26 -4.88 120.64 110.67 3cx6 n GLU 58 Ca 0.11 0.80 0.11 0.00 -0.02 0.00 0.00 57.16 58.15 3cx6 n GLU 58 Cb 0.44 -5.70 -0.08 0.00 -0.02 0.00 0.00 31.44 26.08 3cx6 n GLU 58 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3cx6 n SER 59 N -2.67 0.45 0.00 1.62 3.41 -1.18 -4.73 113.62 110.52 3cx6 n SER 59 Ca -0.05 -0.18 0.00 0.00 -0.26 0.00 0.00 58.87 58.38 3cx6 n SER 59 Cb 0.58 1.28 0.00 0.00 -0.26 0.00 0.00 64.21 65.81 3cx6 n SER 59 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3cx6 n GLY 60 N 1.32 1.53 0.42 5.00 0.00 -1.26 -4.31 105.19 107.89 3cx6 n GLY 60 Ca -0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 3cx6 n GLY 60 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3cx6 h LYS 61 N 0.04 -0.99 -0.51 1.61 1.57 -1.93 -1.28 116.57 115.08 3cx6 h LYS 61 Ca 0.00 0.07 0.11 0.00 -1.87 0.00 0.00 60.65 58.96 3cx6 h LYS 61 Cb 0.00 0.23 -0.03 0.00 0.08 0.00 0.00 32.23 32.51 3cx6 h LYS 61 CO 0.00 -0.66 0.35 0.77 -0.57 0.00 0.00 179.45 179.34 3cx6 h SER 62 N -1.04 0.17 -0.24 0.86 0.02 -1.95 -1.52 113.55 109.84 3cx6 h SER 62 Ca -0.11 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.70 3cx6 h SER 62 Cb 0.79 -0.03 -0.00 0.00 0.14 0.00 0.00 62.40 63.30 3cx6 h SER 62 CO 0.17 0.10 -0.42 0.74 -1.14 0.00 0.00 176.83 176.29 3cx6 h THR 63 N 0.18 1.31 -0.18 -2.27 2.02 -1.82 -2.44 112.91 109.71 3cx6 h THR 63 Ca 0.24 -1.62 0.00 0.00 0.77 0.00 0.00 66.41 65.80 3cx6 h THR 63 Cb 0.70 1.74 -0.01 0.00 -1.74 0.00 0.00 68.15 68.84 3cx6 h THR 63 CO -0.04 0.51 0.12 0.15 0.37 0.00 0.00 175.52 176.63 3cx6 h PHE 64 N 0.43 0.22 -0.94 3.16 3.57 -0.27 -1.51 116.94 121.60 3cx6 h PHE 64 Ca 0.02 0.00 0.14 0.00 3.53 0.00 0.00 57.97 61.66 3cx6 h PHE 64 Cb 1.01 -0.07 -0.09 0.00 2.79 0.00 0.00 35.95 39.59 3cx6 h PHE 64 CO 0.08 0.14 0.56 1.25 -2.23 0.00 0.00 178.31 178.11 3cx6 h LEU 65 N 0.24 0.76 -1.06 0.59 7.12 -1.33 0.87 115.31 122.48 3cx6 h LEU 65 Ca 0.06 0.07 -0.09 0.00 0.13 0.00 0.00 57.88 58.06 3cx6 h LEU 65 Cb -0.02 -0.07 -0.01 0.00 -0.53 0.00 0.00 40.66 40.03 3cx6 h LEU 65 CO -0.01 0.35 -0.33 0.11 -0.13 0.00 0.00 178.44 178.42 3cx6 h LYS 66 N 0.81 0.24 -0.42 1.25 1.57 -0.87 -2.68 116.57 116.48 3cx6 h LYS 66 Ca 0.50 -0.10 -0.11 0.00 -1.87 0.00 0.00 60.65 59.07 3cx6 h LYS 66 Cb 0.63 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.91 3cx6 h LYS 66 CO -0.32 0.55 -0.18 1.96 -0.57 0.00 0.00 179.45 180.89 3cx6 h GLN 67 N 0.21 0.81 -0.69 3.15 1.08 0.12 -1.74 115.11 118.06 3cx6 h GLN 67 Ca 0.03 -0.31 0.00 0.00 -1.45 0.00 0.00 58.65 56.92 3cx6 h GLN 67 Cb 0.70 -0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 28.05 3cx6 h GLN 67 CO 0.05 0.93 0.44 0.52 -0.95 0.00 0.00 178.83 179.83 3cx6 h MET 68 N 0.72 0.92 -0.46 1.46 2.86 -0.96 0.60 114.93 120.05 3cx6 h MET 68 Ca 0.11 -0.06 -0.07 0.00 -2.06 0.00 0.00 59.70 57.61 3cx6 h MET 68 Cb 0.70 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 32.13 3cx6 h MET 68 CO 0.05 0.62 0.00 -0.09 1.06 0.00 0.00 176.91 178.56 3cx6 h ARG 69 N 0.94 0.76 -0.15 1.72 2.43 -1.30 0.44 114.38 119.23 3cx6 h ARG 69 Ca 0.25 -0.20 -0.10 0.00 -0.81 0.00 0.00 59.98 59.12 3cx6 h ARG 69 Cb -0.08 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.38 3cx6 h ARG 69 CO -0.05 0.77 -0.30 0.82 -1.51 0.00 0.00 179.97 179.69 3cx6 h ILE 70 N 0.72 1.36 0.14 1.20 2.04 -0.48 -0.71 117.51 121.77 3cx6 h ILE 70 Ca 0.14 -1.57 -0.18 0.00 1.00 0.00 0.00 64.86 64.25 3cx6 h ILE 70 Cb 0.43 2.01 0.02 0.00 -0.74 0.00 0.00 36.82 38.54 3cx6 h ILE 70 CO 0.02 0.47 -0.79 0.40 0.00 0.00 0.00 178.15 178.24 3cx6 h ILE 71 N 0.08 1.52 -0.00 -0.67 2.04 0.32 -3.42 117.51 117.38 3cx6 h ILE 71 Ca 0.00 -2.53 0.00 0.00 1.00 0.00 0.00 64.86 63.33 3cx6 h ILE 71 Cb 0.90 3.21 0.00 0.00 -0.74 0.00 0.00 36.82 40.19 3cx6 h ILE 71 CO 0.07 0.71 -0.24 1.41 0.00 0.00 0.00 178.15 180.10 3cx6 n HIS 72 N -4.14 0.00 -1.20 1.37 8.25 0.15 -5.05 115.22 114.60 3cx6 n HIS 72 Ca -0.14 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.32 3cx6 n HIS 72 Cb 0.81 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.92 3cx6 n HIS 72 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3cx6 n GLY 73 N 1.08 2.42 0.09 -1.41 0.00 -0.70 -4.51 105.19 102.16 3cx6 n GLY 73 Ca 0.01 -1.89 0.13 0.00 0.00 0.00 0.00 46.02 44.27 3cx6 n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cx6 n GLN 74 N 0.00 0.22 0.00 1.61 0.00 -1.19 -4.82 117.38 113.19 3cx6 n GLN 74 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 57.00 57.18 3cx6 n GLN 74 Cb 0.00 -1.75 0.00 0.00 0.00 0.00 0.00 30.24 28.49 3cx6 n GLN 74 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 3cx6 n ASP 75 N -2.13 -0.31 -4.09 2.61 -0.08 -0.36 -4.80 116.55 107.40 3cx6 n ASP 75 Ca 0.06 0.00 -0.33 0.00 -1.51 0.00 0.00 54.79 53.01 3cx6 n ASP 75 Cb 0.41 0.00 -0.15 0.00 2.34 0.00 0.00 41.12 43.73 3cx6 n ASP 75 CO 0.00 0.00 0.00 -0.36 0.12 0.00 0.00 177.20 176.96 3cx6 s PHE 76 N 0.00 3.30 0.82 -0.67 0.40 -1.26 -4.87 117.98 115.70 3cx6 s PHE 76 Ca 0.00 -2.27 -0.12 0.00 -0.60 0.00 0.00 56.93 53.94 3cx6 s PHE 76 Cb 0.00 -2.03 0.09 0.00 0.51 0.00 0.00 43.02 41.59 3cx6 s PHE 76 CO 0.00 -0.87 1.15 0.16 0.70 0.00 0.00 175.22 176.36 3cx6 s ASP 77 N 1.13 4.33 0.34 1.36 1.47 -1.26 -4.69 116.67 119.35 3cx6 s ASP 77 Ca -0.07 0.92 0.14 0.00 1.18 0.00 0.00 52.55 54.72 3cx6 s ASP 77 Cb -0.20 -1.50 1.05 0.00 -0.34 0.00 0.00 42.92 41.93 3cx6 s ASP 77 CO -0.04 -2.03 1.69 1.56 0.68 0.00 0.00 175.17 177.02 3cx6 h GLN 78 N -1.14 0.38 -0.01 2.11 4.20 -1.98 0.66 115.11 119.34 3cx6 h GLN 78 Ca -0.47 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.21 3cx6 h GLN 78 Cb 1.32 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 29.01 3cx6 h GLN 78 CO 0.64 0.25 0.00 -0.09 -0.67 0.00 0.00 178.83 178.96 3cx6 h ARG 79 N 0.39 0.01 0.00 1.46 9.65 -1.99 -0.74 114.38 123.16 3cx6 h ARG 79 Ca 0.71 -0.00 -0.04 0.00 -1.10 0.00 0.00 59.98 59.55 3cx6 h ARG 79 Cb 1.57 -0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 30.15 3cx6 h ARG 79 CO -0.55 0.25 -0.17 0.00 2.80 0.00 0.00 179.97 182.30 3cx6 h ALA 80 N 0.75 1.51 0.05 2.80 0.00 -1.29 -2.00 119.26 121.08 3cx6 h ALA 80 Ca 0.00 -0.16 -0.23 0.00 0.00 0.00 0.00 54.91 54.53 3cx6 h ALA 80 Cb 0.25 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3cx6 h ALA 80 CO 0.00 0.22 -1.04 0.00 0.00 0.00 0.00 179.25 178.43 3cx6 h ARG 81 N 0.00 0.15 0.00 0.00 3.08 -0.90 -3.18 114.38 113.53 3cx6 h ARG 81 Ca -0.00 -0.23 -0.00 0.00 0.07 0.00 0.00 59.98 59.82 3cx6 h ARG 81 Cb 0.35 0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.48 3cx6 h ARG 81 CO 0.02 1.06 -0.02 1.49 -1.07 0.00 0.00 179.97 181.45 3cx6 h GLU 82 N 0.06 0.00 0.00 0.04 4.81 -0.36 -1.36 114.58 117.76 3cx6 h GLU 82 Ca -0.06 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 3cx6 h GLU 82 Cb 1.75 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.13 3cx6 h GLU 82 CO 0.16 0.02 0.00 0.39 -0.73 0.00 0.00 179.01 178.84 3cx6 n GLU 83 N -3.91 0.06 0.08 1.92 1.02 -1.13 -2.83 120.64 115.84 3cx6 n GLU 83 Ca -0.03 0.09 0.12 0.00 -0.02 0.00 0.00 57.16 57.32 3cx6 n GLU 83 Cb 0.10 -1.50 0.06 0.00 -0.02 0.00 0.00 31.44 30.08 3cx6 n GLU 83 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 3cx6 n PHE 84 N -1.46 0.71 -0.17 -0.32 3.01 -0.51 -4.29 117.46 114.43 3cx6 n PHE 84 Ca 0.07 0.21 -0.01 0.00 1.01 0.00 0.00 57.45 58.72 3cx6 n PHE 84 Cb 0.26 -0.77 0.07 0.00 -0.01 0.00 0.00 39.48 39.03 3cx6 n PHE 84 CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 3cx6 h ARG 85 N 0.00 0.16 -0.26 -1.08 2.43 -1.63 0.15 114.38 114.15 3cx6 h ARG 85 Ca 0.00 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 3cx6 h ARG 85 Cb 0.87 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.37 3cx6 h ARG 85 CO 0.00 0.10 0.12 -1.35 -1.51 0.00 0.00 179.97 177.33 3cx6 h PRO 86 N 0.16 0.35 -0.19 0.20 0.11 -1.79 0.11 132.00 130.96 3cx6 h PRO 86 Ca 0.27 -0.03 -0.19 0.00 0.11 0.00 0.00 66.00 66.16 3cx6 h PRO 86 Cb 0.40 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 31.44 3cx6 h PRO 86 CO -0.41 0.28 -0.64 1.15 -0.21 0.00 0.00 178.00 178.18 3cx6 h THR 87 N 0.36 1.31 -0.29 -1.15 2.02 -1.06 -2.11 112.91 111.99 3cx6 h THR 87 Ca 0.09 -1.88 -0.16 0.00 0.77 0.00 0.00 66.41 65.23 3cx6 h THR 87 Cb 0.05 1.84 -0.00 0.00 -1.74 0.00 0.00 68.15 68.31 3cx6 h THR 87 CO -0.01 0.59 -0.44 0.40 0.37 0.00 0.00 175.52 176.43 3cx6 h ILE 88 N 0.49 1.29 0.00 3.11 2.04 0.17 -0.33 117.51 124.27 3cx6 h ILE 88 Ca -0.01 -1.63 -0.05 0.00 1.00 0.00 0.00 64.86 64.17 3cx6 h ILE 88 Cb 1.22 1.62 -0.01 0.00 -0.74 0.00 0.00 36.82 38.91 3cx6 h ILE 88 CO 0.13 0.53 -0.24 1.88 0.00 0.00 0.00 178.15 180.45 3cx6 h TYR 89 N 0.58 0.00 0.03 1.37 0.05 -0.83 -2.29 116.97 115.87 3cx6 h TYR 89 Ca 0.03 0.00 -0.25 0.00 0.05 0.00 0.00 58.73 58.56 3cx6 h TYR 89 Cb 1.04 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.79 3cx6 h TYR 89 CO 0.07 0.24 -1.02 1.03 -1.05 0.00 0.00 178.16 177.43 3cx6 h SER 90 N 0.00 0.62 -0.09 3.88 0.87 -1.17 -2.33 113.55 115.34 3cx6 h SER 90 Ca -0.00 -0.52 0.01 0.00 -1.23 0.00 0.00 61.79 60.04 3cx6 h SER 90 Cb 0.60 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.36 3cx6 h SER 90 CO 0.03 1.33 0.04 0.78 -0.53 0.00 0.00 176.83 178.48 3cx6 h ASN 91 N 0.25 0.05 0.40 6.23 -0.26 -0.56 -1.57 115.58 120.11 3cx6 h ASN 91 Ca -0.10 0.01 -0.02 0.00 -0.56 0.00 0.00 56.30 55.63 3cx6 h ASN 91 Cb 1.67 -0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 38.93 3cx6 h ASN 91 CO 0.18 0.04 -0.22 0.58 -1.06 0.00 0.00 177.43 176.95 3cx6 h VAL 92 N 0.08 0.54 0.00 2.81 2.07 -1.45 0.13 116.25 120.44 3cx6 h VAL 92 Ca 0.04 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.56 3cx6 h VAL 92 Cb 0.01 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 30.32 3cx6 h VAL 92 CO -0.03 0.00 -0.00 0.40 0.02 0.00 0.00 177.57 177.95 3cx6 h ILE 93 N -0.58 1.04 -0.34 4.57 2.04 -1.40 -1.43 117.51 121.41 3cx6 h ILE 93 Ca -0.05 -0.14 -0.08 0.00 1.00 0.00 0.00 64.86 65.59 3cx6 h ILE 93 Cb 0.47 1.14 -0.02 0.00 -0.74 0.00 0.00 36.82 37.67 3cx6 h ILE 93 CO 0.06 0.04 -0.12 0.11 0.00 0.00 0.00 178.15 178.23 3cx6 h LYS 94 N -0.06 0.60 -0.32 2.37 1.57 -1.29 -1.87 116.57 117.57 3cx6 h LYS 94 Ca -0.00 -0.19 -0.12 0.00 -1.87 0.00 0.00 60.65 58.47 3cx6 h LYS 94 Cb 0.06 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 3cx6 h LYS 94 CO 0.00 0.71 -0.31 0.78 -0.57 0.00 0.00 179.45 180.07 3cx6 h GLY 95 N 0.96 0.74 1.60 3.86 0.00 -0.59 -2.46 103.07 107.18 3cx6 h GLY 95 Ca 0.10 -0.68 -0.15 0.00 0.00 0.00 0.00 47.33 46.60 3cx6 h GLY 95 CO 0.03 0.62 -0.54 1.98 0.00 0.00 0.00 176.54 178.63 3cx6 h MET 96 N 0.58 0.43 -0.79 4.80 1.85 -1.06 -2.12 114.93 118.62 3cx6 h MET 96 Ca 0.07 -0.26 -0.04 0.00 -0.61 0.00 0.00 59.70 58.86 3cx6 h MET 96 Cb 0.81 0.03 -0.04 0.00 0.43 0.00 0.00 31.60 32.84 3cx6 h MET 96 CO 0.07 0.86 0.35 