#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ku2 s ALA 45 N 0.00 2.48 -0.03 6.98 0.00 -1.26 -5.14 121.76 124.79 3ku2 s ALA 45 Ca 0.00 -0.97 0.07 0.00 0.00 0.00 0.00 51.96 51.06 3ku2 s ALA 45 Cb 0.00 -0.95 -0.02 0.00 0.00 0.00 0.00 23.12 22.15 3ku2 s ALA 45 CO 0.00 0.41 -0.24 0.96 0.00 0.00 0.00 175.76 176.89 3ku2 s ILE 46 N -0.20 2.22 0.12 0.00 -4.36 -1.26 -4.69 121.20 113.04 3ku2 s ILE 46 Ca -0.01 -1.04 -0.27 0.00 -0.26 0.00 0.00 60.65 59.07 3ku2 s ILE 46 Cb -0.13 -1.79 -0.06 0.00 1.25 0.00 0.00 42.46 41.72 3ku2 s ILE 46 CO 0.03 0.58 1.63 0.15 0.24 0.00 0.00 174.94 177.57 3ku2 h PHE 47 N 5.52 -0.77 0.00 1.37 3.57 -1.97 -3.16 116.94 121.51 3ku2 h PHE 47 Ca -0.42 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.09 3ku2 h PHE 47 Cb 1.13 0.33 -0.00 0.00 2.79 0.00 0.00 35.95 40.20 3ku2 h PHE 47 CO 0.41 -0.38 -0.04 0.66 -2.23 0.00 0.00 178.31 176.74 3ku2 h SER 48 N -0.45 0.00 1.16 0.41 4.64 -1.99 -1.78 113.55 115.53 3ku2 h SER 48 Ca 0.05 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.31 3ku2 h SER 48 Cb 0.52 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.60 3ku2 h SER 48 CO -0.22 0.04 -0.27 0.44 -0.87 0.00 0.00 176.83 175.95 3ku2 h ASP 49 N 0.00 0.00 0.00 4.97 3.32 -2.00 -3.35 116.42 119.36 3ku2 h ASP 49 Ca -0.00 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 3ku2 h ASP 49 Cb 0.11 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 3ku2 h ASP 49 CO 0.00 0.27 -1.78 -1.14 -1.72 0.00 0.00 179.24 174.88 3ku2 n ARG 50 N -3.32 1.05 -4.21 3.56 3.00 -0.95 -4.88 116.66 110.91 3ku2 n ARG 50 Ca 0.01 -0.08 -0.13 0.00 -0.00 0.00 0.00 57.85 57.65 3ku2 n ARG 50 Cb 0.51 -1.35 -0.10 0.00 0.00 0.00 0.00 32.46 31.52 3ku2 n ARG 50 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 3ku2 s TYR 51 N -2.71 1.09 -0.05 -0.14 1.51 -0.71 -1.56 117.35 114.78 3ku2 s TYR 51 Ca -0.06 -0.80 0.01 0.00 -1.01 0.00 0.00 57.07 55.21 3ku2 s TYR 51 Cb 0.07 -0.58 0.02 0.00 -0.11 0.00 0.00 41.96 41.36 3ku2 s TYR 51 CO 0.58 -0.02 -0.04 -1.59 -1.11 0.00 0.00 175.55 173.38 3ku2 s LYS 52 N -3.63 0.79 0.06 -0.62 0.00 -0.77 -4.47 119.74 111.10 3ku2 s LYS 52 Ca 0.13 -0.07 -0.31 0.00 0.00 0.00 0.00 55.97 55.73 3ku2 s LYS 52 Cb 0.03 -0.86 -0.07 0.00 0.00 0.00 0.00 37.83 36.92 3ku2 s LYS 52 CO -0.02 -0.12 1.44 0.20 0.00 0.00 0.00 175.35 176.85 3ku2 s GLY 53 N 1.11 1.84 -0.25 0.59 0.00 -1.26 -1.68 107.32 107.67 3ku2 s GLY 53 Ca -0.08 1.04 -0.14 0.00 0.00 0.00 0.00 44.72 45.54 3ku2 s GLY 53 CO -0.01 2.51 -0.13 -1.06 0.00 0.00 0.00 173.10 174.42 3ku2 n GLN 54 N 4.81 0.60 -3.50 2.90 6.02 0.12 -4.96 117.38 123.36 3ku2 n GLN 54 Ca 0.13 0.35 -0.09 0.00 -0.01 0.00 0.00 57.00 57.38 3ku2 n GLN 54 Cb 0.42 -1.59 -0.02 0.00 1.02 0.00 0.00 30.24 30.08 3ku2 n GLN 54 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 3ku2 s ARG 55 N -2.47 0.83 0.00 -1.09 1.70 -1.14 -5.03 118.95 111.75 3ku2 s ARG 55 Ca -0.34 -0.30 -0.29 0.00 -0.47 0.00 0.00 55.73 54.33 3ku2 s ARG 55 Cb 0.11 0.38 -0.03 0.00 -0.57 0.00 0.00 34.95 34.84 3ku2 s ARG 55 CO 0.55 -0.36 0.93 0.08 -1.08 0.00 0.00 175.30 175.42 3ku2 s VAL 56 N -3.10 4.86 -0.15 4.99 1.01 -1.26 -0.02 120.40 126.72 3ku2 s VAL 56 Ca 0.05 1.97 0.20 0.00 0.00 0.00 0.00 61.98 64.19 3ku2 s VAL 56 Cb -0.01 -4.28 -0.13 0.00 0.00 0.00 0.00 36.38 31.96 3ku2 s VAL 56 CO -0.09 0.19 0.79 0.18 0.00 0.00 0.00 175.10 176.17 3ku2 n LEU 57 N 3.75 0.67 0.00 3.92 4.77 0.38 -4.84 117.00 125.65 3ku2 n LEU 57 Ca 0.04 0.28 0.00 0.00 -0.03 0.00 0.00 56.01 56.30 3ku2 n LEU 57 Cb 0.51 0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.65 3ku2 n LEU 57 CO 0.51 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 3ku2 n GLY 58 N 1.33 0.16 3.05 -0.72 0.00 -0.86 -4.99 105.19 103.16 3ku2 n GLY 58 Ca -0.07 -1.34 -0.16 0.00 0.00 0.00 0.00 46.02 44.44 3ku2 n GLY 58 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3ku2 s LYS 59 N -1.91 0.62 0.00 1.61 2.47 -1.26 -0.20 119.74 121.08 3ku2 s LYS 59 Ca 0.00 -0.56 0.00 0.00 -1.56 0.00 0.00 55.97 53.85 3ku2 s LYS 59 Cb 0.00 -0.54 0.00 0.00 -1.46 0.00 0.00 37.83 35.83 3ku2 s LYS 59 CO 0.00 0.13 0.00 0.41 0.16 0.00 0.00 175.35 176.05 3ku2 n GLY 60 N 2.12 4.35 0.24 5.54 0.00 -0.28 -4.99 105.19 112.17 3ku2 n GLY 60 Ca -0.18 -1.24 0.09 0.00 0.00 0.00 0.00 46.02 44.70 3ku2 n GLY 60 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3ku2 h SER 61 N 0.00 0.00 0.36 1.61 4.64 -1.94 -3.21 113.55 115.01 3ku2 h SER 61 Ca 0.00 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.18 3ku2 h SER 61 Cb 0.00 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 3ku2 h SER 61 CO 0.00 0.19 -1.77 0.49 -0.87 0.00 0.00 176.83 174.87 3ku2 n PHE 62 N -3.85 0.45 0.00 4.77 3.72 -1.26 -3.35 117.46 117.94 3ku2 n PHE 62 Ca -0.02 0.15 0.00 0.00 -0.05 0.00 0.00 57.45 57.53 3ku2 n PHE 62 Cb 0.28 -0.87 0.00 0.00 -0.94 0.00 0.00 39.48 37.95 3ku2 n PHE 62 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3ku2 n GLY 63 N 1.41 -0.30 3.85 1.37 0.00 -1.22 -4.35 105.19 105.96 3ku2 n GLY 63 Ca -0.12 -0.76 -0.33 0.00 0.00 0.00 0.00 46.02 44.80 3ku2 n GLY 63 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ku2 s GLU 64 N -2.00 3.28 -0.29 1.61 2.02 -1.05 -1.12 118.70 121.14 3ku2 s GLU 64 Ca 0.00 -0.38 -0.06 0.00 0.02 0.00 0.00 54.97 54.55 3ku2 s GLU 64 Cb 0.00 -3.00 0.01 0.00 0.10 0.00 0.00 34.13 31.24 3ku2 s GLU 64 CO 0.00 0.67 0.06 0.08 0.02 0.00 0.00 175.26 176.09 3ku2 s VAL 65 N -1.25 3.80 -0.10 2.63 1.01 0.73 -0.26 120.40 126.95 3ku2 s VAL 65 Ca 0.25 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.46 3ku2 s VAL 65 Cb -0.12 -2.97 -0.02 0.00 0.00 0.00 0.00 36.38 33.27 3ku2 s VAL 65 CO 0.16 0.07 -0.14 -0.63 0.00 0.00 0.00 175.10 174.56 3ku2 s ILE 66 N 1.47 2.98 -0.22 2.22 1.09 0.01 -0.47 121.20 128.27 3ku2 s ILE 66 Ca 0.02 -0.71 -0.29 0.00 -1.10 0.00 0.00 60.65 58.56 3ku2 s ILE 66 Cb -0.17 -2.21 -0.01 0.00 -1.06 0.00 0.00 42.46 39.00 3ku2 s ILE 66 CO 0.02 0.55 1.34 -0.22 -0.10 0.00 0.00 174.94 176.52 3ku2 s LEU 67 N -0.03 4.04 0.19 2.97 2.96 0.97 -0.97 118.68 128.81 3ku2 s LEU 67 Ca -0.04 1.53 0.10 0.00 -0.22 0.00 0.00 54.13 55.50 3ku2 s LEU 67 Cb -0.14 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.97 3ku2 s LEU 67 CO 0.04 -0.95 -0.21 0.00 -1.32 0.00 0.00 176.35 173.91 3ku2 s LYS 69 N -2.84 2.22 0.18 0.00 2.20 -0.68 -0.37 119.74 120.46 3ku2 s LYS 69 Ca 0.20 -0.85 -0.31 0.00 -0.36 0.00 0.00 55.97 54.65 3ku2 s LYS 69 Cb -0.06 -1.98 -0.09 0.00 -1.51 0.00 0.00 37.83 34.18 3ku2 s LYS 69 CO 0.09 0.42 1.43 0.34 -0.36 0.00 0.00 175.35 177.27 3ku2 s ASP 70 N -0.30 6.74 0.49 1.43 -1.08 0.47 -1.85 116.67 122.57 3ku2 s ASP 70 Ca 0.01 2.50 0.27 0.00 -0.52 0.00 0.00 52.55 54.82 3ku2 s ASP 70 Cb -0.12 -2.60 1.19 0.00 -1.46 0.00 0.00 42.92 39.93 3ku2 s ASP 70 CO 0.02 -0.68 1.94 0.11 0.52 0.00 0.00 175.17 177.08 3ku2 h LYS 71 N 5.99 0.00 0.00 4.34 1.57 -1.63 -2.37 116.57 124.48 3ku2 h LYS 71 Ca -0.44 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.29 3ku2 h LYS 71 Cb 1.21 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.51 3ku2 h LYS 71 CO 0.83 0.16 -1.00 -0.89 -0.57 0.00 0.00 179.45 177.98 3ku2 n ILE 72 N -3.43 1.48 0.93 1.86 5.41 -1.26 -4.70 119.36 119.65 3ku2 n ILE 72 Ca -0.01 0.11 0.13 0.00 1.00 0.00 0.00 62.75 63.98 3ku2 n ILE 72 Cb 0.34 -2.31 0.39 0.00 -0.71 0.00 0.00 39.64 37.36 3ku2 n ILE 72 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 3ku2 n THR 73 N -4.49 0.08 -0.90 1.39 -2.24 -1.26 -4.95 114.28 101.92 3ku2 n THR 73 Ca -0.16 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 3ku2 n THR 73 Cb 0.48 -0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.58 3ku2 n THR 73 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ku2 n GLY 74 N 1.47 0.43 3.70 3.38 0.00 -0.89 -4.98 105.19 108.30 3ku2 n GLY 74 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 3ku2 n GLY 74 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3ku2 s GLN 75 N -0.64 4.19 0.18 1.61 0.74 -1.26 -4.48 119.66 120.00 3ku2 s GLN 75 Ca 0.00 2.37 -0.24 0.00 0.05 0.00 0.00 55.36 57.54 3ku2 s GLN 75 Cb 0.00 -3.50 -0.08 0.00 1.10 0.00 0.00 33.01 30.53 3ku2 s GLN 75 CO 0.00 -0.72 0.77 -1.21 -0.55 0.00 0.00 175.29 173.58 3ku2 s GLU 76 N 2.31 4.52 0.17 1.67 2.02 -1.26 -0.40 118.70 127.73 3ku2 s GLU 76 Ca 0.74 1.11 -0.18 0.00 0.02 0.00 0.00 54.97 56.66 3ku2 s GLU 76 Cb -0.41 -3.19 0.04 0.00 0.10 0.00 0.00 34.13 30.66 3ku2 s GLU 76 CO 0.32 0.54 0.51 0.00 0.02 0.00 0.00 175.26 176.66 3ku2 s ALA 78 N -3.83 3.57 -0.21 0.00 0.00 -0.56 -0.48 121.76 120.25 3ku2 s ALA 78 Ca 0.06 -0.76 -0.04 0.00 0.00 0.00 0.00 51.96 51.21 3ku2 s ALA 78 Cb -0.00 -2.63 -0.01 0.00 0.00 0.00 0.00 23.12 20.48 3ku2 s ALA 78 CO -0.07 -0.49 -0.03 0.08 0.00 0.00 0.00 175.76 175.25 3ku2 s VAL 79 N 1.71 3.55 -0.26 0.00 1.01 -0.14 -1.31 120.40 124.95 3ku2 s VAL 79 Ca 0.15 -0.44 -0.18 0.00 0.00 0.00 0.00 61.98 61.51 3ku2 s VAL 79 Cb -0.15 -2.61 -0.03 0.00 0.00 0.00 0.00 36.38 33.59 3ku2 s VAL 79 CO 0.09 0.42 0.53 -1.59 0.00 0.00 0.00 175.10 174.55 3ku2 s LYS 80 N 1.34 4.07 -0.29 2.72 0.00 0.27 -0.81 119.74 127.03 3ku2 s LYS 80 Ca 0.04 0.35 -0.10 0.00 0.00 0.00 0.00 55.97 56.25 3ku2 s LYS 80 Cb -0.14 -3.65 -0.03 0.00 0.00 0.00 0.00 37.83 34.00 3ku2 s LYS 80 CO -0.01 -0.36 0.17 0.08 0.00 0.00 0.00 175.35 175.23 3ku2 s VAL 81 N 2.34 5.00 -0.22 1.79 1.01 0.64 -0.84 120.40 130.11 3ku2 s VAL 81 Ca 0.22 -0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.12 3ku2 s VAL 81 Cb -0.16 -3.44 0.03 0.00 0.00 0.00 0.00 36.38 32.81 3ku2 s VAL 81 CO 0.09 0.18 -0.12 -0.63 0.00 0.00 0.00 175.10 174.61 3ku2 s ILE 82 N 1.70 2.46 0.02 2.22 1.01 -0.61 -2.54 121.20 125.46 3ku2 s ILE 82 Ca 0.06 -1.06 -0.30 0.00 0.00 0.00 0.00 60.65 59.35 3ku2 s ILE 82 Cb -0.16 -2.19 -0.05 0.00 0.01 0.00 0.00 42.46 40.07 3ku2 s ILE 82 CO 0.09 0.32 1.16 -0.55 0.00 0.00 0.00 174.94 175.95 3ku2 s SER 83 N 1.28 7.13 0.16 3.58 0.15 -1.26 -0.88 113.70 123.86 3ku2 s SER 83 Ca 0.01 1.90 -0.09 0.00 0.70 0.00 0.00 55.95 58.47 3ku2 s SER 83 Cb -0.16 -2.57 0.03 0.00 -1.71 0.00 0.00 66.02 61.61 3ku2 s SER 83 CO -0.08 -0.46 1.54 0.11 1.20 0.00 0.00 173.24 175.55 3ku2 h LYS 84 N 6.95 0.93 -0.03 5.44 1.57 -1.12 -0.13 116.57 130.19 3ku2 h LYS 84 Ca -0.40 -0.43 -0.12 0.00 -1.87 0.00 0.00 60.65 57.84 3ku2 h LYS 84 Cb 1.20 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.48 3ku2 h LYS 84 CO 0.82 1.09 -0.53 0.00 -0.57 0.00 0.00 179.45 180.25 3ku2 h ARG 85 N 0.79 0.07 0.09 3.15 2.47 -1.93 -3.29 114.38 115.72 3ku2 h ARG 85 Ca 0.09 -0.04 -0.33 0.00 -1.26 0.00 0.00 59.98 58.44 3ku2 h ARG 85 Cb 0.86 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.16 3ku2 h ARG 85 CO 0.08 0.59 -1.76 0.37 0.56 0.00 0.00 179.97 179.80 3ku2 h GLN 86 N 0.06 0.19 -4.92 0.04 4.15 -1.91 -3.46 115.11 109.26 3ku2 h GLN 86 Ca -0.00 -0.33 -0.67 0.00 0.77 0.00 0.00 58.65 58.42 3ku2 h GLN 86 Cb 0.96 0.12 -0.29 0.00 0.21 0.00 0.00 27.48 28.48 3ku2 h GLN 86 CO 0.07 0.99 -0.71 0.08 -1.93 0.00 0.00 178.83 177.34 3ku2 s VAL 87 N -2.59 3.32 0.24 2.39 1.01 -0.07 -5.04 120.40 119.66 3ku2 s VAL 87 Ca -0.13 -0.74 -0.30 0.00 0.00 0.00 0.00 61.98 60.82 3ku2 s VAL 87 Cb 0.07 -2.62 -0.09 0.00 0.00 0.00 0.00 36.38 33.74 3ku2 s VAL 87 CO 0.81 0.26 1.14 -0.75 0.00 0.00 0.00 175.10 176.57 3ku2 s LYS 88 N 1.43 4.57 -0.17 2.72 2.47 -1.26 -4.57 119.74 124.93 3ku2 s LYS 88 Ca 0.03 1.84 -0.22 0.00 -1.56 0.00 0.00 55.97 56.06 3ku2 s LYS 88 Cb -0.16 -3.21 -0.03 0.00 -1.46 0.00 0.00 37.83 32.98 3ku2 s LYS 88 CO -0.02 0.08 0.67 -0.65 0.16 0.00 0.00 175.35 175.58 3ku2 s GLN 89 N -0.96 4.27 0.23 4.03 -0.21 -1.26 -1.89 119.66 123.87 3ku2 s GLN 89 Ca 0.48 0.72 0.10 0.00 0.02 0.00 0.00 55.36 56.67 3ku2 s GLN 89 Cb -0.32 -3.55 0.18 0.00 1.00 0.00 0.00 33.01 30.32 3ku2 s GLN 89 CO 0.40 -0.18 1.51 0.87 -2.12 0.00 0.00 175.29 175.76 3ku2 h LYS 90 N 7.29 0.00 -5.59 2.91 1.57 -0.67 -3.47 116.57 118.61 3ku2 h LYS 90 Ca -0.33 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 57.88 3ku2 h LYS 90 Cb 1.15 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 33.33 3ku2 h LYS 90 CO 0.78 0.73 -0.63 0.95 -0.57 0.00 0.00 179.45 180.70 3ku2 s THR 91 N -3.30 1.80 0.55 -0.16 -4.23 -1.25 -4.99 115.64 104.07 3ku2 s THR 91 Ca -0.00 -2.07 -0.18 0.00 -1.18 0.00 0.00 61.69 58.27 3ku2 s THR 91 Cb 0.12 -2.78 -0.05 0.00 1.34 0.00 0.00 72.50 71.12 3ku2 s THR 91 CO 0.78 -0.10 1.06 1.51 -0.54 0.00 0.00 174.62 177.32 3ku2 s ASP 92 N -3.59 5.97 0.45 3.99 -4.77 -1.26 -4.89 116.67 112.57 3ku2 s ASP 92 Ca 0.34 1.88 0.25 0.00 -3.30 0.00 0.00 52.55 51.72 3ku2 s ASP 92 Cb 0.07 -2.55 1.26 0.00 -1.09 0.00 0.00 42.92 40.62 3ku2 s ASP 92 CO 0.16 -1.04 1.79 0.50 0.70 0.00 0.00 175.17 177.29 3ku2 h LYS 93 N 0.89 0.24 -0.74 2.11 3.64 -1.99 -1.52 116.57 119.20 3ku2 h LYS 93 Ca -0.48 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 58.84 3ku2 h LYS 93 Cb 1.22 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.96 3ku2 h LYS 93 CO 0.58 0.16 0.28 0.93 -2.27 0.00 0.00 179.45 179.13 3ku2 h GLU 94 N 0.25 1.10 -0.07 1.90 5.08 -1.99 -0.21 114.58 120.65 3ku2 h GLU 94 Ca 0.57 -0.20 -0.15 0.00 -1.00 0.00 0.00 59.36 58.58 3ku2 h GLU 94 Cb 1.73 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.79 3ku2 h GLU 94 CO -0.19 0.90 -0.63 1.03 -1.00 0.00 0.00 179.01 179.12 3ku2 h SER 95 N 1.08 0.30 -0.12 1.42 0.87 -1.65 -2.53 113.55 112.92 3ku2 h SER 95 Ca 0.25 -0.18 -0.05 0.00 -1.23 0.00 0.00 61.79 60.57 3ku2 h SER 95 Cb 0.22 -0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 62.09 3ku2 h SER 95 CO -0.02 0.85 -0.14 0.25 -0.53 0.00 0.00 176.83 177.25 3ku2 h LEU 96 N 0.19 0.33 -1.74 2.23 5.85 -1.30 -2.76 115.31 118.10 3ku2 h LEU 96 Ca -0.01 -0.50 -0.03 0.00 0.84 0.00 0.00 57.88 58.18 3ku2 h LEU 96 Cb 1.15 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 42.08 3ku2 h LEU 96 CO 0.10 0.76 -0.14 -0.07 -0.34 0.00 0.00 178.44 178.75 3ku2 h LEU 97 N -0.10 0.00 -0.03 2.25 3.38 -1.05 -1.56 115.31 118.21 3ku2 h LEU 97 Ca 0.02 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 3ku2 h LEU 97 Cb 0.67 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.42 3ku2 h LEU 97 CO 0.03 0.14 -0.19 0.03 0.09 0.00 0.00 178.44 178.54 3ku2 h ARG 98 N 0.00 0.19 -0.67 1.13 2.47 -1.46 -2.80 114.38 113.24 3ku2 h ARG 98 Ca -0.00 -0.16 -0.05 0.00 -1.26 0.00 0.00 59.98 58.51 3ku2 h ARG 98 Cb 0.26 0.04 -0.03 0.00 -1.65 0.00 0.00 29.97 28.58 3ku2 h ARG 98 CO 0.02 0.83 0.22 1.49 0.56 0.00 0.00 179.97 183.09 3ku2 h GLU 99 N -0.40 1.02 -0.35 0.04 4.81 -1.28 -2.25 114.58 116.17 3ku2 h GLU 99 Ca -0.02 -0.20 0.04 0.00 -0.13 0.00 0.00 59.36 59.05 3ku2 h GLU 99 Cb 0.87 -0.16 -0.04 0.00 0.63 0.00 0.00 28.75 30.06 3ku2 h GLU 99 CO 0.04 0.86 0.13 0.28 -0.73 0.00 0.00 179.01 179.59 3ku2 h VAL 100 N 0.98 0.92 -0.74 0.32 2.07 -1.36 0.90 116.25 119.34 3ku2 h VAL 100 Ca 0.22 -0.10 -0.02 0.00 0.82 0.00 0.00 66.70 67.63 3ku2 h VAL 100 Cb 0.26 0.61 -0.04 0.00 -1.52 0.00 0.00 31.29 30.60 3ku2 h VAL 100 CO -0.01 0.05 0.40 -0.61 0.02 0.00 0.00 177.57 177.42 3ku2 h GLN 101 N 0.29 1.02 -0.22 1.57 5.75 -1.21 -1.64 115.11 120.67 3ku2 h GLN 101 Ca 0.15 -0.11 -0.05 0.00 -0.15 0.00 0.00 58.65 58.49 3ku2 h GLN 101 Cb 0.11 -0.20 -0.01 0.00 1.07 0.00 0.00 27.48 28.45 3ku2 h GLN 101 CO -0.15 0.76 -0.05 1.25 -2.65 0.00 0.00 178.83 177.99 3ku2 h LEU 102 N 1.03 0.43 -1.57 -2.39 5.85 -0.75 -3.10 115.31 114.81 3ku2 h LEU 102 Ca 0.26 -0.36 -0.00 0.00 0.84 0.00 0.00 57.88 58.62 3ku2 h LEU 102 Cb 0.03 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 3ku2 h LEU 102 CO -0.04 0.69 0.24 -0.07 -0.34 0.00 0.00 178.44 178.92 3ku2 h LEU 103 N 0.16 0.46 -1.23 2.25 3.38 -0.49 -1.93 115.31 117.91 3ku2 h LEU 103 Ca 0.06 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 3ku2 h LEU 103 Cb 0.50 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 3ku2 h LEU 103 CO 0.02 0.36 -0.17 0.11 0.09 0.00 0.00 178.44 178.85 3ku2 h LYS 104 N 0.54 0.32 0.00 1.13 1.57 -1.27 -2.87 116.57 115.99 