#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u9i s HIS 15 N 0.00 2.84 -0.12 4.31 2.46 -1.26 -4.86 115.29 118.66 1u9i s HIS 15 Ca 0.00 -1.53 -0.07 0.00 0.47 0.00 0.00 55.06 53.92 1u9i s HIS 15 Cb 0.00 -4.67 0.04 0.00 -0.13 0.00 0.00 32.58 27.83 1u9i s HIS 15 CO 0.00 -1.77 0.29 -0.65 -2.47 0.00 0.00 174.74 170.15 1u9i s GLN 16 N 3.95 0.28 0.37 2.88 -0.21 -1.26 -5.05 119.66 120.61 1u9i s GLN 16 Ca 0.50 0.55 0.27 0.00 0.02 0.00 0.00 55.36 56.70 1u9i s GLN 16 Cb 0.02 -0.03 1.12 0.00 1.00 0.00 0.00 33.01 35.12 1u9i s GLN 16 CO 0.03 -0.13 1.81 0.00 -2.12 0.00 0.00 175.29 174.88 1u9i h ALA 17 N 6.78 1.00 -3.22 6.09 0.00 -1.89 -3.44 119.26 124.58 1u9i h ALA 17 Ca -0.36 0.00 -0.65 0.00 0.00 0.00 0.00 54.91 53.90 1u9i h ALA 17 Cb 1.17 0.00 -0.25 0.00 0.00 0.00 0.00 17.79 18.71 1u9i h ALA 17 CO 0.35 0.00 -0.72 0.42 0.00 0.00 0.00 179.25 179.30 1u9i s ILE 18 N -3.44 3.44 0.07 0.00 -1.09 -1.26 -5.08 121.20 113.85 1u9i s ILE 18 Ca 0.03 -0.50 -0.31 0.00 -2.23 0.00 0.00 60.65 57.64 1u9i s ILE 18 Cb 0.09 -2.51 -0.07 0.00 -1.58 0.00 0.00 42.46 38.40 1u9i s ILE 18 CO 0.45 0.48 1.38 0.00 -1.23 0.00 0.00 174.94 176.03 1u9i s ALA 19 N 0.68 3.57 0.32 9.38 0.00 -1.26 -4.95 121.76 129.49 1u9i s ALA 19 Ca -0.04 1.02 0.09 0.00 0.00 0.00 0.00 51.96 53.03 1u9i s ALA 19 Cb -0.15 -3.55 -0.05 0.00 0.00 0.00 0.00 23.12 19.38 1u9i s ALA 19 CO 0.02 -0.70 0.07 0.15 0.00 0.00 0.00 175.76 175.30 1u9i s LYS 20 N 1.55 2.28 -0.08 0.00 1.02 -1.26 -0.93 119.74 122.32 1u9i s LYS 20 Ca 0.64 -1.56 0.05 0.00 0.02 0.00 0.00 55.97 55.12 1u9i s LYS 20 Cb -0.34 -2.11 -0.01 0.00 -0.52 0.00 0.00 37.83 34.85 1u9i s LYS 20 CO 0.29 0.19 -0.24 1.41 -0.92 0.00 0.00 175.35 176.08 1u9i s MET 21 N -3.76 2.77 0.21 1.68 -2.45 0.48 -4.77 119.30 113.45 1u9i s MET 21 Ca 0.35 -0.88 -0.30 0.00 -1.25 0.00 0.00 55.69 53.61 1u9i s MET 21 Cb -0.03 -2.24 -0.08 0.00 1.25 0.00 0.00 34.83 33.73 1u9i s MET 21 CO 0.21 0.31 1.00 1.03 1.05 0.00 0.00 175.02 178.62 1u9i s ARG 22 N 0.03 4.75 0.05 4.11 0.52 -1.25 -0.68 118.95 126.47 1u9i s ARG 22 Ca -0.09 1.58 0.15 0.00 -0.52 0.00 0.00 55.73 56.85 1u9i s ARG 22 Cb -0.15 -3.28 -0.15 0.00 0.52 0.00 0.00 34.95 31.89 1u9i s ARG 22 CO 0.06 0.34 0.85 1.79 0.02 0.00 0.00 175.30 178.35 1u9i h THR 23 N 3.39 0.66 0.00 0.02 1.35 -1.94 -3.46 112.91 112.93 1u9i h THR 23 Ca -0.45 -2.24 0.00 0.00 -0.55 0.00 0.00 66.41 63.17 1u9i h THR 23 Cb 1.21 2.19 0.00 0.00 -1.73 0.00 0.00 68.15 69.81 1u9i h THR 23 CO 0.69 0.37 0.00 0.23 -0.25 0.00 0.00 175.52 176.57 1u9i n MET 24 N -2.97 -0.75 -2.66 4.72 0.00 -1.26 -4.68 117.12 109.52 1u9i n MET 24 Ca -0.10 0.19 -0.43 0.00 0.00 0.00 0.00 57.70 57.36 1u9i n MET 24 Cb 0.89 -3.83 -0.02 0.00 0.00 0.00 0.00 33.22 30.26 1u9i n MET 24 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 175.97 176.39 1u9i s ILE 25 N -1.74 4.71 -0.25 2.02 -1.09 -1.26 -4.92 121.20 118.66 1u9i s ILE 25 Ca 0.00 2.00 -0.36 0.00 -2.23 0.00 0.00 60.65 60.06 1u9i s ILE 25 Cb 0.00 -4.29 -0.12 0.00 -1.58 0.00 0.00 42.46 36.47 1u9i s ILE 25 CO 0.00 -0.05 2.00 1.21 -1.23 0.00 0.00 174.94 176.87 1u9i n GLU 26 N 5.41 1.45 0.00 2.79 2.13 -1.26 -1.74 120.64 129.42 1u9i n GLU 26 Ca 0.10 0.48 0.00 0.00 0.66 0.00 0.00 57.16 58.40 1u9i n GLU 26 Cb 0.48 -2.47 0.00 0.00 0.27 0.00 0.00 31.44 29.72 1u9i n GLU 26 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1u9i n GLY 27 N 5.36 2.90 0.25 8.31 0.00 -1.26 -1.42 105.19 119.33 1u9i n GLY 27 Ca 0.32 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.26 1u9i n GLY 27 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1u9i h PHE 28 N 0.00 0.84 0.00 1.61 3.57 -1.65 -2.41 116.94 118.89 1u9i h PHE 28 Ca 0.00 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.43 1u9i h PHE 28 Cb 0.00 -0.25 -0.00 0.00 2.79 0.00 0.00 35.95 38.48 1u9i h PHE 28 CO 0.00 0.67 -0.07 -0.44 -2.23 0.00 0.00 178.31 176.24 1u9i h ASP 29 N 0.76 0.00 -0.00 0.41 3.32 -1.91 0.19 116.42 119.20 1u9i h ASP 29 Ca 0.19 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.23 1u9i h ASP 29 Cb 0.