0.00 -0.40 0.00 0.00 176.91 177.78 3cx6 h ARG 97 N 0.33 1.16 -0.64 0.39 3.08 -1.13 -1.04 114.38 116.53 3cx6 h ARG 97 Ca 0.01 -0.19 -0.06 0.00 0.07 0.00 0.00 59.98 59.81 3cx6 h ARG 97 Cb 1.05 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 30.87 3cx6 h ARG 97 CO 0.09 0.92 0.17 0.28 -1.07 0.00 0.00 179.97 180.36 3cx6 h VAL 98 N 1.14 1.24 -0.07 2.04 2.07 -1.23 -1.86 116.25 119.59 3cx6 h VAL 98 Ca 0.27 -0.87 -0.00 0.00 0.82 0.00 0.00 66.70 66.91 3cx6 h VAL 98 Cb 0.16 0.57 -0.00 0.00 -1.52 0.00 0.00 31.29 30.50 3cx6 h VAL 98 CO -0.03 0.33 0.03 -0.07 0.02 0.00 0.00 177.57 177.85 3cx6 h LEU 99 N 0.95 0.10 -1.05 2.57 4.07 -0.59 -0.93 115.31 120.43 3cx6 h LEU 99 Ca 0.21 -0.17 -0.09 0.00 0.08 0.00 0.00 57.88 57.90 3cx6 h LEU 99 Cb 0.31 -0.03 -0.01 0.00 1.08 0.00 0.00 40.66 42.01 3cx6 h LEU 99 CO -0.00 0.24 -0.32 -0.37 -1.08 0.00 0.00 178.44 176.91 3cx6 h VAL 100 N -0.05 1.27 -0.44 1.22 -1.51 -1.13 -1.06 116.25 114.54 3cx6 h VAL 100 Ca 0.02 -1.30 -0.10 0.00 -1.23 0.00 0.00 66.70 64.09 3cx6 h VAL 100 Cb 0.18 1.51 -0.02 0.00 -2.13 0.00 0.00 31.29 30.83 3cx6 h VAL 100 CO -0.00 0.40 -0.12 -0.78 -1.23 0.00 0.00 177.57 175.83 3cx6 h ASP 101 N 0.25 0.80 0.37 4.19 1.82 -1.18 -2.42 116.42 120.25 3cx6 h ASP 101 Ca 0.03 -0.25 -0.14 0.00 -0.39 0.00 0.00 57.03 56.28 3cx6 h ASP 101 Cb 0.68 -0.22 -0.01 0.00 0.68 0.00 0.00 39.33 40.47 3cx6 h ASP 101 CO 0.05 0.94 -0.60 0.00 -1.61 0.00 0.00 179.24 178.02 3cx6 h ALA 102 N 1.13 0.87 -0.84 -0.78 0.00 -0.70 -1.89 119.26 117.05 3cx6 h ALA 102 Ca 0.12 -0.54 -0.03 0.00 0.00 0.00 0.00 54.91 54.46 3cx6 h ALA 102 Cb 0.62 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 3cx6 h ALA 102 CO 0.04 0.72 0.39 -0.09 0.00 0.00 0.00 179.25 180.32 3cx6 h ARG 103 N 0.17 1.22 0.27 0.00 2.43 -0.88 -0.47 114.38 117.12 3cx6 h ARG 103 Ca -0.01 -0.19 -0.01 0.00 -0.81 0.00 0.00 59.98 58.96 3cx6 h ARG 103 Cb 1.09 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 30.43 3cx6 h ARG 103 CO 0.09 0.94 -0.13 1.49 -1.51 0.00 0.00 179.97 180.86 3cx6 h GLU 104 N 1.20 -0.35 0.00 0.20 4.81 -1.32 -0.13 114.58 118.98 3cx6 h GLU 104 Ca 0.29 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.53 3cx6 h GLU 104 Cb 0.14 0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.60 3cx6 h GLU 104 CO -0.03 -0.24 -0.07 0.87 -0.73 0.00 0.00 179.01 178.81 3cx6 h LYS 105 N -0.67 0.00 -0.01 1.92 1.57 -1.39 0.19 116.57 118.18 3cx6 h LYS 105 Ca -0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 3cx6 h LYS 105 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.59 3cx6 h LYS 105 CO 0.06 0.07 -0.05 1.28 -0.57 0.00 0.00 179.45 180.24 3cx6 n LEU 106 N -3.83 0.92 -1.22 2.94 4.77 -0.19 -4.91 117.00 115.48 3cx6 n LEU 106 Ca -0.02 -0.27 -0.16 0.00 -0.03 0.00 0.00 56.01 55.53 3cx6 n LEU 106 Cb 0.16 -0.05 -0.07 0.00 -2.33 0.00 0.00 43.42 41.14 3cx6 n LEU 106 CO 0.30 0.16 -0.15 1.41 -1.33 0.00 0.00 177.39 177.77 3cx6 n HIS 107 N -0.39 0.00 -2.29 -1.77 8.25 0.65 -4.96 115.22 114.70 3cx6 n HIS 107 Ca 0.18 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.23 3cx6 n HIS 107 Cb 0.29 -2.86 -0.03 0.00 1.12 0.00 0.00 29.99 28.50 3cx6 n HIS 107 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3cx6 s ILE 108 N -2.54 3.30 0.48 1.59 1.01 -0.07 -4.99 121.20 119.98 3cx6 s ILE 108 Ca 0.00 1.14 -0.18 0.00 0.00 0.00 0.00 60.65 61.61 3cx6 s ILE 108 Cb 0.00 -3.73 -0.09 0.00 0.01 0.00 0.00 42.46 38.65 3cx6 s ILE 108 CO 0.00 0.20 0.97 -2.16 0.00 0.00 0.00 174.94 173.95 3cx6 s PRO 109 N -0.59 4.06 0.88 2.79 0.04 -1.26 -4.53 135.00 136.38 3cx6 s PRO 109 Ca 0.52 1.01 -0.10 0.00 0.04 0.00 0.00 61.00 62.48 3cx6 s PRO 109 Cb -0.35 -2.16 0.12 0.00 0.04 0.00 0.00 34.50 32.16 3cx6 s PRO 109 CO 0.40 -0.17 1.13 -1.58 0.04 0.00 0.00 177.00 176.82 3cx6 s TRP 110 N -2.45 1.88 -0.15 0.56 0.52 -1.26 -4.16 118.94 113.88 3cx6 s TRP 110 Ca 0.60 1.72 0.19 0.00 0.02 0.00 0.00 56.10 58.63 3cx6 s TRP 110 Cb -0.10 -3.26 -0.10 0.00 -1.15 0.00 0.00 33.47 28.86 3cx6 s TRP 110 CO 0.24 -2.55 0.87 0.41 0.02 0.00 0.00 176.95 175.94 3cx6 n GLY 111 N -0.18 -1.26 3.21 0.98 0.00 -1.26 -4.65 105.19 102.03 3cx6 n GLY 111 Ca 0.11 -0.16 0.02 0.00 0.00 0.00 0.00 46.02 45.99 3cx6 n GLY 111 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3cx6 s ASP 112 N -5.63 -1.22 0.36 1.61 -1.08 -1.26 -4.87 116.67 104.58 3cx6 s ASP 112 Ca -0.02 0.95 0.19 0.00 -0.52 0.00 0.00 52.55 53.15 3cx6 s ASP 112 Cb 0.09 2.11 1.28 0.00 -1.46 0.00 0.00 42.92 44.93 3cx6 s ASP 112 CO 0.81 -0.26 1.61 0.78 0.52 0.00 0.00 175.17 178.63 3cx6 h ASN 113 N 8.02 0.38 0.00 -0.34 2.35 -2.01 0.25 115.58 124.23 3cx6 h ASN 113 Ca -0.22 0.23 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 3cx6 h ASN 113 Cb 1.15 0.23 0.00 0.00 0.05 0.00 0.00 38.32 39.74 3cx6 h ASN 113 CO 0.23 -0.34 0.10 2.29 -1.65 0.00 0.00 177.43 178.06 3cx6 n LYS 114 N -5.18 0.07 0.00 0.81 -0.00 -1.26 -0.23 118.16 112.38 3cx6 n LYS 114 Ca 0.36 0.54 0.14 0.00 -0.00 0.00 0.00 58.31 59.36 3cx6 n LYS 114 Cb 1.21 -1.84 0.65 0.00 -0.00 0.00 0.00 35.03 35.05 3cx6 n LYS 114 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 3cx6 n ASN 115 N -1.89 0.36 -0.17 -5.58 3.02 0.08 -3.59 115.26 107.49 3cx6 n ASN 115 Ca -0.01 -0.51 -0.01 0.00 -0.03 0.00 0.00 54.58 54.02 3cx6 n ASN 115 Cb 0.11 -0.11 0.21 0.00 -0.61 0.00 0.00 39.78 39.39 3cx6 n ASN 115 CO 0.00 0.00 0.00 -0.61 -2.62 0.00 0.00 177.26 174.03 3cx6 h GLN 116 N 0.44 0.91 -0.52 3.52 -0.00 -0.80 -0.97 115.11 117.69 3cx6 h GLN 116 Ca 0.00 -0.12 -0.06 0.00 -0.00 0.00 0.00 58.65 58.47 3cx6 h GLN 116 Cb 0.33 -0.17 -0.02 0.00 0.00 0.00 0.00 27.48 27.62 3cx6 h GLN 116 CO 0.00 0.71 0.08 -0.07 0.00 0.00 0.00 178.83 179.55 3cx6 h LEU 117 N 0.91 0.78 -0.40 -2.39 4.07 -1.77 -1.05 115.31 115.45 3cx6 h LEU 117 Ca 0.22 -0.16 -0.18 0.00 0.08 0.00 0.00 57.88 57.85 3cx6 h LEU 117 Cb 0.11 -0.20 -0.00 0.00 1.08 0.00 0.00 40.66 41.64 3cx6 h LEU 117 CO -0.03 0.79 -0.59 0.45 -1.08 0.00 0.00 178.44 177.99 3cx6 h HIS 118 N 0.79 0.85 -0.21 1.13 3.86 -1.60 -2.03 115.15 117.94 3cx6 h HIS 118 Ca 0.17 -0.32 -0.05 0.00 -1.16 0.00 0.00 60.37 59.01 3cx6 h HIS 118 Cb 0.36 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.66 3cx6 h HIS 118 CO 0.02 1.09 -0.10 0.78 0.86 0.00 0.00 177.93 180.58 3cx6 h GLY 119 N 0.91 0.37 0.73 2.45 0.00 -0.88 -2.15 103.07 104.49 3cx6 h GLY 119 Ca 0.00 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.09 3cx6 h GLY 119 CO 0.12 0.21 -0.01 -0.55 0.00 0.00 0.00 176.54 176.31 3cx6 h ASP 120 N 0.32 0.18 -0.24 0.19 3.32 -0.86 -1.95 116.42 117.39 3cx6 h ASP 120 Ca 0.07 -0.34 0.06 0.00 0.02 0.00 0.00 57.03 56.84 3cx6 h ASP 120 Cb 0.38 -0.05 -0.07 0.00 0.22 0.00 0.00 39.33 39.81 3cx6 h ASP 120 CO 0.02 0.47 -0.23 0.50 -1.72 0.00 0.00 179.24 178.28 3cx6 h LYS 121 N -0.12 -0.23 -0.22 3.56 1.63 -1.07 -1.88 116.57 118.24 3cx6 h LYS 121 Ca 0.03 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.84 3cx6 h LYS 121 Cb 0.39 0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 32.06 3cx6 h LYS 121 CO 0.01 -0.15 0.14 -0.07 -3.45 0.00 0.00 179.45 175.93 3cx6 h LEU 122 N -0.24 0.24 -2.27 5.20 4.07 -1.37 -2.60 115.31 118.35 3cx6 h LEU 122 Ca 0.14 -0.01 -0.00 0.00 0.08 0.00 0.00 57.88 58.09 3cx6 h LEU 122 Cb 0.45 -0.06 -0.00 0.00 1.08 0.00 0.00 40.66 42.13 3cx6 h LEU 122 CO -0.38 0.18 -0.00 0.24 -1.08 0.00 0.00 178.44 177.40 3cx6 h MET 123 N 0.29 0.00 0.00 1.13 2.86 -1.05 -0.48 114.93 117.68 3cx6 h MET 123 Ca 0.08 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.72 3cx6 h MET 123 Cb -0.03 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.63 3cx6 h MET 123 CO -0.02 0.00 0.00 0.00 1.06 0.00 0.00 176.91 177.95 3cx6 n ALA 124 N -2.41 1.94 -1.97 6.32 0.00 -0.73 -4.75 120.51 118.91 3cx6 n ALA 124 Ca -0.03 -0.01 -0.42 0.00 0.00 0.00 0.00 53.44 52.98 3cx6 n ALA 124 Cb 0.09 -1.39 -0.03 0.00 0.00 0.00 0.00 19.45 18.12 3cx6 n ALA 124 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 3cx6 s PHE 125 N -3.14 2.19 -0.65 0.00 5.36 -0.19 -4.92 117.98 116.63 3cx6 s PHE 125 Ca 0.08 0.25 -0.28 0.00 -0.96 0.00 0.00 56.93 56.03 3cx6 s PHE 125 Cb 0.12 -3.94 0.03 0.00 -0.34 0.00 0.00 43.02 38.89 3cx6 s PHE 125 CO 0.44 -3.86 1.22 0.34 -1.46 0.00 0.00 175.22 171.91 3cx6 s ASP 126 N 2.89 6.32 0.52 6.13 -1.08 -1.26 -4.89 116.67 125.31 3cx6 s ASP 126 Ca 0.74 -0.14 0.31 0.00 -0.52 0.00 0.00 52.55 52.94 3cx6 s ASP 126 Cb -0.37 -2.55 1.18 0.00 -1.46 0.00 0.00 42.92 39.72 3cx6 s ASP 126 CO 0.31 -1.63 1.92 0.74 0.52 0.00 0.00 175.17 177.03 3cx6 h THR 127 N 6.10 0.12 -0.04 1.71 2.02 -1.94 -3.18 112.91 117.70 3cx6 h THR 127 Ca -0.26 -0.69 0.00 0.00 0.77 0.00 0.00 66.41 66.23 3cx6 h THR 127 Cb 1.05 1.61 0.00 0.00 -1.74 0.00 0.00 68.15 69.07 3cx6 h THR 127 CO 1.23 0.05 0.00 0.54 0.37 0.00 0.00 175.52 177.70 3cx6 n ARG 128 N -3.16 2.05 -1.30 6.66 1.74 -1.26 -2.94 116.66 118.45 3cx6 n ARG 128 Ca 0.01 -1.52 -0.32 0.00 -0.77 0.00 0.00 57.85 55.24 3cx6 n ARG 128 Cb 0.35 -1.47 0.10 0.00 -1.02 0.00 0.00 32.46 30.42 3cx6 n ARG 128 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3cx6 s ALA 129 N -1.98 2.08 0.02 7.54 0.00 -1.20 -4.53 121.76 123.69 3cx6 s ALA 129 Ca 0.33 0.59 -0.04 0.00 0.00 0.00 0.00 51.96 52.84 3cx6 s ALA 129 Cb 0.20 -3.38 -0.01 0.00 0.00 0.00 0.00 23.12 19.93 3cx6 s ALA 129 CO 0.31 -1.92 1.03 -0.35 0.00 0.00 0.00 175.76 174.84 3cx6 n PRO 130 N -3.19 -0.05 -0.22 0.00 -0.04 -1.26 0.68 135.00 130.92 3cx6 n PRO 130 Ca 0.11 1.03 -0.03 0.00 -0.04 0.00 0.00 63.50 64.57 3cx6 n PRO 130 Cb 0.52 -1.54 0.07 0.00 -0.04 0.00 0.00 33.50 32.51 3cx6 n PRO 130 CO 0.00 0.00 0.00 0.52 -0.04 0.00 0.00 175.50 175.98 3cx6 h MET 131 N 0.00 0.72 -0.54 0.54 2.86 -1.92 -2.37 114.93 114.22 3cx6 h MET 131 Ca 0.02 -0.04 -0.05 0.00 -2.06 0.00 0.00 59.70 57.56 3cx6 h MET 131 Cb 0.05 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 31.52 3cx6 h MET 131 CO -0.11 0.48 0.11 0.00 1.06 0.00 0.00 176.91 178.45 3cx6 h ALA 132 N 1.30 1.19 -0.04 6.32 0.00 -1.40 -1.48 119.26 125.14 3cx6 h ALA 132 Ca 0.27 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3cx6 h ALA 132 Cb 0.07 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 3cx6 h ALA 132 CO -0.13 0.55 -0.00 0.00 0.00 0.00 0.00 179.25 179.67 3cx6 h ALA 133 N 1.32 1.92 -0.60 0.00 0.00 0.78 -1.13 119.26 121.55 3cx6 h ALA 133 Ca 0.17 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 3cx6 h ALA 133 Cb 0.32 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.02 3cx6 h ALA 133 CO 0.00 0.07 0.14 1.04 0.00 0.00 0.00 179.25 180.50 3cx6 n GLN 134 N -4.50 3.91 -3.34 0.00 1.13 -1.02 -4.93 117.38 108.63 3cx6 n GLN 134 Ca -0.02 -2.77 -0.19 0.00 -1.94 0.00 0.00 57.00 52.08 3cx6 n GLN 134 Cb 0.11 -2.15 0.06 0.00 0.11 0.00 0.00 30.24 28.37 3cx6 n GLN 134 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3cx6 