3ku2 h LYS 104 Ca 0.14 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 3ku2 h LYS 104 Cb -0.03 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.25 3ku2 h LYS 104 CO -0.03 0.49 -0.23 1.96 -0.57 0.00 0.00 179.45 181.07 3ku2 h GLN 105 N 0.30 0.00 -6.59 3.15 4.20 -1.29 -3.47 115.11 111.42 3ku2 h GLN 105 Ca 0.06 0.00 -0.52 0.00 0.06 0.00 0.00 58.65 58.25 3ku2 h GLN 105 Cb 0.48 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.23 3ku2 h GLN 105 CO 0.03 0.00 0.08 -0.51 -0.67 0.00 0.00 178.83 177.76 3ku2 s LEU 106 N -4.68 4.25 -0.13 1.46 1.43 -1.07 -5.09 118.68 114.86 3ku2 s LEU 106 Ca 0.08 1.32 -0.05 0.00 -1.03 0.00 0.00 54.13 54.46 3ku2 s LEU 106 Cb 0.12 -3.71 0.06 0.00 0.03 0.00 0.00 46.19 42.69 3ku2 s LEU 106 CO 0.65 -0.04 0.27 -1.81 0.23 0.00 0.00 176.35 175.65 3ku2 s ASP 107 N -1.87 0.14 -0.11 2.29 1.01 -1.26 -4.87 116.67 112.00 3ku2 s ASP 107 Ca 0.46 0.60 -0.10 0.00 0.71 0.00 0.00 52.55 54.22 3ku2 s ASP 107 Cb -0.14 0.64 0.03 0.00 1.01 0.00 0.00 42.92 44.46 3ku2 s ASP 107 CO 0.20 -0.22 0.29 -2.28 0.21 0.00 0.00 175.17 173.37 3ku2 s HIS 108 N 2.07 -0.33 0.29 4.23 2.46 -1.26 -5.05 115.29 117.70 3ku2 s HIS 108 Ca -0.02 0.81 0.36 0.00 0.47 0.00 0.00 55.06 56.68 3ku2 s HIS 108 Cb -0.11 0.11 1.85 0.00 -0.13 0.00 0.00 32.58 34.30 3ku2 s HIS 108 CO -0.09 -0.17 2.11 -1.00 -2.47 0.00 0.00 174.74 173.12 3ku2 h PRO 109 N 5.90 0.00 -0.54 2.88 0.13 -1.99 -2.58 132.00 135.80 3ku2 h PRO 109 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 3ku2 h PRO 109 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3ku2 h PRO 109 CO 0.33 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.19 3ku2 n ASN 110 N -2.87 4.50 -4.04 1.44 5.03 -1.26 -4.68 115.26 113.38 3ku2 n ASN 110 Ca -0.01 -2.53 -0.23 0.00 0.87 0.00 0.00 54.58 52.68 3ku2 n ASN 110 Cb 0.13 -0.54 -0.16 0.00 -1.02 0.00 0.00 39.78 38.19 3ku2 n ASN 110 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3ku2 s ILE 111 N -1.98 1.04 0.14 2.41 -1.09 -0.97 -1.31 121.20 119.43 3ku2 s ILE 111 Ca 0.47 -0.49 -0.31 0.00 -2.23 0.00 0.00 60.65 58.09 3ku2 s ILE 111 Cb 0.31 -0.92 -0.10 0.00 -1.58 0.00 0.00 42.46 40.17 3ku2 s ILE 111 CO 0.20 0.32 1.68 -0.32 -1.23 0.00 0.00 174.94 175.59 3ku2 s MET 112 N 0.26 4.17 -0.08 2.79 -2.45 -0.06 -4.62 119.30 119.31 3ku2 s MET 112 Ca -0.06 2.46 -0.30 0.00 -1.25 0.00 0.00 55.69 56.55 3ku2 s MET 112 Cb -0.11 -3.36 -0.02 0.00 1.25 0.00 0.00 34.83 32.59 3ku2 s MET 112 CO 0.02 -0.73 1.09 0.21 1.05 0.00 0.00 175.02 176.66 3ku2 s LYS 113 N 1.92 4.40 -0.33 4.11 2.47 -1.26 -4.92 119.74 126.13 3ku2 s LYS 113 Ca 0.75 1.51 -0.19 0.00 -1.56 0.00 0.00 55.97 56.48 3ku2 s LYS 113 Cb -0.44 -3.54 -0.01 0.00 -1.46 0.00 0.00 37.83 32.37 3ku2 s LYS 113 CO 0.33 -0.36 0.55 -1.17 0.16 0.00 0.00 175.35 174.86 3ku2 s LEU 114 N 2.07 4.24 -0.15 5.43 2.96 -1.26 -0.31 118.68 131.66 3ku2 s LEU 114 Ca 0.51 0.17 -0.16 0.00 -0.22 0.00 0.00 54.13 54.44 3ku2 s LEU 114 Cb -0.21 -2.67 -0.13 0.00 0.50 0.00 0.00 46.19 43.68 3ku2 s LEU 114 CO 0.20 -0.47 0.23 1.88 -1.32 0.00 0.00 176.35 176.87 3ku2 h TYR 115 N 8.34 0.00 -4.23 5.38 0.05 -1.21 -3.38 116.97 121.91 3ku2 h TYR 115 Ca -0.28 0.00 -0.16 0.00 0.05 0.00 0.00 58.73 58.34 3ku2 h TYR 115 Cb 1.12 0.00 -0.14 0.00 1.01 0.00 0.00 36.73 38.73 3ku2 h TYR 115 CO 0.74 0.68 -0.49 -1.21 -1.05 0.00 0.00 178.16 176.83 3ku2 s GLU 116 N -2.11 1.14 -0.04 4.88 0.41 -0.73 -4.97 118.70 117.28 3ku2 s GLU 116 Ca -0.16 -1.40 -0.01 0.00 -0.41 0.00 0.00 54.97 52.98 3ku2 s GLU 116 Cb 0.01 0.31 0.03 0.00 -1.78 0.00 0.00 34.13 32.71 3ku2 s GLU 116 CO 0.40 -0.39 0.09 0.12 -0.49 0.00 0.00 175.26 174.99 3ku2 s PHE 117 N -4.05 -0.06 0.21 1.61 5.36 -1.26 -1.87 117.98 117.92 3ku2 s PHE 117 Ca 0.26 0.31 0.09 0.00 -0.96 0.00 0.00 56.93 56.63 3ku2 s PHE 117 Cb 0.05 -0.19 -0.05 0.00 -0.34 0.00 0.00 43.02 42.49 3ku2 s PHE 117 CO 0.05 -0.14 -0.17 -0.06 -1.46 0.00 0.00 175.22 173.44 3ku2 s PHE 118 N 1.25 1.91 -0.17 10.12 0.08 -0.60 -4.98 117.98 125.59 3ku2 s PHE 118 Ca -0.08 -0.47 -0.14 0.00 0.12 0.00 0.00 56.93 56.36 3ku2 s PHE 118 Cb -0.12 -0.89 0.05 0.00 -0.57 0.00 0.00 43.02 41.48 3ku2 s PHE 118 CO -0.04 0.44 0.43 -2.00 -0.10 0.00 0.00 175.22 173.95 3ku2 s GLU 119 N -3.29 0.49 0.00 0.44 2.12 -1.26 -0.65 118.70 116.55 3ku2 s GLU 119 Ca 0.22 0.65 0.00 0.00 0.36 0.00 0.00 54.97 56.20 3ku2 s GLU 119 Cb -0.04 0.20 0.00 0.00 0.26 0.00 0.00 34.13 34.55 3ku2 s GLU 119 CO 0.09 -0.08 0.00 -0.40 -0.54 0.00 0.00 175.26 174.33 3ku2 n ASP 120 N 3.12 0.94 -0.18 -1.70 5.68 -0.94 -4.96 116.55 118.51 3ku2 n ASP 120 Ca -0.15 0.00 -0.04 0.00 -0.50 0.00 0.00 54.79 54.10 3ku2 n ASP 120 Cb 0.57 0.00 0.06 0.00 -1.14 0.00 0.00 41.12 40.61 3ku2 n ASP 120 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 3ku2 h LYS 121 N 0.00 0.53 0.00 0.11 1.63 -2.03 -3.35 116.57 113.46 3ku2 h LYS 121 Ca 0.00 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.77 3ku2 h LYS 121 Cb 0.00 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 31.51 3ku2 h LYS 121 CO 0.00 0.35 -0.02 0.41 -3.45 0.00 0.00 179.45 176.74 3ku2 n GLY 122 N -1.26 1.80 3.16 5.01 0.00 -1.26 -4.96 105.19 107.68 3ku2 n GLY 122 Ca 0.05 -0.14 -0.09 0.00 0.00 0.00 0.00 46.02 45.84 3ku2 n GLY 122 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ku2 s TYR 123 N -0.97 0.18 0.06 1.61 1.51 -1.26 -0.63 117.35 117.85 3ku2 s TYR 123 Ca 0.04 -0.52 0.06 0.00 -1.01 0.00 0.00 57.07 55.64 3ku2 s TYR 123 Cb 0.04 -0.11 -0.04 0.00 -0.11 0.00 0.00 41.96 41.74 3ku2 s TYR 123 CO 0.00 -0.44 -0.09 -0.06 -1.11 0.00 0.00 175.55 173.86 3ku2 s PHE 124 N -3.09 2.79 -0.22 2.71 0.40 -0.06 -2.21 117.98 118.31 3ku2 s PHE 124 Ca -0.01 -0.12 -0.01 0.00 -0.60 0.00 0.00 56.93 56.20 3ku2 s PHE 124 Cb 0.02 -1.51 0.06 0.00 0.51 0.00 0.00 43.02 42.10 3ku2 s PHE 124 CO -0.07 0.39 -0.01 0.71 0.70 0.00 0.00 175.22 176.95 3ku2 s TYR 125 N -1.12 1.77 -0.54 0.36 1.51 0.17 -1.57 117.35 117.94 3ku2 s TYR 125 Ca 0.20 -1.36 -0.16 0.00 -1.01 0.00 0.00 57.07 54.74 3ku2 s TYR 125 Cb -0.11 -1.34 0.12 0.00 -0.11 0.00 0.00 41.96 40.53 3ku2 s TYR 125 CO 0.11 -0.70 0.50 -0.51 -1.11 0.00 0.00 175.55 173.84 3ku2 s LEU 126 N 1.60 6.10 -0.26 -1.29 1.43 -0.02 -1.56 118.68 124.68 3ku2 s LEU 126 Ca -0.03 -1.73 -0.19 0.00 -1.03 0.00 0.00 54.13 51.14 3ku2 s LEU 126 Cb -0.18 -2.21 -0.02 0.00 0.03 0.00 0.00 46.19 43.81 3ku2 s LEU 126 CO -0.07 -0.85 0.58 -0.69 0.23 0.00 0.00 176.35 175.55 3ku2 s VAL 127 N 1.64 5.02 0.04 -1.59 1.01 -0.78 -0.57 120.40 125.18 3ku2 s VAL 127 Ca 0.03 1.00 0.00 0.00 0.00 0.00 0.00 61.98 63.01 3ku2 s VAL 127 Cb -0.29 -3.89 0.00 0.00 0.00 0.00 0.00 36.38 32.20 3ku2 s VAL 127 CO 0.03 0.05 0.06 0.61 0.00 0.00 0.00 175.10 175.85 3ku2 n GLY 128 N 4.28 3.20 3.77 4.51 0.00 -0.43 -0.66 105.19 119.87 3ku2 n GLY 128 Ca -0.02 -1.47 -0.37 0.00 0.00 0.00 0.00 46.02 44.16 3ku2 n GLY 128 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3ku2 s GLU 129 N -2.12 3.90 -0.13 1.61 2.12 0.58 -1.49 118.70 123.17 3ku2 s GLU 129 Ca 0.04 1.76 -0.06 0.00 0.36 0.00 0.00 54.97 57.07 3ku2 s GLU 129 Cb -0.00 -2.51 -0.04 0.00 0.26 0.00 0.00 34.13 31.84 3ku2 s GLU 129 CO 0.03 -0.43 0.07 0.54 -0.54 0.00 0.00 175.26 174.93 3ku2 s VAL 130 N -1.52 4.88 -0.06 3.70 0.11 -1.26 -4.19 120.40 122.06 3ku2 s VAL 130 Ca 0.61 -0.02 0.05 0.00 -2.93 0.00 0.00 61.98 59.69 3ku2 s VAL 130 Cb -0.28 -3.13 -0.01 0.00 -1.53 0.00 0.00 36.38 31.43 3ku2 s VAL 130 CO 0.35 0.56 -0.22 -0.31 -3.33 0.00 0.00 175.10 172.14 3ku2 s TYR 131 N -0.46 2.23 -1.67 1.54 2.02 -1.26 -4.97 117.35 114.79 3ku2 s TYR 131 Ca 0.10 -0.73 0.14 0.00 -0.37 0.00 0.00 57.07 56.21 3ku2 s TYR 131 Cb -0.12 -1.49 0.10 0.00 -0.40 0.00 0.00 41.96 40.05 3ku2 s TYR 131 CO 0.02 -0.25 0.92 0.25 -1.57 0.00 0.00 175.55 174.91 3ku2 n THR 132 N 3.17 0.00 0.38 -0.71 -2.24 -1.25 -4.60 114.28 109.03 3ku2 n THR 132 Ca -0.18 -0.49 0.13 0.00 -2.27 0.00 0.00 64.05 61.25 3ku2 n THR 132 Cb 0.52 1.27 0.53 0.00 -2.10 0.00 0.00 70.33 70.56 3ku2 n THR 132 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 3ku2 h GLY 133 N 2.71 0.00 0.00 3.38 0.00 -0.98 -3.44 103.07 104.74 3ku2 h GLY 133 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3ku2 h GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 3ku2 n GLY 134 N 0.12 -2.00 3.73 4.60 0.00 -1.25 -3.69 105.19 106.70 3ku2 n GLY 134 Ca 0.02 -1.48 -0.41 0.00 0.00 0.00 0.00 46.02 44.16 3ku2 n GLY 134 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ku2 s GLU 135 N 0.00 4.74 0.22 1.61 2.02 -1.26 -1.51 118.70 124.52 3ku2 s GLU 135 Ca 0.00 1.47 -0.18 0.00 0.02 0.00 0.00 54.97 56.27 3ku2 s GLU 135 Cb 0.00 -3.35 0.21 0.00 0.10 0.00 0.00 34.13 31.10 3ku2 s GLU 135 CO 0.00 0.30 1.56 1.25 0.02 0.00 0.00 175.26 178.39 3ku2 h LEU 136 N 5.15 -1.34 -1.79 1.80 5.85 -1.37 -1.62 115.31 122.00 3ku2 h LEU 136 Ca -0.43 0.29 -0.03 0.00 0.84 0.00 0.00 57.88 58.54 3ku2 h LEU 136 Cb 1.21 0.70 -0.00 0.00 0.37 0.00 0.00 40.66 42.94 3ku2 h LEU 136 CO 0.71 -0.29 -0.14 -0.26 -0.34 0.00 0.00 178.44 178.12 3ku2 h PHE 137 N -0.04 0.00 0.00 1.25 -1.00 -1.86 -1.53 116.94 113.76 3ku2 h PHE 137 Ca 0.32 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 61.06 3ku2 h PHE 137 Cb 0.59 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.14 3ku2 h PHE 137 CO -0.81 0.14 -0.20 -0.44 -1.61 0.00 0.00 178.31 175.39 3ku2 h ASP 138 N 0.00 0.00 0.00 2.17 3.32 -1.69 -2.60 116.42 117.61 3ku2 h ASP 138 Ca -0.00 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.01 3ku2 h ASP 138 Cb 0.26 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 3ku2 h ASP 138 CO 0.02 0.20 -0.27 -0.08 -1.72 0.00 0.00 179.24 177.38 3ku2 h GLU 139 N 0.00 0.00 -0.84 3.56 4.22 -1.17 -3.37 114.58 116.98 3ku2 h GLU 139 Ca -0.00 0.00 0.21 0.00 0.08 0.00 0.00 59.36 59.65 3ku2 h GLU 139 Cb 0.74 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 29.85 3ku2 h GLU 139 CO 0.03 0.60 0.19 0.82 -2.18 0.00 0.00 179.01 178.47 3ku2 h ILE 140 N -1.00 0.36 0.00 2.32 2.04 -1.30 0.87 117.51 120.79 3ku2 h ILE 140 Ca -0.06 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.73 3ku2 h ILE 140 Cb 0.71 0.13 0.00 0.00 -0.74 0.00 0.00 36.82 36.92 3ku2 h ILE 140 CO -0.04 0.04 0.03 0.16 0.00 0.00 0.00 178.15 178.35 3ku2 h ILE 141 N 0.21 0.00 0.00 -0.67 3.07 -1.63 -1.07 117.51 117.42 3ku2 h ILE 141 Ca 0.51 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.92 3ku2 h ILE 141 Cb 0.97 0.64 0.00 0.00 -0.27 0.00 0.00 36.82 38.17 3ku2 h ILE 141 CO -0.63 0.00 -0.48 -1.54 -1.05 0.00 0.00 178.15 174.46 3ku2 n SER 142 N -2.54 0.49 -4.80 2.16 3.41 0.30 -4.95 113.62 107.69 3ku2 n SER 142 Ca -0.02 -0.09 -0.35 0.00 -0.26 0.00 0.00 58.87 58.15 3ku2 n SER 142 Cb 0.08 0.15 -0.06 0.00 -0.26 0.00 0.00 64.21 64.12 3ku2 n SER 142 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3ku2 s ARG 143 N -3.04 4.30 -0.07 4.33 0.52 -0.41 -5.00 118.95 119.59 3ku2 s ARG 143 Ca 0.10 1.28 0.02 0.00 -0.52 0.00 0.00 55.73 56.62 3ku2 s ARG 143 Cb 0.17 -2.44 -0.25 0.00 0.52 0.00 0.00 34.95 32.94 3ku2 s ARG 143 CO 0.69 0.02 0.57 1.57 0.02 0.00 0.00 175.30 178.16 3ku2 h LYS 144 N 2.40 0.15 -5.98 3.54 5.09 -1.92 -3.47 116.57 116.38 3ku2 h LYS 144 Ca -0.48 -0.25 -0.53 0.00 0.09 0.00 0.00 60.65 59.48 3ku2 h LYS 144 Cb 1.19 0.09 -0.22 0.00 0.10 0.00 0.00 32.23 33.40 3ku2 h LYS 144 CO 0.62 0.89 -0.82 1.03 -2.09 0.00 0.00 179.45 179.08 3ku2 s ARG 145 N -2.58 1.08 -0.17 0.07 0.52 -1.26 -4.99 118.95 111.62 3ku2 s ARG 145 Ca -0.13 -1.09 -0.06 0.00 -0.52 0.00 0.00 55.73 53.93 3ku2 s ARG 145 Cb 0.07 -1.28 0.08 0.00 0.52 0.00 0.00 34.95 34.34 3ku2 s ARG 145 CO 0.81 0.30 0.36 0.12 0.02 0.00 0.00 175.30 176.90 3ku2 s PHE 146 N -1.14 -0.63 0.51 -0.53 5.36 -1.26 -5.02 117.98 115.26 3ku2 s PHE 146 Ca 0.05 1.29 0.05 0.00 -0.96 0.00 0.00 56.93 57.36 3ku2 s PHE 146 Cb -0.10 0.17 0.01 0.00 -0.34 0.00 0.00 43.02 42.77 3ku2 s PHE 146 CO 0.04 -0.42 0.32 -1.54 -1.46 0.00 0.00 175.22 172.16 3ku2 s SER 147 N 2.40 4.58 0.48 6.13 1.04 -1.26 0.14 113.70 127.20 3ku2 s SER 147 Ca -0.02 -1.21 0.21 0.00 0.48 0.00 0.00 55.95 55.41 3ku2 s SER 147 Cb -0.12 0.19 1.20 0.00 0.10 0.00 0.00 66.02 67.39 3ku2 s SER 147 CO -0.11 -0.94 2.01 -0.33 0.98 0.00 0.00 173.24 174.85 3ku2 h GLU 148 N 0.95 0.00 -0.10 4.02 5.08 -1.90 -2.46 114.58 120.17 3ku2 h GLU 148 Ca -0.39 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 57.93 3ku2 h GLU 148 Cb 1.29 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.54 3ku2 h GLU 148 CO 0.61 0.17 -0.09 0.28 -1.00 0.00 0.00 179.01 178.99 3ku2 h VAL 149 N 0.00 1.36 -0.15 3.13 2.07 -1.91 -1.93 116.25 118.82 3ku2 h VAL 149 Ca -0.00 -1.23 0.04 0.00 0.82 0.00 0.00 66.70 66.34 3ku2 h VAL 149 Cb 0.37 1.96 -0.05 0.00 -1.52 0.00 0.00 31.29 32.05 3ku2 h VAL 149 CO 0.02 0.35 -0.15 0.44 0.02 0.00 0.00 177.57 178.24 3ku2 h ASP 150 N -0.18 -0.48 -0.79 0.57 3.32 -1.80 0.29 116.42 117.35 3ku2 h ASP 150 Ca 0.02 0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 3ku2 h ASP 150 Cb 0.59 0.23 -0.04 0.00 0.22 0.00 0.00 39.33 40.34 3ku2 h ASP 150 CO 0.02 -0.20 0.47 0.00 -1.72 0.00 0.00 179.24 177.82 3ku2 h ALA 151 N 0.89 1.01 -0.37 3.45 0.00 -1.51 -1.73 119.26 121.00 3ku2 h ALA 151 Ca 0.10 -0.10 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 3ku2 h ALA 151 Cb 0.33 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3ku2 h ALA 151 CO -0.26 0.49 -0.32 0.00 0.00 0.00 0.00 179.25 179.16 3ku2 h ALA 152 N 1.25 0.54 -0.48 0.00 0.00 -0.85 0.15 119.26 119.87 3ku2 h ALA 152 Ca 0.28 -0.43 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 3ku2 h ALA 152 Cb -0.03 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3ku2 h ALA 152 CO -0.05 0.59 -0.08 0.00 0.00 0.00 0.00 179.25 179.71 3ku2 h ARG 153 N 0.68 0.85 0.09 0.00 3.08 -0.86 0.17 114.38 118.38 3ku2 h ARG 153 Ca 0.06 -0.28 -0.00 0.00 0.07 0.00 0.00 59.98 59.83 3ku2 h ARG 153 Cb 0.91 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.88 3ku2 h ARG 153 CO 0.08 0.90 -0.04 0.82 -1.07 0.00 0.00 179.97 180.66 3ku2 h ILE 154 N 0.77 1.04 0.00 2.04 2.04 -1.08 -3.08 117.51 119.25 3ku2 h ILE 154 Ca 0.13 -0.48 -0.06 0.00 1.00 0.00 0.00 64.86 65.46 3ku2 h ILE 154 Cb 0.58 1.35 -0.01 0.00 -0.74 0.00 0.00 36.82 38.01 3ku2 h ILE 154 CO 0.04 0.12 -0.27 -0.29 0.00 0.00 0.00 178.15 177.74 3ku2 h ILE 155 N -0.34 0.88 -0.47 -0.67 6.09 -0.49 -2.74 117.51 119.77 3ku2 h ILE 155 Ca -0.01 -1.06 -0.13 0.00 -1.37 0.00 0.00 64.86 62.29 3ku2 h ILE 155 Cb 0.28 1.63 -0.01 0.00 0.47 0.00 0.00 36.82 39.19 3ku2 h ILE 155 CO 0.02 0.27 -0.21 -0.09 -3.07 0.00 0.00 178.15 175.07 3ku2 h ARG 156 N 0.00 0.98 -0.17 2.19 2.43 -0.99 0.20 114.38 119.02 3ku2 h ARG 156 Ca -0.00 -0.42 0.00 0.00 -0.81 0.00 0.00 59.98 58.75 3ku2 h ARG 156 Cb 0.61 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.12 3ku2 h ARG 156 CO 0.04 1.09 0.11 1.96 -1.51 0.00 0.00 179.97 181.65 3ku2 h GLN 157 N 0.83 0.23 0.17 0.20 4.20 -1.40 0.14 115.11 119.48 3ku2 h GLN 157 Ca 0.11 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.79 3ku2 h GLN 157 Cb 0.79 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.52 3ku2 h GLN 157 CO 0.07 0.17 -0.08 0.28 -0.67 0.00 0.00 178.83 178.60 3ku2 h VAL 158 N 0.22 0.89 -1.00 -0.54 2.07 -1.39 -2.73 116.25 113.76 3ku2 h VAL 158 Ca 0.06 -0.23 0.09 0.00 0.82 0.00 0.00 66.70 67.45 3ku2 h VAL 158 Cb -0.00 1.03 -0.08 0.00 -1.52 0.00 0.00 31.29 30.72 3ku2 h VAL 158 CO -0.01 0.05 0.63 -0.07 0.02 0.00 0.00 177.57 178.20 3ku2 h LEU 159 N -0.34 0.97 -0.33 2.57 3.38 -0.80 -2.03 115.31 118.74 3ku2 h LEU 159 Ca -0.02 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 3ku2 h LEU 159 Cb 0.26 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 3ku2 h LEU 159 CO 0.04 0.57 0.10 0.28 0.09 0.00 0.00 178.44 179.51 3ku2 h SER 160 N 1.07 0.47 -0.54 -0.43 0.02 -0.51 -1.59 113.55 112.06 3ku2 h SER 160 Ca 0.47 -0.21 0.01 0.00 -0.84 0.00 0.00 61.79 61.22 3ku2 h SER 160 Cb 0.34 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.73 3ku2 h SER 160 