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.72 1u9i h ASP 29 CO -0.02 0.07 -0.05 0.44 -1.72 0.00 0.00 179.24 177.96 1u9i h ASP 30 N 0.00 0.05 -0.60 6.45 3.32 -1.82 0.70 116.42 124.52 1u9i h ASP 30 Ca -0.00 -0.75 0.04 0.00 0.02 0.00 0.00 57.03 56.34 1u9i h ASP 30 Cb 0.27 -0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.76 1u9i h ASP 30 CO 0.01 0.79 0.35 0.40 -1.72 0.00 0.00 179.24 179.06 1u9i h ILE 31 N -0.69 1.03 -0.13 0.35 2.04 -0.92 -1.79 117.51 117.40 1u9i h ILE 31 Ca -0.01 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 65.62 1u9i h ILE 31 Cb 0.79 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 37.17 1u9i h ILE 31 CO 0.01 0.12 0.00 -1.54 0.00 0.00 0.00 178.15 176.74 1u9i n SER 32 N -4.77 0.80 -3.83 1.72 3.41 0.62 -0.17 113.62 111.41 1u9i n SER 32 Ca 0.06 -1.85 -0.25 0.00 -0.26 0.00 0.00 58.87 56.57 1u9i n SER 32 Cb 0.11 -0.09 0.02 0.00 -0.26 0.00 0.00 64.21 63.99 1u9i n SER 32 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1u9i n HIS 33 N -0.13 -1.94 0.00 7.33 8.25 -0.67 -3.68 115.22 124.37 1u9i n HIS 33 Ca 0.08 0.83 0.00 0.00 -0.26 0.00 0.00 57.72 58.38 1u9i n HIS 33 Cb 0.15 -4.10 0.00 0.00 1.12 0.00 0.00 29.99 27.16 1u9i n HIS 33 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1u9i n GLY 34 N -1.68 1.68 0.00 -1.41 0.00 0.24 -5.02 105.19 99.00 1u9i n GLY 34 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1u9i n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u9i n GLY 35 N 0.00 0.37 3.71 -0.02 0.00 -1.24 -3.91 105.19 104.11 1u9i n GLY 35 Ca 0.00 -2.24 -0.42 0.00 0.00 0.00 0.00 46.02 43.36 1u9i n GLY 35 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1u9i s LEU 36 N 0.00 4.38 0.19 0.99 1.43 0.14 -4.55 118.68 121.26 1u9i s LEU 36 Ca 0.00 1.74 -0.33 0.00 -1.03 0.00 0.00 54.13 54.51 1u9i s LEU 36 Cb 0.00 -3.57 -0.15 0.00 0.03 0.00 0.00 46.19 42.50 1u9i s LEU 36 CO 0.00 -0.28 1.36 -2.65 0.23 0.00 0.00 176.35 175.01 1u9i n PRO 37 N 3.79 1.70 -2.55 1.29 -0.02 -1.26 -0.39 135.00 137.56 1u9i n PRO 37 Ca 0.06 0.61 -0.37 0.00 -2.02 0.00 0.00 63.50 61.77 1u9i n PRO 37 Cb 0.50 -2.24 -0.04 0.00 -0.02 0.00 0.00 33.50 31.70 1u9i n PRO 37 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1u9i s ILE 38 N 0.16 3.71 -0.32 4.25 1.01 -0.11 -3.39 121.20 126.51 1u9i s ILE 38 Ca 0.74 1.41 0.00 0.00 0.00 0.00 0.00 60.65 62.80 1u9i s ILE 38 Cb -0.75 -3.78 0.00 0.00 0.01 0.00 0.00 42.46 37.94 1u9i s ILE 38 CO 0.48 0.11 0.00 0.61 0.00 0.00 0.00 174.94 176.14 1u9i n GLY 39 N 0.58 0.59 3.36 6.18 0.00 -1.26 -4.96 105.19 109.68 1u9i n GLY 39 Ca 0.03 -0.36 -0.18 0.00 0.00 0.00 0.00 46.02 45.52 1u9i n GLY 39 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1u9i s ARG 40 N -1.51 1.44 -0.05 1.61 0.52 -1.22 -4.63 118.95 115.12 1u9i s ARG 40 Ca 0.00 -1.77 0.00 0.00 -0.52 0.00 0.00 55.73 53.45 1u9i s ARG 40 Cb 0.00 -0.56 -0.03 0.00 0.52 0.00 0.00 34.95 34.87 1u9i s ARG 40 CO 0.00 -0.19 -0.03 -1.54 0.02 0.00 0.00 175.30 173.56 1u9i s SER 41 N -3.36 4.93 -0.20 0.23 1.04 -1.26 -1.28 113.70 113.80 1u9i s SER 41 Ca 0.34 0.02 0.01 0.00 0.48 0.00 0.00 55.95 56.79 1u9i s SER 41 Cb 0.07 -1.29 0.02 0.00 0.10 0.00 0.00 66.02 64.93 1u9i s SER 41 CO 0.12 0.34 -0.16 -0.89 0.98 0.00 0.00 173.24 173.63 1u9i s THR 42 N -0.91 2.24 0.05 2.02 2.01 -0.49 -2.84 115.64 117.72 1u9i s THR 42 Ca 0.15 -1.01 -0.30 0.00 0.31 0.00 0.00 61.69 60.84 1u9i s THR 42 Cb -0.11 -2.02 -0.05 0.00 0.01 0.00 0.00 72.50 70.33 1u9i s THR 42 CO 0.04 0.43 1.06 -0.22 -0.69 0.00 0.00 174.62 175.24 1u9i s LEU 43 N 1.28 4.40 -0.32 4.42 2.96 0.69 -0.89 118.68 131.23 1u9i s LEU 43 Ca 0.03 1.84 0.02 0.00 -0.22 0.00 0.00 54.13 55.80 1u9i s LEU 43 Cb -0.14 -3.58 0.10 0.00 0.50 0.00 0.00 46.19 43.06 1u9i s LEU 43 CO -0.10 -0.30 0.06 -0.69 -1.32 0.00 0.00 176.35 173.99 1u9i s VAL 44 N 0.76 1.68 0.16 1.68 1.01 0.16 0.68 120.40 126.53 1u9i s VAL 44 Ca 0.53 -1.88 0.10 0.00 0.00 0.00 0.00 61.98 60.74 1u9i s VAL 44 Cb -0.25 -2.22 -0.04 0.00 0.00 0.00 0.00 36.38 33.87 1u9i s VAL 44 CO 0.29 -0.58 -0.20 -0.94 0.00 0.00 0.00 175.10 173.67 1u9i s SER 45 N 1.22 3.67 0.08 3.32 1.04 -0.43 -1.49 113.70 121.10 1u9i s SER 45 Ca 0.09 -0.72 -0.27 0.00 0.48 0.00 0.00 55.95 55.52 1u9i s SER 45 Cb -0.18 -0.40 0.09 0.00 0.10 0.00 0.00 66.02 65.62 1u9i s SER 45 CO -0.14 0.14 1.12 -0.83 0.98 0.00 0.00 173.24 174.51 1u9i s GLY 46 N -2.47 -0.30 1.15 7.32 0.00 -0.81 -0.73 107.32 111.48 1u9i s GLY 46 Ca 0.20 0.36 -0.19 0.00 0.00 0.00 0.00 44.72 45.08 1u9i s GLY 46 CO 0.10 0.27 1.20 -0.51 0.00 0.00 0.00 173.10 174.16 1u9i s THR 47 N -2.82 1.68 0.28 0.90 -4.23 -1.26 -2.00 115.64 108.20 1u9i s THR 47 Ca 0.14 0.00 -0.30 0.00 -1.18 0.00 0.00 61.69 60.35 1u9i s THR 47 Cb 0.01 -2.67 -0.11 0.00 1.34 0.00 0.00 72.50 71.08 1u9i s THR 47 CO -0.00 0.00 1.57 -0.55 -0.54 0.00 0.00 174.62 175.10 1u9i s SER 48 N -4.33 6.43 -0.52 3.99 0.15 -1.26 -2.81 113.70 115.35 1u9i s SER 48 Ca 0.74 2.89 0.00 0.00 0.70 0.00 0.00 55.95 60.28 1u9i s SER 48 Cb -0.06 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.62 1u9i s SER 48 CO 0.55 -0.88 0.00 0.61 1.20 0.00 0.00 173.24 174.72 1u9i n GLY 49 N 2.29 0.76 0.10 9.45 0.00 -1.26 -4.94 105.19 111.59 1u9i n GLY 49 Ca 0.08 -0.75 0.12 0.00 0.00 0.00 0.00 46.02 45.47 1u9i n GLY 49 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1u9i h THR 50 N 0.00 0.00 0.00 2.61 1.35 -1.87 -3.48 112.91 111.52 1u9i h THR 50 Ca -0.10 -0.61 0.00 0.00 -0.55 0.00 0.00 66.41 65.15 1u9i h THR 50 Cb 0.34 1.35 0.00 0.00 -1.73 0.00 0.00 68.15 68.11 1u9i h THR 50 CO 0.15 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.03 1u9i n GLY 51 N 1.28 1.47 0.32 5.82 0.00 -1.26 -4.83 105.19 107.98 1u9i n GLY 51 Ca 0.04 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.89 1u9i n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1u9i h LYS 52 N 0.09 -0.73 -0.18 1.61 1.57 -1.92 -0.85 116.57 116.16 1u9i h LYS 52 Ca 0.00 0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.84 1u9i h LYS 52 Cb 0.00 0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 1u9i h LYS 52 CO 0.00 -0.49 0.09 1.15 -0.57 0.00 0.00 179.45 179.63 1u9i h THR 53 N -0.76 1.00 -0.65 -0.16 2.02 -1.96 -1.45 112.91 110.94 1u9i h THR 53 Ca -0.08 -0.06 0.11 0.00 0.77 0.00 0.00 66.41 67.15 1u9i h THR 53 Cb 0.58 0.79 -0.08 0.00 -1.74 0.00 0.00 68.15 67.70 1u9i h THR 53 CO 0.13 0.03 0.22 0.25 0.37 0.00 0.00 175.52 176.52 1u9i h LEU 54 N 0.19 0.17 0.26 2.58 5.85 -1.96 0.24 115.31 122.64 1u9i h LEU 54 Ca 0.07 0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.88 1u9i h LEU 54 Cb 0.02 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 1u9i h LEU 54 CO -0.05 0.09 -0.17 0.15 -0.34 0.00 0.00 178.44 178.12 1u9i h PHE 55 N 0.37 -0.44 -0.69 1.25 3.57 -0.53 0.54 116.94 121.01 1u9i h PHE 55 Ca 0.34 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.81 1u9i h PHE 55 Cb 0.48 0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.35 1u9i h PHE 55 CO -0.19 -0.27 0.31 0.66 -2.23 0.00 0.00 178.31 176.59 1u9i h SER 56 N -0.42 0.89 -0.11 0.41 4.64 -0.48 -0.70 113.55 117.78 1u9i h SER 56 Ca -0.02 -0.10 -0.05 0.00 -0.47 0.00 0.00 61.79 61.14 1u9i h SER 56 Cb 0.36 -0.23 -0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1u9i h SER 56 CO 0.02 0.77 -0.12 0.40 -0.87 0.00 0.00 176.83 177.03 1u9i h ILE 57 N 0.98 1.36 -0.80 0.95 2.04 -0.36 -2.69 117.51 118.99 1u9i h ILE 57 Ca 0.24 -1.29 0.10 0.00 1.00 0.00 0.00 64.86 64.90 1u9i h ILE 57 Cb 0.13 1.97 -0.06 0.00 -0.74 0.00 0.00 36.82 38.12 1u9i h ILE 57 CO -0.03 0.37 0.52 -0.61 0.00 0.00 0.00 178.15 178.40 1u9i h GLN 58 N -0.14 0.70 -0.97 2.37 4.15 -0.65 0.22 115.11 120.80 1u9i h GLN 58 Ca 0.02 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.40 1u9i h GLN 58 Cb 0.65 -0.16 -0.05 0.00 0.21 0.00 0.00 27.48 28.13 1u9i h GLN 58 CO 0.03 0.47 0.61 0.35 -1.93 0.00 0.00 178.83 178.36 1u9i h PHE 59 N 0.73 1.24 0.18 3.99 3.57 -0.93 0.48 116.94 126.21 1u9i h PHE 59 Ca 0.37 0.01 -0.24 0.00 3.53 0.00 0.00 57.97 61.64 1u9i h PHE 59 Cb 0.47 -0.41 0.03 0.00 2.79 0.00 0.00 35.95 38.82 1u9i h PHE 59 CO -0.00 0.80 -1.06 -0.07 -2.23 0.00 0.00 178.31 175.75 1u9i h LEU 60 N 1.32 0.61 0.51 0.59 3.38 -0.84 -3.03 115.31 117.84 1u9i h LEU 60 Ca 0.35 -0.94 -0.02 0.00 0.09 0.00 0.00 57.88 57.36 1u9i h LEU 60 Cb -0.11 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.44 1u9i h LEU 60 CO -0.07 1.51 -0.38 0.22 0.09 0.00 0.00 178.44 179.81 1u9i h TYR 61 N -0.18 -1.05 -1.01 1.13 3.20 -0.34 -1.08 116.97 117.64 1u9i h TYR 61 Ca -0.18 -0.00 0.23 0.00 3.14 0.00 0.00 58.73 61.91 1u9i h TYR 61 Cb 1.84 0.39 -0.11 0.00 1.54 0.00 0.00 36.73 40.39 1u9i h TYR 61 CO 0.17 -0.54 0.62 -0.91 -1.64 0.00 0.00 178.16 175.86 1u9i h ASN 62 N -0.86 0.64 -0.94 -2.11 4.21 -1.07 0.29 115.58 115.74 1u9i h ASN 62 Ca -0.07 0.10 0.08 0.00 1.21 0.00 0.00 56.30 57.62 1u9i h ASN 62 Cb 0.71 -0.00 -0.07 0.00 -1.12 0.00 0.00 38.32 37.84 1u9i h ASN 62 CO 0.02 0.16 0.59 1.23 -1.29 0.00 0.00 177.43 178.14 1u9i h GLY 63 N 0.58 1.45 0.63 2.83 0.00 -1.13 0.77 103.07 108.20 1u9i h GLY 63 Ca 0.60 -0.42 -0.12 0.00 0.00 0.00 0.00 47.33 47.39 1u9i h GLY 63 CO -0.38 0.26 -0.49 -2.22 0.00 0.00 0.00 176.54 173.72 1u9i h ILE 64 N 1.04 1.49 -0.18 2.60 1.08 0.69 -0.57 117.51 123.67 1u9i h ILE 64 Ca 0.42 -2.10 -0.17 0.00 -0.39 0.00 0.00 64.86 62.63 1u9i h ILE 64 Cb 0.24 2.75 -0.00 0.00 -3.07 0.00 0.00 36.82 36.74 1u9i h ILE 64 CO -0.20 0.59 -0.59 0.40 -0.69 0.00 0.00 178.15 177.67 1u9i h ILE 65 N -0.30 1.32 0.00 -0.67 1.08 -1.02 -2.11 117.51 115.81 1u9i h ILE 65 Ca -0.07 -1.85 -0.31 0.00 -0.39 0.00 0.00 64.86 62.25 1u9i h ILE 65 Cb 1.24 1.82 -0.06 0.00 -3.07 0.00 0.00 36.82 36.75 1u9i h ILE 65 CO 0.09 0.57 -1.89 -0.62 -0.69 0.00 0.00 178.15 175.62 1u9i n GLU 66 N -3.94 0.65 0.00 2.37 -0.58 0.25 -4.60 120.64 114.79 1u9i n GLU 66 Ca -0.04 0.21 0.00 