n GLY 135 N 0.19 -0.27 2.99 1.08 0.00 -0.43 -5.03 105.19 103.72 3cx6 n GLY 135 Ca 0.32 0.07 -0.17 0.00 0.00 0.00 0.00 46.02 46.24 3cx6 n GLY 135 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3cx6 s MET 136 N -6.01 0.56 -0.06 1.61 -1.94 -0.59 -4.05 119.30 108.83 3cx6 s MET 136 Ca 0.46 -0.25 -0.01 0.00 -1.71 0.00 0.00 55.69 54.18 3cx6 s MET 136 Cb -0.20 -0.54 0.03 0.00 2.01 0.00 0.00 34.83 36.12 3cx6 s MET 136 CO 0.56 0.15 0.01 0.08 -0.01 0.00 0.00 175.02 175.81 3cx6 s VAL 137 N -0.15 0.25 0.90 -6.03 1.01 -0.84 -3.14 120.40 112.40 3cx6 s VAL 137 Ca 0.02 0.17 -0.13 0.00 0.00 0.00 0.00 61.98 62.04 3cx6 s VAL 137 Cb -0.03 -0.41 0.03 0.00 0.00 0.00 0.00 36.38 35.97 3cx6 s VAL 137 CO -0.00 0.22 0.49 -0.62 0.00 0.00 0.00 175.10 175.19 3cx6 n GLU 138 N 4.97 -0.16 -0.17 2.72 1.02 -1.26 -4.51 120.64 123.24 3cx6 n GLU 138 Ca -0.10 -0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 56.93 3cx6 n GLU 138 Cb 0.50 -1.90 0.00 0.00 -0.02 0.00 0.00 31.44 30.03 3cx6 n GLU 138 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 3cx6 h THR 139 N -1.32 1.27 -0.27 2.62 2.02 -1.99 -2.51 112.91 112.74 3cx6 h THR 139 Ca -0.44 -1.33 -0.03 0.00 0.77 0.00 0.00 66.41 65.38 3cx6 h THR 139 Cb 1.29 1.07 -0.01 0.00 -1.74 0.00 0.00 68.15 68.76 3cx6 h THR 139 CO 0.36 0.46 0.02 0.08 0.37 0.00 0.00 175.52 176.82 3cx6 h ARG 140 N 0.86 0.39 -0.00 6.66 0.11 -2.00 -1.83 114.38 118.57 3cx6 h ARG 140 Ca 0.12 -0.06 -0.21 0.00 0.10 0.00 0.00 59.98 59.93 3cx6 h ARG 140 Cb 0.75 -0.07 0.02 0.00 1.11 0.00 0.00 29.97 31.78 3cx6 h ARG 140 CO 0.06 0.40 -0.81 0.28 0.10 0.00 0.00 179.97 180.00 3cx6 h VAL 141 N 0.39 1.36 -0.36 0.08 2.07 -1.90 -3.21 116.25 114.67 3cx6 h VAL 141 Ca 0.09 -2.16 0.06 0.00 0.82 0.00 0.00 66.70 65.51 3cx6 h VAL 141 Cb 0.22 2.50 -0.05 0.00 -1.52 0.00 0.00 31.29 32.44 3cx6 h VAL 141 CO 0.00 0.65 0.05 0.15 0.02 0.00 0.00 177.57 178.44 3cx6 h PHE 142 N 0.13 0.08 -0.10 1.57 3.57 -1.11 -1.97 116.94 119.11 3cx6 h PHE 142 Ca -0.10 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.45 3cx6 h PHE 142 Cb 1.50 0.02 -0.00 0.00 2.79 0.00 0.00 35.95 40.25 3cx6 h PHE 142 CO 0.13 -0.01 0.08 -0.07 -2.23 0.00 0.00 178.31 176.21 3cx6 h LEU 143 N 0.17 0.00 -1.03 0.59 3.38 -1.40 -0.59 115.31 116.43 3cx6 h LEU 143 Ca 0.17 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.05 3cx6 h LEU 143 Cb 0.21 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 3cx6 h LEU 143 CO -0.25 0.00 -0.44 1.56 0.09 0.00 0.00 178.44 179.41 3cx6 h GLN 144 N 0.00 0.00 0.00 1.13 4.20 -1.36 -3.02 115.11 116.06 3cx6 h GLN 144 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 3cx6 h GLN 144 Cb 0.21 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.99 3cx6 h GLN 144 CO -0.00 0.44 -0.97 0.66 -0.67 0.00 0.00 178.83 178.29 3cx6 n TYR 145 N -3.77 0.20 -0.00 2.96 4.02 -0.35 -4.54 117.16 115.68 3cx6 n TYR 145 Ca -0.01 0.06 -0.13 0.00 -0.01 0.00 0.00 57.90 57.81 3cx6 n TYR 145 Cb 0.50 -0.36 -0.07 0.00 -0.02 0.00 0.00 39.34 39.39 3cx6 n TYR 145 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 3cx6 h LEU 146 N 0.00 -1.42 -0.47 7.72 5.85 -1.11 -0.55 115.31 125.33 3cx6 h LEU 146 Ca 0.00 0.18 0.10 0.00 0.84 0.00 0.00 57.88 59.00 3cx6 h LEU 146 Cb 0.68 0.57 -0.10 0.00 0.37 0.00 0.00 40.66 42.18 3cx6 h LEU 146 CO 0.00 -0.44 -0.21 -0.65 -0.34 0.00 0.00 178.44 176.79 3cx6 h PRO 147 N -0.52 -0.11 -0.56 5.25 0.11 -1.80 0.24 132.00 134.61 3cx6 h PRO 147 Ca 0.07 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.18 3cx6 h PRO 147 Cb 0.64 0.02 -0.03 0.00 0.11 0.00 0.00 31.00 31.75 3cx6 h PRO 147 CO -0.41 -0.07 0.36 0.00 -0.21 0.00 0.00 178.00 177.67 3cx6 h ALA 148 N 1.21 0.71 -0.75 -0.75 0.00 -1.77 -2.34 119.26 115.57 3cx6 h ALA 148 Ca 0.22 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.08 3cx6 h ALA 148 Cb 0.46 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 3cx6 h ALA 148 CO -0.54 0.17 0.49 0.82 0.00 0.00 0.00 179.25 180.18 3cx6 h ILE 149 N 0.75 1.20 -0.87 0.00 2.04 -0.23 -0.58 117.51 119.81 3cx6 h ILE 149 Ca 0.20 -0.37 -0.03 0.00 1.00 0.00 0.00 64.86 65.67 3cx6 h ILE 149 Cb -0.05 0.10 -0.04 0.00 -0.74 0.00 0.00 36.82 36.09 3cx6 h ILE 149 CO -0.04 0.19 0.44 -0.09 0.00 0.00 0.00 178.15 178.65 3cx6 h ARG 150 N 1.02 1.24 -0.17 2.37 2.43 -0.71 -1.50 114.38 119.06 3cx6 h ARG 150 Ca 0.27 -0.17 -0.04 0.00 -0.81 0.00 0.00 59.98 59.23 3cx6 h ARG 150 Cb -0.11 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 29.21 3cx6 h ARG 150 CO -0.06 0.93 -0.07 0.00 -1.51 0.00 0.00 179.97 179.26 3cx6 h ALA 151 N 1.24 0.24 -0.63 2.80 0.00 -0.95 -2.97 119.26 118.98 3cx6 h ALA 151 Ca 0.30 -0.27 0.05 0.00 0.00 0.00 0.00 54.91 55.00 3cx6 h ALA 151 Cb 0.08 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 3cx6 h ALA 151 CO -0.04 0.03 0.42 -0.07 0.00 0.00 0.00 179.25 179.59 3cx6 h LEU 152 N 0.03 0.58 -0.11 0.00 3.38 -0.89 -1.58 115.31 116.72 3cx6 h LEU 152 Ca 0.04 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3cx6 h LEU 152 Cb 0.53 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.16 3cx6 h LEU 152 CO 0.02 0.38 0.00 1.87 0.09 0.00 0.00 178.44 180.81 3cx6 n TRP 153 N -4.47 0.54 1.07 1.13 -0.00 -0.58 -2.76 117.44 112.36 3cx6 n TRP 153 Ca 0.09 0.17 0.12 0.00 -0.00 0.00 0.00 57.50 57.87 3cx6 n TRP 153 Cb 0.20 -0.78 0.15 0.00 -0.00 0.00 0.00 31.31 30.88 3cx6 n TRP 153 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 177.69 178.08 3cx6 n GLU 154 N -1.96 0.51 -2.74 5.87 -0.58 -0.61 -4.83 120.64 116.30 3cx6 n GLU 154 Ca 0.05 -0.36 -0.42 0.00 -0.42 0.00 0.00 57.16 56.01 3cx6 n GLU 154 Cb 0.34 -1.49 -0.03 0.00 -0.57 0.00 0.00 31.44 29.69 3cx6 n GLU 154 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 3cx6 s ASP 155 N -2.74 7.33 0.53 1.62 2.15 -1.11 -4.95 116.67 119.49 3cx6 s ASP 155 Ca 0.16 1.61 0.29 0.00 0.43 0.00 0.00 52.55 55.03 3cx6 s ASP 155 Cb 0.18 -2.55 1.47 0.00 -0.30 0.00 0.00 42.92 41.71 3cx6 s ASP 155 CO 0.66 -0.26 2.06 0.77 -0.17 0.00 0.00 175.17 178.23 3cx6 h SER 156 N 6.82 0.00 -0.09 -0.34 4.64 -1.89 -2.13 113.55 120.56 3cx6 h SER 156 Ca -0.40 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.88 3cx6 h SER 156 Cb 1.21 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.30 3cx6 h SER 156 CO 0.76 0.11 -0.09 1.23 -0.87 0.00 0.00 176.83 177.97 3cx6 h GLY 157 N 0.99 0.24 1.24 -0.77 0.00 -1.83 -0.94 103.07 102.01 3cx6 h GLY 157 Ca -0.00 -0.24 -0.02 0.00 0.00 0.00 0.00 47.33 47.07 3cx6 h GLY 157 CO 0.01 0.22 0.35 -2.22 0.00 0.00 0.00 176.54 174.91 3cx6 h ILE 158 N -0.19 1.22 -0.50 2.60 1.08 -1.74 -1.17 117.51 118.82 3cx6 h ILE 158 Ca 0.02 -0.59 -0.12 0.00 -0.39 0.00 0.00 64.86 63.78 3cx6 h ILE 158 Cb 0.59 0.30 -0.01 0.00 -3.07 0.00 0.00 36.82 34.63 3cx6 h ILE 158 CO 0.02 0.26 -0.14 1.56 -0.69 0.00 0.00 178.15 179.16 3cx6 h GLN 159 N 0.99 0.97 -0.46 2.37 4.20 -1.32 -1.92 115.11 119.94 3cx6 h GLN 159 Ca 0.25 -0.38 -0.06 0.00 0.06 0.00 0.00 58.65 58.52 3cx6 h GLN 159 Cb 0.07 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 3cx6 h GLN 159 CO -0.03 1.05 0.06 -0.91 -0.67 0.00 0.00 178.83 178.32 3cx6 h ASN 160 N 0.83 0.68 -0.74 1.46 -0.26 -0.73 -1.57 115.58 115.24 3cx6 h ASN 160 Ca 0.12 -0.13 -0.01 0.00 -0.56 0.00 0.00 56.30 55.72 3cx6 h ASN 160 Cb 0.70 -0.18 -0.04 0.00 -1.06 0.00 0.00 38.32 37.75 3cx6 h ASN 160 CO 0.05 0.71 0.41 0.00 -1.06 0.00 0.00 177.43 177.54 3cx6 h ALA 161 N 1.38 0.95 -0.28 -0.83 0.00 -0.88 -2.70 119.26 116.90 3cx6 h ALA 161 Ca 0.15 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3cx6 h ALA 161 Cb 0.34 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3cx6 h ALA 161 CO 0.01 0.46 0.15 -0.92 0.00 0.00 0.00 179.25 178.95 3cx6 h TYR 162 N 1.02 0.38 -0.02 0.00 3.20 -0.54 -1.93 116.97 119.10 3cx6 h TYR 162 Ca 0.26 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.13 3cx6 h TYR 162 Cb 0.03 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.18 3cx6 h TYR 162 CO -0.00 0.32 0.19 -0.44 -1.64 0.00 0.00 178.16 176.59 3cx6 h ASP 163 N 0.34 0.00 -0.30 -2.11 3.32 -1.01 -0.21 116.42 116.45 3cx6 h ASP 163 Ca 0.10 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 3cx6 h ASP 163 Cb 0.06 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 3cx6 h ASP 163 CO -0.02 0.00 0.00 0.54 -1.72 0.00 0.00 179.24 178.05 3cx6 n ARG 164 N -3.04 3.05 -0.02 3.56 1.74 -0.74 -4.71 116.66 116.50 3cx6 n ARG 164 Ca -0.02 -2.89 0.24 0.00 -0.77 0.00 0.00 57.85 54.40 3cx6 n ARG 164 Cb 0.25 -1.89 0.71 0.00 -1.02 0.00 0.00 32.46 30.51 3cx6 n ARG 164 CO 0.00 0.00 0.00 0.07 -1.52 0.00 0.00 177.63 176.18 3cx6 h ARG 165 N 1.96 0.00 -0.04 5.56 0.11 -0.82 -0.08 114.38 121.07 3cx6 h ARG 165 Ca 0.02 0.00 0.01 0.00 0.10 0.00 0.00 59.98 60.11 3cx6 h ARG 165 Cb 1.52 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.60 3cx6 h ARG 165 CO 0.26 0.00 0.10 0.07 0.10 0.00 0.00 179.97 180.51 3cx6 h ARG 166 N 0.00 0.00 0.00 0.08 0.11 -1.84 0.31 114.38 113.04 3cx6 h ARG 166 Ca 0.29 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.37 3cx6 h ARG 166 Cb 1.46 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.54 3cx6 h ARG 166 CO -0.00 0.00 0.00 0.39 0.10 0.00 0.00 179.97 180.46 3cx6 n GLU 167 N -3.35 0.12 0.00 0.08 1.02 -0.04 -4.58 120.64 113.88 3cx6 n GLU 167 Ca -0.02 0.17 0.00 0.00 -0.02 0.00 0.00 57.16 57.29 3cx6 n GLU 167 Cb 0.18 -1.66 0.00 0.00 -0.02 0.00 0.00 31.44 29.95 3cx6 n GLU 167 CO 0.00 0.00 0.00 1.97 1.18 0.00 0.00 177.13 180.28 3cx6 n PHE 168 N -1.87 0.00 -3.98 -0.32 1.16 0.11 -5.13 117.46 107.43 3cx6 n PHE 168 Ca 0.05 0.00 -0.30 0.00 -1.87 0.00 0.00 57.45 55.34 3cx6 n PHE 168 Cb 0.33 0.00 -0.16 0.00 -1.61 0.00 0.00 39.48 38.04 3cx6 n PHE 168 CO 0.00 0.00 0.00 -0.65 -1.87 0.00 0.00 176.76 174.24 3cx6 s GLN 169 N 2.45 2.03 -0.29 3.97 -1.52 -1.25 -4.90 119.66 120.15 3cx6 s GLN 169 Ca 0.00 -0.59 -0.15 0.00 -1.95 0.00 0.00 55.36 52.67 3cx6 s GLN 169 Cb 0.00 -2.11 0.11 0.00 -0.22 0.00 0.00 33.01 30.80 3cx6 s GLN 169 CO 0.00 -0.31 0.79 -1.17 -0.25 0.00 0.00 175.29 174.35 3cx6 s LEU 170 N 1.51 -0.82 0.21 2.90 2.96 -1.26 -5.04 118.68 119.13 3cx6 s LEU 170 Ca 0.03 1.26 -0.30 0.00 -0.22 0.00 0.00 54.13 54.90 3cx6 s LEU 170 Cb -0.14 2.12 -0.08 0.00 0.50 0.00 0.00 46.19 48.59 3cx6 s LEU 170 CO -0.09 -0.19 0.95 -0.83 -1.32 0.00 0.00 176.35 174.86 3cx6 s GLY 171 N 1.84 3.09 0.00 7.98 0.00 -1.26 -4.91 107.32 114.06 3cx6 s GLY 171 Ca -0.08 0.61 0.06 0.00 0.00 0.00 0.00 44.72 45.31 3cx6 s GLY 171 CO -0.18 1.26 0.81 -1.84 0.00 0.00 0.00 173.10 173.14 3cx6 n GLU 172 N 1.81 0.45 0.18 2.90 0.00 -1.26 -2.00 120.64 122.72 3cx6 n GLU 172 Ca -0.01 0.00 0.12 0.00 0.00 0.00 0.00 57.16 57.27 3cx6 n GLU 172 Cb 0.48 -1.21 0.20 0.00 0.00 0.00 0.00 31.44 30.91 3cx6 n GLU 172 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 3cx6 h SER 173 N 