CO -0.22 0.55 0.35 1.23 -1.14 0.00 0.00 176.83 177.60 3ku2 h GLY 161 N 0.37 0.76 1.00 -3.77 0.00 -1.19 -2.54 103.07 97.69 3ku2 h GLY 161 Ca 0.10 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.17 3ku2 h GLY 161 CO -0.00 0.26 0.14 -2.22 0.00 0.00 0.00 176.54 174.71 3ku2 h ILE 162 N 0.70 1.06 -0.36 2.60 2.04 -1.25 -1.97 117.51 120.33 3ku2 h ILE 162 Ca 0.20 -0.12 0.06 0.00 1.00 0.00 0.00 64.86 66.00 3ku2 h ILE 162 Cb -0.05 0.75 -0.05 0.00 -0.74 0.00 0.00 36.82 36.73 3ku2 h ILE 162 CO -0.06 0.06 0.05 0.74 0.00 0.00 0.00 178.15 178.94 3ku2 h THR 163 N 0.29 0.80 -0.12 -0.27 2.02 -1.13 0.24 112.91 114.74 3ku2 h THR 163 Ca 0.08 -0.06 -0.01 0.00 0.77 0.00 0.00 66.41 67.20 3ku2 h THR 163 Cb -0.02 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 67.00 3ku2 h THR 163 CO -0.02 0.03 0.05 0.22 0.37 0.00 0.00 175.52 176.18 3ku2 h TYR 164 N 0.16 0.17 -0.57 3.16 3.20 -1.39 -0.88 116.97 120.83 3ku2 h TYR 164 Ca 0.17 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.02 3ku2 h TYR 164 Cb 0.21 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.40 3ku2 h TYR 164 CO -0.20 0.24 0.30 0.52 -1.64 0.00 0.00 178.16 177.38 3ku2 h MET 165 N 0.06 0.80 -0.48 1.82 2.86 -1.05 -2.70 114.93 116.24 3ku2 h MET 165 Ca 0.04 -0.10 -0.04 0.00 -2.06 0.00 0.00 59.70 57.54 3ku2 h MET 165 Cb 0.13 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.62 3ku2 h MET 165 CO -0.00 0.62 0.12 0.45 1.06 0.00 0.00 176.91 179.16 3ku2 h HIS 166 N 0.77 0.73 -0.23 -0.22 3.86 -0.37 -0.55 115.15 119.14 3ku2 h HIS 166 Ca 0.20 -0.06 0.00 0.00 -1.16 0.00 0.00 60.37 59.35 3ku2 h HIS 166 Cb 0.06 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.30 3ku2 h HIS 166 CO -0.01 0.62 0.15 0.87 0.86 0.00 0.00 177.93 180.41 3ku2 h LYS 167 N 0.70 0.31 -0.66 2.45 1.57 -0.85 -0.19 116.57 119.91 3ku2 h LYS 167 Ca 0.16 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 3ku2 h LYS 167 Cb 0.25 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.49 3ku2 h LYS 167 CO -0.00 0.21 0.00 0.09 -0.57 0.00 0.00 179.45 179.18 3ku2 n ASN 168 N -4.49 4.39 -3.09 0.86 3.02 -0.70 -4.94 115.26 110.31 3ku2 n ASN 168 Ca 0.00 -2.59 -0.22 0.00 -0.03 0.00 0.00 54.58 51.75 3ku2 n ASN 168 Cb 0.08 -0.60 0.01 0.00 -0.61 0.00 0.00 39.78 38.66 3ku2 n ASN 168 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 3ku2 n LYS 169 N 0.62 -3.78 -4.00 3.52 2.85 -0.08 -4.99 118.16 112.30 3ku2 n LYS 169 Ca 0.21 0.67 -0.35 0.00 -1.05 0.00 0.00 58.31 57.79 3ku2 n LYS 169 Cb 0.90 -5.43 -0.13 0.00 -0.65 0.00 0.00 35.03 29.72 3ku2 n LYS 169 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 3ku2 s ILE 170 N -2.99 3.76 -0.10 0.58 1.01 -0.30 -4.99 121.20 118.17 3ku2 s ILE 170 Ca 0.30 -0.37 -0.03 0.00 0.00 0.00 0.00 60.65 60.55 3ku2 s ILE 170 Cb -0.15 -2.71 -0.03 0.00 0.01 0.00 0.00 42.46 39.58 3ku2 s ILE 170 CO 0.37 0.42 0.01 -0.69 0.00 0.00 0.00 174.94 175.05 3ku2 s VAL 171 N 1.23 4.37 -0.11 2.92 1.01 -1.26 -3.48 120.40 125.08 3ku2 s VAL 171 Ca 0.03 -0.22 -0.07 0.00 0.00 0.00 0.00 61.98 61.73 3ku2 s VAL 171 Cb -0.15 -2.86 -0.06 0.00 0.00 0.00 0.00 36.38 33.32 3ku2 s VAL 171 CO 0.00 0.59 0.16 -0.74 0.00 0.00 0.00 175.10 175.11 3ku2 h HIS 172 N 5.39 0.00 0.00 5.22 2.76 -1.93 -2.93 115.15 123.66 3ku2 h HIS 172 Ca -0.48 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.69 3ku2 h HIS 172 Cb 1.19 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.15 3ku2 h HIS 172 CO 0.62 0.23 0.00 -2.13 -1.30 0.00 0.00 177.93 175.35 3ku2 n ARG 173 N -4.73 0.00 -1.84 5.26 0.63 -1.26 -4.53 116.66 110.19 3ku2 n ARG 173 Ca -0.03 0.00 -0.30 0.00 -0.92 0.00 0.00 57.85 56.60 3ku2 n ARG 173 Cb 0.12 -0.05 0.04 0.00 0.45 0.00 0.00 32.46 33.02 3ku2 n ARG 173 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3ku2 n ASP 174 N 1.82 6.15 -4.70 6.15 10.43 -1.26 -4.78 116.55 130.36 3ku2 n ASP 174 Ca 0.00 -3.77 -0.42 0.00 2.57 0.00 0.00 54.79 53.17 3ku2 n ASP 174 Cb 0.00 -0.66 -0.03 0.00 1.84 0.00 0.00 41.12 42.27 3ku2 n ASP 174 CO 0.00 0.00 0.00 -0.22 -1.07 0.00 0.00 177.20 175.91 3ku2 s LEU 175 N -3.73 4.32 0.20 0.64 2.96 -1.26 -4.95 118.68 116.86 3ku2 s LEU 175 Ca 0.55 1.97 -0.12 0.00 -0.22 0.00 0.00 54.13 56.32 3ku2 s LEU 175 Cb 0.45 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.57 3ku2 s LEU 175 CO -0.06 -0.58 0.39 -1.59 -1.32 0.00 0.00 176.35 173.19 3ku2 s LYS 176 N 1.82 1.32 0.44 1.98 -2.85 -1.26 -4.77 119.74 116.41 3ku2 s LYS 176 Ca 0.59 -1.14 0.15 0.00 -1.00 0.00 0.00 55.97 54.57 3ku2 s LYS 176 Cb -0.28 0.43 1.07 0.00 -2.06 0.00 0.00 37.83 36.99 3ku2 s LYS 176 CO 0.26 -0.52 1.97 -1.35 0.10 0.00 0.00 175.35 175.81 3ku2 h PRO 177 N 2.39 0.36 0.00 1.78 0.11 -1.95 -1.98 132.00 132.70 3ku2 h PRO 177 Ca -0.30 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.77 3ku2 h PRO 177 Cb 1.24 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 3ku2 h PRO 177 CO 0.42 0.24 -0.09 0.93 -0.21 0.00 0.00 178.00 179.29 3ku2 h GLU 178 N 0.37 0.00 -0.03 1.05 3.07 -1.97 -1.79 114.58 115.28 3ku2 h GLU 178 Ca 0.29 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.15 3ku2 h GLU 178 Cb 0.65 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.56 3ku2 h GLU 178 CO -0.08 0.09 0.00 0.09 -1.40 0.00 0.00 179.01 177.71 3ku2 n ASN 179 N -4.01 0.36 -4.18 1.42 5.03 -0.74 -4.69 115.26 108.45 3ku2 n ASN 179 Ca -0.02 -1.38 -0.39 0.00 0.87 0.00 0.00 54.58 53.65 3ku2 n ASN 179 Cb 0.18 -0.02 -0.10 0.00 -1.02 0.00 0.00 39.78 38.82 3ku2 n ASN 179 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 3ku2 s LEU 180 N -1.70 5.52 0.09 3.41 1.43 -0.67 -1.23 118.68 125.54 3ku2 s LEU 180 Ca 0.34 -1.95 0.02 0.00 -1.03 0.00 0.00 54.13 51.51 3ku2 s LEU 180 Cb 0.16 -1.94 -0.04 0.00 0.03 0.00 0.00 46.19 44.40 3ku2 s LEU 180 CO 0.26 -0.64 0.18 -0.76 0.23 0.00 0.00 176.35 175.62 3ku2 s LEU 181 N 1.28 4.14 0.13 1.79 1.43 -0.57 -1.20 118.68 125.69 3ku2 s LEU 181 Ca 0.07 0.14 0.05 0.00 -1.03 0.00 0.00 54.13 53.35 3ku2 s LEU 181 Cb -0.25 -2.76 -0.04 0.00 0.03 0.00 0.00 46.19 43.17 3ku2 s LEU 181 CO -0.02 0.14 0.08 -0.76 0.23 0.00 0.00 176.35 176.02 3ku2 s LEU 182 N -2.66 3.67 0.23 1.79 1.43 -0.57 -0.38 118.68 122.19 3ku2 s LEU 182 Ca 0.33 -0.14 0.12 0.00 -1.03 0.00 0.00 54.13 53.41 3ku2 s LEU 182 Cb -0.12 -2.33 0.03 0.00 0.03 0.00 0.00 46.19 43.79 3ku2 s LEU 182 CO 0.26 0.12 1.41 -0.33 0.23 0.00 0.00 176.35 178.05 3ku2 h GLU 183 N 2.91 0.00 -3.47 1.70 5.08 -1.79 -0.10 114.58 118.90 3ku2 h GLU 183 Ca -0.47 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 57.73 3ku2 h GLU 183 Cb 1.18 0.00 -0.22 0.00 0.50 0.00 0.00 28.75 30.21 3ku2 h GLU 183 CO 0.63 0.69 -0.50 -1.54 -1.00 0.00 0.00 179.01 177.28 3ku2 s SER 184 N -6.57 -0.02 -1.45 1.42 1.04 -1.26 -3.25 113.70 103.61 3ku2 s SER 184 Ca 0.02 -0.07 -0.14 0.00 0.48 0.00 0.00 55.95 56.25 3ku2 s SER 184 Cb 0.09 0.24 0.05 0.00 0.10 0.00 0.00 66.02 66.49 3ku2 s SER 184 CO 0.77 -0.28 2.20 1.17 0.98 0.00 0.00 173.24 178.08 3ku2 n LYS 185 N 1.87 2.89 -3.92 4.02 4.81 -1.24 -4.68 118.16 121.91 3ku2 n LYS 185 Ca -0.20 -2.65 -0.09 0.00 -0.87 0.00 0.00 58.31 54.49 3ku2 n LYS 185 Cb 0.56 -3.28 -0.07 0.00 0.02 0.00 0.00 35.03 32.26 3ku2 n LYS 185 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 3ku2 s SER 186 N 3.12 0.08 0.67 3.14 1.04 -1.26 -5.07 113.70 115.42 3ku2 s SER 186 Ca 0.47 -0.78 -0.15 0.00 0.48 0.00 0.00 55.95 55.96 3ku2 s SER 186 Cb 0.14 0.39 0.01 0.00 0.10 0.00 0.00 66.02 66.65 3ku2 s SER 186 CO -0.08 -0.82 1.14 -0.75 0.98 0.00 0.00 173.24 173.71 3ku2 s LYS 187 N -3.92 2.63 0.00 4.02 2.20 -1.26 -3.30 119.74 120.11 3ku2 s LYS 187 Ca 0.12 1.53 0.00 0.00 -0.36 0.00 0.00 55.97 57.26 3ku2 s LYS 187 Cb 0.04 -1.92 0.00 0.00 -1.51 0.00 0.00 37.83 34.44 3ku2 s LYS 187 CO -0.05 -1.41 0.00 -0.25 -0.36 0.00 0.00 175.35 173.28 3ku2 n ASP 188 N -2.42 0.00 -4.76 1.43 8.00 -1.26 -4.97 116.55 112.57 3ku2 n ASP 188 Ca 0.11 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.24 3ku2 n ASP 188 Cb 0.51 -1.98 0.00 0.00 -0.02 0.00 0.00 41.12 39.64 3ku2 n ASP 188 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3ku2 s ALA 189 N -1.59 2.99 0.28 2.24 0.00 -1.21 -4.97 121.76 119.50 3ku2 s ALA 189 Ca 0.00 1.08 -0.30 0.00 0.00 0.00 0.00 51.96 52.74 3ku2 s ALA 189 Cb 0.00 -3.44 -0.11 0.00 0.00 0.00 0.00 23.12 19.57 3ku2 s ALA 189 CO 0.00 -0.85 1.53 1.21 0.00 0.00 0.00 175.76 177.65 3ku2 s ASN 190 N -1.16 6.48 -0.17 0.00 2.47 -1.26 -4.87 114.94 116.43 3ku2 s ASN 190 Ca 0.64 2.85 -0.08 0.00 0.42 0.00 0.00 52.86 56.68 3ku2 s ASN 190 Cb -0.33 -2.63 -0.05 0.00 -1.45 0.00 0.00 41.25 36.79 3ku2 s ASN 190 CO 0.40 -0.83 0.12 -0.63 -3.72 0.00 0.00 177.10 172.44 3ku2 s ILE 191 N -0.04 5.28 -0.12 -5.21 1.01 -1.26 -2.30 121.20 118.55 3ku2 s ILE 191 Ca 0.61 0.14 0.03 0.00 0.00 0.00 0.00 60.65 61.43 3ku2 s ILE 191 Cb -0.45 -3.37 0.01 0.00 0.01 0.00 0.00 42.46 38.65 3ku2 s ILE 191 CO 0.47 0.49 -0.22 -0.13 0.00 0.00 0.00 174.94 175.55 3ku2 s ARG 192 N -0.03 2.96 -0.09 2.79 1.81 0.49 -4.20 118.95 122.68 3ku2 s ARG 192 Ca 0.09 -0.84 -0.25 0.00 -1.72 0.00 0.00 55.73 53.01 3ku2 s ARG 192 Cb -0.11 -2.35 -0.03 0.00 -0.45 0.00 0.00 34.95 32.01 3ku2 s ARG 192 CO 0.00 0.04 0.80 0.42 -0.68 0.00 0.00 175.30 175.89 3ku2 s ILE 193 N 0.67 4.95 0.17 1.52 1.01 -0.43 -1.51 121.20 127.59 3ku2 s ILE 193 Ca -0.11 1.63 0.04 0.00 0.00 0.00 0.00 60.65 62.21 3ku2 s ILE 193 Cb -0.16 -4.13 -0.03 0.00 0.01 0.00 0.00 42.46 38.14 3ku2 s ILE 193 CO 0.02 0.15 0.28 0.27 0.00 0.00 0.00 174.94 175.66 3ku2 s ILE 194 N 1.33 5.16 -0.59 2.92 -4.36 -0.36 -0.88 121.20 124.41 3ku2 s ILE 194 Ca 0.41 -0.83 0.00 0.00 -0.26 0.00 0.00 60.65 59.97 3ku2 s ILE 194 Cb -0.18 -3.69 0.00 0.00 1.25 0.00 0.00 42.46 39.84 3ku2 s ILE 194 CO 0.18 -0.15 0.00 0.47 0.24 0.00 0.00 174.94 175.68 3ku2 n ASP 195 N -0.72 -3.85 -4.74 4.36 8.00 -1.26 -4.85 116.55 113.49 3ku2 n ASP 195 Ca -0.08 0.14 -0.42 0.00 0.71 0.00 0.00 54.79 55.15 3ku2 n ASP 195 Cb 0.55 -1.84 -0.02 0.00 -0.02 0.00 0.00 41.12 39.79 3ku2 n ASP 195 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3ku2 s PHE 196 N -2.15 3.00 0.00 1.24 0.08 -1.26 -2.52 117.98 116.36 3ku2 s PHE 196 Ca 0.00 0.84 0.00 0.00 0.12 0.00 0.00 56.93 57.89 3ku2 s PHE 196 Cb 0.00 -3.90 0.00 0.00 -0.57 0.00 0.00 43.02 38.55 3ku2 s PHE 196 CO 0.00 -3.09 0.00 0.41 -0.10 0.00 0.00 175.22 172.44 3ku2 n GLY 197 N 2.80 1.49 0.10 4.36 0.00 -1.11 -4.90 105.19 107.94 3ku2 n GLY 197 Ca 0.10 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.99 3ku2 n GLY 197 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3ku2 h LEU 198 N 0.00 -0.15 -0.86 0.99 -0.00 -1.78 -3.25 115.31 110.26 3ku2 h LEU 198 Ca 0.00 0.01 0.21 0.00 -0.00 0.00 0.00 57.88 58.09 3ku2 h LEU 198 Cb 0.00 0.04 -0.12 0.00 -0.00 0.00 0.00 40.66 40.58 3ku2 h LEU 198 CO 0.00 -0.10 0.33 0.77 -0.00 0.00 0.00 178.44 179.44 3ku2 h SER 199 N -0.17 0.23 -0.09 -0.43 4.64 -1.79 -2.12 113.55 113.82 3ku2 h SER 199 Ca -0.02 0.16 0.03 0.00 -0.47 0.00 0.00 61.79 61.49 3ku2 h SER 199 Cb 0.13 0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 62.38 3ku2 h SER 199 CO 0.03 -0.02 0.07 0.74 -0.87 0.00 0.00 176.83 176.77 3ku2 h THR 200 N 0.36 0.89 0.00 2.95 2.02 -1.88 -3.27 112.91 113.97 3ku2 h THR 200 Ca 0.53 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.65 3ku2 h THR 200 Cb 0.98 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 68.33 3ku2 h THR 200 CO -0.54 0.00 -1.43 1.41 0.37 0.00 0.00 175.52 175.33 3ku2 n HIS 201 N -4.41 0.00 -5.22 3.16 8.25 -0.93 -4.48 115.22 111.60 3ku2 n HIS 201 Ca -0.01 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.13 3ku2 n HIS 201 Cb 0.18 -0.26 -0.17 0.00 1.12 0.00 0.00 29.99 30.86 3ku2 n HIS 201 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 3ku2 s PHE 202 N -2.41 2.54 -0.39 4.41 0.08 -0.84 0.04 117.98 121.42 3ku2 s PHE 202 Ca -0.03 -1.03 -0.29 0.00 0.12 0.00 0.00 56.93 55.69 3ku2 s PHE 202 Cb 0.04 -1.70 0.02 0.00 -0.57 0.00 0.00 43.02 40.81 3ku2 s PHE 202 CO 0.33 -0.41 1.15 -2.00 -0.10 0.00 0.00 175.22 174.18 3ku2 s GLU 203 N 0.33 3.88 0.76 0.44 2.12 -0.79 -4.55 118.70 120.88 3ku2 s GLU 203 Ca -0.18 0.88 -0.13 0.00 0.36 0.00 0.00 54.97 55.89 3ku2 s GLU 203 Cb -0.18 -3.84 0.05 0.00 0.26 0.00 0.00 34.13 30.43 3ku2 s GLU 203 CO 0.09 -1.16 1.16 0.00 -0.54 0.00 0.00 175.26 174.80 3ku2 s ALA 204 N 4.16 2.09 -0.00 6.30 0.00 -1.26 -4.43 121.76 128.62 3ku2 s ALA 204 Ca 0.49 0.66 -0.30 0.00 0.00 0.00 0.00 51.96 52.81 3ku2 s ALA 204 Cb -0.11 -3.40 -0.07 0.00 0.00 0.00 0.00 23.12 19.54 3ku2 s ALA 204 CO 0.24 -1.90 1.75 0.45 0.00 0.00 0.00 175.76 176.30 3ku2 s SER 205 N -2.47 6.59 0.00 0.00 0.15 -1.21 -4.93 113.70 111.82 3ku2 s SER 205 Ca 0.69 2.42 0.31 0.00 0.70 0.00 0.00 55.95 60.07 3ku2 s SER 205 Cb -0.24 -2.54 1.62 0.00 -1.71 0.00 0.00 66.02 63.15 3ku2 s SER 205 CO 0.48 -0.96 2.08 0.29 1.20 0.00 0.00 173.24 176.34 3ku2 n LYS 206 N 6.97 0.89 -2.16 5.44 5.02 -1.26 -4.53 118.16 128.54 3ku2 n LYS 206 Ca 0.18 -0.14 -0.41 0.00 -2.02 0.00 0.00 58.31 55.92 3ku2 n LYS 206 Cb 0.42 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.90 3ku2 n LYS 206 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3ku2 s LYS 207 N -2.20 4.35 0.33 1.97 -0.14 -1.26 -4.87 119.74 117.92 3ku2 s LYS 207 Ca 0.40 2.13 0.10 0.00 -1.36 0.00 0.00 55.97 57.23 3ku2 s LYS 207 Cb 0.21 -3.17 0.86 0.00 -1.68 0.00 0.00 37.83 34.05 3ku2 s LYS 207 CO 0.40 -0.30 1.77 1.98 -0.76 0.00 0.00 175.35 178.44 3ku2 h MET 208 N 5.30 0.62 -0.54 1.68 4.05 -1.96 -0.81 114.93 123.27 3ku2 h MET 208 Ca -0.45 -0.04 0.15 0.00 -0.28 0.00 0.00 59.70 59.08 3ku2 h MET 208 Cb 1.22 -0.14 -0.02 0.00 -0.80 0.00 0.00 31.60 31.85 3ku2 h MET 208 CO 0.78 0.41 0.38 0.87 0.23 0.00 0.00 176.91 179.58 3ku2 h LYS 209 N 0.63 0.04 0.00 0.39 6.56 -1.93 -1.41 116.57 120.86 3ku2 h LYS 209 Ca 0.58 -0.00 -0.12 0.00 -1.06 0.00 0.00 60.65 60.05 3ku2 h LYS 209 Cb 1.09 -0.01 -0.02 0.00 -0.57 0.00 0.00 32.23 32.72 3ku2 h LYS 209 CO -0.37 0.03 -1.73 -0.25 -2.06 0.00 0.00 179.45 175.08 3ku2 n ASP 210 N -4.39 0.40 0.19 0.86 8.00 -0.37 -4.34 116.55 116.90 3ku2 n ASP 210 Ca 0.10 0.17 0.13 0.00 0.71 0.00 0.00 54.79 55.90 3ku2 n ASP 210 Cb 0.58 1.00 0.30 0.00 -0.02 0.00 0.00 41.12 42.99 3ku2 n ASP 210 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 3ku2 h LYS 211 N 0.00 0.00 -6.67 -1.24 1.57 -0.65 -3.46 116.57 106.12 3ku2 h LYS 211 Ca -0.15 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.10 3ku2 h LYS 211 Cb 1.41 0.00 0.05 0.00 0.08 0.00 0.00 32.23 33.76 3ku2 h LYS 211 CO 0.02 0.00 0.78 0.96 -0.57 0.00 0.00 179.45 180.64 3ku2 s ILE 212 N -3.23 2.77 -0.37 1.86 -5.25 -0.92 -2.82 121.20 113.24 3ku2 s ILE 212 Ca 0.07 0.60 0.00 0.00 -0.99 0.00 0.00 60.65 60.34 3ku2 s ILE 212 Cb 0.08 -3.39 0.00 0.00 2.95 0.00 0.00 42.46 42.10 3ku2 s ILE 212 CO 0.62 0.07 0.00 0.61 -1.79 0.00 0.00 174.94 174.46 3ku2 n GLY 213 N 2.86 0.50 0.09 6.27 0.00 -1.26 -4.95 105.19 108.69 3ku2 n GLY 213 Ca 0.09 -0.84 -0.11 0.00 0.00 0.00 0.00 46.02 45.16 3ku2 n GLY 213 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ku2 n THR 214 N -3.30 1.01 0.26 2.61 -2.24 -1.13 -4.65 114.28 106.85 3ku2 n THR 214 Ca -0.04 -0.44 0.09 0.00 -2.27 0.00 0.00 64.05 61.39 3ku2 n THR 214 Cb 0.27 -1.02 0.66 0.00 -2.10 0.00 0.00 70.33 68.15 3ku2 n THR 214 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ku2 h ALA 215 N 0.16 1.75 -0.64 6.98 0.00 -1.93 -2.98 119.26 122.61 3ku2 h ALA 215 Ca -0.40 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.42 3ku2 h ALA 215 Cb 1.68 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.43 3ku2 h ALA 215 CO -0.04 0.08 0.25 1.88 0.00 0.00 0.00 179.25 181.42 3ku2 h TYR 216 N 0.00 0.95 0.00 0.00 -1.99 -1.85 -3.34 116.97 110.74 3ku2 h TYR 216 Ca -0.00 -0.06 -0.27 0.00 2.00 0.00 0.00 58.73 60.40 3ku2 h TYR 216 Cb 0.13 -0.29 -0.05 0.00 2.00 0.00 0.00 36.73 38.52 3ku2 h TYR 216 CO 0.00 0.73 -1.96 0.66 -0.00 0.00 0.00 178.16 177.59 3ku2 n TYR 217 N -4.31 0.47 -1.69 4.88 4.02 -1.13 -4.81 117.16 114.59 3ku2 n TYR 217 Ca 0.05 0.16 -0.44 0.00 -0.01 0.00 0.00 57.90 57.67 3ku2 n TYR 217 Cb 0.18 -1.01 -0.04 0.00 -0.02 0.00 0.00 39.34 38.45 3ku2 n TYR 217 CO 0.00 0.00 0.00 1.51 -1.01 0.00 0.00 176.86 177.36 3ku2 n ILE 218 N -2.80 0.09 -2.19 -0.72 0.13 -1.19 -3.97 119.36 108.71 3ku2 n ILE 218 Ca -0.21 -0.02 -0.37 0.00 -1.10 0.00 0.00 62.75 61.05 3ku2 n ILE 218 Cb 1.00 -1.81 -0.00 0.00 -0.84 0.00 0.00 39.64 37.99 3ku2 n ILE 218 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 3ku2 s ALA 219 N 1.46 2.99 0.47 1.51 0.00 -1.26 -4.95 121.76 121.97 3ku2 s ALA 219 Ca 0.79 1.01 0.15 0.00 0.00 0.00 0.00 51.96 53.90 3ku2 s ALA 219 Cb -0.59 -3.41 1.09 0.00 0.00 0.00 0.00 23.12 20.21 3ku2 s ALA 219 CO 0.36 -0.75 2.05 -1.35 0.00 0.00 0.00 175.76 176.08 3ku2 h PRO 220 N 2.06 0.01 0.00 0.00 0.11 -1.94 -2.50 132.00 129.74 3ku2 h PRO 220 Ca -0.49 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 3ku2 h PRO 220 Cb 1.25 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 3ku2 h PRO 220 CO 0.60 0.12 -0.04 1.05 -0.21 0.00 0.00 178.00 179.52 3ku2 h GLU 221 N 0.01 0.00 -0.26 1.05 9.09 -1.91 -2.86 114.58 119.69 3ku2 h GLU 221 Ca 0.00 0.00 -0.18 0.00 0.05 0.00 0.00 59.36 59.23 3ku2 h GLU 221 Cb 0.21 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.30 3ku2 h GLU 221 CO 0.01 0.04 -0.55 0.28 0.05 0.00 0.00 179.01 178.84 3ku2 h VAL 222 N 0.00 1.28 -0.56 -1.06 2.07 -1.67 -2.18 116.25 114.14 3ku2 h VAL 222 Ca -0.00 -1.75 0.03 0.00 0.82 0.00 0.00 66.70 65.80 3ku2 h VAL 222 Cb 0.67 1.67 -0.04 0.00 -1.52 0.00 0.00 31.29 32.06 3ku2 h VAL 222 CO 0.00 0.57 0.33 -0.07 0.02 0.00 0.00 177.57 178.42 3ku2 h LEU 223 N 0.61 0.53 -0.08 2.57 3.38 -1.53 -2.92 115.31 117.87 3ku2 h LEU 223 Ca 0.01 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3ku2 h LEU 223 Cb 1.15 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.80 3ku2 h LEU 223 CO 0.12 0.37 -0.15 1.41 0.09 0.00 0.00 178.44 180.28 3ku2 n HIS 224 N -4.78 0.00 0.00 1.13 8.25 -1.15 -4.99 115.22 113.68 3ku2 n HIS 224 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 3ku2 n HIS 224 Cb 0.09 -0.32 0.00 0.00 1.12 0.00 0.00 29.99 30.88 3ku2 n HIS 224 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3ku2 n GLY 225 N 1.41 2.47 3.48 -1.41 0.00 -0.84 -5.05 105.19 105.25 3ku2 n GLY 225 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 3ku2 n GLY 225 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ku2 s THR 226 N -2.52 5.03 0.14 2.61 2.01 -1.12 -4.96 115.64 116.83 3ku2 s THR 226 Ca 0.00 -0.38 -0.12 0.00 0.31 0.00 0.00 61.69 61.50 3ku2 s THR 226 Cb 0.00 -3.62 0.01 0.00 0.01 0.00 0.00 72.50 68.90 3ku2 s THR 226 CO 0.00 -0.04 0.33 -0.72 -0.69 0.00 0.00 174.62 173.50 3ku2 s TYR 227 N 1.67 0.10 0.00 4.92 -0.85 -1.26 -4.47 117.35 117.46 3ku2 s TYR 227 Ca 0.05 -0.47 0.00 0.00 -0.52 0.00 0.00 57.07 56.13 3ku2 s TYR 227 Cb -0.18 0.10 0.00 0.00 0.38 0.00 0.00 41.96 42.26 3ku2 s TYR 227 CO 0.09 -0.70 0.00 -0.40 -1.52 0.00 0.00 175.55 173.01 3ku2 n ASP 228 N -0.20 0.00 0.12 -0.18 5.68 -1.26 -5.04 116.55 115.67 3ku2 n ASP 228 Ca -0.12 -0.42 0.18 0.00 -0.50 0.00 0.00 54.79 53.93 3ku2 n ASP 228 Cb 0.63 0.00 0.76 0.00 -1.14 0.00 0.00 41.12 41.36 3ku2 n ASP 228 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 3ku2 h GLU 229 N 0.00 0.00 -0.12 0.11 9.09 -1.99 -2.59 114.58 119.07 3ku2 h GLU 229 Ca 0.00 0.00 0.04 0.00 0.05 0.00 0.00 59.36 59.45 3ku2 h GLU 229 Cb 0.00 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.10 3ku2 h GLU 229 CO 0.00 0.00 0.20 0.87 0.05 0.00 0.00 179.01 180.13 3ku2 h LYS 230 N 0.00 0.00 0.00 1.06 1.79 -1.95 -0.81 116.57 116.66 3ku2 h LYS 230 Ca 0.15 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.59 3ku2 h LYS 230 Cb 0.73 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.38 3ku2 h LYS 230 CO -0.00 0.00 -0.13 0.00 -1.08 0.00 0.00 179.45 178.24 3ku2 h ASP 232 N 0.00 0.51 -0.14 0.00 3.32 -1.38 -2.60 116.42 116.13 3ku2 h ASP 232 Ca -0.00 -0.21 -0.01 0.00 0.02 0.00 0.00 57.03 56.83 3ku2 h ASP 232 Cb 0.24 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 3ku2 h ASP 232 CO 0.02 0.83 0.07 0.58 -1.72 0.00 0.00 179.24 179.01 3ku2 h VAL 233 N 0.42 1.13 -0.22 -1.35 2.07 -1.58 -1.92 116.25 114.80 3ku2 h VAL 233 Ca 0.05 -0.37 0.05 0.00 0.82 0.00 0.00 66.70 67.24 3ku2 h VAL 233 Cb 0.81 1.12 -0.05 0.00 -1.52 0.00 0.00 31.29 31.65 3ku2 h VAL 233 CO 0.07 0.12 -0.08 -0.25 0.02 0.00 0.00 177.57 177.44 3ku2 h TRP 234 N 0.10 -0.18 -0.98 1.57 2.91 -1.44 0.94 115.95 118.86 3ku2 h TRP 234 Ca 0.05 0.02 0.02 0.00 1.13 0.00 0.00 58.89 60.11 3ku2 h TRP 234 Cb 0.13 0.11 -0.05 0.00 -0.51 0.00 0.00 29.16 28.84 3ku2 h TRP 234 CO -0.03 -0.13 0.64 0.77 -1.03 0.00 0.00 178.44 178.67 3ku2 h SER 235 N -0.04 1.10 -0.61 2.65 0.02 -1.33 -1.65 113.55 113.70 3ku2 h SER 235 Ca 0.11 -0.02 -0.08 0.00 -0.84 0.00 0.00 61.79 60.96 3ku2 h SER 235 Cb 0.21 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.46 3ku2 h SER 235 CO -0.25 0.79 0.09 0.74 -1.14 0.00 0.00 176.83 177.05 3ku2 h THR 236 N 1.30 1.26 -0.81 -2.27 2.02 -0.82 -2.08 112.91 111.50 3ku2 h THR 236 Ca 0.37 -1.03 -0.00 0.00 0.77 0.00 0.00 66.41 66.52 3ku2 h THR 236 Cb -0.11 0.68 -0.04 0.00 -1.74 0.00 0.00 68.15 66.95 3ku2 h THR 236 CO -0.09 0.38 0.50 1.23 0.37 0.00 0.00 175.52 177.92 3ku2 h GLY 237 N 1.03 1.16 0.96 2.16 0.00 -0.27 -0.69 103.07 107.42 3ku2 h GLY 237 Ca 0.19 -0.47 -0.02 0.00 0.00 0.00 0.00 47.33 47.04 3ku2 h GLY 237 CO 0.01 0.46 0.19 -2.08 0.00 0.00 0.00 176.54 175.13 3ku2 h VAL 238 N 1.11 1.18 -0.18 4.60 2.07 -0.99 -1.17 116.25 122.86 3ku2 h VAL 238 Ca 0.29 -0.51 0.01 0.00 0.82 0.00 0.00 66.70 67.32 3ku2 h VAL 238 Cb -0.07 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 3ku2 h VAL 238 CO -0.06 0.19 0.07 0.40 0.02 0.00 0.00 177.57 178.20 3ku2 h ILE 239 N 0.52 0.97 0.05 4.57 2.04 -1.08 -2.09 117.51 122.49 3ku2 h ILE 239 Ca 0.14 -0.06 0.02 0.00 1.00 0.00 0.00 64.86 65.97 3ku2 h ILE 239 Cb 0.12 0.79 -0.03 0.00 -0.74 0.00 0.00 36.82 36.96 3ku2 h ILE 239 CO -0.02 0.03 -0.22 0.25 0.00 0.00 0.00 178.15 178.20 3ku2 h LEU 240 N 0.16 -0.63 -0.77 1.44 5.85 -0.97 0.19 115.31 120.58 3ku2 h LEU 240 Ca 0.08 0.08 0.16 0.00 0.84 0.00 0.00 57.88 59.04 3ku2 h LEU 240 Cb 0.04 0.25 -0.10 0.00 0.37 0.00 0.00 40.66 41.21 3ku2 h LEU 240 CO -0.07 -0.29 0.29 0.22 -0.34 0.00 0.00 178.44 178.24 3ku2 h TYR 241 N -0.37 0.48 -0.34 1.25 3.20 -1.07 -0.92 116.97 119.20 3ku2 h TYR 241 Ca 0.04 0.04 -0.08 0.00 3.14 0.00 0.00 58.73 61.88 3ku2 h TYR 241 Cb 0.43 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 3ku2 h TYR 241 CO -0.23 0.01 -0.09 0.82 -1.64 0.00 0.00 178.16 177.03 3ku2 h ILE 242 N 0.39 1.28 -0.83 1.81 2.04 -0.82 -1.41 117.51 119.97 3ku2 h ILE 242 Ca 0.44 -1.15 0.08 0.00 1.00 0.00 0.00 64.86 65.24 3ku2 h ILE 242 Cb 0.72 1.33 -0.07 0.00 -0.74 0.00 0.00 36.82 38.05 3ku2 h ILE 242 CO -0.45 0.37 0.49 -0.07 0.00 0.00 0.00 178.15 178.49 3ku2 h LEU 243 N 0.44 0.72 0.00 1.44 3.38 0.48 0.63 115.31 122.41 3ku2 h LEU 243 Ca 0.09 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3ku2 h LEU 243 Cb 0.59 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.23 3ku2 h LEU 243 CO 0.03 0.43 -0.34 -0.07 0.09 0.00 0.00 178.44 178.58 3ku2 h LEU 244 N 0.84 0.00 0.00 1.67 3.38 -1.15 -3.41 115.31 116.64 3ku2 h LEU 244 Ca 0.39 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.29 3ku2 h LEU 244 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3ku2 h LEU 244 CO -0.22 0.03 -0.41 -1.54 0.09 0.00 0.00 178.44 176.39 3ku2 n SER 245 N -2.45 2.04 -0.06 -0.43 3.41 -0.54 -4.80 113.62 110.80 3ku2 n SER 245 Ca 0.04 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.64 3ku2 n SER 245 Cb 0.47 0.37 -0.00 0.00 -0.26 0.00 0.00 64.21 64.79 3ku2 n SER 245 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ku2 n GLY 246 N 1.12 0.46 3.11 5.00 0.00 0.22 -4.25 105.19 110.85 3ku2 n GLY 246 Ca 0.00 -0.17 -0.25 0.00 0.00 0.00 0.00 46.02 45.61 3ku2 n GLY 246 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ku2 s PRO 248 N -0.02 4.36 0.43 0.00 0.02 -1.26 -4.06 135.00 134.47 3ku2 s PRO 248 Ca -0.01 2.19 0.13 0.00 0.02 0.00 0.00 61.00 63.32 3ku2 s PRO 248 Cb -0.10 -3.10 0.95 0.00 0.02 0.00 0.00 34.50 32.28 3ku2 s PRO 248 CO 0.01 -0.22 1.99 -1.00 -0.33 0.00 0.00 177.00 177.46 3ku2 h PRO 249 N 3.97 0.11 -4.55 5.54 0.13 -1.91 -3.36 132.00 131.94 3ku2 h PRO 249 Ca -0.48 -0.02 -0.67 0.00 -0.87 0.00 0.00 66.00 63.96 3ku2 h PRO 249 Cb 1.22 -0.02 -0.39 0.00 0.13 0.00 0.00 31.00 31.95 3ku2 h PRO 249 CO 0.69 0.23 -0.67 -0.06 -0.23 0.00 0.00 178.00 177.97 3ku2 s PHE 250 N -4.78 3.69 0.39 1.56 0.40 -1.26 -4.72 117.98 113.25 3ku2 s PHE 250 Ca -0.05 -2.87 0.08 0.00 -0.60 0.00 0.00 56.93 53.49 3ku2 s PHE 250 Cb 0.16 -3.00 -0.07 0.00 0.51 0.00 0.00 43.02 40.62 3ku2 s PHE 250 CO 0.71 -0.94 0.03 1.21 0.70 0.00 0.00 175.22 176.93 3ku2 s ASN 251 N 1.06 4.04 0.00 1.36 3.84 -1.26 -4.74 114.94 119.24 3ku2 s ASN 251 Ca 0.11 -1.20 0.00 0.00 0.21 0.00 0.00 52.86 51.98 3ku2 s ASN 251 Cb -0.20 -0.44 0.00 0.00 -0.55 0.00 0.00 41.25 40.06 3ku2 s ASN 251 CO -0.07 -0.39 0.00 0.61 -2.79 0.00 0.00 177.10 174.47 3ku2 n GLY 252 N -1.00 0.84 0.16 1.21 0.00 -1.26 -4.41 105.19 100.73 3ku2 n GLY 252 Ca -0.04 -0.86 -0.10 0.00 0.00 0.00 0.00 46.02 45.03 3ku2 n GLY 252 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ku2 h ALA 253 N 0.00 0.41 -1.78 4.61 0.00 -1.95 -3.45 119.26 117.11 3ku2 h ALA 253 Ca 0.00 -0.13 -0.53 0.00 0.00 0.00 0.00 54.91 54.26 3ku2 h ALA 253 Cb 0.00 -0.12 -0.13 0.00 0.00 0.00 0.00 17.79 17.53 3ku2 h ALA 253 CO 0.00 0.01 -0.54 0.54 0.00 0.00 0.00 179.25 179.27 3ku2 s ASN 254 N -5.75 2.58 0.15 0.00 2.20 -1.26 -3.55 114.94 109.31 3ku2 s ASN 254 Ca -0.13 -1.61 -0.21 0.00 -0.94 0.00 0.00 52.86 49.96 3ku2 s ASN 254 Cb 0.09 0.39 0.03 0.00 -2.00 0.00 0.00 41.25 39.76 3ku2 s ASN 254 CO 0.73 -0.87 1.64 -0.08 -2.94 0.00 0.00 177.10 175.59 3ku2 h GLU 255 N 1.89 -0.19 -0.38 3.55 4.81 -1.90 -2.57 114.58 119.79 3ku2 h GLU 255 Ca -0.36 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 58.94 3ku2 h GLU 255 Cb 1.27 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 30.64 3ku2 h GLU 255 CO 0.59 -0.13 0.09 -0.92 -0.73 0.00 0.00 179.01 177.91 3ku2 h TYR 256 N -0.20 0.15 -0.99 0.92 5.03 -1.98 -0.74 116.97 119.17 3ku2 h TYR 256 Ca 0.14 0.02 0.09 0.00 2.58 0.00 0.00 58.73 61.56 3ku2 h TYR 256 Cb 0.41 -0.01 -0.07 0.00 1.55 0.00 0.00 36.73 38.61 3ku2 h TYR 256 CO -0.37 0.03 0.63 -0.44 -1.32 0.00 0.00 178.16 176.69 3ku2 h ASP 257 N 0.22 0.97 -0.17 -2.11 5.19 -1.89 0.97 116.42 119.59 3ku2 h ASP 257 Ca 0.18 0.03 -0.09 0.00 -0.62 0.00 0.00 57.03 56.53 3ku2 h ASP 257 Cb 0.20 -0.18 -0.00 0.00 0.18 0.00 0.00 39.33 39.53 3ku2 h ASP 257 CO -0.22 0.58 -0.23 0.40 -3.12 0.00 0.00 179.24 176.64 3ku2 h ILE 258 N 1.08 1.34 -0.52 0.35 2.04 -1.08 -2.89 117.51 117.85 3ku2 h ILE 258 Ca 0.45 -1.43 -0.02 0.00 1.00 0.00 0.00 64.86 64.86 3ku2 h ILE 258 Cb 0.29 1.87 -0.03 0.00 -0.74 0.00 0.00 36.82 38.22 3ku2 h ILE 258 CO -0.21 0.43 0.26 -0.07 0.00 0.00 0.00 178.15 178.56 3ku2 h LEU 259 N 0.11 0.64 -0.15 1.44 3.38 -0.40 -1.05 115.31 119.27 3ku2 h LEU 259 Ca 0.02 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3ku2 h LEU 259 Cb 0.79 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 3ku2 h LEU 259 CO 0.05 0.54 0.10 0.11 0.09 0.00 0.00 178.44 179.33 3ku2 h LYS 260 N 0.72 0.20 -0.12 1.13 6.56 -0.80 -0.68 116.57 123.58 3ku2 h LYS 260 Ca 0.18 -0.01 -0.00 0.00 -1.06 0.00 0.00 60.65 59.76 3ku2 h LYS 260 Cb 0.06 -0.05 -0.01 0.00 -0.57 0.00 0.00 32.23 31.67 3ku2 h LYS 260 CO -0.03 0.15 0.07 0.87 -2.06 0.00 0.00 179.45 178.45 3ku2 h LYS 261 N 0.20 0.16 0.02 3.15 1.57 -1.22 -2.55 116.57 117.90 3ku2 h LYS 261 Ca 0.06 -0.02 0.03 0.00 -1.87 0.00 0.00 60.65 58.84 3ku2 h LYS 261 Cb -0.01 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.23 3ku2 h LYS 261 CO -0.01 0.17 -0.19 0.28 -0.57 0.00 0.00 179.45 179.13 3ku2 h VAL 262 N 0.11 0.55 -0.90 0.50 2.07 -1.01 -1.35 116.25 116.22 3ku2 h VAL 262 Ca 0.04 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.67 3ku2 h VAL 262 Cb 0.05 0.55 -0.08 0.00 -1.52 0.00 0.00 31.29 30.30 3ku2 h VAL 262 CO -0.01 0.00 0.54 -0.08 0.02 0.00 0.00 177.57 178.04 3ku2 h GLU 263 N -0.31 0.84 0.00 1.57 4.22 -1.10 -0.88 114.58 118.91 3ku2 h GLU 263 Ca 0.05 -0.05 -0.11 0.00 0.08 0.00 0.00 59.36 59.33 3ku2 h GLU 263 Cb 0.38 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 3ku2 h GLU 263 CO -0.17 0.56 -0.52 0.87 -2.18 0.00 0.00 179.01 177.57 3ku2 h LYS 264 N 0.87 0.00 0.00 1.92 1.79 -1.21 -3.48 116.57 116.46 3ku2 h LYS 264 Ca 0.44 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.91 3ku2 h LYS 264 Cb 0.43 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.08 3ku2 h LYS 264 CO -0.26 0.52 0.00 0.41 -1.08 0.00 0.00 179.45 179.04 3ku2 n GLY 265 N 0.79 0.33 3.75 3.86 0.00 -0.34 -5.01 105.19 108.57 3ku2 n GLY 265 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 3ku2 n GLY 265 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ku2 s LYS 266 N -0.81 4.31 0.19 1.61 -2.85 -1.26 -4.94 119.74 115.98 3ku2 s LYS 266 Ca 0.00 0.64 -0.10 0.00 -1.00 0.00 0.00 55.97 55.51 3ku2 s LYS 266 Cb 0.00 -3.38 -0.00 0.00 -2.06 0.00 0.00 37.83 32.39 3ku2 s LYS 266 CO 0.00 0.29 0.34 1.52 0.10 0.00 0.00 175.35 177.60 3ku2 s TYR 267 N 0.12 0.36 0.19 1.78 -0.85 -1.26 -4.90 117.35 112.79 3ku2 s TYR 267 Ca 0.30 -0.72 0.00 0.00 -0.52 0.00 0.00 57.07 56.13 3ku2 s TYR 267 Cb -0.17 0.02 -0.04 0.00 0.38 0.00 0.00 41.96 42.15 3ku2 s TYR 267 CO 0.15 -0.79 0.08 0.95 -1.52 0.00 0.00 175.55 174.42 3ku2 s THR 268 N -3.97 0.28 -0.24 -3.49 -4.23 -1.26 -5.03 115.64 97.70 3ku2 s THR 268 Ca 0.18 -1.97 0.14 0.00 -1.18 0.00 0.00 61.69 58.86 3ku2 s THR 268 Cb 0.02 -2.36 0.63 0.00 1.34 0.00 0.00 72.50 72.13 3ku2 s THR 268 CO 0.02 -0.20 1.57 0.49 -0.54 0.00 0.00 174.62 175.96 3ku2 n PHE 269 N -0.27 1.50 0.22 3.99 3.01 -1.26 -4.74 117.46 119.91 3ku2 n PHE 269 Ca -0.02 -1.01 0.03 0.00 1.01 0.00 0.00 57.45 57.46 3ku2 n PHE 269 Cb 0.65 -0.45 0.13 0.00 -0.01 0.00 0.00 39.48 39.79 3ku2 n PHE 269 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 3ku2 n GLU 270 N -0.32 0.04 -2.53 -1.08 4.71 -1.26 -4.62 120.64 115.58 3ku2 n GLU 270 Ca 0.28 0.32 -0.39 0.00 -0.01 0.00 0.00 57.16 57.37 3ku2 n GLU 270 Cb 1.08 -1.50 -0.04 0.00 -1.01 0.00 0.00 31.44 29.96 3ku2 n GLU 270 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 3ku2 s LEU 271 N -2.80 4.37 0.59 -4.62 1.43 -1.26 -4.96 118.68 111.43 3ku2 s LEU 271 Ca 0.04 2.14 0.29 0.00 -1.03 0.00 0.00 54.13 55.57 3ku2 s LEU 271 Cb 0.04 -3.88 1.70 0.00 0.03 0.00 0.00 46.19 44.08 3ku2 s LEU 271 CO 0.09 -0.28 2.15 -0.65 0.23 0.00 0.00 176.35 177.90 3ku2 h PRO 272 N 3.24 0.00 0.00 1.29 0.11 -2.02 -1.58 132.00 133.04 3ku2 h PRO 272 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3ku2 h PRO 272 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3ku2 h PRO 272 CO 0.65 0.00 0.00 -0.56 -0.21 0.00 0.00 178.00 177.88 3ku2 h GLN 273 N 0.00 0.00 0.00 1.05 -0.00 -1.93 -3.04 115.11 111.19 3ku2 h GLN 273 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.71 3ku2 h GLN 273 Cb 0.32 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.80 3ku2 h GLN 273 CO -0.00 0.00 0.00 -1.49 -0.00 0.00 0.00 178.83 177.34 3ku2 h TRP 274 N 0.00 0.00 -0.34 0.06 4.06 -1.54 -3.05 115.95 115.14 3ku2 h TRP 274 Ca 0.00 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 60.92 3ku2 h TRP 274 Cb 0.61 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.75 3ku2 h TRP 274 CO 0.00 0.00 0.10 0.87 -3.56 0.00 0.00 178.44 175.85 3ku2 h LYS 275 N 0.00 0.49 -0.12 0.49 6.56 -1.69 -2.45 116.57 119.85 3ku2 h LYS 275 Ca 0.00 -0.07 0.00 0.00 -1.06 0.00 0.00 60.65 59.52 3ku2 h LYS 275 Cb 0.62 -0.09 0.00 0.00 -0.57 0.00 0.00 32.23 32.19 3ku2 h LYS 275 CO 0.00 0.44 0.00 1.63 -2.06 0.00 0.00 179.45 179.46 3ku2 n LYS 276 N -4.36 1.58 -4.23 3.15 5.02 -1.15 -4.88 118.16 113.27 3ku2 n LYS 276 Ca 0.02 -0.86 -0.35 0.00 -2.02 0.00 0.00 58.31 55.09 3ku2 n LYS 276 Cb 0.17 -1.38 -0.09 0.00 -0.02 0.00 0.00 35.03 33.71 3ku2 n LYS 276 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3ku2 s VAL 277 N -1.85 4.62 0.64 -0.18 1.01 -0.92 -5.05 120.40 118.67 3ku2 s VAL 277 Ca 0.32 -0.13 -0.18 0.00 0.00 0.00 0.00 61.98 61.99 3ku2 s VAL 277 Cb 0.17 -2.97 -0.02 0.00 0.00 0.00 0.00 36.38 33.56 3ku2 s VAL 277 CO 0.26 0.60 1.29 -1.54 0.00 0.00 0.00 175.10 175.70 3ku2 n SER 278 N 2.22 2.08 0.20 3.32 3.41 -1.26 -4.94 113.62 118.64 3ku2 n SER 278 Ca -0.19 0.84 0.04 0.00 -0.26 0.00 0.00 58.87 59.31 3ku2 n SER 278 Cb 0.54 -1.55 0.42 0.00 -0.26 0.00 0.00 64.21 63.36 3ku2 n SER 278 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 3ku2 h GLU 279 N 0.60 0.00 -0.66 4.33 4.57 -1.98 -3.07 114.58 118.37 3ku2 h GLU 279 Ca -0.51 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 57.61 3ku2 h GLU 279 Cb 1.34 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.90 3ku2 h GLU 279 CO 0.53 0.31 0.18 1.03 -1.18 0.00 0.00 179.01 179.88 3ku2 h SER 280 N 0.00 0.97 -0.35 1.04 0.87 -1.99 -1.35 113.55 112.74 3ku2 h SER 280 Ca -0.00 -0.19 -0.08 0.00 -1.23 0.00 0.00 61.79 60.29 3ku2 h SER 280 Cb 0.59 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.28 3ku2 h SER 280 CO 0.04 0.92 -0.10 0.00 -0.53 0.00 0.00 176.83 177.16 3ku2 h ALA 281 N 1.20 0.48 -0.86 6.23 0.00 -1.92 -2.74 119.26 121.64 3ku2 h ALA 281 Ca 0.21 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3ku2 h ALA 281 Cb 0.33 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 3ku2 h ALA 281 CO -0.00 0.35 0.54 0.87 0.00 0.00 0.00 179.25 181.00 3ku2 h LYS 282 N 0.47 1.16 -0.11 0.00 1.57 -1.45 -2.39 116.57 115.82 3ku2 h LYS 282 Ca 0.09 -0.09 -0.07 0.00 -1.87 0.00 0.00 60.65 58.70 3ku2 h LYS 282 Cb 0.62 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 3ku2 h LYS 282 CO 0.04 0.80 -0.25 0.22 -0.57 0.00 0.00 179.45 179.68 3ku2 h ASP 283 N 1.18 0.19 -0.07 0.86 3.58 -1.16 -1.14 116.42 119.86 3ku2 h ASP 283 Ca 0.31 -0.05 -0.07 0.00 0.42 0.00 0.00 57.03 57.64 3ku2 h ASP 283 Cb -0.08 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 40.92 3ku2 h ASP 283 CO -0.06 0.45 -0.22 0.25 -2.88 0.00 0.00 179.24 176.77 3ku2 h LEU 284 N 0.17 0.31 -0.31 2.28 5.85 -1.15 -2.93 115.31 119.53 3ku2 h LEU 284 Ca 0.03 -0.62 0.05 0.00 0.84 0.00 0.00 57.88 58.19 3ku2 h LEU 284 Cb 0.55 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.43 3ku2 h LEU 284 CO 0.04 0.88 -0.01 0.40 -0.34 0.00 0.00 178.44 179.40 3ku2 h ILE 285 N -0.23 0.76 -1.00 4.05 2.04 -1.29 0.47 117.51 122.32 3ku2 h ILE 285 Ca -0.01 -0.03 0.10 0.00 1.00 0.00 0.00 64.86 65.93 3ku2 h ILE 285 Cb 0.85 0.68 -0.08 0.00 -0.74 0.00 0.00 36.82 37.53 3ku2 h ILE 285 CO 0.05 0.01 0.64 0.03 0.00 0.00 0.00 178.15 178.88 3ku2 h ARG 286 N 0.08 1.02 -0.11 2.37 3.08 -1.27 0.33 114.38 119.87 3ku2 h ARG 286 Ca 0.15 -0.06 -0.20 0.00 0.07 0.00 0.00 59.98 59.94 3ku2 h ARG 286 Cb 0.20 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.02 3ku2 h ARG 286 CO -0.26 0.68 -0.73 0.87 -1.07 0.00 0.00 179.97 179.46 3ku2 h LYS 287 N 1.05 0.55 0.01 0.04 1.57 -1.19 -2.87 116.57 115.73 3ku2 h LYS 287 Ca 0.48 -0.44 -0.19 0.00 -1.87 0.00 0.00 60.65 58.63 3ku2 h LYS 287 Cb 0.39 0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.77 3ku2 h LYS 287 CO -0.23 1.07 -0.86 0.52 -0.57 0.00 0.00 179.45 179.37 3ku2 h MET 288 N 0.38 0.07 -0.90 3.15 2.86 -0.07 -3.01 114.93 117.42 3ku2 h MET 288 Ca -0.03 -0.08 -0.39 0.00 -2.06 0.00 0.00 59.70 57.13 3ku2 h MET 288 Cb 1.32 0.03 -0.23 0.00 0.06 0.00 0.00 31.60 32.77 3ku2 h MET 288 CO 0.14 0.89 0.50 1.28 1.06 0.00 0.00 176.91 180.77 3ku2 n LEU 289 N -3.58 6.48 -4.67 1.22 4.77 0.11 -3.60 117.00 117.73 3ku2 n LEU 289 Ca -0.02 -3.43 -0.43 0.00 -0.03 0.00 0.00 56.01 52.11 3ku2 n LEU 289 Cb 0.81 -0.80 -0.02 0.00 -2.33 0.00 0.00 43.42 41.08 3ku2 n LEU 289 CO 0.46 0.94 1.05 -0.89 -1.33 0.00 0.00 177.39 177.62 3ku2 s THR 290 N -3.15 4.19 0.12 -5.08 2.01 -1.08 -4.96 115.64 107.69 3ku2 s THR 290 Ca 0.56 1.49 -0.31 0.00 0.31 0.00 0.00 61.69 63.73 3ku2 s THR 290 Cb 0.46 -3.96 -0.09 0.00 0.01 0.00 0.00 72.50 68.92 3ku2 s THR 290 CO 0.12 -0.07 1.58 0.22 -0.69 0.00 0.00 174.62 175.78 3ku2 h TYR 291 N 7.94 -1.30 -2.95 4.92 3.20 -1.92 -3.42 116.97 123.43 3ku2 h TYR 291 Ca -0.31 0.04 -0.57 0.00 3.14 0.00 0.00 58.73 61.04 3ku2 h TYR 291 Cb 1.14 0.57 -0.04 0.00 1.54 0.00 0.00 36.73 39.94 3ku2 h TYR 291 CO 0.77 -0.52 0.92 0.08 -1.64 0.00 0.00 178.16 177.77 3ku2 s VAL 292 N -5.85 4.25 0.49 1.81 1.01 -1.26 -4.90 120.40 115.94 3ku2 s VAL 292 Ca -0.16 1.49 0.19 0.00 0.00 0.00 0.00 61.98 63.51 3ku2 s VAL 292 Cb 0.08 -4.03 0.35 0.00 0.00 0.00 0.00 36.38 32.78 3ku2 s VAL 292 CO 0.63 -0.21 2.01 -0.65 0.00 0.00 0.00 175.10 176.88 3ku2 h PRO 293 N 8.45 0.17 -0.51 2.72 0.11 -1.94 -1.56 132.00 139.43 3ku2 h PRO 293 Ca -0.26 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.73 3ku2 h PRO 293 Cb 1.10 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 3ku2 h PRO 293 CO 0.98 0.11 -0.10 0.66 -0.21 0.00 0.00 178.00 179.44 3ku2 h SER 294 N 0.17 0.93 0.67 -2.05 4.64 -1.95 -2.95 113.55 113.01 3ku2 h SER 294 Ca 0.23 -0.29 -0.13 0.00 -0.47 0.00 0.00 61.79 61.13 3ku2 h SER 294 Cb 0.69 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 62.51 3ku2 h SER 294 CO -0.04 1.04 -0.60 0.24 -0.87 0.00 0.00 176.83 176.61 3ku2 h MET 295 N 0.84 0.00 -6.87 4.77 2.86 -1.72 -3.46 114.93 111.35 3ku2 h MET 295 Ca 0.14 0.00 -0.52 0.00 -2.06 0.00 0.00 59.70 57.26 3ku2 h MET 295 Cb 0.64 0.00 0.06 0.00 0.06 0.00 0.00 31.60 32.35 3ku2 h MET 295 CO 0.04 0.60 0.61 0.50 1.06 0.00 0.00 176.91 179.73 3ku2 s ARG 296 N -3.57 4.40 0.47 1.72 3.52 -0.67 -5.00 118.95 119.82 3ku2 s ARG 296 Ca -0.01 2.15 -0.24 0.00 -0.13 0.00 0.00 55.73 57.49 3ku2 s ARG 296 Cb 0.12 -3.08 -0.07 0.00 -1.56 0.00 0.00 34.95 30.35 3ku2 s ARG 296 CO 0.75 -0.13 1.38 -1.50 -0.81 0.00 0.00 175.30 174.99 3ku2 s ILE 297 N -1.15 2.22 0.76 4.11 2.07 -1.14 -4.99 121.20 123.09 3ku2 s ILE 297 Ca 0.48 0.19 -0.12 0.00 -1.41 0.00 0.00 60.65 59.79 3ku2 s ILE 297 Cb -0.38 -3.11 0.05 0.00 0.13 0.00 0.00 42.46 39.15 3ku2 s ILE 297 CO 0.51 0.02 1.13 -0.94 -1.91 0.00 0.00 174.94 173.75 3ku2 s SER 298 N -0.70 4.92 0.24 4.50 1.04 -1.26 -4.91 113.70 117.54 3ku2 s SER 298 Ca 0.63 1.02 -0.03 0.00 0.48 0.00 0.00 55.95 58.04 3ku2 s SER 298 Cb -0.41 -1.69 0.28 0.00 0.10 0.00 0.00 66.02 64.30 3ku2 s SER 298 CO 0.52 -1.66 1.72 0.00 0.98 0.00 0.00 173.24 174.80 3ku2 h ALA 299 N -0.88 1.03 0.01 5.32 0.00 -1.95 -1.43 119.26 121.36 3ku2 h ALA 299 Ca -0.46 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.16 3ku2 h ALA 299 Cb 1.29 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.89 3ku2 h ALA 299 CO 0.64 0.59 -0.00 -0.09 0.00 0.00 0.00 179.25 180.39 3ku2 h ARG 300 N 0.75 -0.01 0.00 0.00 9.65 -1.92 -2.96 114.38 119.89 3ku2 h ARG 300 Ca 0.14 0.00 -0.06 0.00 -1.10 0.00 0.00 59.98 58.96 3ku2 h ARG 300 Cb 0.52 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.09 3ku2 h ARG 300 CO 0.03 0.08 -0.29 -0.44 2.80 0.00 0.00 179.97 182.15 3ku2 h ASP 301 N -0.10 0.00 0.33 -3.80 3.32 -1.91 -2.82 116.42 111.44 3ku2 h ASP 301 Ca -0.00 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.95 3ku2 h ASP 301 Cb 0.10 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 3ku2 h ASP 301 CO 0.00 0.29 -0.42 0.00 -1.72 0.00 0.00 179.24 177.40 3ku2 h ALA 302 N 1.71 1.20 -0.00 3.45 0.00 -1.15 -2.69 119.26 121.77 3ku2 h ALA 302 Ca -0.00 -0.40 -0.09 0.00 0.00 0.00 0.00 54.91 54.42 3ku2 h ALA 302 Cb 0.81 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 3ku2 h ALA 302 CO 0.04 0.56 -0.41 -0.07 0.00 0.00 0.00 179.25 179.37 3ku2 h LEU 303 N 0.10 0.01 -0.46 0.00 3.38 -1.34 -2.67 115.31 114.33 3ku2 h LEU 303 Ca 0.01 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3ku2 h LEU 303 Cb 0.79 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 3ku2 h LEU 303 CO 0.06 0.42 -0.15 0.47 0.09 0.00 0.00 178.44 179.33 3ku2 n ASP 304 N -4.05 0.86 -4.77 -0.43 8.00 -1.05 -4.25 116.55 110.87 3ku2 n ASP 304 Ca -0.02 -0.89 -0.40 0.00 0.71 0.00 0.00 54.79 54.19 3ku2 n ASP 304 Cb 0.44 0.03 -0.02 0.00 -0.02 0.00 0.00 41.12 41.56 3ku2 n ASP 304 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 3ku2 s HIS 305 N -2.38 2.96 0.27 1.24 2.46 -1.01 -4.79 115.29 114.04 3ku2 s HIS 305 Ca 0.29 1.41 -0.09 0.00 0.47 0.00 0.00 55.06 57.14 3ku2 s HIS 305 Cb 0.20 -3.69 0.43 0.00 -0.13 0.00 0.00 32.58 29.39 3ku2 s HIS 305 CO 0.46 -1.97 1.57 1.49 -2.47 0.00 0.00 174.74 173.82 3ku2 h GLU 306 N 3.13 -0.00 -0.75 2.88 4.81 -1.91 -1.11 114.58 121.63 3ku2 h GLU 306 Ca -0.49 0.00 0.05 0.00 -0.13 0.00 0.00 59.36 58.79 3ku2 h GLU 306 Cb 1.23 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.56 3ku2 h GLU 306 CO 0.64 -0.00 0.45 2.35 -0.73 0.00 0.00 179.01 181.73 3ku2 h TRP 307 N -0.00 0.84 0.62 0.92 7.01 -1.92 -0.63 115.95 122.80 3ku2 h TRP 307 Ca 0.46 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.45 3ku2 h TRP 307 Cb 0.70 -0.27 0.01 0.00 -2.10 0.00 0.00 29.16 27.49 3ku2 h TRP 307 CO -0.74 0.44 -0.30 0.82 -2.79 0.00 0.00 178.44 175.87 3ku2 h ILE 308 N 0.85 0.12 -0.95 2.65 1.08 -1.52 -0.34 117.51 119.41 3ku2 h ILE 308 Ca 0.32 -0.37 0.12 0.00 -0.39 0.00 0.00 64.86 64.53 3ku2 h ILE 308 Cb 0.12 0.17 -0.08 0.00 -3.07 0.00 0.00 36.82 33.96 3ku2 h ILE 308 CO -0.15 0.02 0.61 1.56 -0.69 0.00 0.00 178.15 179.49 3ku2 h GLN 309 N -1.16 0.88 0.07 2.37 4.20 -1.34 -1.42 115.11 118.71 3ku2 h GLN 309 Ca -0.08 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.57 3ku2 h GLN 309 Cb 0.67 -0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.25 3ku2 h GLN 309 CO 0.14 0.59 -0.03 1.15 -0.67 0.00 0.00 178.83 180.00 3ku2 h THR 310 N 0.91 1.11 0.00 -0.54 2.02 -1.16 -3.38 112.91 111.88 3ku2 h THR 310 Ca 0.46 -1.52 0.00 0.00 0.77 0.00 0.00 66.41 66.12 3ku2 h THR 310 Cb 0.51 1.98 0.00 0.00 -1.74 0.00 0.00 68.15 68.90 3ku2 h THR 310 CO -0.23 0.33 0.00 -1.22 0.37 0.00 0.00 175.52 174.77 3ku2 n TYR 311 N -4.79 0.13 -1.18 3.16 4.02 -0.14 -3.62 117.16 114.74 3ku2 n TYR 311 Ca -0.08 0.04 -0.07 0.00 -0.01 0.00 0.00 57.90 57.78 3ku2 n TYR 311 Cb 0.30 -0.56 0.25 0.00 -0.02 0.00 0.00 39.34 39.31 3ku2 n TYR 311 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 3ku2 n THR 312 N -1.60 2.82 -2.26 -0.72 -2.24 -0.54 -4.65 114.28 105.09 3ku2 n THR 312 Ca 0.07 -2.00 -0.41 0.00 -2.27 0.00 0.00 64.05 59.43 3ku2 n THR 312 Cb 0.34 -0.36 -0.03 0.00 -2.10 0.00 0.00 70.33 68.18 3ku2 n THR 312 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3ku2 s LYS 313 N -3.10 4.45 0.20 -0.78 1.02 -1.24 -4.94 119.74 115.35 3ku2 s LYS 313 Ca 0.51 2.03 -0.11 0.00 0.02 0.00 0.00 55.97 58.43 3ku2 s LYS 313 Cb 0.43 -3.16 0.24 0.00 -0.52 0.00 0.00 37.83 34.82 3ku2 s LYS 313 CO 0.09 -0.11 1.73 1.05 -0.92 0.00 0.00 175.35 177.20 3ku2 h GLU 314 N 4.32 0.32 -4.62 1.68 -0.00 -1.95 -3.35 114.58 110.98 3ku2 h GLU 314 Ca -0.47 -0.02 -0.70 0.00 -0.00 0.00 0.00 59.36 58.17 3ku2 h GLU 314 Cb 1.22 -0.07 -0.25 0.00 -0.00 0.00 0.00 28.75 29.64 3ku2 h GLU 314 CO 0.71 0.21 -0.54 1.14 -0.00 0.00 0.00 179.01 180.53 3ku2 s GLN 315 N -6.11 2.82 -0.13 1.06 -2.07 -1.26 -5.06 119.66 108.90 3ku2 s GLN 315 Ca -0.13 -1.08 -0.36 0.00 -1.82 0.00 0.00 55.36 51.97 3ku2 s GLN 315 Cb 0.16 -3.66 -0.13 0.00 -1.09 0.00 0.00 33.01 28.29 3ku2 s GLN 315 CO 0.74 -0.67 1.82 -0.89 -1.32 0.00 0.00 175.29 174.96 3ku2 n ILE 316 N 4.96 0.47 0.00 3.63 5.41 -1.26 -4.90 119.36 127.67 3ku2 n ILE 316 Ca -0.12 -0.08 0.06 0.00 1.00 0.00 0.00 62.75 63.60 3ku2 n ILE 316 Cb 0.46 -1.66 0.13 0.00 -0.71 0.00 0.00 39.64 37.86 3ku2 n ILE 316 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 3ku2 n SER 317 N 6.07 2.70 -4.44 4.38 3.41 -1.26 -5.04 113.62 119.44 3ku2 n SER 317 Ca 0.23 -1.86 -0.22 0.00 -0.26 0.00 0.00 58.87 56.76 3ku2 n SER 317 Cb 0.25 -0.18 -0.10 0.00 -0.26 0.00 0.00 64.21 63.92 3ku2 n SER 317 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 3ku2 s VAL 318 N -0.99 1.17 0.18 -3.33 -7.23 -1.26 -5.13 120.40 103.81 3ku2 s VAL 318 Ca 0.21 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 58.08 3ku2 s VAL 318 Cb 0.12 -2.76 -0.08 0.00 0.56 0.00 0.00 36.38 34.22 3ku2 s VAL 318 CO 0.16 0.00 1.22 -1.81 -0.31 0.00 0.00 175.10 174.36 3ku2 s ASP 319 N -3.51 7.05 -0.57 4.85 1.11 -1.26 -5.00 116.67 119.35 3ku2 s ASP 319 Ca 0.35 2.26 0.03 0.00 0.18 0.00 0.00 52.55 55.36 3ku2 s ASP 319 Cb 0.08 -2.61 0.41 0.00 1.07 0.00 0.00 42.92 41.87 3ku2 s ASP 319 CO 0.15 -0.40 1.47 1.33 1.18 0.00 0.00 175.17 178.90 3ku2 n VAL 320 N 2.57 2.87 -1.79 -1.27 0.24 -1.26 -4.89 118.33 114.80 3ku2 n VAL 320 Ca 0.05 -4.50 -0.40 0.00 -2.04 0.00 0.00 64.34 57.45 3ku2 n VAL 320 Cb 0.44 -1.24 0.02 0.00 -1.47 0.00 0.00 33.84 31.60 3ku2 n VAL 320 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 3ku2 s PRO 321 N -3.74 3.60 0.19 7.34 0.04 -1.26 -4.83 135.00 136.34 3ku2 s PRO 321 Ca 0.51 2.40 -0.30 0.00 0.04 0.00 0.00 61.00 63.65 3ku2 s PRO 321 Cb 0.42 -2.60 -0.08 0.00 0.04 0.00 0.00 34.50 32.29 3ku2 s PRO 321 CO -0.22 -0.88 1.06 0.45 0.04 0.00 0.00 177.00 177.45 3ku2 s SER 322 N -0.56 7.35 -1.28 6.66 0.15 -1.26 -4.48 113.70 120.28 3ku2 s SER 322 Ca 0.63 2.05 -0.12 0.00 0.70 0.00 0.00 55.95 59.20 3ku2 s SER 322 Cb -0.43 -2.60 0.15 0.00 -1.71 0.00 0.00 66.02 61.42 3ku2 s SER 322 CO 0.55 -0.14 1.75 0.18 1.20 0.00 0.00 173.24 176.78 3ku2 n LEU 323 N 2.21 6.02 -0.11 3.45 4.77 0.12 -4.83 117.00 128.63 3ku2 n LEU 323 Ca 0.02 -4.46 -0.07 0.00 -0.03 0.00 0.00 56.01 51.47 3ku2 n LEU 323 Cb 0.47 -1.57 0.01 0.00 -2.33 0.00 0.00 43.42 39.99 3ku2 n LEU 323 CO 0.53 1.01 0.98 0.44 -1.33 0.00 0.00 177.39 179.02 3ku2 h ASP 324 N 6.42 0.28 -0.62 -1.43 3.32 -1.93 -1.86 116.42 120.61 3ku2 h ASP 324 Ca 0.39 0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.38 3ku2 h ASP 324 Cb 0.74 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 40.22 3ku2 h ASP 324 CO 1.51 0.21 0.10 -1.13 -1.72 0.00 0.00 179.24 178.21 3ku2 h ASN 325 N 0.38 1.00 -0.11 6.45 -0.00 -1.96 -2.71 115.58 118.64 3ku2 h ASN 325 Ca 0.15 -0.23 -0.00 0.00 -0.00 0.00 0.00 56.30 56.22 3ku2 h ASN 325 Cb 0.05 -0.27 -0.01 0.00 -0.00 0.00 0.00 38.32 38.10 3ku2 h ASN 325 CO -0.10 1.00 0.07 0.00 -0.00 0.00 0.00 177.43 178.40 3ku2 h ALA 326 N 1.12 0.14 -0.40 1.57 0.00 -1.67 -1.70 119.26 118.33 3ku2 h ALA 326 Ca 0.20 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3ku2 h ALA 326 Cb 0.43 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3ku2 h ALA 326 CO 0.01 -0.34 0.22 0.97 0.00 0.00 0.00 179.25 180.11 3ku2 h ILE 327 N 0.11 1.13 -0.06 0.00 6.09 -1.30 0.50 117.51 123.98 3ku2 h ILE 327 Ca 0.04 -0.32 -0.02 0.00 -1.37 0.00 0.00 64.86 63.19 3ku2 h ILE 327 Cb 0.04 0.58 -0.00 0.00 0.47 0.00 0.00 36.82 37.91 3ku2 h ILE 327 CO -0.01 0.14 -0.03 0.25 -3.07 0.00 0.00 178.15 175.43 3ku2 h LEU 328 N 0.56 0.13 -0.78 2.19 5.85 -1.24 -2.72 115.31 119.30 3ku2 h LEU 328 Ca 0.14 -0.41 -0.08 0.00 0.84 0.00 0.00 57.88 58.38 3ku2 h LEU 328 Cb 0.02 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 3ku2 h LEU 328 CO -0.02 0.51 0.03 0.78 -0.34 0.00 0.00 178.44 179.40 3ku2 h ASN 329 N -0.24 0.92 -0.64 1.25 2.35 -0.95 -2.43 115.58 115.84 3ku2 h ASN 329 Ca 0.01 -0.23 -0.02 0.00 -0.55 0.00 0.00 56.30 55.52 3ku2 h ASN 329 Cb 0.46 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.55 3ku2 h ASN 329 CO 0.01 0.96 0.34 0.40 -1.65 0.00 0.00 177.43 177.49 3ku2 h ILE 330 N 0.89 1.21 -0.70 2.81 2.04 -0.90 0.16 117.51 123.02 3ku2 h ILE 330 Ca 0.17 -0.55 -0.07 0.00 1.00 0.00 0.00 64.86 65.41 3ku2 h ILE 330 Cb 0.48 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 36.93 3ku2 h ILE 330 CO 0.02 0.24 0.18 0.03 0.00 0.00 0.00 178.15 178.61 3ku2 h ARG 331 N 0.88 1.11 -0.16 2.37 3.08 -1.39 0.42 114.38 120.69 3ku2 h ARG 331 Ca 0.22 -0.26 -0.06 0.00 0.07 0.00 0.00 59.98 59.95 3ku2 h ARG 331 Cb 0.07 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 29.97 3ku2 h ARG 331 CO -0.03 0.98 -0.14 0.37 -1.07 0.00 0.00 179.97 180.08 3ku2 h GLN 332 N 1.06 0.38 0.21 0.04 4.15 -1.21 -1.11 115.11 118.63 3ku2 h GLN 332 Ca 0.22 -0.19 -0.01 0.00 0.77 0.00 0.00 58.65 59.44 3ku2 h GLN 332 Cb 0.36 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.05 3ku2 h GLN 332 CO 0.00 0.74 -0.12 0.35 -1.93 0.00 0.00 178.83 177.87 3ku2 h PHE 333 N 0.03 -0.31 -0.03 3.99 3.57 -0.38 -1.38 116.94 122.43 3ku2 h PHE 333 Ca 0.03 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.54 3ku2 h PHE 333 Cb 0.65 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.48 3ku2 h PHE 333 CO 0.08 -0.19 -0.07 0.37 -2.23 0.00 0.00 178.31 176.27 3ku2 h GLN 334 N -0.31 -0.10 -0.86 1.11 5.75 -0.20 -1.31 115.11 119.19 3ku2 h GLN 334 Ca -0.02 0.01 0.08 0.00 -0.15 0.00 0.00 58.65 58.56 3ku2 h GLN 334 Cb 0.26 0.02 -0.07 0.00 1.07 0.00 0.00 27.48 28.76 3ku2 h GLN 334 CO 0.03 -0.07 0.52 0.78 -2.65 0.00 0.00 178.83 177.44 3ku2 h GLY 335 N -0.11 1.31 1.03 2.39 0.00 -1.14 -0.55 103.07 106.00 3ku2 h GLY 335 Ca 0.04 -0.36 -0.07 0.00 0.00 0.00 0.00 47.33 46.93 3ku2 h GLY 335 CO -0.09 0.21 0.06 -0.84 0.00 0.00 0.00 176.54 175.89 3ku2 h THR 336 N 0.91 1.26 0.25 4.70 2.02 -0.87 -1.30 112.91 119.88 3ku2 h THR 336 Ca 0.39 -1.02 -0.01 0.00 0.77 0.00 0.00 66.41 66.54 3ku2 h THR 336 Cb 0.25 0.82 0.00 0.00 -1.74 0.00 0.00 68.15 67.48 3ku2 h THR 336 CO -0.20 0.37 -0.12 1.56 0.37 0.00 0.00 175.52 177.50 3ku2 h GLN 337 N 0.84 -0.32 -0.42 6.66 1.08 -0.60 -2.37 115.11 119.97 3ku2 h GLN 337 Ca 0.17 0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.38 3ku2 h GLN 337 Cb 0.45 0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 27.94 3ku2 h GLN 337 CO 0.02 -0.10 0.20 0.87 -0.95 0.00 0.00 178.83 178.87 3ku2 h LYS 338 N -0.50 0.59 -0.16 1.46 1.79 -1.05 -1.09 116.57 117.60 3ku2 h LYS 338 Ca -0.03 -0.07 -0.22 0.00 -2.18 0.00 0.00 60.65 58.15 3ku2 h LYS 338 Cb 0.37 -0.12 0.01 0.00 -1.58 0.00 0.00 32.23 30.92 3ku2 h LYS 338 CO 0.06 0.46 -0.75 1.25 -1.08 0.00 0.00 179.45 179.39 3ku2 h LEU 339 N 0.59 0.94 -0.84 2.94 5.85 -1.22 -1.14 115.31 122.43 3ku2 h LEU 339 Ca 0.15 -0.62 -0.10 0.00 0.84 0.00 0.00 57.88 58.14 3ku2 h LEU 339 Cb 0.07 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.81 3ku2 h LEU 339 CO -0.02 1.41 -0.26 0.00 -0.34 0.00 0.00 178.44 179.23 3ku2 h ALA 340 N 0.55 1.01 -0.04 1.25 0.00 -1.09 -0.63 119.26 120.31 3ku2 h ALA 340 Ca -0.05 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 3ku2 h ALA 340 Cb 1.38 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 3ku2 h ALA 340 CO 0.16 0.59 0.01 1.96 0.00 0.00 0.00 179.25 181.97 3ku2 h GLN 341 N 0.50 0.07 -0.45 0.00 4.20 -1.19 -2.77 115.11 115.47 3ku2 h GLN 341 Ca 0.07 -0.01 -0.05 0.00 0.06 0.00 0.00 58.65 58.72 3ku2 h GLN 341 Cb 0.71 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.46 3ku2 h GLN 341 CO 0.05 0.23 0.07 0.00 -0.67 0.00 0.00 178.83 178.52 3ku2 h ALA 342 N 0.83 1.29 -0.11 3.87 0.00 -1.04 -1.64 119.26 122.47 3ku2 h ALA 342 Ca 0.01 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 3ku2 h ALA 342 Cb 0.19 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 3ku2 h ALA 342 CO -0.00 0.49 0.04 0.00 0.00 0.00 0.00 179.25 179.77 3ku2 h ALA 343 N 1.42 0.15 -0.68 0.00 0.00 -1.09 -0.85 119.26 118.21 3ku2 h ALA 343 Ca 0.14 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 3ku2 h ALA 343 Cb 0.30 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 3ku2 h ALA 343 CO 0.00 -0.24 0.15 -0.07 0.00 0.00 0.00 179.25 179.09 3ku2 h LEU 344 N -0.00 1.05 -0.65 0.00 3.38 -1.35 -1.84 115.31 115.90 3ku2 h LEU 344 Ca 0.04 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 3ku2 h LEU 344 Cb 0.21 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 3ku2 h LEU 344 CO -0.00 1.02 0.32 0.25 0.09 0.00 0.00 178.44 180.12 3ku2 h LEU 345 N 1.03 0.84 -0.55 1.67 5.85 -1.21 -0.04 115.31 122.91 3ku2 h LEU 345 Ca 0.21 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 3ku2 h LEU 345 Cb 0.39 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.18 3ku2 h LEU 345 CO 0.01 0.73 0.31 0.22 -0.34 0.00 0.00 178.44 179.37 3ku2 h TYR 346 N 0.90 0.75 -0.40 1.25 3.20 -0.96 0.86 116.97 122.56 3ku2 h TYR 346 Ca 0.22 -0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.96 3ku2 h TYR 346 Cb 0.10 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.12 3ku2 h TYR 346 CO 0.00 0.54 -0.23 0.52 -1.64 0.00 0.00 178.16 177.35 3ku2 h MET 347 N 0.74 0.87 -0.82 1.82 2.86 -1.12 -2.58 114.93 116.71 3ku2 h MET 347 Ca 0.20 -0.40 -0.03 0.00 -2.06 0.00 0.00 59.70 57.41 3ku2 h MET 347 Cb 0.03 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 31.64 3ku2 h MET 347 CO -0.03 1.04 0.40 0.78 1.06 0.00 0.00 176.91 180.16 3ku2 h GLY 348 N 0.69 1.25 2.00 8.32 0.00 -0.77 -2.45 103.07 112.11 3ku2 h GLY 348 Ca 0.09 -0.61 -0.11 0.00 0.00 0.00 0.00 47.33 46.70 3ku2 h GLY 348 CO 0.07 0.58 -0.52 1.48 0.00 0.00 0.00 176.54 178.15 3ku2 h SER 349 N 1.16 0.00 0.58 0.19 4.64 -0.80 -3.17 113.55 116.15 3ku2 h SER 349 Ca 0.28 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.40 3ku2 h SER 349 Cb 0.10 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.18 3ku2 h SER 349 CO -0.04 0.52 -0.88 0.50 -0.87 0.00 0.00 176.83 176.07 3ku2 h LYS 350 N 0.00 0.20 0.00 4.77 1.63 -1.11 0.76 116.57 122.82 3ku2 h LYS 350 Ca -0.01 -0.22 0.00 0.00 -0.85 0.00 0.00 60.65 59.58 3ku2 h LYS 350 Cb 1.08 0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.78 3ku2 h LYS 350 CO 0.07 0.95 0.00 1.28 -3.45 0.00 0.00 179.45 178.30 3ku2 n LEU 351 N -3.66 0.00 -0.08 5.20 4.77 -0.95 -2.45 117.00 119.82 3ku2 n LEU 351 Ca -0.04 0.31 -0.13 0.00 -0.03 0.00 0.00 56.01 56.13 3ku2 n LEU 351 Cb 0.81 -0.31 -0.07 0.00 -2.33 0.00 0.00 43.42 41.51 3ku2 n LEU 351 CO 0.48 -0.10 -1.06 0.41 -1.33 0.00 0.00 177.39 175.79 3ku2 n THR 352 N -1.31 0.96 0.27 -5.08 -1.04 -1.03 -4.47 114.28 102.57 3ku2 n THR 352 Ca 0.09 -0.34 0.16 0.00 -2.04 0.00 0.00 64.05 61.91 3ku2 n THR 352 Cb 0.17 -1.21 0.72 0.00 -1.82 0.00 0.00 70.33 68.19 3ku2 n THR 352 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 3ku2 h SER 353 N -0.12 0.00 0.86 8.00 0.02 -0.83 -3.02 113.55 118.46 3ku2 h SER 353 Ca -0.39 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.35 3ku2 h SER 353 Cb 1.54 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 64.06 3ku2 h SER 353 CO -0.10 0.07 -0.99 1.56 -1.14 0.00 0.00 176.83 176.23 3ku2 h GLN 354 N 0.00 0.07 -0.06 3.45 1.08 -1.72 -3.19 115.11 114.74 3ku2 h GLN 354 Ca -0.00 -0.10 -0.01 0.00 -1.45 0.00 0.00 58.65 57.09 3ku2 h GLN 354 Cb 0.45 0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 27.92 3ku2 h GLN 354 CO 0.01 1.00 0.01 0.22 -0.95 0.00 0.00 178.83 179.12 3ku2 h ASP 355 N 0.03 0.09 -0.29 1.46 1.82 -1.75 -3.35 116.42 114.43 3ku2 h ASP 355 Ca -0.03 -0.24 0.04 0.00 -0.39 0.00 0.00 57.03 56.40 3ku2 h ASP 355 Cb 1.71 -0.02 -0.04 0.00 0.68 0.00 0.00 39.33 41.66 3ku2 h ASP 355 CO 0.14 0.31 0.08 -0.33 -1.61 0.00 0.00 179.24 177.82 3ku2 h GLU 356 N -0.13 0.18 -0.68 0.28 5.08 -1.60 -2.45 114.58 115.27 3ku2 h GLU 356 Ca 0.02 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.41 3ku2 h GLU 356 Cb 0.25 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.42 3ku2 h GLU 356 CO 0.00 0.12 0.45 1.15 -1.00 0.00 0.00 179.01 179.73 3ku2 h THR 357 N 0.19 1.08 0.06 1.13 2.02 -1.68 0.62 112.91 116.34 3ku2 h THR 357 Ca 0.13 -0.27 -0.21 0.00 0.77 0.00 0.00 66.41 66.83 3ku2 h THR 357 Cb 0.12 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 66.74 3ku2 h THR 357 CO -0.16 0.14 -1.11 0.07 0.37 0.00 0.00 175.52 174.83 3ku2 h LYS 358 N 0.79 0.14 -0.58 6.66 5.09 -1.72 -3.29 116.57 123.64 3ku2 h LYS 358 Ca 0.28 -0.23 -0.00 0.00 0.09 0.00 0.00 60.65 60.79 3ku2 h LYS 358 Cb 0.12 0.09 -0.03 0.00 0.10 0.00 0.00 32.23 32.51 3ku2 h LYS 358 CO -0.08 1.11 0.36 1.49 -2.09 0.00 0.00 179.45 180.24 3ku2 h GLU 359 N -0.61 0.78 -0.10 0.07 4.57 -1.35 -2.39 114.58 115.54 3ku2 h GLU 359 Ca -0.26 -0.06 -0.20 0.00 -1.18 0.00 0.00 59.36 57.66 3ku2 h GLU 359 Cb 1.50 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 29.92 3ku2 h GLU 359 CO -0.02 0.54 -0.75 1.25 -1.18 0.00 0.00 179.01 178.84 3ku2 h LEU 360 N 0.80 0.63 -1.05 1.64 5.85 -1.04 -2.39 115.31 119.75 3ku2 h LEU 360 Ca 0.21 -0.42 -0.10 0.00 0.84 0.00 0.00 57.88 58.42 3ku2 h LEU 360 Cb -0.05 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.78 3ku2 h LEU 360 CO -0.04 1.18 -0.45 0.71 -0.34 0.00 0.00 178.44 179.49 3ku2 h THR 361 N 0.36 1.24 0.23 1.05 1.35 -1.57 -1.95 112.91 113.62 3ku2 h THR 361 Ca -0.04 -1.60 -0.01 0.00 -0.55 0.00 0.00 66.41 64.21 3ku2 h THR 361 Cb 1.34 1.89 0.00 0.00 -1.73 0.00 0.00 68.15 69.65 3ku2 h THR 361 CO 0.14 0.45 -0.11 0.00 -0.25 0.00 0.00 175.52 175.74 3ku2 h ALA 362 N 1.55 -0.30 -0.44 6.62 0.00 -1.38 -1.48 119.26 123.82 3ku2 h ALA 362 Ca -0.00 -0.21 0.09 0.00 0.00 0.00 0.00 54.91 54.79 3ku2 h ALA 362 Cb 0.85 0.12 -0.09 0.00 0.00 0.00 0.00 17.79 18.66 3ku2 h ALA 362 CO 0.06 -0.41 -0.21 0.82 0.00 0.00 0.00 179.25 179.51 3ku2 h ILE 363 N -0.84 0.37 -0.79 0.00 2.04 -1.41 -0.82 117.51 116.07 3ku2 h ILE 363 Ca -0.03 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.78 3ku2 h ILE 363 Cb 0.51 0.37 -0.04 0.00 -0.74 0.00 0.00 36.82 36.93 3ku2 h ILE 363 CO 0.05 0.00 0.32 -0.26 0.00 0.00 0.00 178.15 178.26 3ku2 h PHE 364 N -0.12 1.20 -0.53 1.37 0.05 -1.42 -2.48 116.94 115.00 3ku2 h PHE 364 Ca 0.21 -0.09 -0.01 0.00 3.82 0.00 0.00 57.97 61.90 3ku2 h PHE 364 Cb 0.45 -0.36 -0.03 0.00 2.00 0.00 0.00 35.95 38.02 3ku2 h PHE 364 CO -0.47 0.90 0.30 1.25 -0.18 0.00 0.00 178.31 180.11 3ku2 h HIS 365 N 1.15 0.72 -0.61 -0.55 2.76 -0.37 -2.37 115.15 115.87 3ku2 h HIS 365 Ca 0.26 -0.01 0.04 0.00 -2.20 0.00 0.00 60.37 58.46 3ku2 h HIS 365 Cb 0.21 -0.23 -0.05 0.00 1.55 0.00 0.00 27.41 28.90 3ku2 h HIS 365 CO 0.02 0.52 0.35 -0.22 -1.30 0.00 0.00 177.93 177.31 3ku2 h LYS 366 N 0.71 0.66 0.00 5.26 3.11 -0.93 -2.41 116.57 122.98 3ku2 h LYS 366 Ca 0.19 -0.04 -0.03 0.00 -2.81 0.00 0.00 60.65 57.96 3ku2 h LYS 366 Cb 0.03 -0.15 -0.00 0.00 -1.00 0.00 0.00 32.23 31.11 3ku2 h LYS 366 CO -0.03 0.44 -0.12 0.52 -2.81 0.00 0.00 179.45 177.44 3ku2 h MET 367 N 0.68 0.00 -6.10 1.90 2.07 -1.25 -3.40 114.93 108.83 3ku2 h MET 367 Ca 0.26 0.00 -0.59 0.00 -2.07 0.00 0.00 59.70 57.30 3ku2 h MET 367 Cb 0.09 0.00 -0.10 0.00 -1.87 0.00 0.00 31.60 29.73 3ku2 h MET 367 CO -0.14 0.12 1.47 0.34 1.07 0.00 0.00 176.91 179.78 3ku2 s ASP 368 N -5.99 6.45 0.10 1.22 2.15 -0.91 -4.87 116.67 114.82 3ku2 s ASP 368 Ca -0.01 -1.42 -0.19 0.00 0.43 0.00 0.00 52.55 51.37 3ku2 s ASP 368 Cb 0.11 -2.57 -0.06 0.00 -0.30 0.00 0.00 42.92 40.10 3ku2 s ASP 368 CO 0.58 -1.56 1.63 0.07 -0.17 0.00 0.00 175.17 175.73 3ku2 h LYS 369 N 9.86 0.39 -0.12 4.34 2.10 -1.84 -3.16 116.57 128.14 3ku2 h LYS 369 Ca 0.19 -0.08 -0.12 0.00 -2.00 0.00 0.00 60.65 58.65 3ku2 h LYS 369 Cb 1.01 -0.06 -0.01 0.00 -0.90 0.00 0.00 32.23 32.27 3ku2 h LYS 369 CO 1.42 0.44 -0.45 -2.95 -2.00 0.00 0.00 179.45 175.91 3ku2 h ASN 370 N 0.26 0.29 0.00 7.07 -0.00 -1.95 -3.47 115.58 117.78 3ku2 h ASN 370 Ca 0.09 -0.13 0.00 0.00 -0.00 0.00 0.00 56.30 56.25 3ku2 h ASN 370 Cb 0.20 -0.08 0.00 0.00 -0.00 0.00 0.00 38.32 38.44 3ku2 h ASN 370 CO -0.01 0.71 0.00 0.61 -0.00 0.00 0.00 177.43 178.74 3ku2 n GLY 371 N -0.08 0.62 0.00 9.14 0.00 -1.20 -4.97 105.19 108.71 3ku2 n GLY 371 Ca -0.02 -0.16 0.05 0.00 0.00 0.00 0.00 46.02 45.89 3ku2 n GLY 371 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3ku2 n ASP 372 N 0.30 0.00 -1.20 1.61 5.75 -1.26 -4.89 116.55 116.86 3ku2 n ASP 372 Ca 0.00 -1.49 -0.16 0.00 -0.01 0.00 0.00 54.79 53.13 3ku2 n ASP 372 Cb 0.00 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.02 3ku2 n ASP 372 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3ku2 n GLY 373 N 0.51 1.50 3.34 6.12 0.00 -1.26 -4.97 105.19 110.42 3ku2 n GLY 373 Ca 0.07 -0.02 -0.24 0.00 0.00 0.00 0.00 46.02 45.83 3ku2 n GLY 373 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ku2 s GLN 374 N -3.31 1.27 0.11 1.61 -0.21 -1.26 -2.06 119.66 115.81 3ku2 s GLN 374 Ca 0.00 -1.34 -0.11 0.00 0.02 0.00 0.00 55.36 53.93 3ku2 s GLN 374 Cb 0.00 -1.48 0.01 0.00 1.00 0.00 0.00 33.01 32.54 3ku2 s GLN 374 CO 0.00 0.32 0.27 -0.51 -2.12 0.00 0.00 175.29 173.26 3ku2 s LEU 375 N -2.35 1.03 0.41 2.90 1.43 0.39 -4.85 118.68 117.64 3ku2 s LEU 375 Ca 0.13 -0.58 0.08 0.00 -1.03 0.00 0.00 54.13 52.73 3ku2 s LEU 375 Cb -0.08 1.32 0.01 0.00 0.03 0.00 0.00 46.19 47.47 3ku2 s LEU 375 CO 0.06 -0.80 0.55 1.51 0.23 0.00 0.00 176.35 177.90 3ku2 s ASP 376 N -2.86 5.64 0.29 2.29 1.47 -1.26 -0.20 116.67 122.04 3ku2 s ASP 376 Ca 0.06 -0.42 0.03 0.00 1.18 0.00 0.00 52.55 53.39 3ku2 s ASP 376 Cb 0.04 -0.70 0.72 0.00 -0.34 0.00 0.00 42.92 42.64 3ku2 s ASP 376 CO -0.09 -0.73 1.66 -0.09 0.68 0.00 0.00 175.17 176.60 3ku2 h ARG 377 N 0.68 0.26 -0.47 2.11 2.43 -1.99 -1.15 114.38 116.25 3ku2 h ARG 377 Ca -0.40 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 58.72 3ku2 h ARG 377 Cb 1.28 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.75 3ku2 h ARG 377 CO 0.46 0.17 0.17 0.00 -1.51 0.00 0.00 179.97 179.26 3ku2 h ALA 378 N 1.75 0.62 -0.52 2.80 0.00 -1.97 -1.84 119.26 120.10 3ku2 h ALA 378 Ca 0.55 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 55.24 3ku2 h ALA 378 Cb 1.10 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 3ku2 h ALA 378 CO -0.61 0.26 0.12 0.93 0.00 0.00 0.00 179.25 179.95 3ku2 h GLU 379 N 0.63 0.84 -0.68 0.00 5.08 -1.64 0.31 114.58 119.12 3ku2 h GLU 379 Ca 0.16 -0.21 -0.05 0.00 -1.00 0.00 0.00 59.36 58.26 3ku2 h GLU 379 Cb 0.24 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 3ku2 h GLU 379 CO -0.01 0.81 0.22 -0.07 -1.00 0.00 0.00 179.01 178.96 3ku2 h LEU 380 N 0.73 0.98 0.48 1.33 3.38 -1.25 -0.42 115.31 120.55 3ku2 h LEU 380 Ca 0.16 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 3ku2 h LEU 380 Cb 0.35 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.85 3ku2 h LEU 380 CO 0.00 0.92 -0.23 0.40 0.09 0.00 0.00 178.44 179.63 3ku2 h ILE 381 N 0.99 0.53 -0.84 1.22 2.04 -1.02 -1.31 117.51 119.11 3ku2 h ILE 381 Ca 0.22 -0.11 0.12 0.00 1.00 0.00 0.00 64.86 66.09 3ku2 h ILE 381 Cb 0.28 0.58 -0.06 0.00 -0.74 0.00 0.00 36.82 36.88 3ku2 h ILE 381 CO -0.01 0.02 0.55 -0.33 0.00 0.00 0.00 178.15 178.38 3ku2 h GLU 382 N -0.71 0.67 -0.17 2.37 5.08 -0.88 -1.61 114.58 119.33 3ku2 h GLU 382 Ca -0.07 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.17 3ku2 h GLU 382 Cb 0.52 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 3ku2 h GLU 382 CO 0.11 0.44 -0.23 0.78 -1.00 0.00 0.00 179.01 179.11 3ku2 h GLY 383 N 0.69 0.49 1.55 -3.84 0.00 -0.83 -2.44 103.07 98.68 3ku2 h GLY 383 Ca 0.41 -0.53 -0.12 0.00 0.00 0.00 0.00 47.33 47.09 3ku2 h GLY 383 CO -0.17 0.48 -0.36 -1.82 0.00 0.00 0.00 176.54 174.67 3ku2 h TYR 384 N 0.08 0.59 -0.60 5.60 -0.00 -1.00 -2.64 116.97 119.01 3ku2 h TYR 384 Ca 0.02 -0.16 -0.04 0.00 -0.00 0.00 0.00 58.73 58.55 3ku2 h TYR 384 Cb 0.79 -0.13 -0.03 0.00 -0.00 0.00 0.00 36.73 37.36 3ku2 h TYR 384 CO 0.09 0.80 0.21 0.87 -0.00 0.00 0.00 178.16 180.12 3ku2 h LYS 385 N 0.43 0.92 -0.78 1.82 1.57 -1.33 -2.48 116.57 116.71 3ku2 h LYS 385 Ca 0.05 -0.19 -0.04 0.00 -1.87 0.00 0.00 60.65 58.59 3ku2 h LYS 385 Cb 0.83 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.96 3ku2 h LYS 385 CO 0.07 0.81 0.31 0.93 -0.57 0.00 0.00 179.45 180.99 3ku2 h GLU 386 N 0.84 1.16 -0.56 3.15 4.39 -1.33 -0.88 114.58 121.35 3ku2 h GLU 386 Ca 0.20 -0.21 -0.04 0.00 0.34 0.00 0.00 59.36 59.64 3ku2 h GLU 386 Cb 0.26 -0.19 -0.03 0.00 -0.10 0.00 0.00 28.75 28.69 3ku2 h GLU 386 CO -0.01 0.94 0.17 1.25 -1.16 0.00 0.00 179.01 180.20 3ku2 h LEU 387 N 1.13 0.77 0.02 1.33 5.85 -1.27 -3.09 115.31 120.05 3ku2 h LEU 387 Ca 0.26 -0.12 -0.27 