0.00 -0.42 0.00 0.00 57.16 56.91 1u9i n GLU 66 Cb 0.63 -1.72 0.00 0.00 -0.57 0.00 0.00 31.44 29.78 1u9i n GLU 66 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 1u9i n PHE 67 N -2.96 0.00 -3.78 -0.32 3.01 -1.01 -5.00 117.46 107.40 1u9i n PHE 67 Ca -0.21 -0.08 -0.26 0.00 1.01 0.00 0.00 57.45 57.91 1u9i n PHE 67 Cb 1.07 -0.01 0.04 0.00 -0.01 0.00 0.00 39.48 40.58 1u9i n PHE 67 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1u9i n ASP 68 N -0.08 -3.79 -4.38 4.37 4.64 -0.79 -4.93 116.55 111.59 1u9i n ASP 68 Ca 0.00 -0.75 -0.41 0.00 -1.38 0.00 0.00 54.79 52.25 1u9i n ASP 68 Cb 0.18 -4.16 -0.11 0.00 -1.04 0.00 0.00 41.12 35.99 1u9i n ASP 68 CO 0.00 0.00 0.00 -1.61 -0.82 0.00 0.00 177.20 174.77 1u9i s GLU 69 N -6.32 2.82 0.52 -0.67 2.02 -0.25 -4.95 118.70 111.87 1u9i s GLU 69 Ca 0.42 -1.13 -0.22 0.00 0.02 0.00 0.00 54.97 54.06 1u9i s GLU 69 Cb -0.20 -3.79 -0.07 0.00 0.10 0.00 0.00 34.13 30.16 1u9i s GLU 69 CO 0.81 -0.75 1.14 -2.30 0.02 0.00 0.00 175.26 174.17 1u9i n PRO 70 N 5.02 1.40 -4.27 0.39 -0.02 -1.26 -3.36 135.00 132.90 1u9i n PRO 70 Ca -0.12 0.52 -0.18 0.00 -2.02 0.00 0.00 63.50 61.70 1u9i n PRO 70 Cb 0.46 -2.30 -0.13 0.00 -0.02 0.00 0.00 33.50 31.51 1u9i n PRO 70 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1u9i s GLY 71 N -0.92 0.67 -0.20 -1.23 0.00 -0.09 -1.33 107.32 104.22 1u9i s GLY 71 Ca 0.69 -0.75 -0.03 0.00 0.00 0.00 0.00 44.72 44.64 1u9i s GLY 71 CO 0.52 -0.74 -0.08 0.14 0.00 0.00 0.00 173.10 172.94 1u9i s VAL 72 N -0.87 3.14 -0.30 1.40 1.01 -0.59 -1.18 120.40 123.01 1u9i s VAL 72 Ca -0.01 -0.58 -0.06 0.00 0.00 0.00 0.00 61.98 61.33 1u9i s VAL 72 Cb -0.08 -2.40 0.02 0.00 0.00 0.00 0.00 36.38 33.92 1u9i s VAL 72 CO 0.01 0.46 0.07 0.12 0.00 0.00 0.00 175.10 175.76 1u9i s PHE 73 N 1.26 3.17 -0.32 5.22 5.36 0.12 -2.11 117.98 130.68 1u9i s PHE 73 Ca 0.03 -1.18 -0.16 0.00 -0.96 0.00 0.00 56.93 54.66 1u9i s PHE 73 Cb -0.14 -2.24 -0.02 0.00 -0.34 0.00 0.00 43.02 40.28 1u9i s PHE 73 CO -0.03 -0.64 0.40 0.08 -1.46 0.00 0.00 175.22 173.56 1u9i s VAL 74 N 1.45 5.14 -0.13 3.12 1.01 -0.32 0.31 120.40 130.97 1u9i s VAL 74 Ca 0.01 0.30 -0.00 0.00 0.00 0.00 0.00 61.98 62.28 1u9i s VAL 74 Cb -0.18 -3.81 -0.02 0.00 0.00 0.00 0.00 36.38 32.38 1u9i s VAL 74 CO 0.02 -0.03 -0.12 0.28 0.00 0.00 0.00 175.10 175.25 1u9i s THR 75 N 2.12 3.17 -0.29 3.92 -1.32 -0.96 -0.24 115.64 122.04 1u9i s THR 75 Ca 0.14 -0.62 0.19 0.00 -1.21 0.00 0.00 61.69 60.19 1u9i s THR 75 Cb -0.16 -2.33 -0.27 0.00 -1.51 0.00 0.00 72.50 68.22 1u9i s THR 75 CO 0.11 0.52 0.54 0.49 -2.21 0.00 0.00 174.62 174.08 1u9i n PHE 76 N 3.48 0.00 0.04 9.09 3.01 -1.19 -1.26 117.46 130.63 1u9i n PHE 76 Ca -0.18 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.28 1u9i n PHE 76 Cb 0.53 -0.31 0.00 0.00 -0.01 0.00 0.00 39.48 39.69 1u9i n PHE 76 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 1u9i n GLU 77 N -1.96 0.00 -1.51 -1.08 2.13 -1.26 -3.89 120.64 113.07 1u9i n GLU 77 Ca -0.01 0.00 -0.33 0.00 0.66 0.00 0.00 57.16 57.47 1u9i n GLU 77 Cb 0.44 -0.34 0.08 0.00 0.27 0.00 0.00 31.44 31.89 1u9i n GLU 77 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 1u9i s GLU 78 N -2.00 2.33 0.11 5.31 2.02 -1.26 -4.90 118.70 120.30 1u9i s GLU 78 Ca 0.00 1.59 -0.14 0.00 0.02 0.00 0.00 54.97 56.44 1u9i s GLU 78 Cb 0.00 -1.87 -0.06 0.00 0.10 0.00 0.00 34.13 32.29 1u9i s GLU 78 CO 0.00 -1.65 0.50 -0.08 0.02 0.00 0.00 175.26 174.05 1u9i s THR 79 N -2.19 4.91 0.49 3.63 -1.32 -1.26 -4.82 115.64 115.08 1u9i s THR 79 Ca 0.71 0.80 0.28 0.00 -1.21 0.00 0.00 61.69 62.26 1u9i s THR 79 Cb -0.25 -3.73 0.47 0.00 -1.51 0.00 0.00 72.50 67.48 1u9i s THR 79 CO 0.45 0.33 1.83 -0.65 -2.21 0.00 0.00 174.62 174.36 1u9i h PRO 80 N 3.84 0.15 -0.13 7.08 0.11 -1.97 0.12 132.00 141.20 1u9i h PRO 80 Ca -0.49 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.52 1u9i h PRO 80 Cb 1.20 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1u9i h PRO 80 CO 0.65 0.10 -0.28 1.96 -0.21 0.00 0.00 178.00 180.22 1u9i h GLN 81 N 0.15 0.41 -0.66 1.05 1.08 -1.99 -2.65 115.11 112.51 1u9i h GLN 81 Ca 0.52 -0.27 -0.01 0.00 -1.45 0.00 0.00 58.65 57.44 1u9i h GLN 81 Cb 1.77 0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 29.21 1u9i h GLN 81 CO -0.11 0.88 0.37 -0.44 -0.95 0.00 0.00 178.83 178.58 1u9i h ASP 82 N 0.00 0.82 -0.67 1.46 3.32 -1.25 0.45 116.42 120.54 1u9i h ASP 82 Ca 0.00 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.96 1u9i h ASP 82 Cb 0.87 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 40.18 1u9i h ASP 82 CO 0.06 0.67 0.43 0.40 -1.72 0.00 0.00 179.24 179.07 1u9i h ILE 83 N 0.90 