0.00 0.00 0.69 -1.84 4.64 -1.91 -3.09 113.55 112.04 3cx6 h SER 173 Ca 0.00 -0.01 -0.12 0.00 -0.47 0.00 0.00 61.79 61.19 3cx6 h SER 173 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 3cx6 h SER 173 CO 0.00 0.00 -0.57 -0.37 -0.87 0.00 0.00 176.83 175.03 3cx6 h VAL 174 N 0.00 1.31 -0.27 0.95 -1.51 -1.77 -2.83 116.25 112.13 3cx6 h VAL 174 Ca 0.00 -2.01 -0.05 0.00 -1.23 0.00 0.00 66.70 63.41 3cx6 h VAL 174 Cb 0.93 2.11 -0.01 0.00 -2.13 0.00 0.00 31.29 32.20 3cx6 h VAL 174 CO 0.00 0.56 -0.02 0.50 -1.23 0.00 0.00 177.57 177.38 3cx6 h LYS 175 N 0.00 0.50 -0.93 5.19 3.64 -1.73 0.13 116.57 123.36 3cx6 h LYS 175 Ca -0.01 -0.17 0.14 0.00 -1.27 0.00 0.00 60.65 59.35 3cx6 h LYS 175 Cb 1.07 -0.04 -0.09 0.00 -0.41 0.00 0.00 32.23 32.75 3cx6 h LYS 175 CO 0.07 0.67 0.54 -0.92 -2.27 0.00 0.00 179.45 177.54 3cx6 h TYR 176 N 0.27 0.97 0.10 1.91 3.20 -1.50 0.58 116.97 122.50 3cx6 h TYR 176 Ca 0.08 0.03 -0.26 0.00 3.14 0.00 0.00 58.73 61.72 3cx6 h TYR 176 Cb 0.45 -0.29 0.00 0.00 1.54 0.00 0.00 36.73 38.43 3cx6 h TYR 176 CO 0.04 0.31 -1.18 0.74 -1.64 0.00 0.00 178.16 176.43 3cx6 h PHE 177 N 0.81 0.45 -0.39 -3.82 -1.00 -1.28 -3.09 116.94 108.62 3cx6 h PHE 177 Ca 0.49 -0.32 -0.06 0.00 2.81 0.00 0.00 57.97 60.89 3cx6 h PHE 177 Cb 0.60 -0.02 -0.02 0.00 3.61 0.00 0.00 35.95 40.12 3cx6 h PHE 177 CO -0.04 1.23 0.00 -0.07 -1.61 0.00 0.00 178.31 177.83 3cx6 h LEU 178 N 0.08 0.58 0.00 1.54 3.38 -0.09 -0.92 115.31 119.88 3cx6 h LEU 178 Ca -0.12 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.74 3cx6 h LEU 178 Cb 1.91 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.50 3cx6 h LEU 178 CO 0.19 0.65 0.00 0.47 0.09 0.00 0.00 178.44 179.84 3cx6 n ASP 179 N -4.26 0.00 -0.40 -0.43 8.00 0.13 -3.04 116.55 116.56 3cx6 n ASP 179 Ca 0.02 -0.02 0.07 0.00 0.71 0.00 0.00 54.79 55.57 3cx6 n ASP 179 Cb 0.26 -0.29 0.14 0.00 -0.02 0.00 0.00 41.12 41.21 3cx6 n ASP 179 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3cx6 n ASN 180 N -1.29 1.78 -0.21 -2.24 3.02 -0.40 -4.79 115.26 111.13 3cx6 n ASN 180 Ca 0.11 -3.16 0.19 0.00 -0.03 0.00 0.00 54.58 51.69 3cx6 n ASN 180 Cb 0.19 -0.43 0.54 0.00 -0.61 0.00 0.00 39.78 39.47 3cx6 n ASN 180 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 3cx6 h LEU 181 N 0.41 0.34 -0.29 3.41 3.38 -1.33 -1.98 115.31 119.25 3cx6 h LEU 181 Ca -0.02 0.03 0.06 0.00 0.09 0.00 0.00 57.88 58.05 3cx6 h LEU 181 Cb 1.11 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 41.77 3cx6 h LEU 181 CO 0.01 0.14 -0.08 0.44 0.09 0.00 0.00 178.44 179.04 3cx6 h ASP 182 N 0.35 -0.30 1.37 -0.43 3.32 -1.88 0.63 116.42 119.47 3cx6 h ASP 182 Ca 0.44 0.09 -0.09 0.00 0.02 0.00 0.00 57.03 57.49 3cx6 h ASP 182 Cb 1.16 0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.89 3cx6 h ASP 182 CO -0.14 -0.11 -0.40 0.07 -1.72 0.00 0.00 179.24 176.94 3cx6 h LYS 183 N -0.01 0.00 0.00 3.56 2.10 -1.76 -3.07 116.57 117.38 3cx6 h LYS 183 Ca 0.14 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.66 3cx6 h LYS 183 Cb 0.23 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.54 3cx6 h LYS 183 CO -0.31 0.40 -0.64 -0.07 -2.00 0.00 0.00 179.45 176.83 3cx6 h LEU 184 N 0.00 0.00 -0.06 7.07 3.38 -1.16 -3.32 115.31 121.21 3cx6 h LEU 184 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3cx6 h LEU 184 Cb 1.20 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.95 3cx6 h LEU 184 CO 0.05 0.64 0.00 1.23 0.09 0.00 0.00 178.44 180.46 3cx6 h GLY 185 N 2.80 0.11 -5.30 0.83 0.00 -0.78 -3.46 103.07 97.28 3cx6 h GLY 185 Ca -0.01 -0.08 -0.69 0.00 0.00 0.00 0.00 47.33 46.56 3cx6 h GLY 185 CO 0.08 0.07 0.15 1.55 0.00 0.00 0.00 176.54 178.40 3cx6 n VAL 186 N -4.88 0.72 -0.31 4.60 3.14 -1.19 -4.88 118.33 115.54 3cx6 n VAL 186 Ca -0.07 -0.18 0.08 0.00 -2.96 0.00 0.00 64.34 61.21 3cx6 n VAL 186 Cb 0.18 -0.55 0.18 0.00 -1.06 0.00 0.00 33.84 32.59 3cx6 n VAL 186 CO 0.00 0.00 0.00 1.55 -6.46 0.00 0.00 176.83 171.92 3cx6 h PRO 187 N 3.14 0.03 -1.23 1.45 0.13 -1.92 -2.60 132.00 131.01 3cx6 h PRO 187 Ca -0.44 -0.00 -0.64 0.00 -0.87 0.00 0.00 66.00 64.05 3cx6 h PRO 187 Cb 1.37 -0.01 -0.26 0.00 0.13 0.00 0.00 31.00 32.23 3cx6 h PRO 187 CO 0.68 0.02 0.83 -0.40 -0.23 0.00 0.00 178.00 178.90 3cx6 n ASP 188 N -5.48 7.49 -4.71 1.44 5.75 -1.26 -4.99 116.55 114.79 3cx6 n ASP 188 Ca 0.16 -3.68 -0.42 0.00 -0.01 0.00 0.00 54.79 50.84 3cx6 n ASP 188 Cb 0.55 -1.01 -0.03 0.00 -1.03 0.00 0.00 41.12 39.60 3cx6 n ASP 188 CO 0.00 0.00 0.00 -0.47 -0.11 0.00 0.00 177.20 176.62 3cx6 s TYR 189 N -3.53 3.14 -0.15 2.11 6.14 -0.98 -5.02 117.35 119.07 3cx6 s TYR 189 Ca 0.59 0.94 0.00 0.00 0.64 0.00 0.00 57.07 59.24 3cx6 s TYR 189 Cb 0.46 -3.65 0.02 0.00 0.42 0.00 0.00 41.96 39.21 3cx6 s TYR 189 CO -0.07 -2.30 -0.13 0.42 0.64 0.00 0.00 175.55 174.11 3cx6 s ILE 190 N 1.48 1.54 0.20 3.14 1.01 -1.26 -5.04 121.20 122.26 3cx6 s ILE 190 Ca 0.64 -0.63 -0.33 0.00 0.00 0.00 0.00 60.65 60.33 3cx6 s ILE 190 Cb -0.35 -1.46 -0.14 0.00 0.01 0.00 0.00 42.46 40.53 3cx6 s ILE 190 CO 0.29 0.44 1.46 -2.65 0.00 0.00 0.00 174.94 174.48 3cx6 n PRO 191 N 4.78 2.00 -1.67 2.79 -0.02 -1.26 -4.99 135.00 136.62 3cx6 n PRO 191 Ca -0.17 0.72 -0.30 0.00 -2.02 0.00 0.00 63.50 61.74 3cx6 n PRO 191 Cb 0.50 -2.41 0.18 0.00 -0.02 0.00 0.00 33.50 31.75 3cx6 n PRO 191 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3cx6 s SER 192 N 0.52 2.89 0.09 2.55 1.04 -1.26 -4.80 113.70 114.73 3cx6 s SER 192 Ca 0.73 0.54 -0.22 0.00 0.48 0.00 0.00 55.95 57.48 3cx6 s SER 192 Cb -0.68 -0.78 -0.13 0.00 0.10 0.00 0.00 66.02 64.53 3cx6 s SER 192 CO 0.45 -2.90 1.71 -0.61 0.98 0.00 0.00 173.24 172.88 3cx6 h GLN 193 N -1.75 0.08 -0.52 4.02 4.15 -1.95 -1.05 115.11 118.09 3cx6 h GLN 193 Ca -0.46 -0.01 0.08 0.00 0.77 0.00 0.00 58.65 59.03 3cx6 h GLN 193 Cb 1.28 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.92 3cx6 h GLN 193 CO 0.45 0.09 0.35 0.37 -1.93 0.00 0.00 178.83 178.16 3cx6 h GLN 194 N 0.04 0.37 -0.11 1.69 5.75 -1.95 -0.88 115.11 120.02 3cx6 h GLN 194 Ca 0.02 -0.02 -0.02 0.00 -0.15 0.00 0.00 58.65 58.48 3cx6 h GLN 194 Cb 0.04 -0.08 -0.00 0.00 1.07 0.00 0.00 27.48 28.50 3cx6 h GLN 194 CO -0.00 0.25 -0.02 -0.44 -2.65 0.00 0.00 178.83 175.97 3cx6 h ASP 195 N 0.38 0.21 -0.82 -0.69 3.32 -1.72 -2.50 116.42 114.60 3cx6 h ASP 195 Ca 0.23 -0.35 0.08 0.00 0.02 0.00 0.00 57.03 57.01 3cx6 h ASP 195 Cb 0.42 -0.06 -0.07 0.00 0.22 0.00 0.00 39.33 39.85 3cx6 h ASP 195 CO -0.06 0.51 0.49 0.40 -1.72 0.00 0.00 179.24 178.86 3cx6 h ILE 196 N -0.09 0.97 -0.17 0.35 5.03 -0.02 0.12 117.51 123.70 3cx6 h ILE 196 Ca 0.03 -0.29 -0.07 0.00 -0.12 0.00 0.00 64.86 64.41 3cx6 h ILE 196 Cb 0.41 0.04 -0.01 0.00 -3.03 0.00 0.00 36.82 34.23 3cx6 h ILE 196 CO 0.01 0.16 -0.21 -0.07 -0.68 0.00 0.00 178.15 177.36 3cx6 h LEU 197 N 0.85 0.29 0.00 1.44 3.38 -1.14 -3.05 115.31 117.08 3cx6 h LEU 197 Ca 0.38 -0.08 -0.16 0.00 0.09 0.00 0.00 57.88 58.11 3cx6 h LEU 197 Cb 0.27 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 3cx6 h LEU 197 CO -0.21 0.51 -1.03 -0.07 0.09 0.00 0.00 178.44 177.73 3cx6 h LEU 198 N 0.27 0.00 -9.57 1.67 3.38 -0.75 -3.47 115.31 106.84 3cx6 h LEU 198 Ca 0.05 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.43 3cx6 h LEU 198 Cb 0.53 0.00 0.11 0.00 0.09 0.00 0.00 40.66 41.38 3cx6 h LEU 198 CO 0.04 0.63 0.30 0.00 0.09 0.00 0.00 178.44 179.50 3cx6 n ALA 199 N -2.33 0.38 -3.65 1.53 0.00 0.30 -4.92 120.51 111.82 3cx6 n ALA 199 Ca -0.04 0.38 -0.35 0.00 0.00 0.00 0.00 53.44 53.43 3cx6 n ALA 199 Cb 0.83 -2.12 -0.14 0.00 0.00 0.00 0.00 19.45 18.02 3cx6 n ALA 199 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3cx6 s ARG 200 N -1.58 2.63 -0.12 0.00 6.06 -1.26 -5.01 118.95 119.67 3cx6 s ARG 200 Ca 0.58 -1.12 0.03 0.00 -2.50 0.00 0.00 55.73 52.72 3cx6 s ARG 200 Cb -0.65 -3.11 0.01 0.00 0.06 0.00 0.00 34.95 31.26 3cx6 s ARG 200 CO 0.60 -0.52 -0.20 1.03 -2.50 0.00 0.00 175.30 173.71 3cx6 s ARG 201 N 1.30 2.80 0.85 5.12 0.52 -1.26 -4.94 118.95 123.34 3cx6 s ARG 201 Ca -0.03 -0.78 -0.12 0.00 -0.52 0.00 0.00 55.73 54.28 3cx6 s ARG 201 Cb -0.18 -2.26 0.10 0.00 0.52 0.00 0.00 34.95 33.13 3cx6 s ARG 201 CO -0.02 0.01 1.15 -2.30 0.02 0.00 0.00 175.30 174.15 3cx6 n PRO 202 N 4.01 -0.04 -3.73 3.54 -0.02 -1.26 -4.95 135.00 132.55 3cx6 n PRO 202 Ca -0.20 0.07 -0.33 0.00 -2.02 0.00 0.00 63.50 61.02 3cx6 n PRO 202 Cb 0.52 -2.39 -0.09 0.00 -0.02 0.00 0.00 33.50 31.52 3cx6 n PRO 202 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 3cx6 n THR 203 N -3.61 2.49 -3.14 3.45 -1.04 -1.26 -5.00 114.28 106.18 3cx6 n THR 203 Ca 0.13 -5.04 -0.43 0.00 -2.04 0.00 0.00 64.05 56.67 3cx6 n THR 203 Cb 0.51 -2.29 -0.07 0.00 -1.82 0.00 0.00 70.33 66.66 3cx6 n THR 203 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 3cx6 s LYS 204 N -1.49 3.21 0.00 -2.82 -0.14 -1.26 -3.02 119.74 114.22 3cx6 s LYS 204 Ca 0.27 -0.56 0.00 0.00 -1.36 0.00 0.00 55.97 54.32 3cx6 s LYS 204 Cb -0.05 -4.00 0.00 0.00 -1.68 0.00 0.00 37.83 32.11 3cx6 s LYS 204 CO -0.14 -1.06 0.00 0.41 -0.76 0.00 0.00 175.35 173.80 3cx6 n GLY 205 N 5.09 0.89 3.19 -3.33 0.00 -1.26 -5.02 105.19 104.75 3cx6 n GLY 205 Ca -0.04 -2.24 -0.34 0.00 0.00 0.00 0.00 46.02 43.40 3cx6 n GLY 205 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cx6 s ILE 206 N -0.98 2.77 -0.19 -0.61 1.01 -1.26 -3.93 121.20 118.01 3cx6 s ILE 206 Ca 0.00 -1.00 -0.10 0.00 0.00 0.00 0.00 60.65 59.56 3cx6 s ILE 206 Cb 0.00 -2.38 -0.05 0.00 0.01 0.00 0.00 42.46 40.05 3cx6 s ILE 206 CO 0.00 0.25 0.12 -1.00 0.00 0.00 0.00 174.94 174.32 3cx6 s HIS 207 N 1.32 3.40 -0.05 3.97 3.76 -0.54 -4.98 115.29 122.18 3cx6 s HIS 207 Ca 0.01 0.31 0.06 0.00 -0.15 0.00 0.00 55.06 55.29 3cx6 s HIS 207 Cb -0.16 -2.14 -0.01 0.00 1.11 0.00 0.00 32.58 31.38 3cx6 s HIS 207 CO -0.06 0.30 -0.25 -2.00 -0.85 0.00 0.00 174.74 171.88 3cx6 s GLU 208 N 0.30 2.40 -0.07 1.40 2.12 -1.26 -0.49 118.70 123.09 3cx6 s GLU 208 Ca 0.08 -0.89 0.01 0.00 0.36 0.00 0.00 54.97 54.52 3cx6 s GLU 208 Cb -0.11 -2.09 0.02 0.00 0.26 0.00 0.00 34.13 32.21 3cx6 s GLU 208 CO -0.02 0.41 -0.06 -0.47 -0.54 0.00 0.00 175.26 174.59 3cx6 s TYR 209 N -0.26 1.06 -0.15 5.30 5.04 0.44 -4.99 117.35 123.80 3cx6 s TYR 209 Ca -0.00 -0.39 -0.06 0.00 -2.44 0.00 0.00 57.07 54.17 3cx6 s TYR 209 Cb -0.13 -0.91 -0.04 0.00 0.35 0.00 0.00 41.96 41.24 3cx6 s TYR 209 CO 0.03 -0.31 0.06 -0.51 -1.34 0.00 0.00 175.55 173.47 3cx6 s ASP 210 N 1.22 5.62 0.28 4.32 1.01 -1.26 -0.64 116.67 127.22 3cx6 s ASP 210 Ca -0.06 0.15 -0.09 0.00 0.71 0.00 0.00 52.55 53.26 3cx6 s ASP 210 Cb -0.14 -1.86 -0.00 0.00 1.01 0.00 0.00 42.92 41.93 3cx6 s ASP 210 CO -0.02 0.26 0.47 0.72 0.21 0.00 0.00 175.17 176.81 3cx6 s PHE 211 N -0.13 0.61 0.06 4.23 -0.71 -0.56 -4.99 117.98 116.48 3cx6 s PHE 211 Ca 0.07 -0.94 0.04 0.00 -1.04 0.00 0.00 56.93 55.06 