0.00 0.84 0.00 0.00 57.88 58.59 3ku2 h LEU 387 Cb 0.21 -0.20 0.02 0.00 0.37 0.00 0.00 40.66 41.06 3ku2 h LEU 387 CO -0.02 0.73 -1.08 0.24 -0.34 0.00 0.00 178.44 177.97 3ku2 h MET 388 N 0.82 0.69 0.00 1.25 2.86 -1.08 -3.29 114.93 116.17 3ku2 h MET 388 Ca 0.19 -0.77 0.00 0.00 -2.06 0.00 0.00 59.70 57.06 3ku2 h MET 388 Cb 0.24 0.22 0.00 0.00 0.06 0.00 0.00 31.60 32.12 3ku2 h MET 388 CO -0.01 1.34 0.02 0.54 1.06 0.00 0.00 176.91 179.86 3ku2 n ARG 389 N -3.84 0.10 -2.93 1.72 1.74 -0.37 -3.08 116.66 110.00 3ku2 n ARG 389 Ca -0.11 0.60 -0.36 0.00 -0.77 0.00 0.00 57.85 57.21 3ku2 n ARG 389 Cb 0.90 -1.86 -0.01 0.00 -1.02 0.00 0.00 32.46 30.46 3ku2 n ARG 389 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3ku2 n MET 390 N -2.07 4.18 -3.79 5.56 0.00 -1.22 -5.00 117.12 114.79 3ku2 n MET 390 Ca -0.01 -4.70 -0.10 0.00 0.00 0.00 0.00 57.70 52.90 3ku2 n MET 390 Cb 0.04 -2.38 -0.04 0.00 0.00 0.00 0.00 33.22 30.84 3ku2 n MET 390 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 3ku2 s LYS 391 N -3.46 1.34 -0.43 3.17 3.01 -1.18 -5.04 119.74 117.15 3ku2 s LYS 391 Ca 0.40 -0.94 0.10 0.00 -1.01 0.00 0.00 55.97 54.51 3ku2 s LYS 391 Cb 0.17 0.49 0.40 0.00 -1.01 0.00 0.00 37.83 37.89 3ku2 s LYS 391 CO -0.06 -0.55 0.97 0.41 0.51 0.00 0.00 175.35 176.63 3ku2 n GLY 392 N -0.31 4.36 3.82 -3.33 0.00 -1.26 -5.14 105.19 103.31 3ku2 n GLY 392 Ca -0.09 -2.21 -0.36 0.00 0.00 0.00 0.00 46.02 43.36 3ku2 n GLY 392 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3ku2 s SER 396 N -3.24 6.00 0.52 1.61 0.15 -1.26 -5.17 113.70 112.31 3ku2 s SER 396 Ca 0.41 0.35 0.30 0.00 0.70 0.00 0.00 55.95 57.71 3ku2 s SER 396 Cb 0.38 -1.86 1.29 0.00 -1.71 0.00 0.00 66.02 64.12 3ku2 s SER 396 CO -0.10 0.39 1.97 0.24 1.20 0.00 0.00 173.24 176.93 3ku2 h MET 397 N 4.92 0.00 -0.01 5.44 0.00 -2.01 -2.96 114.93 120.31 3ku2 h MET 397 Ca -0.53 0.00 0.00 0.00 0.00 0.00 0.00 59.70 59.17 3ku2 h MET 397 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 31.60 32.81 3ku2 h MET 397 CO 0.58 0.10 -0.19 1.28 0.00 0.00 0.00 176.91 178.67 3ku2 n LEU 398 N -3.29 1.35 0.07 1.22 4.77 -1.26 -4.46 117.00 115.41 3ku2 n LEU 398 Ca -0.00 -0.41 0.01 0.00 -0.03 0.00 0.00 56.01 55.58 3ku2 n LEU 398 Cb 0.32 -0.07 0.34 0.00 -2.33 0.00 0.00 43.42 41.68 3ku2 n LEU 398 CO 0.29 0.24 0.87 0.44 -1.33 0.00 0.00 177.39 177.91 3ku2 h ASP 399 N 1.82 0.32 -0.15 -1.43 3.32 -1.95 -2.53 116.42 115.82 3ku2 h ASP 399 Ca 0.00 -0.07 -0.09 0.00 0.02 0.00 0.00 57.03 56.89 3ku2 h ASP 399 Cb 0.55 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 40.02 3ku2 h ASP 399 CO 0.00 0.48 -0.25 0.00 -1.72 0.00 0.00 179.24 177.75 3ku2 h ALA 400 N 1.56 0.24 0.00 3.45 0.00 -1.81 -3.07 119.26 119.63 3ku2 h ALA 400 Ca 0.06 -0.39 -0.08 0.00 0.00 0.00 0.00 54.91 54.51 3ku2 h ALA 400 Cb 0.41 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3ku2 h ALA 400 CO 0.02 0.22 -0.39 0.77 0.00 0.00 0.00 179.25 179.87 3ku2 h SER 401 N 0.07 0.00 1.47 0.00 0.02 -1.86 -2.97 113.55 110.29 3ku2 h SER 401 Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 3ku2 h SER 401 Cb 0.83 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.37 3ku2 h SER 401 CO 0.06 0.39 -0.04 0.00 -1.14 0.00 0.00 176.83 176.09 3ku2 h ALA 402 N 1.61 0.97 0.25 3.77 0.00 -1.49 -3.39 119.26 120.99 3ku2 h ALA 402 Ca -0.00 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.91 3ku2 h ALA 402 Cb 0.83 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 3ku2 h ALA 402 CO 0.05 0.00 -0.32 -0.24 0.00 0.00 0.00 179.25 178.74 3ku2 h VAL 403 N 0.00 0.33 -0.62 0.00 3.04 -1.42 -2.99 116.25 114.59 3ku2 h VAL 403 Ca 0.00 0.00 0.12 0.00 -1.01 0.00 0.00 66.70 65.81 3ku2 h VAL 403 Cb 0.76 0.33 -0.09 0.00 -2.01 0.00 0.00 31.29 30.27 3ku2 h VAL 403 CO 0.00 0.00 0.09 -0.08 -1.01 0.00 0.00 177.57 176.57 3ku2 h GLU 404 N -0.63 0.20 -0.48 4.17 4.81 -1.79 0.11 114.58 120.97 3ku2 h GLU 404 Ca -0.00 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.13 3ku2 h GLU 404 Cb 0.60 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.91 3ku2 h GLU 404 CO -0.10 0.13 -0.04 1.25 -0.73 0.00 0.00 179.01 179.52 3ku2 h HIS 405 N 0.20 0.90 -0.35 0.92 2.76 -1.83 -1.71 115.15 116.04 3ku2 h HIS 405 Ca 0.33 -0.14 -0.14 0.00 -2.20 0.00 0.00 60.37 58.22 3ku2 h HIS 405 Cb 0.51 -0.24 -0.01 0.00 1.55 0.00 0.00 27.41 29.23 3ku2 h HIS 405 CO -0.29 0.84 -0.32 1.49 -1.30 0.00 0.00 177.93 178.35 3ku2 h GLU 406 N 0.76 0.84 -0.39 5.26 4.57 -1.21 -1.39 114.58 123.02 3ku2 h GLU 406 Ca 0.14 -0.43 0.01 0.00 -1.18 0.00 0.00 59.36 57.90 3ku2 h GLU 406 Cb 0.52 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.10 3ku2 h GLU 406 CO 0.03 1.07 0.25 0.28 -1.18 0.00 0.00 179.01 179.46 3ku2 h VAL 407 N 0.63 1.08 -0.24 0.32 2.07 -0.86 -1.24 116.25 118.00 3ku2 h VAL 407 Ca 0.06 -0.18 -0.09 0.00 0.82 0.00 0.00 66.70 67.32 3ku2 h VAL 407 Cb 0.90 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 3ku2 h VAL 407 CO 0.08 0.09 -0.22 0.44 0.02 0.00 0.00 177.57 177.98 3ku2 h ASP 408 N 0.51 0.44 -0.03 0.57 3.32 -1.28 -0.28 116.42 119.67 3ku2 h ASP 408 Ca 0.15 -0.14 -0.10 0.00 0.02 0.00 0.00 57.03 56.96 3ku2 h ASP 408 Cb -0.04 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 3ku2 h ASP 408 CO -0.04 0.67 -0.27 1.56 -1.72 0.00 0.00 179.24 179.44 3ku2 h GLN 409 N 0.40 0.45 -0.12 3.56 1.08 -0.81 -0.89 115.11 118.78 3ku2 h GLN 409 Ca 0.06 -0.17 -0.11 0.00 -1.45 0.00 0.00 58.65 56.98 3ku2 h GLN 409 Cb 0.61 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.02 3ku2 h GLN 409 CO 0.04 0.69 -0.37 0.28 -0.95 0.00 0.00 178.83 178.52 3ku2 h VAL 410 N 0.40 1.37 0.00 -0.54 2.07 -0.79 -3.19 116.25 115.57 3ku2 h VAL 410 Ca 0.06 -1.67 -0.02 0.00 0.82 0.00 0.00 66.70 65.89 3ku2 h VAL 410 Cb 0.68 2.11 -0.00 0.00 -1.52 0.00 0.00 31.29 32.55 3ku2 h VAL 410 CO 0.05 0.50 -0.09 -0.07 0.02 0.00 0.00 177.57 177.98 3ku2 h LEU 411 N 0.06 0.00 -0.68 2.57 3.38 -0.88 -0.87 115.31 118.90 3ku2 h LEU 411 Ca -0.01 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3ku2 h LEU 411 Cb 0.99 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.71 3ku2 h LEU 411 CO 0.08 0.09 0.35 -0.78 0.09 0.00 0.00 178.44 178.26 3ku2 h ASP 412 N 0.00 0.86 0.54 -0.43 1.82 -1.15 0.65 116.42 118.72 3ku2 h ASP 412 Ca -0.00 -0.11 -0.29 0.00 -0.39 0.00 0.00 57.03 56.24 3ku2 h ASP 412 Cb 0.21 -0.22 -0.01 0.00 0.68 0.00 0.00 39.33 39.99 3ku2 h ASP 412 CO 0.01 0.73 -1.44 0.00 -1.61 0.00 0.00 179.24 176.93 3ku2 h ALA 413 N 1.17 0.28 0.00 -0.78 0.00 -1.51 -3.42 119.26 115.01 3ku2 h ALA 413 Ca 0.24 -1.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.07 3ku2 h ALA 413 Cb 0.08 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3ku2 h ALA 413 CO -0.03 1.15 -0.00 -0.24 0.00 0.00 0.00 179.25 180.13 3ku2 h VAL 414 N 0.06 0.00 -0.41 0.00 3.04 -1.08 -3.53 116.25 114.33 3ku2 h VAL 414 Ca -0.20 -0.35 0.00 0.00 -1.01 0.00 0.00 66.70 65.14 3ku2 h VAL 414 Cb 1.98 0.00 0.00 0.00 -2.01 0.00 0.00 31.29 31.26 3ku2 h VAL 414 CO 0.16 0.00 0.00 -0.67 -1.01 0.00 0.00 177.57 176.05 3ku2 n ASP 415 N -2.97 0.00 0.00 3.17 4.64 0.21 -5.05 116.55 116.55 3ku2 n ASP 415 Ca -0.00 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.41 3ku2 n ASP 415 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.08 3ku2 n ASP 415 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 3ku2 n GLY 420 N 5.00 -0.61 3.40 0.27 0.00 -1.26 -4.66 105.19 107.33 3ku2 n GLY 420 Ca 0.00 -1.63 -0.44 0.00 0.00 0.00 0.00 46.02 43.94 3ku2 n GLY 420 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3ku2 s TYR 421 N 0.00 3.15 -0.15 1.61 1.13 -1.26 -4.39 117.35 117.44 3ku2 s TYR 421 Ca 0.00 -0.83 -0.14 0.00 -1.41 0.00 0.00 57.07 54.69 3ku2 s TYR 421 Cb 0.00 -3.46 -0.05 0.00 -1.10 0.00 0.00 41.96 37.35 3ku2 s TYR 421 CO 0.00 -0.96 0.30 0.42 -2.51 0.00 0.00 175.55 172.80 3ku2 s ILE 422 N 2.10 5.30 -0.38 -3.49 -1.09 0.72 -4.82 121.20 119.53 3ku2 s ILE 422 Ca 0.09 0.56 -0.28 0.00 -2.23 0.00 0.00 60.65 58.78 3ku2 s ILE 422 Cb -0.23 -3.63 -0.01 0.00 -1.58 0.00 0.00 42.46 37.01 3ku2 s ILE 422 CO 0.08 0.41 1.62 -1.61 -1.23 0.00 0.00 174.94 174.21 3ku2 s GLU 423 N 0.34 3.42 0.47 2.79 2.02 -1.26 -0.46 118.70 126.01 3ku2 s GLU 423 Ca 0.17 1.17 0.16 0.00 0.02 0.00 0.00 54.97 56.49 3ku2 s GLU 423 Cb -0.13 -4.12 1.14 0.00 0.10 0.00 0.00 34.13 31.11 3ku2 s GLU 423 CO 0.04 -1.75 2.02 0.10 0.02 0.00 0.00 175.26 175.69 3ku2 h TYR 424 N 11.92 0.27 -0.45 1.61 -0.00 -1.76 -2.61 116.97 125.96 3ku2 h TYR 424 Ca -0.31 0.01 -0.01 0.00 -0.00 0.00 0.00 58.73 58.42 3ku2 h TYR 424 Cb 1.14 -0.09 -0.02 0.00 -0.00 0.00 0.00 36.73 37.76 3ku2 h TYR 424 CO 0.97 0.13 0.25 0.66 -0.00 0.00 0.00 178.16 180.17 3ku2 h SER 425 N 0.26 0.55 -0.68 0.10 4.64 -1.91 0.20 113.55 116.71 3ku2 h SER 425 Ca 0.21 -0.08 -0.03 0.00 -0.47 0.00 0.00 61.79 61.42 3ku2 h SER 425 Cb 0.50 -0.14 -0.03 0.00 -0.31 0.00 0.00 62.40 62.42 3ku2 h SER 425 CO -0.04 0.48 0.31 -0.08 -0.87 0.00 0.00 176.83 176.63 3ku2 h GLU 426 N 0.58 1.00 0.15 4.77 4.81 -1.86 -2.17 114.58 121.85 3ku2 h GLU 426 Ca 0.16 -0.16 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 3ku2 h GLU 426 Cb 0.04 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.25 3ku2 h GLU 426 CO -0.03 0.80 -0.07 0.35 -0.73 0.00 0.00 179.01 179.33 3ku2 h PHE 427 N 0.96 -0.19 0.14 0.92 3.57 -1.12 -2.57 116.94 118.65 3ku2 h PHE 427 Ca 0.23 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.75 3ku2 h PHE 427 Cb 0.15 0.06 -0.04 0.00 2.79 0.00 0.00 35.95 38.91 3ku2 h PHE 427 CO 0.01 -0.03 -0.37 0.28 -2.23 0.00 0.00 178.31 175.97 3ku2 h VAL 428 N -0.30 0.23 0.12 1.41 2.07 -0.46 0.39 116.25 119.71 3ku2 h VAL 428 Ca -0.02 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.51 3ku2 h VAL 428 Cb 0.24 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 3ku2 h VAL 428 CO 0.03 0.00 -0.18 0.71 0.02 0.00 0.00 177.57 178.16 3ku2 h THR 429 N -0.62 0.60 -0.64 2.57 1.35 -1.46 0.29 112.91 115.00 3ku2 h THR 429 Ca 0.02 0.00 0.07 0.00 -0.55 0.00 0.00 66.41 65.96 3ku2 h THR 429 Cb 0.64 0.60 -0.06 0.00 -1.73 0.00 0.00 68.15 67.59 3ku2 h THR 429 CO -0.21 0.00 0.32 0.58 -0.25 0.00 0.00 175.52 175.96 3ku2 h VAL 430 N -0.36 0.89 -0.62 6.82 2.07 -1.33 0.13 116.25 123.85 3ku2 h VAL 430 Ca 0.02 -0.20 -0.04 0.00 0.82 0.00 0.00 66.70 67.30 3ku2 h VAL 430 Cb 0.36 0.27 -0.03 0.00 -1.52 0.00 0.00 31.29 30.37 3ku2 h VAL 430 CO -0.09 0.11 0.24 0.00 0.02 0.00 0.00 177.57 177.85 3ku2 h ALA 431 N 1.37 0.80 -0.02 1.67 0.00 0.12 -2.40 119.26 120.80 3ku2 h ALA 431 Ca 0.30 -0.17 -0.23 0.00 0.00 0.00 0.00 54.91 54.81 3ku2 h ALA 431 Cb 0.27 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.82 3ku2 h ALA 431 CO -0.23 0.43 -0.92 0.52 0.00 0.00 0.00 179.25 179.05 3ku2 h MET 432 N 0.86 0.50 -0.77 0.00 2.86 -0.52 -3.08 114.93 114.78 3ku2 h MET 432 Ca 0.20 -0.51 -0.04 0.00 -2.06 0.00 0.00 59.70 57.30 3ku2 h MET 432 Cb 0.22 0.14 -0.03 0.00 0.06 0.00 0.00 31.60 31.98 3ku2 h MET 432 CO -0.02 1.15 0.34 -0.44 1.06 0.00 0.00 176.91 179.01 3ku2 h ASP 433 N 0.30 1.04 -0.85 1.22 3.32 -0.71 -0.51 116.42 120.23 3ku2 h ASP 433 Ca -0.08 -0.15 0.01 0.00 0.02 0.00 0.00 57.03 56.82 3ku2 h ASP 433 Cb 1.55 -0.27 -0.04 0.00 0.22 0.00 0.00 39.33 40.79 3ku2 h ASP 433 CO 0.17 0.90 0.55 0.03 -1.72 0.00 0.00 179.24 179.17 3ku2 h ARG 434 N 1.10 1.13 -0.58 3.56 3.08 -1.48 0.50 114.38 121.70 3ku2 h ARG 434 Ca 0.26 -0.08 -0.09 0.00 0.07 0.00 0.00 59.98 60.14 3ku2 h ARG 434 Cb 0.16 -0.25 -0.02 0.00 0.08 0.00 0.00 29.97 29.94 3ku2 h ARG 434 CO -0.03 0.76 -0.00 0.87 -1.07 0.00 0.00 179.97 180.50 3ku2 h LYS 435 N 1.16 1.01 -0.26 0.04 6.56 -1.31 -1.60 116.57 122.16 3ku2 h LYS 435 Ca 0.31 -0.31 -0.03 0.00 -1.06 0.00 0.00 60.65 59.56 3ku2 h LYS 435 Cb -0.11 -0.10 -0.01 0.00 -0.57 0.00 0.00 32.23 31.44 3ku2 h LYS 435 CO -0.06 0.99 0.03 1.15 -2.06 0.00 0.00 179.45 179.50 3ku2 h THR 436 N 0.92 1.23 0.29 -0.16 2.02 -0.77 -2.47 112.91 113.97 3ku2 h THR 436 Ca 0.17 -0.80 -0.01 0.00 0.77 0.00 0.00 66.41 66.53 3ku2 h THR 436 Cb 0.54 1.26 0.00 0.00 -1.74 0.00 0.00 68.15 68.22 3ku2 h THR 436 CO 0.03 0.26 -0.14 0.25 0.37 0.00 0.00 175.52 176.29 3ku2 h LEU 437 N 0.23 -0.32 -1.06 2.58 6.46 -0.79 -0.97 115.31 121.44 3ku2 h LEU 437 Ca 0.08 -0.05 0.12 0.00 -0.12 0.00 0.00 57.88 57.91 3ku2 h LEU 437 Cb 0.35 0.08 -0.08 0.00 -0.73 0.00 0.00 40.66 40.28 3ku2 h LEU 437 CO 0.01 -0.16 0.62 -0.07 -0.62 0.00 0.00 178.44 178.22 3ku2 h LEU 438 N -0.47 0.88 -0.51 2.25 3.38 -1.30 0.35 115.31 119.89 3ku2 h LEU 438 Ca -0.04 0.05 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 3ku2 h LEU 438 Cb 0.35 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 3ku2 h LEU 438 CO 0.06 0.46 -0.01 -1.28 0.09 0.00 0.00 178.44 177.77 3ku2 h SER 439 N 0.94 0.89 -0.43 -0.43 0.87 -1.28 -2.60 113.55 111.52 3ku2 h SER 439 Ca 0.49 -0.31 -0.08 0.00 -1.23 0.00 0.00 61.79 60.65 3ku2 h SER 439 Cb 0.53 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.24 3ku2 h SER 439 CO -0.26 0.99 -0.06 -0.09 -0.53 0.00 0.00 176.83 176.88 3ku2 h ARG 440 N 0.78 0.79 -0.82 2.24 2.43 0.05 -3.00 114.38 116.84 3ku2 h ARG 440 Ca 0.14 -0.28 -0.03 0.00 -0.81 0.00 0.00 59.98 59.00 3ku2 h ARG 440 Cb 0.54 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.99 3ku2 h ARG 440 CO 0.03 0.89 0.38 0.93 -1.51 0.00 0.00 179.97 180.69 3ku2 h GLU 441 N 0.62 1.19 0.05 0.20 5.08 -0.94 -0.68 114.58 120.10 3ku2 h GLU 441 Ca 0.11 -0.18 -0.00 0.00 -1.00 0.00 0.00 59.36 58.29 3ku2 h GLU 441 Cb 0.57 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.61 3ku2 h GLU 441 CO 0.03 0.92 -0.02 0.00 -1.00 0.00 0.00 179.01 178.94 3ku2 h ARG 442 N 1.17 -0.06 -0.76 2.33 3.08 -1.47 -1.50 114.38 117.17 3ku2 h ARG 442 Ca 0.28 0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.36 3ku2 h ARG 442 Cb 0.13 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.15 3ku2 h ARG 442 CO -0.03 0.04 0.48 1.25 -1.07 0.00 0.00 179.97 180.64 3ku2 h LEU 443 N -0.16 0.80 -0.12 3.04 5.85 -1.36 -2.91 115.31 120.45 3ku2 h LEU 443 Ca -0.01 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.71 3ku2 h LEU 443 Cb 0.14 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 3ku2 h LEU 443 CO 0.01 0.55 0.08 -0.08 -0.34 0.00 0.00 178.44 178.66 3ku2 h GLU 444 N 0.95 0.16 -0.68 1.25 4.81 -0.97 -1.66 114.58 118.44 3ku2 h GLU 444 Ca 0.30 -0.01 0.12 0.00 -0.13 0.00 0.00 59.36 59.64 3ku2 h GLU 444 Cb 0.01 -0.04 -0.08 0.00 0.63 0.00 0.00 28.75 29.27 3ku2 h GLU 444 CO -0.11 0.12 0.25 0.00 -0.73 0.00 0.00 179.01 178.54 3ku2 h ARG 445 N 0.15 0.40 -0.30 1.92 3.08 -1.12 0.11 114.38 118.61 3ku2 h ARG 445 Ca 0.04 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 3ku2 h ARG 445 Cb -0.00 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 3ku2 h ARG 445 CO -0.01 0.26 0.13 0.00 -1.07 0.00 0.00 179.97 179.29 3ku2 h ALA 446 N 1.48 0.39 -0.07 0.04 0.00 -1.33 -1.31 119.26 118.48 3ku2 h ALA 446 Ca 0.36 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.17 3ku2 h ALA 446 Cb 0.50 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3ku2 h ALA 446 CO -0.36 -0.03 -0.00 0.35 0.00 0.00 0.00 179.25 179.21 3ku2 h PHE 447 N 0.35 -0.01 -0.78 0.00 3.57 -0.45 -1.13 116.94 118.49 3ku2 h PHE 447 Ca 0.10 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.64 3ku2 h PHE 447 Cb 0.15 0.01 -0.05 0.00 2.79 0.00 0.00 35.95 38.86 3ku2 h PHE 447 CO -0.01 -0.01 0.50 0.00 -2.23 0.00 0.00 178.31 176.55 3ku2 h ARG 448 N 0.02 0.95 -0.49 1.11 2.47 -0.77 -1.05 114.38 116.62 3ku2 h ARG 448 Ca 0.03 -0.06 -0.01 0.00 -1.26 0.00 0.00 59.98 58.68 3ku2 h ARG 448 Cb 0.04 -0.21 -0.02 0.00 -1.65 0.00 0.00 29.97 28.12 3ku2 h ARG 448 CO -0.06 0.63 0.27 1.98 0.56 0.00 0.00 179.97 183.35 3ku2 h MET 449 N 0.98 0.69 -0.27 0.04 4.05 -0.93 -2.92 114.93 116.56 3ku2 h MET 449 Ca 0.31 -0.08 -0.10 0.00 -0.28 0.00 0.00 59.70 59.56 3ku2 h MET 449 Cb 0.00 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 30.65 3ku2 h MET 449 CO -0.11 0.54 -0.24 0.35 0.23 0.00 0.00 176.91 177.68 3ku2 h PHE 450 N 0.65 0.57 -0.34 1.39 3.57 -0.85 -3.35 116.94 118.58 3ku2 h PHE 450 Ca 0.17 -0.12 -0.66 0.00 3.53 0.00 0.00 57.97 60.89 3ku2 h PHE 450 Cb 0.05 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.60 3ku2 h PHE 450 CO -0.02 0.71 2.55 -3.47 -2.23 0.00 0.00 178.31 175.86 3ku2 n ASP 451 N -4.12 4.04 0.13 0.41 2.03 -0.43 -4.81 116.55 113.80 3ku2 n ASP 451 Ca -0.00 -2.84 0.03 0.00 0.52 0.00 0.00 54.79 52.50 3ku2 n ASP 451 Cb 0.40 -1.64 0.42 0.00 -0.72 0.00 0.00 41.12 39.59 3ku2 n ASP 451 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 3ku2 h SER 452 N 7.06 0.21 -0.30 1.67 4.64 -1.77 -2.81 113.55 122.24 3ku2 h SER 452 Ca 0.48 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.77 3ku2 h SER 452 Cb 0.75 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 3ku2 h SER 452 CO 1.69 0.33 0.00 -0.90 -0.87 0.00 0.00 176.83 177.08 3ku2 n ASP 453 N -4.31 2.17 -4.03 4.97 5.75 -1.26 -4.97 116.55 114.86 3ku2 n ASP 453 Ca -0.01 -1.86 -0.32 0.00 -0.01 0.00 0.00 54.79 52.59 3ku2 n ASP 453 Cb 0.24 -0.20 -0.00 0.00 -1.03 0.00 0.00 41.12 40.13 3ku2 n ASP 453 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 3ku2 n ASN 454 N 0.66 -3.38 0.15 -1.12 4.13 -1.06 -4.89 115.26 109.74 3ku2 n ASN 454 Ca 0.16 -0.91 0.12 0.00 1.68 0.00 0.00 54.58 55.63 3ku2 n ASN 454 Cb 0.38 -3.33 0.17 0.00 -1.54 0.00 0.00 39.78 35.46 3ku2 n ASN 454 CO 0.00 0.00 0.00 0.77 0.28 0.00 0.00 177.26 178.31 3ku2 h SER 455 N -1.81 0.00 0.00 6.41 4.64 -1.93 -3.47 113.55 117.39 3ku2 h SER 455 Ca -0.59 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 60.70 3ku2 h SER 455 Cb 1.