1.18 0.01 0.35 2.04 -1.06 0.35 117.51 121.29 1u9i h ILE 83 Ca 0.23 -0.37 -0.24 0.00 1.00 0.00 0.00 64.86 65.48 1u9i h ILE 83 Cb 0.03 0.21 0.02 0.00 -0.74 0.00 0.00 36.82 36.34 1u9i h ILE 83 CO -0.04 0.18 -0.94 0.40 0.00 0.00 0.00 178.15 177.75 1u9i h ILE 84 N 0.92 1.32 -0.31 -0.67 2.04 -1.00 -2.70 117.51 117.11 1u9i h ILE 84 Ca 0.25 -2.22 0.01 0.00 1.00 0.00 0.00 64.86 63.90 1u9i h ILE 84 Cb -0.07 2.46 -0.02 0.00 -0.74 0.00 0.00 36.82 38.46 1u9i h ILE 84 CO -0.05 0.68 0.18 0.50 0.00 0.00 0.00 178.15 179.46 1u9i h LYS 85 N 0.25 0.37 -0.45 2.37 1.63 0.38 -2.95 116.57 118.16 1u9i h LYS 85 Ca -0.12 -0.02 -0.08 0.00 -0.85 0.00 0.00 60.65 59.57 1u9i h LYS 85 Cb 1.62 -0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 33.14 1u9i h LYS 85 CO 0.19 0.24 -0.06 -0.91 -3.45 0.00 0.00 179.45 175.45 1u9i h ASN 86 N 0.38 0.76 0.41 4.20 2.35 -0.39 -2.72 115.58 120.58 1u9i h ASN 86 Ca 0.12 -0.21 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 1u9i h ASN 86 Cb -0.01 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.15 1u9i h ASN 86 CO -0.05 0.87 0.00 0.00 -1.65 0.00 0.00 177.43 176.60 1u9i h ALA 87 N 1.21 1.00 0.00 -0.83 0.00 -1.30 -0.81 119.26 118.52 1u9i h ALA 87 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1u9i h ALA 87 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1u9i h ALA 87 CO 0.03 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.28 1u9i h ARG 88 N 0.00 0.00 -0.33 0.00 3.08 -1.45 -1.67 114.38 114.01 1u9i h ARG 88 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1u9i h ARG 88 Cb 0.21 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 1u9i h ARG 88 CO 0.00 0.00 0.21 1.03 -1.07 0.00 0.00 179.97 180.14 1u9i h SER 89 N 0.00 0.38 -0.43 7.04 0.87 -1.31 -1.33 113.55 118.77 1u9i h SER 89 Ca 0.00 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1u9i h SER 89 Cb 0.29 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.16 1u9i h SER 89 CO 0.00 0.28 0.00 0.49 -0.53 0.00 0.00 176.83 177.07 1u9i n PHE 90 N -4.48 1.40 -2.24 2.24 3.01 -0.67 -4.79 117.46 111.94 1u9i n PHE 90 Ca 0.02 -0.77 -0.14 0.00 1.01 0.00 0.00 57.45 57.57 1u9i n PHE 90 Cb 0.07 -0.36 -0.01 0.00 -0.01 0.00 0.00 39.48 39.17 1u9i n PHE 90 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1u9i n GLY 91 N 0.17 -0.15 3.66 1.37 0.00 -0.50 -4.77 105.19 104.97 1u9i n GLY 91 Ca 0.24 -0.28 -0.35 0.00 0.00 0.00 0.00 46.02 45.63 1u9i n GLY 91 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1u9i s TRP 92 N -2.71 3.17 -0.78 1.61 0.51 -0.99 -5.00 118.94 114.75 1u9i s TRP 92 Ca 0.00 0.12 -0.04 0.00 -2.12 0.00 0.00 56.10 54.06 1u9i s TRP 92 Cb 0.00 -1.85 0.20 0.00 -0.81 0.00 0.00 33.47 31.00 1u9i s TRP 92 CO 0.00 0.37 0.64 0.34 -0.51 0.00 0.00 176.95 177.78 1u9i s ASP 93 N -0.55 5.77 0.24 2.95 2.15 -1.26 -3.75 116.67 122.21 1u9i s ASP 93 Ca 0.09 -3.24 -0.05 0.00 0.43 0.00 0.00 52.55 49.79 1u9i s ASP 93 Cb -0.12 -1.92 0.25 0.00 -0.30 0.00 0.00 42.92 40.83 1u9i s ASP 93 CO 0.02 -0.31 1.75 -0.07 -0.17 0.00 0.00 175.17 176.39 1u9i h LEU 94 N 6.65 0.90 -0.83 -1.34 3.38 -1.94 -2.65 115.31 119.48 1u9i h LEU 94 Ca 0.08 -0.20 0.17 0.00 0.09 0.00 0.00 57.88 58.02 1u9i h LEU 94 Cb 0.90 -0.24 -0.11 0.00 0.09 0.00 0.00 40.66 41.31 1u9i h LEU 94 CO 0.78 0.91 0.37 0.00 0.09 0.00 0.00 178.44 180.59 1u9i h ALA 95 N 1.19 1.24 -0.26 1.53 0.00 -1.90 0.30 119.26 121.37 1u9i h ALA 95 Ca 0.18 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 1u9i h ALA 95 Cb 0.40 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1u9i h ALA 95 CO 0.01 -0.22 0.12 -0.22 0.00 0.00 0.00 179.25 178.94 1u9i h LYS 96 N 0.48 0.37 -0.07 0.00 3.64 -1.89 -2.43 116.57 116.67 1u9i h LYS 96 Ca 0.48 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.77 1u9i h LYS 96 Cb 0.78 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.53 1u9i h LYS 96 CO -0.44 0.37 -0.11 -0.07 -2.27 0.00 0.00 179.45 176.93 1u9i h LEU 97 N 0.28 0.10 -0.75 5.20 3.38 -0.76 -1.67 115.31 121.09 1u9i h LEU 97 Ca 0.09 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.91 1u9i h LEU 97 Cb 0.13 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1u9i h LEU 97 CO -0.01 0.22 -0.47 0.58 0.09 0.00 0.00 178.44 178.85 1u9i h VAL 98 N 0.10 1.33 0.22 1.22 2.07 -0.13 -0.23 116.25 120.83 1u9i h VAL 98 Ca 0.02 -1.68 -0.01 0.00 0.82 0.00 0.00 66.70 65.85 1u9i h VAL 98 Cb 0.26 1.73 0.00 0.00 -1.52 0.00 0.00 31.29 31.77 1u9i h VAL 98 CO 0.02 0.51 -0.11 0.44 0.02 0.00 0.00 177.57 178.45 1u9i h ASP 99 N 0.30 -0.25 0.00 0.57 3.32 -0.92 -2.64 116.42 116.80 1u9i h ASP 99 Ca 0.02 -0.25 0.00 0.00 0.02 0.00 0.00 57.03 56.81 1u9i h ASP 99 Cb 0.94 