3cx6 s PHE 211 Cb -0.12 0.10 -0.03 0.00 -1.21 0.00 0.00 43.02 41.76 3cx6 s PHE 211 CO 0.01 -1.04 -0.12 -1.21 -1.34 0.00 0.00 175.22 171.51 3cx6 s GLU 212 N -3.65 0.75 -0.15 1.99 2.02 -1.26 -0.21 118.70 118.18 3cx6 s GLU 212 Ca 0.26 -0.87 -0.04 0.00 0.02 0.00 0.00 54.97 54.33 3cx6 s GLU 212 Cb -0.00 -0.69 0.07 0.00 0.10 0.00 0.00 34.13 33.60 3cx6 s GLU 212 CO 0.13 0.15 0.15 0.42 0.02 0.00 0.00 175.26 176.13 3cx6 s ILE 213 N -1.24 -0.21 -1.33 -1.63 1.01 -1.09 -4.90 121.20 111.81 3cx6 s ILE 213 Ca -0.04 0.02 -0.06 0.00 0.00 0.00 0.00 60.65 60.57 3cx6 s ILE 213 Cb -0.10 -0.52 -0.00 0.00 0.01 0.00 0.00 42.46 41.86 3cx6 s ILE 213 CO 0.02 -0.12 0.53 0.29 0.00 0.00 0.00 174.94 175.65 3cx6 n LYS 214 N 5.31 -2.81 -1.22 2.79 4.01 -1.26 -1.50 118.16 123.48 3cx6 n LYS 214 Ca -0.06 0.42 -0.08 0.00 -0.51 0.00 0.00 58.31 58.09 3cx6 n LYS 214 Cb 0.49 -4.40 -0.03 0.00 -0.51 0.00 0.00 35.03 30.58 3cx6 n LYS 214 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 3cx6 n ASN 215 N -2.89 -4.55 -4.25 4.39 3.02 -1.26 -5.00 115.26 104.72 3cx6 n ASN 215 Ca -0.25 0.19 -0.36 0.00 -0.03 0.00 0.00 54.58 54.12 3cx6 n ASN 215 Cb 0.66 -2.71 -0.13 0.00 -0.61 0.00 0.00 39.78 36.99 3cx6 n ASN 215 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3cx6 s VAL 216 N -2.07 3.43 0.27 2.41 1.01 -0.56 -5.08 120.40 119.80 3cx6 s VAL 216 Ca 0.00 -1.07 -0.30 0.00 0.00 0.00 0.00 61.98 60.62 3cx6 s VAL 216 Cb 0.00 -2.86 -0.10 0.00 0.00 0.00 0.00 36.38 33.42 3cx6 s VAL 216 CO 0.00 -0.02 1.43 -2.16 0.00 0.00 0.00 175.10 174.35 3cx6 s PRO 217 N 1.37 4.26 0.04 2.72 0.04 -1.26 -2.66 135.00 139.51 3cx6 s PRO 217 Ca -0.01 2.32 0.05 0.00 0.04 0.00 0.00 61.00 63.40 3cx6 s PRO 217 Cb -0.18 -3.09 -0.02 0.00 0.04 0.00 0.00 34.50 31.25 3cx6 s PRO 217 CO 0.00 -0.40 -0.16 -0.06 0.04 0.00 0.00 177.00 176.42 3cx6 s PHE 218 N -0.26 1.36 -0.13 0.56 0.40 0.70 -2.22 117.98 118.39 3cx6 s PHE 218 Ca 0.57 -0.35 -0.02 0.00 -0.60 0.00 0.00 56.93 56.53 3cx6 s PHE 218 Cb -0.42 -0.81 0.05 0.00 0.51 0.00 0.00 43.02 42.34 3cx6 s PHE 218 CO 0.46 0.05 0.03 0.21 0.70 0.00 0.00 175.22 176.67 3cx6 s LYS 219 N -1.11 0.52 -0.14 0.44 2.20 -0.28 -1.50 119.74 119.87 3cx6 s LYS 219 Ca 0.03 -0.13 -0.05 0.00 -0.36 0.00 0.00 55.97 55.47 3cx6 s LYS 219 Cb -0.08 -1.54 -0.03 0.00 -1.51 0.00 0.00 37.83 34.66 3cx6 s LYS 219 CO 0.01 -0.50 0.02 1.41 -0.36 0.00 0.00 175.35 175.94 3cx6 s MET 220 N 1.96 3.56 -0.12 4.03 -2.45 0.19 -0.97 119.30 125.50 3cx6 s MET 220 Ca 0.02 -0.40 0.02 0.00 -1.25 0.00 0.00 55.69 54.08 3cx6 s MET 220 Cb -0.15 -3.00 -0.01 0.00 1.25 0.00 0.00 34.83 32.92 3cx6 s MET 220 CO -0.07 0.42 -0.18 0.08 1.05 0.00 0.00 175.02 176.33 3cx6 s VAL 221 N -0.09 2.63 -0.17 10.11 1.01 -0.00 -0.42 120.40 133.47 3cx6 s VAL 221 Ca 0.05 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.22 3cx6 s VAL 221 Cb -0.13 -2.07 0.01 0.00 0.00 0.00 0.00 36.38 34.20 3cx6 s VAL 221 CO 0.02 0.54 -0.18 -0.62 0.00 0.00 0.00 175.10 174.86 3cx6 s ASP 222 N 0.34 3.35 0.32 3.32 2.15 0.35 -0.90 116.67 125.59 3cx6 s ASP 222 Ca -0.14 -0.58 0.09 0.00 0.43 0.00 0.00 52.55 52.35 3cx6 s ASP 222 Cb -0.17 -1.52 -0.05 0.00 -0.30 0.00 0.00 42.92 40.88 3cx6 s ASP 222 CO 0.07 0.03 -0.01 -0.69 -0.17 0.00 0.00 175.17 174.40 3cx6 s VAL 223 N 1.13 2.73 0.75 1.11 1.01 -1.26 -1.47 120.40 124.41 3cx6 s VAL 223 Ca 0.01 -2.01 -0.11 0.00 0.00 0.00 0.00 61.98 59.87 3cx6 s VAL 223 Cb -0.14 -2.75 0.04 0.00 0.00 0.00 0.00 36.38 33.53 3cx6 s VAL 223 CO -0.07 -0.25 1.09 -0.83 0.00 0.00 0.00 175.10 175.04 3cx6 s GLY 224 N -3.69 1.70 0.00 4.51 0.00 -1.17 -4.95 107.32 103.73 3cx6 s GLY 224 Ca 0.34 0.25 0.03 0.00 0.00 0.00 0.00 44.72 45.34 3cx6 s GLY 224 CO 0.19 0.59 0.89 0.61 0.00 0.00 0.00 173.10 175.38 3cx6 n GLY 225 N -1.31 1.39 3.79 0.20 0.00 -1.26 -4.29 105.19 103.71 3cx6 n GLY 225 Ca 0.09 -0.10 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 3cx6 n GLY 225 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3cx6 s LEU 226 N -0.72 3.89 0.27 0.99 2.96 -1.26 -1.51 118.68 123.29 3cx6 s LEU 226 Ca 0.05 2.04 -0.03 0.00 -0.22 0.00 0.00 54.13 55.97 3cx6 s LEU 226 Cb 0.03 -4.47 0.57 0.00 0.50 0.00 0.00 46.19 42.82 3cx6 s LEU 226 CO 0.04 -0.84 1.65 0.03 -1.32 0.00 0.00 176.35 175.91 3cx6 h ARG 227 N 1.70 0.17 0.00 1.98 3.08 -1.99 0.15 114.38 119.46 3cx6 h ARG 227 Ca -0.49 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 59.53 3cx6 h ARG 227 Cb 1.23 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 31.24 3cx6 h ARG 227 CO 0.59 0.11 -0.07 0.66 -1.07 0.00 0.00 179.97 180.20 3cx6 h SER 228 N 0.17 0.00 0.68 7.04 4.64 -1.99 -3.01 113.55 121.08 3cx6 h SER 228 Ca 0.48 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.53 3cx6 h SER 228 Cb 0.90 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.96 3cx6 h SER 228 CO -0.65 0.07 -1.39 -0.33 -0.87 0.00 0.00 176.83 173.65 3cx6 h GLU 229 N 0.00 0.06 -0.09 4.77 5.08 -1.04 -3.36 114.58 120.00 3cx6 h GLU 229 Ca -0.00 -0.10 0.03 0.00 -1.00 0.00 0.00 59.36 58.28 3cx6 h GLU 229 Cb 0.39 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.67 3cx6 h GLU 229 CO 0.01 0.84 0.26 0.00 -1.00 0.00 0.00 179.01 179.12 3cx6 h ARG 230 N 0.02 0.00 0.00 2.33 3.08 -1.31 -1.96 114.38 116.54 3cx6 h ARG 230 Ca -0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.88 3cx6 h ARG 230 Cb 1.92 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.97 3cx6 h ARG 230 CO 0.12 0.00 0.00 0.36 -1.07 0.00 0.00 179.97 179.38 3cx6 n LYS 231 N -3.23 0.04 0.00 0.04 2.85 -1.26 -0.74 118.16 115.87 3cx6 n LYS 231 Ca -0.00 0.50 0.11 0.00 -1.05 0.00 0.00 58.31 57.86 3cx6 n LYS 231 Cb 0.34 -1.63 -0.02 0.00 -0.65 0.00 0.00 35.03 33.08 3cx6 n LYS 231 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 3cx6 n ARG 232 N -1.72 0.43 0.17 -1.58 1.74 -0.74 -4.47 116.66 110.49 3cx6 n ARG 232 Ca 0.00 -0.34 0.17 0.00 -0.77 0.00 0.00 57.85 56.91 3cx6 n ARG 232 Cb 0.04 -1.49 0.79 0.00 -1.02 0.00 0.00 32.46 30.78 3cx6 n ARG 232 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 3cx6 h TRP 233 N 0.83 0.00 0.00 -1.55 4.06 -1.12 -1.68 115.95 116.49 3cx6 h TRP 233 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 3cx6 h TRP 233 Cb 0.58 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.74 3cx6 h TRP 233 CO 0.00 0.00 0.00 0.27 -3.56 0.00 0.00 178.44 175.15 3cx6 h PHE 234 N 0.00 0.00 0.00 0.49 -5.15 -1.78 -3.05 116.94 107.45 3cx6 h PHE 234 Ca 0.11 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.88 3cx6 h PHE 234 Cb 0.54 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.71 3cx6 h PHE 234 CO 0.00 0.00 0.00 0.93 -2.00 0.00 0.00 178.31 177.24 3cx6 h GLU 235 N 0.00 0.00 -0.27 6.09 5.08 -1.63 -3.29 114.58 120.56 3cx6 h GLU 235 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3cx6 h GLU 235 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 3cx6 h GLU 235 CO 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.01 3cx6 n PHE 237 N 0.82 0.06 -2.58 0.00 3.01 -1.24 -4.76 117.46 112.77 3cx6 n PHE 237 Ca 0.12 -0.03 -0.43 0.00 1.01 0.00 0.00 57.45 58.13 3cx6 n PHE 237 Cb 0.43 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.88 3cx6 n PHE 237 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3cx6 s ASP 238 N -1.54 7.08 -1.24 4.37 1.01 -1.26 -3.74 116.67 121.35 3cx6 s ASP 238 Ca 0.27 1.55 0.00 0.00 0.71 0.00 0.00 52.55 55.09 3cx6 s ASP 238 Cb 0.13 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.52 3cx6 s ASP 238 CO 0.21 -0.63 0.00 -1.20 0.21 0.00 0.00 175.17 173.76 3cx6 n SER 239 N 5.95 -4.35 -4.71 0.27 7.64 -1.26 -4.97 113.62 112.19 3cx6 n SER 239 Ca 0.12 0.04 -0.42 0.00 1.01 0.00 0.00 58.87 59.62 3cx6 n SER 239 Cb 0.46 -3.46 -0.03 0.00 -1.01 0.00 0.00 64.21 60.18 3cx6 n SER 239 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3cx6 s VAL 240 N -2.67 4.13 -0.13 0.44 1.01 -1.25 -4.53 120.40 117.41 3cx6 s VAL 240 Ca 0.00 1.52 -0.09 0.00 0.00 0.00 0.00 61.98 63.41 3cx6 s VAL 240 Cb 0.00 -3.97 -0.26 0.00 0.00 0.00 0.00 36.38 32.15 3cx6 s VAL 240 CO 0.00 0.09 0.37 0.74 0.00 0.00 0.00 175.10 176.30 3cx6 h THR 241 N 4.63 0.67 -3.22 3.92 2.02 -1.38 -3.46 112.91 116.09 3cx6 h THR 241 Ca -0.40 -2.33 -0.10 0.00 0.77 0.00 0.00 66.41 64.35 3cx6 h THR 241 Cb 1.20 2.49 -0.17 0.00 -1.74 0.00 0.00 68.15 69.93 3cx6 h THR 241 CO 0.82 0.83 -0.24 -0.55 0.37 0.00 0.00 175.52 176.75 3cx6 s SER 242 N -7.04 -0.15 -0.09 4.18 0.15 -1.06 -2.50 113.70 107.19 3cx6 s SER 242 Ca -0.23 -0.12 0.03 0.00 0.70 0.00 0.00 55.95 56.34 3cx6 s SER 242 Cb 0.06 0.35 0.00 0.00 -1.71 0.00 0.00 66.02 64.73 3cx6 s SER 242 CO 0.75 -0.58 -0.20 -0.63 1.20 0.00 0.00 173.24 173.78 3cx6 s ILE 243 N -2.29 1.74 -0.35 6.45 1.01 0.26 -1.33 121.20 126.70 3cx6 s ILE 243 Ca -0.07 -0.84 -0.08 0.00 0.00 0.00 0.00 60.65 59.66 3cx6 s ILE 243 Cb -0.02 -1.53 0.03 0.00 0.01 0.00 0.00 42.46 40.95 3cx6 s ILE 243 CO -0.02 0.49 0.14 -0.76 0.00 0.00 0.00 174.94 174.80 3cx6 s LEU 244 N 0.45 4.40 -0.39 2.97 1.43 0.44 -0.07 118.68 127.91 3cx6 s LEU 244 Ca -0.17 -0.99 -0.17 0.00 -1.03 0.00 0.00 54.13 51.76 3cx6 s LEU 244 Cb -0.17 -1.94 0.01 0.00 0.03 0.00 0.00 46.19 44.12 3cx6 s LEU 244 CO 0.07 -0.32 0.44 0.12 0.23 0.00 0.00 176.35 176.89 3cx6 s PHE 245 N 1.49 3.17 -0.03 0.29 5.36 0.18 -1.69 117.98 126.75 3cx6 s PHE 245 Ca 0.01 -0.19 -0.08 0.00 -0.96 0.00 0.00 56.93 55.70 3cx6 s PHE 245 Cb -0.19 -2.88 -0.05 0.00 -0.34 0.00 0.00 43.02 39.57 3cx6 s PHE 245 CO 0.04 -0.63 0.26 -0.51 -1.46 0.00 0.00 175.22 172.92 3cx6 s LEU 246 N 2.19 4.40 -0.01 6.12 1.02 -0.17 -0.26 118.68 131.97 3cx6 s LEU 246 Ca 0.14 0.61 0.00 0.00 0.02 0.00 0.00 54.13 54.90 3cx6 s LEU 246 Cb -0.16 -2.47 0.02 0.00 0.02 0.00 0.00 46.19 43.59 3cx6 s LEU 246 CO 0.13 0.32 0.01 -0.69 0.02 0.00 0.00 176.35 176.14 3cx6 s VAL 247 N -1.17 0.03 -0.63 -1.59 1.01 -0.09 -4.39 120.40 113.58 3cx6 s VAL 247 Ca 0.23 0.09 -0.28 0.00 0.00 0.00 0.00 61.98 62.02 3cx6 s VAL 247 Cb -0.14 -0.10 0.03 0.00 0.00 0.00 0.00 36.38 36.17 3cx6 s VAL 247 CO 0.12 0.07 1.25 -0.55 0.00 0.00 0.00 175.10 175.99 3cx6 s SER 248 N 0.60 6.31 0.49 3.32 0.15 -1.26 0.21 113.70 123.53 3cx6 s SER 248 Ca -0.05 -0.03 0.33 0.00 0.70 0.00 0.00 55.95 56.89 3cx6 s SER 248 Cb -0.08 -2.55 1.78 0.00 -1.71 0.00 0.00 66.02 63.46 3cx6 s SER 248 CO -0.02 -1.62 2.00 0.77 1.20 0.00 0.00 173.24 175.57 3cx6 h SER 249 N 9.92 0.00 -0.71 5.45 4.64 -1.39 -2.46 113.55 129.00 3cx6 h SER 249 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 3cx6 h SER 249 Cb 1.