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.47 3ku2 h SER 455 CO 0.70 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 177.29 3ku2 n GLY 456 N 1.18 1.26 3.24 -0.77 0.00 -1.26 -5.01 105.19 103.83 3ku2 n GLY 456 Ca 0.03 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.87 3ku2 n GLY 456 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ku2 s LYS 457 N -0.18 1.02 -0.11 1.61 -0.14 -1.26 -3.73 119.74 116.94 3ku2 s LYS 457 Ca 0.00 -1.20 0.03 0.00 -1.36 0.00 0.00 55.97 53.44 3ku2 s LYS 457 Cb 0.00 -0.95 0.00 0.00 -1.68 0.00 0.00 37.83 35.20 3ku2 s LYS 457 CO 0.00 0.19 -0.23 0.96 -0.76 0.00 0.00 175.35 175.51 3ku2 s ILE 458 N -1.95 2.13 0.78 2.17 -4.36 0.11 -4.92 121.20 115.15 3ku2 s ILE 458 Ca 0.08 -0.98 -0.11 0.00 -0.26 0.00 0.00 60.65 59.37 3ku2 s ILE 458 Cb -0.06 -1.83 0.06 0.00 1.25 0.00 0.00 42.46 41.89 3ku2 s ILE 458 CO 0.03 0.55 1.11 -0.94 0.24 0.00 0.00 174.94 175.94 3ku2 s SER 459 N 0.49 4.28 0.44 4.36 1.04 -1.26 -1.60 113.70 121.44 3ku2 s SER 459 Ca -0.15 1.95 0.11 0.00 0.48 0.00 0.00 55.95 58.34 3ku2 s SER 459 Cb -0.17 -2.54 0.99 0.00 0.10 0.00 0.00 66.02 64.40 3ku2 s SER 459 CO 0.06 -2.19 2.07 0.28 0.98 0.00 0.00 173.24 174.43 3ku2 h SER 460 N -1.03 0.33 -0.27 7.02 0.02 -1.64 -0.14 113.55 117.85 3ku2 h SER 460 Ca -0.44 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 60.48 3ku2 h SER 460 Cb 1.24 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 3ku2 h SER 460 CO 0.50 0.24 0.09 0.74 -1.14 0.00 0.00 176.83 177.25 3ku2 h THR 461 N 0.39 1.20 -0.33 -2.27 2.02 -1.92 -1.43 112.91 110.56 3ku2 h THR 461 Ca 0.14 -0.62 -0.11 0.00 0.77 0.00 0.00 66.41 66.59 3ku2 h THR 461 Cb 0.08 1.10 -0.01 0.00 -1.74 0.00 0.00 68.15 67.58 3ku2 h THR 461 CO -0.03 0.21 -0.24 -0.33 0.37 0.00 0.00 175.52 175.49 3ku2 h GLU 462 N 0.27 0.64 -0.81 6.66 5.08 -1.67 -2.74 114.58 122.00 3ku2 h GLU 462 Ca 0.09 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.18 3ku2 h GLU 462 Cb 0.24 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.41 3ku2 h GLU 462 CO -0.00 0.83 0.45 -0.07 -1.00 0.00 0.00 179.01 179.21 3ku2 h LEU 463 N 0.56 1.01 -0.64 1.33 3.38 -0.87 -1.17 115.31 118.90 3ku2 h LEU 463 Ca 0.08 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3ku2 h LEU 463 Cb 0.71 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.17 3ku2 h LEU 463 CO 0.05 0.82 0.42 0.00 0.09 0.00 0.00 178.44 179.82 3ku2 h ALA 464 N 1.24 0.82 0.16 1.53 0.00 -0.97 -0.61 119.26 121.42 3ku2 h ALA 464 Ca 0.29 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 3ku2 h ALA 464 Cb 0.02 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.56 3ku2 h ALA 464 CO -0.05 0.26 -0.08 1.15 0.00 0.00 0.00 179.25 180.54 3ku2 h THR 465 N 0.87 0.95 0.11 0.00 2.02 -1.27 -1.25 112.91 114.35 3ku2 h THR 465 Ca 0.23 -0.50 -0.00 0.00 0.77 0.00 0.00 66.41 66.91 3ku2 h THR 465 Cb -0.08 1.26 -0.00 0.00 -1.74 0.00 0.00 68.15 67.59 3ku2 h THR 465 CO -0.05 0.12 -0.07 0.40 0.37 0.00 0.00 175.52 176.28 3ku2 h ILE 466 N -0.46 0.84 0.00 3.11 2.04 -1.08 -2.06 117.51 119.90 3ku2 h ILE 466 Ca -0.02 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.80 3ku2 h ILE 466 Cb 0.36 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 3ku2 h ILE 466 CO 0.04 0.00 -0.20 -0.26 0.00 0.00 0.00 178.15 177.73 3ku2 h PHE 467 N -0.19 0.00 -0.26 1.37 0.05 -1.17 -2.02 116.94 114.73 3ku2 h PHE 467 Ca -0.01 0.00 -0.10 0.00 3.82 0.00 0.00 57.97 61.69 3ku2 h PHE 467 Cb 0.16 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.11 3ku2 h PHE 467 CO -0.09 0.20 -0.21 0.78 -0.18 0.00 0.00 178.31 178.81 3ku2 h GLY 468 N 0.86 0.66 1.87 -1.45 0.00 -0.92 0.15 103.07 104.24 3ku2 h GLY 468 Ca -0.00 -0.65 -0.07 0.00 0.00 0.00 0.00 47.33 46.60 3ku2 h GLY 468 CO 0.03 0.59 -0.29 -2.08 0.00 0.00 0.00 176.54 174.78 3ku2 h VAL 469 N 0.33 1.24 -0.35 4.60 2.07 -1.15 -2.97 116.25 120.03 3ku2 h VAL 469 Ca 0.05 -1.14 0.00 0.00 0.82 0.00 0.00 66.70 66.42 3ku2 h VAL 469 Cb 0.75 1.50 0.00 0.00 -1.52 0.00 0.00 31.29 32.03 3ku2 h VAL 469 CO 0.05 0.34 0.00 -1.54 0.02 0.00 0.00 177.57 176.45 3ku2 n SER 470 N -4.15 2.83 -3.63 0.57 3.41 -0.78 -4.78 113.62 107.10 3ku2 n SER 470 Ca -0.01 -1.91 -0.23 0.00 -0.26 0.00 0.00 58.87 56.46 3ku2 n SER 470 Cb 0.37 -0.23 0.06 0.00 -0.26 0.00 0.00 64.21 64.16 3ku2 n SER 470 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3ku2 n ASP 471 N 1.08 -3.94 -4.62 4.04 2.03 -0.58 -4.98 116.55 109.58 3ku2 n ASP 471 Ca 0.18 -0.66 -0.35 0.00 0.52 0.00 0.00 54.79 54.48 3ku2 n ASP 471 Cb 0.50 -4.69 -0.10 0.00 -0.72 0.00 0.00 41.12 36.11 3ku2 n ASP 471 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 3ku2 s VAL 472 N -3.39 4.91 0.31 5.18 1.01 0.44 -5.04 120.40 123.82 3ku2 s VAL 472 Ca 0.33 0.02 -0.30 0.00 0.00 0.00 0.00 61.98 62.03 3ku2 s VAL 472 Cb -0.15 -3.25 -0.11 0.00 0.00 0.00 0.00 36.38 32.86 3ku2 s VAL 472 CO 0.76 0.41 1.56 -0.62 0.00 0.00 0.00 175.10 177.21 3ku2 s ASP 473 N 0.77 6.39 0.14 3.32 -1.08 -1.26 -4.43 116.67 120.51 3ku2 s ASP 473 Ca 0.05 2.95 -0.27 0.00 -0.52 0.00 0.00 52.55 54.76 3ku2 s ASP 473 Cb -0.13 -2.64 -0.02 0.00 -1.46 0.00 0.00 42.92 38.67 3ku2 s ASP 473 CO 0.02 -0.89 1.59 -1.28 0.52 0.00 0.00 175.17 175.13 3ku2 h SER 474 N 4.52 -1.19 -0.16 -0.34 0.87 -1.97 -1.97 113.55 113.30 3ku2 h SER 474 Ca -0.48 0.17 -0.04 0.00 -1.23 0.00 0.00 61.79 60.22 3ku2 h SER 474 Cb 1.22 0.50 -0.02 0.00 -0.44 0.00 0.00 62.40 63.67 3ku2 h SER 474 CO 0.76 -0.39 0.00 -0.33 -0.53 0.00 0.00 176.83 176.35 3ku2 h GLU 475 N -0.41 0.41 0.52 2.24 3.07 -1.98 -1.47 114.58 116.95 3ku2 h GLU 475 Ca 0.10 -0.07 -0.03 0.00 -0.50 0.00 0.00 59.36 58.86 3ku2 h GLU 475 Cb 0.59 -0.07 0.01 0.00 -0.84 0.00 0.00 28.75 28.43 3ku2 h GLU 475 CO -0.42 0.44 -0.25 1.15 -1.40 0.00 0.00 179.01 178.52 3ku2 h THR 476 N 0.40 0.43 -0.78 1.13 2.02 -1.82 -1.93 112.91 112.35 3ku2 h THR 476 Ca 0.09 -0.28 -0.05 0.00 0.77 0.00 0.00 66.41 66.94 3ku2 h THR 476 Cb 0.26 0.54 -0.03 0.00 -1.74 0.00 0.00 68.15 67.18 3ku2 h THR 476 CO 0.01 0.04 0.28 4.11 0.37 0.00 0.00 175.52 180.33 3ku2 h TRP 477 N -0.88 1.22 -0.71 3.16 5.08 -1.26 -2.43 115.95 120.12 3ku2 h TRP 477 Ca -0.07 -0.11 0.01 0.00 1.08 0.00 0.00 58.89 59.80 3ku2 h TRP 477 Cb 0.61 -0.36 -0.04 0.00 -3.00 0.00 0.00 29.16 26.37 3ku2 h TRP 477 CO -0.01 0.94 0.47 0.87 -1.28 0.00 0.00 178.44 179.44 3ku2 h LYS 478 N 1.15 0.94 -0.08 0.12 1.57 -1.32 -1.17 116.57 117.78 3ku2 h LYS 478 Ca 0.26 -0.06 -0.18 0.00 -1.87 0.00 0.00 60.65 58.80 3ku2 h LYS 478 Cb 0.26 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.36 3ku2 h LYS 478 CO -0.01 0.62 -0.73 0.66 -0.57 0.00 0.00 179.45 179.42 3ku2 h SER 479 N 0.97 0.49 -0.31 0.86 4.64 -1.11 -2.84 113.55 116.25 3ku2 h SER 479 Ca 0.26 -0.32 -0.14 0.00 -0.47 0.00 0.00 61.79 61.12 3ku2 h SER 479 Cb -0.11 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 61.82 3ku2 h SER 479 CO -0.06 1.06 -0.34 0.58 -0.87 0.00 0.00 176.83 177.21 3ku2 h VAL 480 N 0.28 1.28 -0.21 0.95 2.07 -0.95 -2.63 116.25 117.04 3ku2 h VAL 480 Ca -0.03 -1.50 0.02 0.00 0.82 0.00 0.00 66.70 66.01 3ku2 h VAL 480 Cb 1.30 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 32.40 3ku2 h VAL 480 CO 0.13 0.50 0.08 0.25 0.02 0.00 0.00 177.57 178.55 3ku2 h LEU 481 N 0.71 0.10 -0.99 2.57 5.85 -1.20 -1.00 115.31 121.35 3ku2 h LEU 481 Ca 0.07 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 3ku2 h LEU 481 Cb 0.90 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.89 3ku2 h LEU 481 CO 0.08 0.09 0.36 0.28 -0.34 0.00 0.00 178.44 178.91 3ku2 h SER 482 N 0.19 0.98 -0.42 1.25 0.02 -1.46 -1.62 113.55 112.49 3ku2 h SER 482 Ca 0.09 -0.11 -0.11 0.00 -0.84 0.00 0.00 61.79 60.82 3ku2 h SER 482 Cb 0.05 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.32 3ku2 h SER 482 CO -0.08 0.83 -0.16 -0.08 -1.14 0.00 0.00 176.83 176.20 3ku2 h GLU 483 N 1.07 0.90 -0.13 3.45 4.81 -1.18 -3.25 114.58 120.25 3ku2 h GLU 483 Ca 0.26 -0.34 -0.16 0.00 -0.13 0.00 0.00 59.36 58.99 3ku2 h GLU 483 Cb 0.11 -0.05 0.01 0.00 0.63 0.00 0.00 28.75 29.45 3ku2 h GLU 483 CO -0.03 0.99 -0.54 -0.39 -0.73 0.00 0.00 179.01 178.31 3ku2 h VAL 484 N 0.79 1.34 -2.97 0.32 -1.51 -0.83 -3.44 116.25 109.95 3ku2 h VAL 484 Ca 0.12 -1.82 -0.42 0.00 -1.23 0.00 0.00 66.70 63.35 3ku2 h VAL 484 Cb 0.70 2.09 -0.40 0.00 -2.13 0.00 0.00 31.29 31.55 3ku2 h VAL 484 CO 0.05 0.56 -0.72 -0.62 -1.23 0.00 0.00 177.57 175.61 3ku2 s ASP 485 N -6.75 1.99 0.31 4.19 3.68 -0.64 -5.03 116.67 114.41 3ku2 s ASP 485 Ca -0.12 -0.44 0.05 0.00 2.13 0.00 0.00 52.55 54.17 3ku2 s ASP 485 Cb 0.06 -0.09 0.50 0.00 -1.45 0.00 0.00 42.92 41.95 3ku2 s ASP 485 CO 0.84 -0.33 1.77 0.07 0.13 0.00 0.00 175.17 177.65 3ku2 h LYS 486 N 8.40 0.40 -1.08 4.34 5.09 -1.83 -2.90 116.57 128.98 3ku2 h LYS 486 Ca -0.15 -0.14 -0.45 0.00 0.09 0.00 0.00 60.65 60.00 3ku2 h LYS 486 Cb 1.15 -0.03 -0.24 0.00 0.10 0.00 0.00 32.23 33.21 3ku2 h LYS 486 CO 0.27 0.61 0.57 0.09 -2.09 0.00 0.00 179.45 178.90 3ku2 n ASN 487 N -4.15 4.85 -4.76 7.07 3.02 -1.26 -4.99 115.26 115.04 3ku2 n ASN 487 Ca -0.00 -3.34 -0.41 0.00 -0.03 0.00 0.00 54.58 50.80 3ku2 n ASN 487 Cb 0.38 -0.85 -0.02 0.00 -0.61 0.00 0.00 39.78 38.67 3ku2 n ASN 487 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 3ku2 s ASN 488 N -0.86 6.85 -0.39 6.41 3.84 -1.10 -4.98 114.94 124.72 3ku2 s ASN 488 Ca 0.47 2.60 0.12 0.00 0.21 0.00 0.00 52.86 56.26 3ku2 s ASN 488 Cb 0.38 -2.64 0.40 0.00 -0.55 0.00 0.00 41.25 38.84 3ku2 s ASN 488 CO 0.05 -0.48 0.90 -0.90 -2.79 0.00 0.00 177.10 173.88 3ku2 n ASP 489 N 1.07 2.13 -1.70 -4.21 3.85 -1.26 -4.96 116.55 111.47 3ku2 n ASP 489 Ca 0.01 -3.09 -0.16 0.00 -0.71 0.00 0.00 54.79 50.83 3ku2 n ASP 489 Cb 0.42 -0.55 -0.02 0.00 -1.35 0.00 0.00 41.12 39.61 3ku2 n ASP 489 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3ku2 n GLY 490 N -0.03 0.21 3.25 6.12 0.00 -1.26 -5.00 105.19 108.47 3ku2 n GLY 490 Ca 0.22 -0.21 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 3ku2 n GLY 490 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ku2 s GLU 491 N -4.43 0.41 -0.00 1.61 2.02 -1.26 -1.42 118.70 115.62 3ku2 s GLU 491 Ca 0.00 0.58 0.07 0.00 0.02 0.00 0.00 54.97 55.64 3ku2 s GLU 491 Cb 0.00 0.13 -0.02 0.00 0.10 0.00 0.00 34.13 34.34 3ku2 s GLU 491 CO 0.00 -0.09 -0.22 0.14 0.02 0.00 0.00 175.26 175.12 3ku2 s VAL 492 N 0.56 1.72 0.73 2.63 -7.23 -0.63 -4.93 120.40 113.24 3ku2 s VAL 492 Ca -0.03 -1.00 -0.00 0.00 -1.81 0.00 0.00 61.98 59.14 3ku2 s VAL 492 Cb -0.05 -1.44 0.13 0.00 0.56 0.00 0.00 36.38 35.59 3ku2 s VAL 492 CO -0.03 0.42 1.00 1.51 -0.31 0.00 0.00 175.10 177.69 3ku2 s ASP 493 N -0.67 4.31 0.20 4.85 1.47 -1.26 0.06 116.67 125.63 3ku2 s ASP 493 Ca 0.08 -0.41 -0.11 0.00 1.18 0.00 0.00 52.55 53.29 3ku2 s ASP 493 Cb -0.08 0.06 0.20 0.00 -0.34 0.00 0.00 42.92 42.76 3ku2 s ASP 493 CO -0.00 -1.89 1.78 0.15 0.68 0.00 0.00 175.17 175.89 3ku2 h PHE 494 N -0.54 0.53 -0.21 2.11 3.57 -1.99 -1.74 116.94 118.68 3ku2 h PHE 494 Ca -0.36 0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.07 3ku2 h PHE 494 Cb 1.27 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.84 3ku2 h PHE 494 CO -0.21 0.23 -0.31 0.22 -2.23 0.00 0.00 178.31 176.01 3ku2 h ASP 495 N 0.54 0.42 -0.14 0.41 3.58 -1.95 -1.48 116.42 117.81 3ku2 h ASP 495 Ca 0.27 -0.15 -0.13 0.00 0.42 0.00 0.00 57.03 57.43 3ku2 h ASP 495 Cb 0.21 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.13 3ku2 h ASP 495 CO -0.20 0.72 -0.37 -0.33 -2.88 0.00 0.00 179.24 176.18 3ku2 h GLU 496 N 0.36 0.66 -0.17 0.28 5.08 -1.88 -1.15 114.58 117.76 3ku2 h GLU 496 Ca 0.05 -0.32 -0.01 0.00 -1.00 0.00 0.00 59.36 58.07 3ku2 h GLU 496 Cb 0.72 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 3ku2 h GLU 496 CO 0.06 0.92 0.06 0.35 -1.00 0.00 0.00 179.01 179.39 3ku2 h PHE 497 N 0.55 0.27 -0.77 4.33 3.57 -1.02 -1.43 116.94 122.44 3ku2 h PHE 497 Ca 0.05 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 3ku2 h PHE 497 Cb 0.88 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 39.50 3ku2 h PHE 497 CO 0.04 0.36 0.50 0.37 -2.23 0.00 0.00 178.31 177.36 3ku2 h GLN 498 N 0.10 1.02 -0.64 1.11 -0.00 -1.23 -2.20 115.11 113.27 3ku2 h GLN 498 Ca 0.06 -0.07 -0.03 0.00 -0.00 0.00 0.00 58.65 58.60 3ku2 h GLN 498 Cb 0.22 -0.23 -0.03 0.00 0.00 0.00 0.00 27.48 27.44 3ku2 h GLN 498 CO -0.00 0.69 0.27 1.96 0.00 0.00 0.00 178.83 181.74 3ku2 h GLN 499 N 1.05 0.95 -0.27 1.69 4.20 -1.07 -1.67 115.11 120.00 3ku2 h GLN 499 Ca 0.28 -0.17 0.03 0.00 0.06 0.00 0.00 58.65 58.85 3ku2 h GLN 499 Cb -0.10 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.49 3ku2 h GLN 499 CO -0.06 0.79 0.09 0.52 -0.67 0.00 0.00 178.83 179.50 3ku2 h MET 500 N 0.90 0.20 -0.12 1.46 2.86 -0.74 -1.95 114.93 117.53 3ku2 h MET 500 Ca 0.22 -0.01 -0.08 0.00 -2.06 0.00 0.00 59.70 57.77 3ku2 h MET 500 Cb 0.19 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 3ku2 h MET 500 CO -0.02 0.13 -0.27 -0.07 1.06 0.00 0.00 176.91 177.74 3ku2 h LEU 501 N 0.20 0.21 -0.31 1.22 3.38 -1.30 -1.51 115.31 117.20 3ku2 h LEU 501 Ca 0.12 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 3ku2 h LEU 501 Cb 0.09 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 3ku2 h LEU 501 CO -0.13 0.49 0.00 -0.07 0.09 0.00 0.00 178.44 178.82 3ku2 h LEU 502 N 0.19 0.53 -1.19 1.67 3.38 -0.85 -2.97 115.31 116.08 3ku2 h LEU 502 Ca 0.03 -0.31 -0.08 0.00 0.09 0.00 0.00 57.88 57.61 3ku2 h LEU 502 Cb 0.59 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 3ku2 h LEU 502 CO 0.04 0.71 -0.39 0.11 0.09 0.00 0.00 178.44 179.00 3ku2 h LYS 503 N 0.34 0.03 0.00 1.13 1.57 -1.18 0.10 116.57 118.57 3ku2 h LYS 503 Ca 0.09 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 3ku2 h LYS 503 Cb 0.44 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.75 3ku2 h LYS 503 CO 0.02 0.42 0.00 1.28 -0.57 0.00 0.00 179.45 180.59 3ku2 n LEU 504 N -4.07 0.21 -1.34 2.94 4.77 -0.59 -2.87 117.00 116.04 3ku2 n LEU 504 Ca -0.02 0.54 -0.04 0.00 -0.03 0.00 0.00 56.01 56.46 3ku2 n LEU 504 Cb 0.43 -0.50 0.11 0.00 -2.33 0.00 0.00 43.42 41.13 3ku2 n LEU 504 CO 0.39 -0.25 0.24 0.00 -1.33 0.00 0.00 177.39 176.44 3ku2 n GLY 506 N -0.75 -0.34 0.00 0.00 0.00 -1.14 -4.88 105.19 98.09 3ku2 n GLY 506 Ca 0.25 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.40 3ku2 n GLY 506 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02