0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.56 1u9i h ASP 99 CO 0.08 0.16 0.00 -0.62 -1.72 0.00 0.00 179.24 177.14 1u9i n GLU 100 N -5.04 0.00 -1.67 3.56 1.02 -0.70 -4.80 120.64 113.01 1u9i n GLU 100 Ca -0.09 0.45 -0.05 0.00 -0.02 0.00 0.00 57.16 57.45 1u9i n GLU 100 Cb 0.25 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.16 1u9i n GLU 100 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1u9i n GLY 101 N -1.45 0.43 0.08 0.62 0.00 -0.95 -4.93 105.19 99.00 1u9i n GLY 101 Ca 0.00 -0.76 -0.04 0.00 0.00 0.00 0.00 46.02 45.22 1u9i n GLY 101 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1u9i n LYS 102 N -2.08 0.65 -4.75 1.61 4.76 -0.14 -4.90 118.16 113.31 1u9i n LYS 102 Ca -0.05 0.11 -0.25 0.00 -2.87 0.00 0.00 58.31 55.24 1u9i n LYS 102 Cb 0.37 -1.67 -0.16 0.00 -1.84 0.00 0.00 35.03 31.73 1u9i n LYS 102 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1u9i s LEU 103 N -5.58 1.87 -0.14 -0.35 2.96 -0.95 -0.92 118.68 115.56 1u9i s LEU 103 Ca -0.06 -0.33 -0.00 0.00 -0.22 0.00 0.00 54.13 53.52 1u9i s LEU 103 Cb 0.08 -0.90 0.03 0.00 0.50 0.00 0.00 46.19 45.90 1u9i s LEU 103 CO 0.83 0.13 -0.09 0.12 -1.32 0.00 0.00 176.35 176.02 1u9i s PHE 104 N 0.15 1.80 -0.28 5.38 5.36 -0.33 -4.04 117.98 126.01 1u9i s PHE 104 Ca -0.05 -1.01 -0.17 0.00 -0.96 0.00 0.00 56.93 54.73 1u9i s PHE 104 Cb -0.12 -1.38 -0.02 0.00 -0.34 0.00 0.00 43.02 41.15 1u9i s PHE 104 CO 0.02 -0.60 0.48 0.42 -1.46 0.00 0.00 175.22 174.09 1u9i s ILE 105 N 1.61 5.08 -0.56 3.12 1.01 -1.26 -0.70 121.20 129.49 1u9i s ILE 105 Ca 0.04 0.69 -0.19 0.00 0.00 0.00 0.00 60.65 61.18 1u9i s ILE 105 Cb -0.13 -3.83 0.08 0.00 0.01 0.00 0.00 42.46 38.58 1u9i s ILE 105 CO -0.09 0.03 0.70 -0.22 0.00 0.00 0.00 174.94 175.36 1u9i s LEU 106 N 2.28 5.10 -0.37 2.97 2.96 0.15 -4.94 118.68 126.83 1u9i s LEU 106 Ca 0.19 -1.16 -0.29 0.00 -0.22 0.00 0.00 54.13 52.65 1u9i s LEU 106 Cb -0.16 -2.38 -0.00 0.00 0.50 0.00 0.00 46.19 44.15 1u9i s LEU 106 CO 0.10 -1.06 1.60 -0.62 -1.32 0.00 0.00 176.35 175.05 1u9i s ASP 107 N 3.25 6.14 0.00 3.68 -1.08 -1.26 -2.25 116.67 125.14 1u9i s ASP 107 Ca 0.14 1.08 0.01 0.00 -0.52 0.00 0.00 52.55 53.26 1u9i s ASP 107 Cb -0.21 -2.53 0.02 0.00 -1.46 0.00 0.00 42.92 38.73 1u9i s ASP 107 CO 0.09 -1.55 0.77 0.00 0.52 0.00 0.00 175.17 175.00 1u9i n ALA 108 N 9.47 2.26 -1.47 3.66 0.00 -0.39 -4.98 120.51 129.06 1u9i n ALA 108 Ca 0.20 -0.75 -0.33 0.00 0.00 0.00 0.00 53.44 52.55 1u9i n ALA 108 Cb 0.47 -0.03 0.06 0.00 0.00 0.00 0.00 19.45 19.95 1u9i n ALA 108 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1u9i s SER 109 N -0.52 4.92 0.78 0.00 1.04 -0.97 -4.73 113.70 114.21 1u9i s SER 109 Ca 0.01 2.05 -0.11 0.00 0.48 0.00 0.00 55.95 58.38 1u9i s SER 109 Cb 0.01 -2.56 0.06 0.00 0.10 0.00 0.00 66.02 63.64 1u9i s SER 109 CO 0.01 -1.76 1.14 -2.84 0.98 0.00 0.00 173.24 170.78 1u9i s PRO 110 N -4.10 2.19 0.04 4.02 0.02 -1.26 -5.03 135.00 130.88 1u9i s PRO 110 Ca 0.68 0.16 0.02 0.00 0.02 0.00 0.00 61.00 61.87 1u9i s PRO 110 Cb -0.22 -1.99 -0.04 0.00 0.02 0.00 0.00 34.50 32.28 1u9i s PRO 110 CO 0.43 -1.43 0.05 0.34 -0.33 0.00 0.00 177.00 176.06 1u9i s ASP 111 N -4.52 5.44 0.00 2.53 2.15 -1.26 -4.99 116.67 116.01 1u9i s ASP 111 Ca 0.61 0.02 -0.01 0.00 0.43 0.00 0.00 52.55 53.60 1u9i s ASP 111 Cb -0.11 -1.47 -0.04 0.00 -0.30 0.00 0.00 42.92 41.01 1u9i s ASP 111 CO 0.49 0.23 1.08 -2.65 -0.17 0.00 0.00 175.17 174.15 1u9i n PRO 112 N 0.89 0.51 0.00 4.34 -0.02 -1.26 -2.33 135.00 137.13 1u9i n PRO 112 Ca -0.11 -0.14 0.00 0.00 -2.02 0.00 0.00 63.50 61.23 1u9i n PRO 112 Cb 0.52 -1.45 0.00 0.00 -0.02 0.00 0.00 33.50 32.55 1u9i n PRO 112 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1u9i n GLU 113 N 2.19 0.00 0.00 -0.52 -0.58 -1.26 -5.16 120.64 115.31 1u9i n GLU 113 Ca 0.06 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.80 1u9i n GLU 113 Cb 0.24 -0.01 0.00 0.00 -0.57 0.00 0.00 31.44 31.10 1u9i n GLU 113 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1u9i n GLY 114 N 1.05 0.00 0.00 0.62 0.00 -0.98 -5.07 105.19 100.80 1u9i n GLY 114 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1u9i n GLY 114 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u9i n GLN 115 N -0.01 0.00 -3.64 1.61 10.64 -1.26 -5.14 117.38 119.58 1u9i n GLN 115 Ca 0.00 0.00 -0.08 0.00 -1.83 0.00 0.00 57.00 55.09 1u9i n GLN 115 Cb 0.00 0.00 -0.07 0.00 -0.86 0.00 0.00 30.24 29.31 1u9i n GLN 115 CO 0.00 0.00 0.00 -2.00 -1.83 0.00 0.00 177.06 173.23 1u9i s GLU 116 N 2.93 0.62 0.00 2.61 -6.30 -1.26 -5.13 118.70 112.16 1u9i s GLU 116 Ca 0.00 0.88 0.00 0.00 -2.50 0.00 0.00 54.97 