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 3cx6 h SER 249 CO 1.21 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 175.63 3cx6 n SER 250 N -2.66 4.36 -0.58 4.97 3.41 -1.26 -4.43 113.62 117.44 3cx6 n SER 250 Ca -0.02 -2.19 0.06 0.00 -0.26 0.00 0.00 58.87 56.45 3cx6 n SER 250 Cb 0.06 -0.54 0.17 0.00 -0.26 0.00 0.00 64.21 63.64 3cx6 n SER 250 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 3cx6 n GLU 251 N 1.47 1.73 0.31 4.33 0.28 -0.93 -4.37 120.64 123.47 3cx6 n GLU 251 Ca 0.26 -1.13 0.20 0.00 -0.16 0.00 0.00 57.16 56.32 3cx6 n GLU 251 Cb 0.75 -1.26 1.02 0.00 1.43 0.00 0.00 31.44 33.38 3cx6 n GLU 251 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 3cx6 h PHE 252 N 1.87 0.00 -0.46 -1.84 -5.15 -1.83 -2.27 116.94 107.26 3cx6 h PHE 252 Ca 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.77 3cx6 h PHE 252 Cb 0.43 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.60 3cx6 h PHE 252 CO 0.20 0.02 0.00 -0.40 -2.00 0.00 0.00 178.31 176.13 3cx6 n ASP 253 N -3.25 3.35 -4.73 -0.68 5.75 -1.26 -4.83 116.55 110.89 3cx6 n ASP 253 Ca -0.02 -1.95 -0.23 0.00 -0.01 0.00 0.00 54.79 52.58 3cx6 n ASP 253 Cb 0.14 -0.30 -0.06 0.00 -1.03 0.00 0.00 41.12 39.87 3cx6 n ASP 253 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 3cx6 s GLN 254 N -1.15 2.45 0.26 0.11 -0.21 -0.86 -4.90 119.66 115.37 3cx6 s GLN 254 Ca 0.36 -1.44 0.11 0.00 0.02 0.00 0.00 55.36 54.41 3cx6 s GLN 254 Cb 0.20 -2.24 -0.05 0.00 1.00 0.00 0.00 33.01 31.92 3cx6 s GLN 254 CO 0.26 0.20 -0.15 0.14 -2.12 0.00 0.00 175.29 173.63 3cx6 s VAL 255 N -2.36 2.74 0.76 1.09 -7.23 -1.26 -1.25 120.40 112.90 3cx6 s VAL 255 Ca 0.36 -2.18 -0.15 0.00 -1.81 0.00 0.00 61.98 58.20 3cx6 s VAL 255 Cb -0.04 -2.42 0.06 0.00 0.56 0.00 0.00 36.38 34.53 3cx6 s VAL 255 CO 0.23 -0.33 1.22 0.18 -0.31 0.00 0.00 175.10 176.08 3cx6 n LEU 256 N -0.51 4.84 0.04 1.32 4.77 0.16 -4.74 117.00 122.88 3cx6 n LEU 256 Ca -0.07 0.65 -0.07 0.00 -0.03 0.00 0.00 56.01 56.50 3cx6 n LEU 256 Cb 0.59 -1.52 -0.12 0.00 -2.33 0.00 0.00 43.42 40.04 3cx6 n LEU 256 CO 0.37 -1.52 -0.04 -0.03 -1.33 0.00 0.00 177.39 174.85 3cx6 h MET 257 N -0.51 0.00 0.71 3.23 1.85 -1.98 -3.20 114.93 115.04 3cx6 h MET 257 Ca -0.48 0.00 -0.03 0.00 -0.61 0.00 0.00 59.70 58.58 3cx6 h MET 257 Cb 1.31 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.34 3cx6 h MET 257 CO 0.48 0.80 -0.38 0.93 -0.40 0.00 0.00 176.91 178.35 3cx6 h GLU 258 N 0.00 -0.96 -4.50 0.39 3.07 -1.98 -3.39 114.58 107.20 3cx6 h GLU 258 Ca -0.09 0.07 -0.61 0.00 -0.50 0.00 0.00 59.36 58.23 3cx6 h GLU 258 Cb 1.81 0.22 -0.37 0.00 -0.84 0.00 0.00 28.75 29.56 3cx6 h GLU 258 CO 0.11 -0.64 -0.81 0.16 -1.40 0.00 0.00 179.01 176.43 3cx6 s ASP 259 N -3.57 3.33 0.00 1.42 1.47 -1.26 -5.01 116.67 113.05 3cx6 s ASP 259 Ca -0.15 -0.87 -0.02 0.00 1.18 0.00 0.00 52.55 52.69 3cx6 s ASP 259 Cb 0.02 -1.18 -0.10 0.00 -0.34 0.00 0.00 42.92 41.31 3cx6 s ASP 259 CO 0.46 -0.16 1.97 0.54 0.68 0.00 0.00 175.17 178.66 3cx6 n ARG 260 N 4.71 0.99 0.00 2.11 1.74 -1.21 -2.91 116.66 122.10 3cx6 n ARG 260 Ca -0.14 -0.39 0.00 0.00 -0.77 0.00 0.00 57.85 56.55 3cx6 n ARG 260 Cb 0.47 -1.58 0.00 0.00 -1.02 0.00 0.00 32.46 30.32 3cx6 n ARG 260 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 3cx6 n GLN 261 N 2.33 0.00 -4.31 5.56 -0.06 -1.26 -4.89 117.38 114.75 3cx6 n GLN 261 Ca 0.17 0.00 -0.34 0.00 -2.00 0.00 0.00 57.00 54.83 3cx6 n GLN 261 Cb 0.47 -0.21 -0.12 0.00 -4.06 0.00 0.00 30.24 26.32 3cx6 n GLN 261 CO 0.00 0.00 0.00 0.99 -0.20 0.00 0.00 177.06 177.85 3cx6 s THR 262 N 0.00 3.95 0.31 1.69 2.01 -1.15 -4.95 115.64 117.50 3cx6 s THR 262 Ca 0.00 -0.33 -0.30 0.00 0.31 0.00 0.00 61.69 61.37 3cx6 s THR 262 Cb 0.00 -2.75 -0.11 0.00 0.01 0.00 0.00 72.50 69.65 3cx6 s THR 262 CO 0.00 0.48 1.59 0.21 -0.69 0.00 0.00 174.62 176.21 3cx6 s ASN 263 N 0.50 6.34 0.11 3.53 3.84 -1.26 0.40 114.94 128.40 3cx6 s ASN 263 Ca -0.02 2.99 -0.20 0.00 0.21 0.00 0.00 52.86 55.83 3cx6 s ASN 263 Cb -0.14 -2.64 -0.09 0.00 -0.55 0.00 0.00 41.25 37.83 3cx6 s ASN 263 CO 0.02 -0.93 1.72 0.03 -2.79 0.00 0.00 177.10 175.16 3cx6 h ARG 264 N 4.61 0.23 -0.72 0.43 3.08 -1.34 -1.91 114.38 118.75 3cx6 h ARG 264 Ca -0.48 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 59.54 3cx6 h ARG 264 Cb 1.22 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 31.19 3cx6 h ARG 264 CO 0.78 0.21 0.42 1.25 -1.07 0.00 0.00 179.97 181.55 3cx6 h LEU 265 N 0.18 0.88 -0.60 3.04 5.85 -1.83 -1.18 115.31 121.65 3cx6 h LEU 265 Ca 0.06 -0.08 0.06 0.00 0.84 0.00 0.00 57.88 58.77 3cx6 h LEU 265 Cb 0.04 -0.22 -0.06 0.00 0.37 0.00 0.00 40.66 40.79 3cx6 h LEU 265 CO -0.01 0.70 0.30 0.74 -0.34 0.00 0.00 178.44 179.83 3cx6 h THR 266 N 0.99 0.91 -0.32 1.05 2.02 -1.88 0.66 112.91 116.33 3cx6 h THR 266 Ca 0.26 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 67.24 3cx6 h THR 266 Cb -0.00 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 66.70 3cx6 h THR 266 CO -0.05 0.10 0.16 -0.08 0.37 0.00 0.00 175.52 176.02 3cx6 h GLU 267 N 0.55 0.46 -0.24 6.66 4.57 -0.86 -1.27 114.58 124.45 3cx6 h GLU 267 Ca 0.28 -0.07 0.03 0.00 -1.18 0.00 0.00 59.36 58.42 3cx6 h GLU 267 Cb 0.23 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 28.70 3cx6 h GLU 267 CO -0.21 0.43 0.04 0.77 -1.18 0.00 0.00 179.01 178.86 3cx6 h SER 268 N 0.39 -0.01 -0.82 1.04 0.02 -0.28 0.23 113.55 114.12 3cx6 h SER 268 Ca 0.11 0.04 0.02 0.00 -0.84 0.00 0.00 61.79 61.12 3cx6 h SER 268 Cb 0.11 0.06 -0.05 0.00 0.14 0.00 0.00 62.40 62.67 3cx6 h SER 268 CO -0.01 0.03 0.54 -0.07 -1.14 0.00 0.00 176.83 176.17 3cx6 h LEU 269 N 0.13 0.90 -1.05 5.07 3.38 -0.72 0.16 115.31 123.18 3cx6 h LEU 269 Ca 0.11 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.97 3cx6 h LEU 269 Cb 0.11 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3cx6 h LEU 269 CO -0.15 0.64 -0.44 0.78 0.09 0.00 0.00 178.44 179.35 3cx6 h ASN 270 N 1.06 0.00 0.03 -0.43 2.35 -0.79 -0.45 115.58 117.36 3cx6 h ASN 270 Ca 0.32 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.07 3cx6 h ASN 270 Cb -0.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.33 3cx6 h ASN 270 CO -0.10 0.44 -0.01 0.40 -1.65 0.00 0.00 177.43 176.51 3cx6 h ILE 271 N 0.00 1.35 -0.81 2.81 2.04 0.14 -2.88 117.51 120.17 3cx6 h ILE 271 Ca -0.00 -1.28 0.10 0.00 1.00 0.00 0.00 64.86 64.67 3cx6 h ILE 271 Cb 0.85 2.20 -0.07 0.00 -0.74 0.00 0.00 36.82 39.05 3cx6 h ILE 271 CO 0.06 0.32 0.45 0.15 0.00 0.00 0.00 178.15 179.13 3cx6 h PHE 272 N -0.61 0.82 -0.35 1.37 3.57 -0.61 -2.21 116.94 118.92 3cx6 h PHE 272 Ca -0.00 0.03 0.06 0.00 3.53 0.00 0.00 57.97 61.59 3cx6 h PHE 272 Cb 0.56 -0.25 -0.06 0.00 2.79 0.00 0.00 35.95 39.00 3cx6 h PHE 272 CO 0.12 0.32 0.01 1.49 -2.23 0.00 0.00 178.31 178.02 3cx6 h GLU 273 N 0.75 0.11 0.00 1.11 4.22 -1.05 0.28 114.58 120.00 3cx6 h GLU 273 Ca 0.40 -0.01 -0.06 0.00 0.08 0.00 0.00 59.36 59.77 3cx6 h GLU 273 Cb 0.39 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 3cx6 h GLU 273 CO -0.26 0.07 -0.28 0.00 -2.18 0.00 0.00 179.01 176.36 3cx6 h THR 274 N 0.11 0.70 0.00 0.32 1.03 -1.18 -2.73 112.91 111.16 3cx6 h THR 274 Ca 0.17 -1.26 -0.03 0.00 -0.01 0.00 0.00 66.41 65.29 3cx6 h THR 274 Cb 0.23 1.81 -0.00 0.00 -1.07 0.00 0.00 68.15 69.12 3cx6 h THR 274 CO -0.28 0.28 -0.18 0.40 -0.01 0.00 0.00 175.52 175.73 3cx6 h ILE 275 N 0.00 1.12 0.00 0.00 1.08 -0.94 -3.28 117.51 115.48 3cx6 h ILE 275 Ca -0.00 -1.90 -0.00 0.00 -0.39 0.00 0.00 64.86 62.57 3cx6 h ILE 275 Cb 0.79 2.17 -0.00 0.00 -3.07 0.00 0.00 36.82 36.71 3cx6 h ILE 275 CO 0.04 0.38 -0.01 1.62 -0.69 0.00 0.00 178.15 179.48 3cx6 h VAL 276 N -1.00 0.09 -0.18 1.67 3.04 -0.53 -2.69 116.25 116.65 3cx6 h VAL 276 Ca -0.04 -0.20 0.00 0.00 -1.01 0.00 0.00 66.70 65.45 3cx6 h VAL 276 Cb 0.75 1.18 0.00 0.00 -2.01 0.00 0.00 31.29 31.20 3cx6 h VAL 276 CO -0.03 0.01 0.00 0.59 -1.01 0.00 0.00 177.57 177.14 3cx6 n ASN 277 N -3.18 2.87 -4.63 3.17 3.02 -1.03 -4.84 115.26 110.64 3cx6 n ASN 277 Ca -0.02 -1.85 -0.43 0.00 -0.03 0.00 0.00 54.58 52.25 3cx6 n ASN 277 Cb 0.15 -0.11 -0.02 0.00 -0.61 0.00 0.00 39.78 39.19 3cx6 n ASN 277 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 3cx6 s ASN 278 N -1.44 6.81 0.55 6.41 3.84 -1.02 -4.90 114.94 125.20 3cx6 s ASN 278 Ca 0.27 0.93 0.24 0.00 0.21 0.00 0.00 52.86 54.51 3cx6 s ASN 278 Cb 0.17 -2.54 1.48 0.00 -0.55 0.00 0.00 41.25 39.81 3cx6 s ASN 278 CO 0.25 -1.01 2.11 0.03 -2.79 0.00 0.00 177.10 175.69 3cx6 h ARG 279 N 8.59 0.00 -0.06 0.43 3.08 -1.90 -1.33 114.38 123.19 3cx6 h ARG 279 Ca -0.22 0.00 0.02 0.00 0.07 0.00 0.00 59.98 59.85 3cx6 h ARG 279 Cb 1.07 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.11 3cx6 h ARG 279 CO 1.06 0.00 0.07 0.28 -1.07 0.00 0.00 179.97 180.31 3cx6 h VAL 280 N 0.00 0.54 -0.57 2.04 2.07 -1.95 0.17 116.25 118.54 3cx6 h VAL 280 Ca 0.09 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.56 3cx6 h VAL 280 Cb 0.38 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 3cx6 h VAL 280 CO -0.00 0.00 0.06 0.49 0.02 0.00 0.00 177.57 178.14 3cx6 n PHE 281 N -3.88 2.02 -0.21 1.57 0.99 -0.50 -4.56 117.46 112.90 3cx6 n PHE 281 Ca -0.01 -0.78 0.10 0.00 -0.00 0.00 0.00 57.45 56.76 3cx6 n PHE 281 Cb 0.17 -0.53 0.38 0.00 -1.00 0.00 0.00 39.48 38.50 3cx6 n PHE 281 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 3cx6 h SER 282 N 3.42 0.62 -0.46 4.37 4.64 -0.75 -1.86 113.55 123.53 3cx6 h SER 282 Ca 0.06 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 3cx6 h SER 282 Cb 1.96 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.94 3cx6 h SER 282 CO 0.51 0.36 0.00 0.59 -0.87 0.00 0.00 176.83 177.43 3cx6 n ASN 283 N -4.51 4.66 -4.82 4.97 3.02 -1.26 -4.95 115.26 112.37 3cx6 n ASN 283 Ca 0.13 -2.80 -0.36 0.00 -0.03 0.00 0.00 54.58 51.52 3cx6 n ASN 283 Cb 0.35 -0.58 -0.07 0.00 -0.61 0.00 0.00 39.78 38.87 3cx6 n ASN 283 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3cx6 s VAL 284 N -2.47 5.31 -0.15 2.41 1.01 -0.70 -4.99 120.40 120.81 3cx6 s VAL 284 Ca 0.47 0.14 -0.29 0.00 0.00 0.00 0.00 61.98 62.30 3cx6 s VAL 284 Cb 0.35 -3.33 -0.01 0.00 0.00 0.00 0.00 36.38 33.40 3cx6 s VAL 284 CO 0.15 0.58 1.08 -0.44 0.00 0.00 0.00 175.10 176.47 3cx6 s SER 285 N -0.72 7.13 -0.29 3.32 0.01 -1.04 -4.91 113.70 117.19 3cx6 s SER 285 Ca 0.13 1.53 -0.07 0.00 1.31 0.00 0.00 55.95 58.85 3cx6 s SER 285 Cb -0.12 -2.55 0.01 0.00 0.21 0.00 0.00 66.02 63.57 3cx6 s SER 285 CO 0.03 -0.59 0.08 -0.63 0.41 0.00 0.00 173.24 172.54 3cx6 s ILE 286 N 2.67 4.03 -0.11 1.44 -1.09 -1.26 0.91 121.20 127.79 3cx6 s ILE 286 Ca 0.49 -0.64 0.02 0.00 -2.23 0.00 0.00 60.65 58.28 3cx6 s ILE 286 Cb -0.18 -3.07 -0.01 0.00 -1.58 0.00 0.00 42.46 37.62 3cx6 s ILE 286 CO 0.14 0.09 -0.17 -0.63 -1.23 0.00 0.00 174.94 173.14 3cx6 s ILE 287 N 1.52 2.71 -0.22 2.92 1.01 0.90 -4.30 121.20 125.73 3cx6 s ILE 287 Ca 0.03 -0.79 -0.13 0.00 0.00 0.00 0.00 60.65 59.76 3cx6 s ILE 287 Cb -0.17 -2.10 -0.04 0.00 0.01 0.00 0.00 42.46 40.15 3cx6 s ILE 287 CO 0.03 0.54 0.27 -0.22 0.00 0.00 0.00 174.94 175.56 3cx6 s LEU 288 N 0.27 4.13 -0.24 2.97 2.96 -0.74 0.50 118.68 128.53 3cx6 s LEU 