53.35 1u9i s GLU 116 Cb 0.00 0.22 0.00 0.00 0.00 0.00 0.00 34.13 34.35 1u9i s GLU 116 CO 0.00 -0.10 0.00 0.28 0.02 0.00 0.00 175.26 175.46 1u9i n VAL 117 N 3.24 -1.39 0.00 3.70 0.31 -1.26 -5.10 118.33 117.83 1u9i n VAL 117 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 1u9i n VAL 117 Cb 0.57 -1.59 0.00 0.00 -0.91 0.00 0.00 33.84 31.91 1u9i n VAL 117 CO 0.00 0.00 0.00 0.55 -1.32 0.00 0.00 176.83 176.06 1u9i n VAL 118 N 0.92 0.00 0.21 2.52 3.14 -1.26 -5.02 118.33 118.84 1u9i n VAL 118 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 1u9i n VAL 118 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 1u9i n VAL 118 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1u9i n GLY 119 N 0.00 -0.09 0.69 7.55 0.00 -1.26 -2.84 105.19 109.23 1u9i n GLY 119 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 1u9i n GLY 119 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u9i n GLY 120 N -0.36 -0.09 0.26 -0.02 0.00 -1.26 -4.33 105.19 99.40 1u9i n GLY 120 Ca 0.00 -0.01 0.07 0.00 0.00 0.00 0.00 46.02 46.09 1u9i n GLY 120 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1u9i h PHE 121 N -0.02 0.05 -0.19 1.61 0.05 -2.00 0.69 116.94 117.13 1u9i h PHE 121 Ca 0.00 0.00 -0.02 0.00 3.82 0.00 0.00 57.97 61.77 1u9i h PHE 121 Cb 0.02 -0.02 -0.01 0.00 2.00 0.00 0.00 35.95 37.94 1u9i h PHE 121 CO -0.01 0.04 0.02 0.38 -0.18 0.00 0.00 178.31 178.56 1u9i h ASP 122 N 0.06 0.25 0.39 2.17 -0.00 -1.80 2.96 116.42 120.44 1u9i h ASP 122 Ca 0.02 -0.03 -0.02 0.00 -0.00 0.00 0.00 57.03 57.00 1u9i h ASP 122 Cb 0.00 -0.06 -0.00 0.00 -0.00 0.00 0.00 39.33 39.27 1u9i h ASP 122 CO -0.00 0.28 -0.09 0.25 -0.00 0.00 0.00 179.24 179.67 1u9i h LEU 123 N 0.27 0.00 0.00 0.15 7.12 0.21 3.49 115.31 126.56 1u9i h LEU 123 Ca 0.07 0.00 -0.36 0.00 0.13 0.00 0.00 57.88 57.71 1u9i h LEU 123 Cb 0.15 0.00 -0.07 0.00 -0.53 0.00 0.00 40.66 40.22 1u9i h LEU 123 CO 0.00 0.09 -2.29 -1.20 -0.13 0.00 0.00 178.44 174.91 1u9i n SER 124 N -3.53 0.52 -0.08 1.25 7.64 0.16 -2.98 113.62 116.60 1u9i n SER 124 Ca -0.02 0.05 -0.14 0.00 1.01 0.00 0.00 58.87 59.77 1u9i n SER 124 Cb 0.23 0.55 -0.05 0.00 -1.01 0.00 0.00 64.21 63.93 1u9i n SER 124 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1u9i h ALA 125 N 0.81 0.39 -0.30 -0.43 0.00 0.61 -1.80 119.26 118.53 1u9i h ALA 125 Ca -0.51 -0.44 -0.03 0.00 0.00 0.00 0.00 54.91 53.93 1u9i h ALA 125 Cb 2.15 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.86 1u9i h ALA 125 CO 0.02 0.47 0.08 1.25 0.00 0.00 0.00 179.25 181.07 1u9i h LEU 126 N 0.43 0.45 -0.03 0.00 5.85 0.63 0.22 115.31 122.87 1u9i h LEU 126 Ca 0.02 -0.23 0.03 0.00 0.84 0.00 0.00 57.88 58.55 1u9i h LEU 126 Cb 0.97 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.85 1u9i h LEU 126 CO 0.09 0.56 -0.15 0.40 -0.34 0.00 0.00 178.44 179.00 1u9i h ILE 127 N 0.32 0.62 -0.14 4.05 1.08 -1.49 0.29 117.51 122.24 1u9i h ILE 127 Ca 0.09 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.54 1u9i h ILE 127 Cb 0.28 0.62 -0.01 0.00 -3.07 0.00 0.00 36.82 34.64 1u9i h ILE 127 CO 0.00 0.00 -0.05 -0.33 -0.69 0.00 0.00 178.15 177.08 1u9i h GLU 128 N -0.24 0.20 0.57 2.37 5.08 -1.08 -1.50 114.58 119.99 1u9i h GLU 128 Ca 0.06 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 1u9i h GLU 128 Cb 0.32 -0.03 0.01 0.00 0.50 0.00 0.00 28.75 29.54 1u9i h GLU 128 CO -0.17 0.27 -0.27 0.00 -1.00 0.00 0.00 179.01 177.84 1u9i h ARG 129 N 0.20 -0.73 -0.87 2.33 3.08 0.98 -2.76 114.38 116.60 1u9i h ARG 129 Ca 0.05 0.05 0.11 0.00 0.07 0.00 0.00 59.98 60.25 1u9i h ARG 129 Cb 0.23 0.17 -0.06 0.00 0.08 0.00 0.00 29.97 30.38 1u9i h ARG 129 CO 0.01 -0.43 0.56 0.82 -1.07 0.00 0.00 179.97 179.87 1u9i h ILE 130 N -1.02 0.94 0.00 2.04 2.04 -0.32 0.19 117.51 121.38 1u9i h ILE 130 Ca -0.08 -0.28 -0.06 0.00 1.00 0.00 0.00 64.86 65.44 1u9i h ILE 130 Cb 0.65 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 1u9i h ILE 130 CO 0.13 0.15 -0.29 -1.13 0.00 0.00 0.00 178.15 177.01 1u9i h ASN 131 N 0.81 0.00 0.28 1.72 -1.24 -1.26 0.28 115.58 116.17 1u9i h ASN 131 Ca 0.41 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 57.40 1u9i h ASN 131 Cb 0.47 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.53 1u9i h ASN 131 CO -0.17 0.29 -0.13 0.22 -1.29 0.00 0.00 177.43 176.34 1u9i h TYR 132 N 0.00 -0.35 -0.29 0.67 3.20 -0.68 -1.95 116.97 117.58 1u9i h TYR 132 Ca -0.00 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.91 1u9i h TYR 132 Cb 0.53 0.12 -0.05 0.00 1.54 0.00 0.00 36.73 38.87 1u9i h TYR 132 CO 0.00 0.01 -0.00 0.00 -1.64 0.00 0.00 178.16 176.53 1u9i h ALA 133 N -0.32 0.25 -0.63 1.82 0.00 -1.10 0.48 119.26 