288 Ca -0.12 0.29 -0.05 0.00 -0.22 0.00 0.00 54.13 54.03 3cx6 s LEU 288 Cb -0.16 -2.29 -0.01 0.00 0.50 0.00 0.00 46.19 44.22 3cx6 s LEU 288 CO 0.06 -0.01 0.00 -0.36 -1.32 0.00 0.00 176.35 174.73 3cx6 s PHE 289 N 1.21 3.01 -1.00 5.38 0.08 0.65 -0.62 117.98 126.69 3cx6 s PHE 289 Ca 0.13 -0.78 -0.13 0.00 0.12 0.00 0.00 56.93 56.27 3cx6 s PHE 289 Cb -0.14 -2.16 0.22 0.00 -0.57 0.00 0.00 43.02 40.37 3cx6 s PHE 289 CO 0.06 -0.49 1.05 -0.51 -0.10 0.00 0.00 175.22 175.23 3cx6 s LEU 290 N 1.52 6.07 1.01 -0.37 1.43 0.10 -0.92 118.68 127.53 3cx6 s LEU 290 Ca 0.06 -2.95 -0.15 0.00 -1.03 0.00 0.00 54.13 50.06 3cx6 s LEU 290 Cb -0.15 -2.27 0.19 0.00 0.03 0.00 0.00 46.19 44.00 3cx6 s LEU 290 CO -0.01 -0.58 1.16 0.21 0.23 0.00 0.00 176.35 177.36 3cx6 s ASN 291 N 2.21 2.66 -1.41 2.29 2.47 0.13 -1.59 114.94 121.71 3cx6 s ASN 291 Ca 0.29 0.77 -0.08 0.00 0.42 0.00 0.00 52.86 54.25 3cx6 s ASN 291 Cb -0.08 -1.17 0.04 0.00 -1.45 0.00 0.00 41.25 38.59 3cx6 s ASN 291 CO -0.07 -3.06 1.00 0.29 -3.72 0.00 0.00 177.10 171.53 3cx6 n LYS 292 N -4.07 -6.30 -0.16 0.43 5.02 -0.96 -1.17 118.16 110.95 3cx6 n LYS 292 Ca 0.10 0.70 -0.05 0.00 -2.02 0.00 0.00 58.31 57.04 3cx6 n LYS 292 Cb 0.59 -5.60 0.14 0.00 -0.02 0.00 0.00 35.03 30.14 3cx6 n LYS 292 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 3cx6 h THR 293 N -2.22 1.24 -0.39 -0.18 2.02 -1.42 -2.06 112.91 109.89 3cx6 h THR 293 Ca -0.58 -0.93 -0.04 0.00 0.77 0.00 0.00 66.41 65.63 3cx6 h THR 293 Cb 1.37 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 68.46 3cx6 h THR 293 CO 0.60 0.34 0.08 -2.24 0.37 0.00 0.00 175.52 174.68 3cx6 h ASP 294 N 0.86 0.54 0.30 4.18 2.03 -1.90 -1.25 116.42 121.18 3cx6 h ASP 294 Ca 0.18 -0.08 -0.23 0.00 -0.73 0.00 0.00 57.03 56.17 3cx6 h ASP 294 Cb 0.38 -0.14 0.00 0.00 -0.83 0.00 0.00 39.33 38.74 3cx6 h ASP 294 CO 0.01 0.55 -0.95 -0.07 -1.03 0.00 0.00 179.24 177.75 3cx6 h LEU 295 N 0.57 0.57 -0.96 0.15 3.38 -1.82 -3.10 115.31 114.10 3cx6 h LEU 295 Ca 0.13 -0.46 -0.05 0.00 0.09 0.00 0.00 57.88 57.60 3cx6 h LEU 295 Cb 0.24 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 3cx6 h LEU 295 CO -0.00 1.25 0.21 0.25 0.09 0.00 0.00 178.44 180.25 3cx6 h LEU 296 N 0.25 0.90 -1.85 1.67 5.85 -1.00 0.29 115.31 121.41 3cx6 h LEU 296 Ca -0.08 -0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.49 3cx6 h LEU 296 Cb 1.58 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.37 3cx6 h LEU 296 CO 0.17 0.83 0.06 -0.08 -0.34 0.00 0.00 178.44 179.08 3cx6 h GLU 297 N 0.94 0.15 0.01 1.25 4.81 -1.19 -0.61 114.58 119.95 3cx6 h GLU 297 Ca 0.21 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.37 3cx6 h GLU 297 Cb 0.25 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.59 3cx6 h GLU 297 CO -0.01 0.12 -0.31 0.93 -0.73 0.00 0.00 179.01 179.01 3cx6 h GLU 298 N 0.16 0.03 -0.39 1.92 5.08 -1.25 -3.40 114.58 116.73 3cx6 h GLU 298 Ca 0.04 -0.05 0.03 0.00 -1.00 0.00 0.00 59.36 58.38 3cx6 h GLU 298 Cb 0.01 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 3cx6 h GLU 298 CO -0.01 1.02 0.19 -0.22 -1.00 0.00 0.00 179.01 179.00 3cx6 h LYS 299 N -0.94 0.38 -0.28 2.33 3.64 -0.59 -2.73 116.57 118.38 3cx6 h LYS 299 Ca -0.08 -0.02 0.08 0.00 -1.27 0.00 0.00 60.65 59.36 3cx6 h LYS 299 Cb 1.12 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.84 3cx6 h LYS 299 CO -0.02 0.25 0.49 -0.39 -2.27 0.00 0.00 179.45 177.51 3cx6 h VAL 300 N 0.40 0.19 0.00 2.00 -1.51 -1.31 -0.02 116.25 115.99 3cx6 h VAL 300 Ca 0.16 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.63 3cx6 h VAL 300 Cb 0.07 0.57 0.00 0.00 -2.13 0.00 0.00 31.29 29.80 3cx6 h VAL 300 CO -0.11 0.00 -0.15 0.00 -1.23 0.00 0.00 177.57 176.08 3cx6 n GLN 301 N -3.30 0.13 0.00 5.19 6.02 -1.03 -4.15 117.38 120.24 3cx6 n GLN 301 Ca 0.05 0.09 0.00 0.00 -0.01 0.00 0.00 57.00 57.12 3cx6 n GLN 301 Cb 0.62 -1.63 0.00 0.00 1.02 0.00 0.00 30.24 30.25 3cx6 n GLN 301 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 3cx6 n VAL 302 N -1.85 0.00 -4.13 5.09 0.24 -0.15 -5.06 118.33 112.47 3cx6 n VAL 302 Ca 0.06 -0.21 -0.15 0.00 -2.04 0.00 0.00 64.34 61.99 3cx6 n VAL 302 Cb 0.39 0.77 -0.11 0.00 -1.47 0.00 0.00 33.84 33.41 3cx6 n VAL 302 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3cx6 s VAL 303 N -0.86 0.84 -0.16 3.34 1.01 -0.42 -5.14 120.40 119.01 3cx6 s VAL 303 Ca 0.00 -1.28 0.00 0.00 0.00 0.00 0.00 61.98 60.71 3cx6 s VAL 303 Cb 0.00 -0.93 0.00 0.00 0.00 0.00 0.00 36.38 35.45 3cx6 s VAL 303 CO 0.00 -0.35 -0.16 -0.55 0.00 0.00 0.00 175.10 174.03 3cx6 s SER 304 N -1.81 3.54 0.63 3.32 0.15 -1.26 -4.31 113.70 113.97 3cx6 s SER 304 Ca -0.04 -0.51 0.39 0.00 0.70 0.00 0.00 55.95 56.49 3cx6 s SER 304 Cb -0.09 -1.54 2.16 0.00 -1.71 0.00 0.00 66.02 64.84 3cx6 s SER 304 CO 0.01 0.07 2.31 -0.29 1.20 0.00 0.00 173.24 176.54 3cx6 h ILE 305 N 5.73 0.20 -0.84 6.45 2.10 -1.94 -1.31 117.51 127.90 3cx6 h ILE 305 Ca -0.35 -0.04 0.09 0.00 1.08 0.00 0.00 64.86 65.64 3cx6 h ILE 305 Cb 1.18 1.03 -0.06 0.00 -1.09 0.00 0.00 36.82 37.89 3cx6 h ILE 305 CO 0.58 0.01 0.55 0.50 -1.08 0.00 0.00 178.15 178.70 3cx6 h LYS 306 N 0.00 0.80 0.00 2.19 3.11 -1.93 0.12 116.57 120.86 3cx6 h LYS 306 Ca -0.00 -0.05 0.00 0.00 -2.81 0.00 0.00 60.65 57.79 3cx6 h LYS 306 Cb 0.03 -0.18 0.00 0.00 -1.00 0.00 0.00 32.23 31.08 3cx6 h LYS 306 CO 0.00 0.53 0.00 -0.25 -2.81 0.00 0.00 179.45 176.92 3cx6 n ASP 307 N -4.51 0.00 -0.01 4.20 8.00 -0.49 -3.35 116.55 120.39 3cx6 n ASP 307 Ca 0.14 0.34 -0.01 0.00 0.71 0.00 0.00 54.79 55.98 3cx6 n ASP 307 Cb 0.29 -0.42 -0.01 0.00 -0.02 0.00 0.00 41.12 40.96 3cx6 n ASP 307 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3cx6 n TYR 308 N -1.42 0.00 -3.69 1.24 4.02 -0.01 -4.96 117.16 112.34 3cx6 n TYR 308 Ca 0.05 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 57.65 3cx6 n TYR 308 Cb 0.15 -0.08 -0.15 0.00 -0.02 0.00 0.00 39.34 39.24 3cx6 n TYR 308 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 3cx6 s PHE 309 N -2.05 1.22 0.18 -0.72 0.40 0.21 -5.02 117.98 112.19 3cx6 s PHE 309 Ca -0.01 -1.32 -0.13 0.00 -0.60 0.00 0.00 56.93 54.88 3cx6 s PHE 309 Cb 0.01 -1.35 0.18 0.00 0.51 0.00 0.00 43.02 42.37 3cx6 s PHE 309 CO 0.07 -0.80 1.71 -0.07 0.70 0.00 0.00 175.22 176.84 3cx6 h LEU 310 N 8.20 -0.01 -1.15 -0.37 3.38 -1.84 -2.18 115.31 121.34 3cx6 h LEU 310 Ca -0.16 0.09 0.33 0.00 0.09 0.00 0.00 57.88 58.23 3cx6 h LEU 310 Cb 1.04 0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.87 3cx6 h LEU 310 CO 0.43 0.02 1.19 -0.62 0.09 0.00 0.00 178.44 179.56 3cx6 n GLU 311 N -5.12 0.01 -1.93 1.13 4.71 -1.26 -4.51 120.64 113.67 3cx6 n GLU 311 Ca 0.05 0.97 -0.42 0.00 -0.01 0.00 0.00 57.16 57.76 3cx6 n GLU 311 Cb 0.24 -2.38 -0.03 0.00 -1.01 0.00 0.00 31.44 28.26 3cx6 n GLU 311 CO 0.00 0.00 0.00 0.12 0.09 0.00 0.00 177.13 177.34 3cx6 s PHE 312 N -4.38 3.04 -0.14 -0.32 5.36 -0.82 -5.00 117.98 115.71 3cx6 s PHE 312 Ca -0.03 0.68 -0.04 0.00 -0.96 0.00 0.00 56.93 56.58 3cx6 s PHE 312 Cb 0.16 -3.93 0.06 0.00 -0.34 0.00 0.00 43.02 38.97 3cx6 s PHE 312 CO 0.52 -3.37 0.15 -1.83 -1.46 0.00 0.00 175.22 169.23 3cx6 s GLU 313 N 0.86 0.08 0.00 10.12 1.03 -1.26 -4.97 118.70 124.56 3cx6 s GLU 313 Ca 0.68 0.24 0.00 0.00 0.03 0.00 0.00 54.97 55.93 3cx6 s GLU 313 Cb -0.44 -1.05 0.00 0.00 -0.80 0.00 0.00 34.13 31.84 3cx6 s GLU 313 CO 0.34 -0.53 0.00 0.41 -1.33 0.00 0.00 175.26 174.15 3cx6 n GLY 314 N 5.31 -0.77 3.58 -3.83 0.00 -1.26 -5.06 105.19 103.15 3cx6 n GLY 314 Ca -0.05 -1.45 -0.42 0.00 0.00 0.00 0.00 46.02 44.09 3cx6 n GLY 314 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3cx6 s ASP 315 N -3.51 6.45 0.22 1.61 3.68 -1.26 -4.87 116.67 119.00 3cx6 s ASP 315 Ca 0.00 0.09 0.20 0.00 2.13 0.00 0.00 52.55 54.98 3cx6 s ASP 315 Cb 0.00 -2.54 0.92 0.00 -1.45 0.00 0.00 42.92 39.85 3cx6 s ASP 315 CO 0.00 -1.43 1.62 -0.81 0.13 0.00 0.00 175.17 174.68 3cx6 n PRO 316 N 8.28 0.14 0.00 4.34 -0.04 -1.26 -1.19 135.00 145.27 3cx6 n PRO 316 Ca 0.08 0.46 0.14 0.00 -0.04 0.00 0.00 63.50 64.13 3cx6 n PRO 316 Cb 0.49 -1.82 0.46 0.00 -0.04 0.00 0.00 33.50 32.58 3cx6 n PRO 316 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 3cx6 n HIS 317 N -2.10 0.00 -3.91 0.54 -0.00 -1.26 -4.68 115.22 103.81 3cx6 n HIS 317 Ca 0.01 0.00 -0.36 0.00 0.46 0.00 0.00 57.72 57.84 3cx6 n HIS 317 Cb 0.16 -0.06 -0.12 0.00 -0.12 0.00 0.00 29.99 29.85 3cx6 n HIS 317 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 3cx6 h LEU 319 N 7.81 -0.27 -1.15 0.00 5.85 -1.88 -2.48 115.31 123.18 3cx6 h LEU 319 Ca -0.37 0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.48 3cx6 h LEU 319 Cb 1.17 0.16 -0.06 0.00 0.37 0.00 0.00 40.66 42.31 3cx6 h LEU 319 CO 0.60 -0.10 0.59 0.03 -0.34 0.00 0.00 178.44 179.21 3cx6 h ARG 320 N -0.04 1.00 -0.38 1.25 3.08 -1.95 -0.13 114.38 117.20 3cx6 h ARG 320 Ca 0.11 -0.06 -0.08 0.00 0.07 0.00 0.00 59.98 60.02 3cx6 h ARG 320 Cb 0.21 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 3cx6 h ARG 320 CO -0.24 0.66 -0.07 -0.44 -1.07 0.00 0.00 179.97 178.81 3cx6 h ASP 321 N 1.03 0.72 -0.08 7.04 5.19 -1.75 -2.48 116.42 126.09 3cx6 h ASP 321 Ca 0.39 -0.35 -0.18 0.00 -0.62 0.00 0.00 57.03 56.27 3cx6 h ASP 321 Cb 0.19 -0.20 -0.00 0.00 0.18 0.00 0.00 39.33 39.50 3cx6 h ASP 321 CO -0.14 0.90 -0.61 0.58 -3.12 0.00 0.00 179.24 176.85 3cx6 h VAL 322 N 0.53 1.30 -0.90 -1.35 2.07 -1.10 -2.80 116.25 114.01 3cx6 h VAL 322 Ca 0.10 -1.85 -0.00 0.00 0.82 0.00 0.00 66.70 65.77 3cx6 h VAL 322 Cb 0.57 1.80 -0.04 0.00 -1.52 0.00 0.00 31.29 32.10 3cx6 h VAL 322 CO 0.03 0.58 0.56 1.56 0.02 0.00 0.00 177.57 180.33 3cx6 h GLN 323 N 0.51 1.21 -0.39 1.57 4.20 -0.98 -1.49 115.11 119.74 3cx6 h GLN 323 Ca -0.01 -0.10 -0.09 0.00 0.06 0.00 0.00 58.65 58.52 3cx6 h GLN 323 Cb 1.19 -0.26 -0.01 0.00 0.30 0.00 0.00 27.48 28.70 3cx6 h GLN 323 CO 0.12 0.83 -0.10 0.87 -0.67 0.00 0.00 178.83 179.88 3cx6 h LYS 324 N 1.24 0.75 -0.41 1.46 1.57 -1.39 -1.46 116.57 118.33 3cx6 h LYS 324 Ca 0.33 -0.29 0.04 0.00 -1.87 0.00 0.00 60.65 58.86 3cx6 h LYS 324 Cb -0.09 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.15 3cx6 h LYS 324 CO -0.06 0.89 0.18 0.35 -0.57 0.00 0.00 179.45 180.24 3cx6 h PHE 325 N 0.55 0.33 -0.05 -1.35 3.57 -1.21 0.76 116.94 119.54 3cx6 h PHE 325 Ca 0.10 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.63 3cx6 h PHE 325 Cb 0.62 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.26 3cx6 h PHE 325 CO 0.05 0.16 -0.04 -0.07 -2.23 0.00 0.00 178.31 176.18 3cx6 h LEU 326 N 0.37 -0.13 -0.28 0.59 3.38 -1.10 -0.24 115.31 117.90 3cx6 h LEU 326 Ca 0.18 0.03 0.05 0.00 0.09 0.00 0.00 57.88 58.23 3cx6 h LEU 326 Cb 0.12 0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.89 3cx6 h LEU 326 CO -0.15 -0.06 -0.03 0.58 0.09 0.00 0.00 178.44 178.88 3cx6 h VAL 327 N -0.05 0.77 -0.92 1.22 2.07 -0.76 -1.88 116.25 116.70 3cx6 h VAL 327 Ca 0.04 -0.02 0.01 0.00 0.82 0.00 0.00 66.70 67.55 3cx6 h VAL 327 Cb 0.10 0.71 -0.05 0.00 -1.52 0.00 0.00 31.29 30.54 3cx6 h VAL 327 CO -0.08 0.01 0.61 -0.33 0.02 0.00 0.00 177.57 177.79 3cx6 h GLU 328 N 0.05 1.19 -0.91 1.57 5.08 -0.58 -1.25 114.58 119.73 3cx6 h GLU 328 Ca 0.13 -0.07 0.05 0.00 -1.00 0.00 0.00 59.36 58.47 3cx6 h GLU 328 Cb 0.19 -0.27 -0.06 0.00 0.50 0.00 0.00 28.75 29.11 3cx6 h GLU 328 CO -0.25 0.79 0.58 0.00 -1.00 0.00 0.00 179.01 179.13 3cx6 h PHE 330 N 1.10 0.63 -0.50 0.00 -1.00 -0.78 -3.22 116.94 113.15 3cx6 h PHE 330 Ca 0.38 -0.41 -0.11 0.00 2.81 0.00 0.00 57.97 60.64 3cx6 h PHE 330 Cb 0.09 -0.04 -0.02 0.00 3.61 0.00 0.00 35.95 39.59 3cx6 h PHE 330 CO -0.02 1.27 -0.12 0.00 -1.61 0.00 0.00 178.31 177.84 3cx6 h ARG 331 N 0.16 0.97 -0.32 1.51 3.08 -0.97 -2.64 114.38 116.17 3cx6 h ARG 331 Ca -0.13 -0.37 0.09 0.00 0.07 0.00 0.00 59.98 59.64 3cx6 h ARG 331 Cb 1.84 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.82 3cx6 h ARG 331 CO 0.20 1.04 0.52 0.78 -1.07 0.00 0.00 179.97 181.44 3cx6 h GLY 332 N 0.83 0.00 2.00 0.04 0.00 0.06 -0.17 103.07 105.84 3cx6 h GLY 332 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.46 3cx6 h GLY 332 CO 0.05 0.00 0.00 0.50 0.00 0.00 0.00 176.54 177.09 3cx6 h LYS 333 N 0.00 0.00 -7.10 4.80 1.79 -1.50 -3.46 116.57 111.10 3cx6 h LYS 333 Ca 0.15 0.00 -0.50 0.00 -2.18 0.00 0.00 60.65 58.12 3cx6 h LYS 333 Cb 1.19 0.00 0.08 0.00 -1.58 0.00 0.00 32.23 31.91 3cx6 h LYS 333 CO -0.00 0.00 0.43 1.03 -1.08 0.00 0.00 179.45 179.83 3cx6 s ARG 334 N -3.18 3.29 -0.46 3.15 0.52 -0.08 -4.89 118.95 117.31 3cx6 s ARG 334 Ca 0.09 1.61 0.06 0.00 -0.52 0.00 0.00 55.73 56.97 3cx6 s ARG 334 Cb 0.10 -2.00 0.22 0.00 0.52 0.00 0.00 34.95 33.79 3cx6 s ARG 334 CO 0.60 -0.90 0.50 0.54 0.02 0.00 0.00 175.30 176.06 3cx6 n ARG 335 N -1.41 0.91 0.00 3.54 3.00 -1.26 -5.11 116.66 116.34 3cx6 n ARG 335 Ca 0.12 -3.52 0.00 0.00 -0.01 0.00 0.00 57.85 54.44 3cx6 n ARG 335 Cb 0.51 -1.58 0.00 0.00 0.00 0.00 0.00 32.46 31.39 3cx6 n ARG 335 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.63 177.23 3cx6 n ASP 336 N 1.78 0.00 -0.99 0.55 3.85 -1.26 -5.05 116.55 115.43 3cx6 n ASP 336 Ca 0.25 0.00 0.00 0.00 -0.71 0.00 0.00 54.79 54.33 3cx6 n ASP 336 Cb 0.48 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.25 3cx6 n ASP 336 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.20 175.05 3cx6 n ARG 340 N 0.00 0.00 -3.73 0.11 0.00 -1.26 -5.30 116.66 106.47 3cx6 n ARG 340 Ca 0.00 0.45 -0.20 0.00 -0.00 0.00 0.00 57.85 58.10 3cx6 n ARG 340 Cb 0.00 -0.54 -0.02 0.00 0.00 0.00 0.00 32.46 31.91 3cx6 n ARG 340 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 3cx6 s PRO 341 N -1.73 3.15 -0.26 -0.14 0.04 -1.26 -5.11 135.00 129.69 3cx6 s PRO 341 Ca 0.00 -0.98 0.02 0.00 0.04 0.00 0.00 61.00 60.08 3cx6 s PRO 341 Cb 0.00 -2.77 0.07 0.00 0.04 0.00 0.00 34.50 31.84 3cx6 s PRO 341 CO 0.00 0.21 -0.05 -1.17 0.04 0.00 0.00 177.00 176.03 3cx6 s LEU 342 N -4.06 3.13 0.15 -3.56 2.96 -1.26 -4.87 118.68 111.17 3cx6 s LEU 342 Ca 0.40 -1.39 -0.16 0.00 -0.22 0.00 0.00 54.13 52.75 3cx6 s LEU 342 Cb -0.09 -1.35 -0.07 0.00 0.50 0.00 0.00 46.19 45.18 3cx6 s LEU 342 CO 0.29 -0.25 0.60 -0.31 -1.32 0.00 0.00 176.35 175.37 3cx6 s TYR 343 N 1.24 3.65 0.15 5.38 2.02 -1.26 -5.00 117.35 123.54 3cx6 s TYR 343 Ca -0.04 1.18 0.03 0.00 -0.37 0.00 0.00 57.07 57.87 3cx6 s TYR 343 Cb -0.19 -2.46 -0.05 0.00 -0.40 0.00 0.00 41.96 38.87 3cx6 s TYR 343 CO -0.07 0.43 -0.07 -3.38 -1.57 0.00 0.00 175.55 170.90 3cx6 s HIS 344 N -1.42 1.22 -0.10 2.71 -3.43 -1.26 -1.79 115.29 111.22 3cx6 s HIS 344 Ca 0.38 -0.85 -0.09 0.00 -0.80 0.00 0.00 55.06 53.70 3cx6 s HIS 344 Cb -0.16 -0.66 0.03 0.00 -1.43 0.00 0.00 32.58 30.36 3cx6 s HIS 344 CO 0.20 -0.02 0.26 -1.01 -2.00 0.00 0.00 174.74 172.17 3cx6 s HIS 345 N -3.44 -0.30 -0.39 0.38 3.76 0.21 -4.95 115.29 110.56 3cx6 s HIS 345 Ca 0.18 0.72 -0.18 0.00 -0.15 0.00 0.00 55.06 55.63 3cx6 s HIS 345 Cb 0.04 0.10 0.01 0.00 1.11 0.00 0.00 32.58 33.83 3cx6 s HIS 345 CO 0.01 -0.15 0.49 -0.06 -0.85 0.00 0.00 174.74 174.18 3cx6 s PHE 346 N 0.28 3.16 0.42 1.40 2.99 -1.26 0.01 117.98 124.98 3cx6 s PHE 346 Ca -0.01 -0.07 0.06 0.00 0.00 0.00 0.00 56.93 56.91 3cx6 s PHE 346 Cb -0.03 -2.95 -0.07 0.00 0.00 0.00 0.00 43.02 39.98 3cx6 s PHE 346 CO -0.01 -0.63 0.01 0.95 -0.00 0.00 0.00 175.22 175.55 3cx6 s THR 347 N 2.32 1.85 -0.37 0.64 -4.23 -0.62 -4.94 115.64 110.29 3cx6 s THR 347 Ca 0.16 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.69 3cx6 s THR 347 Cb -0.16 -2.89 0.15 0.00 1.34 0.00 0.00 72.50 70.94 3cx6 s THR 347 CO 0.14 0.00 0.28 -0.89 -0.54 0.00 0.00 174.62 173.61 3cx6 s THR 348 N -2.77 0.11 0.44 3.99 2.01 -1.26 -1.43 115.64 116.73 3cx6 s THR 348 Ca 0.32 -1.87 0.26 0.00 0.31 0.00 0.00 61.69 60.71 3cx6 s THR 348 Cb 0.09 -1.07 0.46 0.00 0.01 0.00 0.00 72.50 71.99 3cx6 s THR 348 CO 0.16 -0.99 1.72 0.00 -0.69 0.00 0.00 174.62 174.82 3cx6 h ALA 349 N 6.58 2.60 0.00 7.40 0.00 -1.95 0.28 119.26 134.17 3cx6 h ALA 349 Ca 0.12 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3cx6 h ALA 349 Cb 0.97 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.86 3cx6 h ALA 349 CO 0.28 -1.08 0.00 0.44 0.00 0.00 0.00 179.25 178.89 3cx6 n ILE 350 N -4.55 0.07 -3.21 0.00 -5.35 -1.26 -4.62 119.36 100.44 3cx6 n ILE 350 Ca 0.30 0.02 -0.44 0.00 -0.27 0.00 0.00 62.75 62.36 3cx6 n ILE 350 Cb 1.16 -0.54 -0.06 0.00 -1.74 0.00 0.00 39.64 38.45 3cx6 n ILE 350 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 3cx6 s ASN 351 N -2.66 6.20 0.16 7.28 3.84 0.99 -4.95 114.94 125.80 3cx6 s ASN 351 Ca 0.24 -1.07 -0.17 0.00 0.21 0.00 0.00 52.86 52.08 3cx6 s ASN 351 Cb 0.19 -2.26 0.07 0.00 -0.55 0.00 0.00 41.25 38.70 3cx6 s ASN 351 CO 0.45 -0.85 1.71 0.74 -2.79 0.00 0.00 177.10 176.36 3cx6 h THR 352 N 5.84 0.78 -0.52 -5.21 2.02 -1.83 -1.69 112.91 112.29 3cx6 h THR 352 Ca -0.28 -0.05 -0.01 0.00 0.77 0.00 0.00 66.41 66.84 3cx6 h THR 352 Cb 1.10 0.63 -0.03 0.00 -1.74 0.00 0.00 68.15 68.11 3cx6 h THR 352 CO 0.96 0.02 0.27 -0.33 0.37 0.00 0.00 175.52 176.81 3cx6 h GLU 353 N 0.13 0.72 -0.22 6.66 4.39 -1.95 0.04 114.58 124.36 3cx6 h GLU 353 Ca 0.17 -0.08 -0.16 0.00 0.34 0.00 0.00 59.36 59.63 3cx6 h GLU 353 Cb 0.22 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.71 3cx6 h GLU 353 CO -0.26 0.54 -0.51 -0.97 -1.16 0.00 0.00 179.01 176.66 3cx6 h ASN 354 N 0.73 0.67 1.16 1.42 -0.73 -1.75 -2.90 115.58 114.19 3cx6 h ASN 354 Ca 0.19 -0.34 -0.10 0.00 1.87 0.00 0.00 56.30 57.91 3cx6 h ASN 354 Cb 0.04 -0.19 -0.01 0.00 0.27 0.00 0.00 38.32 38.43 3cx6 h ASN 354 CO -0.03 1.06 -0.49 0.40 -0.37 0.00 0.00 177.43 178.01 3cx6 h ILE 355 N 0.48 0.94 -0.17 2.57 1.08 -0.87 -2.14 117.51 119.40 3cx6 h ILE 355 Ca 0.02 -2.01 -0.01 0.00 -0.39 0.00 0.00 64.86 62.47 3cx6 h ILE 355 Cb 1.05 2.24 -0.01 0.00 -3.07 0.00 0.00 36.82 37.03 3cx6 h ILE 355 CO 0.10 0.48 0.05 -0.09 -0.69 0.00 0.00 178.15 178.00 3cx6 h ARG 356 N 0.00 0.27 0.06 2.37 2.43 -0.80 -1.86 114.38 116.85 3cx6 h ARG 356 Ca -0.00 -0.06 -0.24 0.00 -0.81 0.00 0.00 59.98 58.87 3cx6 h ARG 356 Cb 1.20 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.70 3cx6 h ARG 356 CO 0.06 0.38 -1.11 1.37 -1.51 0.00 0.00 179.97 179.17 3cx6 h LEU 357 N 0.10 0.22 -0.39 3.80 8.10 -1.52 -3.02 115.31 122.61 3cx6 h LEU 357 Ca 0.06 -0.24 -0.04 0.00 0.11 0.00 0.00 57.88 57.77 3cx6 h LEU 357 Cb 0.23 -0.07 -0.02 0.00 -0.44 0.00 0.00 40.66 40.36 3cx6 h LEU 357 CO -0.00 1.17 0.10 0.58 -4.11 0.00 0.00 178.44 176.18 3cx6 h VAL 358 N 0.04 1.22 0.00 0.15 2.07 -1.39 -2.36 116.25 115.99 3cx6 h VAL 358 Ca -0.07 -0.76 -0.03 0.00 0.82 0.00 0.00 66.70 66.66 3cx6 h VAL 358 Cb 1.85 0.98 -0.00 0.00 -1.52 0.00 0.00 31.29 32.60 3cx6 h VAL 358 CO 0.17 0.26 -0.14 0.15 0.02 0.00 0.00 177.57 178.03 3cx6 h PHE 359 N 0.48 0.00 -0.44 1.57 3.57 -1.40 -0.81 116.94 119.92 3cx6 h PHE 359 Ca 0.12 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.66 3cx6 h PHE 359 Cb 0.30 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.00 3cx6 h PHE 359 CO 0.02 0.14 0.21 -0.09 -2.23 0.00 0.00 178.31 176.36 3cx6 h ARG 360 N 0.00 0.42 -0.47 1.11 9.65 -1.29 0.33 114.38 124.14 3cx6 h ARG 360 Ca -0.00 -0.03 -0.11 0.00 -1.10 0.00 0.00 59.98 58.74 3cx6 h ARG 360 Cb 0.29 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 28.76 3cx6 h ARG 360 CO 0.02 0.28 -0.14 -0.44 2.80 0.00 0.00 179.97 182.49 3cx6 h ASP 361 N 0.43 0.93 -0.12 -3.80 3.32 -1.01 -2.49 116.42 113.67 3cx6 h ASP 361 Ca 0.19 -0.37 0.01 0.00 0.02 0.00 0.00 57.03 56.87 3cx6 h ASP 361 Cb 0.10 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 3cx6 h ASP 361 CO -0.14 1.08 0.06 0.58 -1.72 0.00 0.00 179.24 179.11 3cx6 h VAL 362 N 0.76 1.00 -0.26 -1.35 2.07 -0.58 -0.10 116.25 117.78 3cx6 h VAL 362 Ca 0.11 -0.05 0.04 0.00 0.82 0.00 0.00 66.70 67.63 3cx6 h VAL 362 Cb 0.69 0.86 -0.04 0.00 -1.52 0.00 0.00 31.29 31.28 3cx6 h VAL 362 CO 0.05 0.02 0.03 0.50 0.02 0.00 0.00 177.57 178.19 3cx6 h LYS 363 N 0.13 0.11 -0.34 1.57 3.64 -0.29 0.10 116.57 121.50 3cx6 h LYS 363 Ca 0.05 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.35 3cx6 h LYS 363 Cb 0.01 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.78 3cx6 h LYS 363 CO -0.03 0.07 -0.10 -0.44 -2.27 0.00 0.00 179.45 176.68 3cx6 h ASP 364 N 0.12 0.56 0.55 4.20 3.32 -1.27 0.36 116.42 124.25 3cx6 h ASP 364 Ca 0.12 -0.15 -0.03 0.00 0.02 0.00 0.00 57.03 57.00 3cx6 h ASP 364 Cb 0.14 -0.15 0.01 0.00 0.22 0.00 0.00 39.33 39.55 3cx6 h ASP 364 CO -0.18 0.70 -0.27 0.74 -1.72 0.00 0.00 179.24 178.51 3cx6 h THR 365 N 0.53 0.41 -0.45 0.35 2.02 -0.42 -1.85 112.91 113.51 3cx6 h THR 365 Ca 0.10 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 67.06 3cx6 h THR 365 Cb 0.50 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 67.38 3cx6 h THR 365 CO 0.03 0.03 0.29 0.40 0.37 0.00 0.00 175.52 176.64 3cx6 h ILE 366 N -0.89 1.12 0.00 3.11 2.04 -0.89 -1.84 117.51 120.16 3cx6 h ILE 366 Ca -0.08 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.54 3cx6 h ILE 366 Cb 0.62 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 37.18 3cx6 h ILE 366 CO 0.12 0.12 0.00 0.18 0.00 0.00 0.00 178.15 178.57 3cx6 n LEU 367 N -4.76 0.14 -1.25 1.44 4.77 0.12 -1.80 117.00 115.66 3cx6 n LEU 367 Ca 0.01 0.55 -0.05 0.00 -0.03 0.00 0.00 56.01 56.49 3cx6 n LEU 367 Cb 0.03 -0.55 0.20 0.00 -2.33 0.00 0.00 43.42 40.77 3cx6 n LEU 367 CO 0.35 -0.47 0.75 1.41 -1.33 0.00 0.00 177.39 178.10 3cx6 n HIS 368 N -1.68 1.28 -0.52 -1.77 8.25 -0.70 -5.04 115.22 115.04 3cx6 n HIS 368 Ca 0.01 -1.55 0.00 0.00 -0.26 0.00 0.00 57.72 55.92 3cx6 n HIS 368 Cb 0.09 -0.52 0.00 0.00 1.12 0.00 0.00 29.99 30.68 3cx6 n HIS 368 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73