119.75 1u9i h ALA 133 Ca -0.04 0.08 0.07 0.00 0.00 0.00 0.00 54.91 55.02 1u9i h ALA 133 Cb 0.51 0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.38 1u9i h ALA 133 CO 0.06 -0.41 0.32 0.82 0.00 0.00 0.00 179.25 180.04 1u9i h ILE 134 N 0.08 0.90 -0.23 0.00 1.08 -0.98 0.21 117.51 118.56 1u9i h ILE 134 Ca 0.14 -0.20 -0.13 0.00 -0.39 0.00 0.00 64.86 64.28 1u9i h ILE 134 Cb 0.18 0.27 -0.00 0.00 -3.07 0.00 0.00 36.82 34.20 1u9i h ILE 134 CO -0.23 0.10 -0.35 1.56 -0.69 0.00 0.00 178.15 178.54 1u9i h GLN 135 N 0.57 0.65 -0.60 2.37 4.20 -0.65 0.94 115.11 122.60 1u9i h GLN 135 Ca 0.30 -0.39 -0.02 0.00 0.06 0.00 0.00 58.65 58.60 1u9i h GLN 135 Cb 0.26 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.04 1u9i h GLN 135 CO -0.22 1.00 0.31 -0.22 -0.67 0.00 0.00 178.83 179.03 1u9i h LYS 136 N 0.36 0.85 -0.17 1.46 3.64 0.59 -3.02 116.57 120.28 1u9i h LYS 136 Ca 0.02 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1u9i h LYS 136 Cb 0.94 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 1u9i h LYS 136 CO 0.08 0.67 0.00 0.66 -2.27 0.00 0.00 179.45 178.59 1u9i n TYR 137 N -4.55 0.20 -3.67 1.91 4.02 0.69 -4.94 117.16 110.82 1u9i n TYR 137 Ca 0.04 -0.10 -0.21 0.00 -0.01 0.00 0.00 57.90 57.61 1u9i n TYR 137 Cb 0.11 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.47 1u9i n TYR 137 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1u9i n ARG 138 N 1.11 -5.35 -2.38 -0.72 1.74 0.15 -4.75 116.66 106.46 1u9i n ARG 138 Ca 0.17 0.66 -0.36 0.00 -0.77 0.00 0.00 57.85 57.55 1u9i n ARG 138 Cb 0.53 -5.34 -0.02 0.00 -1.02 0.00 0.00 32.46 26.61 1u9i n ARG 138 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1u9i s ALA 139 N -3.58 2.97 0.00 7.54 0.00 -0.15 -4.38 121.76 124.16 1u9i s ALA 139 Ca 0.08 0.82 0.00 0.00 0.00 0.00 0.00 51.96 52.86 1u9i s ALA 139 Cb -0.04 -3.33 0.00 0.00 0.00 0.00 0.00 23.12 19.75 1u9i s ALA 139 CO 0.80 -0.50 0.00 0.54 0.00 0.00 0.00 175.76 176.60 1u9i n ARG 140 N -0.49 2.87 -5.07 0.00 5.12 -0.44 -4.94 116.66 113.71 1u9i n ARG 140 Ca 0.07 0.00 -0.31 0.00 -1.93 0.00 0.00 57.85 55.69 1u9i n ARG 140 Cb 0.49 -0.98 -0.15 0.00 -1.16 0.00 0.00 32.46 30.66 1u9i n ARG 140 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 1u9i s ARG 141 N -1.96 1.99 -0.01 5.56 0.52 -1.17 -2.67 118.95 121.21 1u9i s ARG 141 Ca 0.00 -1.00 -0.00 0.00 -0.52 0.00 0.00 55.73 54.21 1u9i s ARG 141 Cb 0.00 -2.04 0.01 0.00 0.52 0.00 0.00 34.95 33.44 1u9i s ARG 141 CO 0.00 0.54 0.02 0.08 0.02 0.00 0.00 175.30 175.96 1u9i s VAL 142 N -0.72 -0.03 -0.05 3.52 1.01 -0.66 -1.54 120.40 121.92 1u9i s VAL 142 Ca 0.11 0.11 -0.01 0.00 0.00 0.00 0.00 61.98 62.19 1u9i s VAL 142 Cb -0.10 -0.05 0.03 0.00 0.00 0.00 0.00 36.38 36.26 1u9i s VAL 142 CO 0.01 0.04 0.00 -0.94 0.00 0.00 0.00 175.10 174.21 1u9i s SER 143 N 0.53 1.06 -0.39 3.32 1.04 -0.90 -0.10 113.70 118.27 1u9i s SER 143 Ca -0.04 -0.05 -0.13 0.00 0.48 0.00 0.00 55.95 56.21 1u9i s SER 143 Cb -0.06 -0.33 0.02 0.00 0.10 0.00 0.00 66.02 65.75 1u9i s SER 143 CO -0.01 -0.15 0.25 -0.63 0.98 0.00 0.00 173.24 173.67 1u9i s ILE 144 N 1.54 4.90 -0.31 -1.02 1.01 -0.21 -1.17 121.20 125.93 1u9i s ILE 144 Ca -0.02 -0.75 -0.22 0.00 0.00 0.00 0.00 60.65 59.65 1u9i s ILE 144 Cb -0.13 -3.73 -0.00 0.00 0.01 0.00 0.00 42.46 38.61 1u9i s ILE 144 CO -0.03 -0.26 0.74 -0.62 0.00 0.00 0.00 174.94 174.77 1u9i s ASP 145 N 1.62 6.61 -0.72 3.58 3.68 0.67 -1.59 116.67 130.51 1u9i s ASP 145 Ca 0.03 0.58 -0.00 0.00 2.13 0.00 0.00 52.55 55.29 1u9i s ASP 145 Cb -0.19 -2.38 -0.00 0.00 -1.45 0.00 0.00 42.92 38.89 1u9i s ASP 145 CO 0.08 -0.58 0.68 -1.54 0.13 0.00 0.00 175.17 173.95 1u9i n SER 146 N 6.11 -7.45 0.18 -0.34 3.41 -1.23 -3.14 113.62 111.16 1u9i n SER 146 Ca 0.02 -0.11 0.03 0.00 -0.26 0.00 0.00 58.87 58.56 1u9i n SER 146 Cb 0.48 -5.10 0.31 0.00 -0.26 0.00 0.00 64.21 59.65 1u9i n SER 146 CO 0.00 0.00 0.00 -0.37 -0.16 0.00 0.00 175.04 174.51 1u9i h VAL 147 N 0.34 1.13 -0.67 -3.33 -1.51 -1.73 -3.09 116.25 107.39 1u9i h VAL 147 Ca -0.04 -1.59 0.13 0.00 -1.23 0.00 0.00 66.70 63.97 1u9i h VAL 147 Cb 1.02 1.90 -0.13 0.00 -2.13 0.00 0.00 31.29 31.96 1u9i h VAL 147 CO 0.29 0.43 -0.22 0.74 -1.23 0.00 0.00 177.57 177.58 1u9i h THR 148 N 0.00 0.26 -0.01 7.19 2.02 -1.92 0.31 112.91 120.77 1u9i h THR 148 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1u9i h THR 148 Cb 0.87 0.26 -0.00 0.00 -1.74 0.00 0.00 68.15 67.54 1u9i h THR 148 CO 0.06 0.00 0.03 0.77 0.37 0.00 0.00 175.52 176.75 1u9i h SER 149 N -0.05 0.00 0.57 4.18 4.64 -1.92 -2.89 113.55 118.08 1u9i h SER 149 Ca 0.31 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.60 1u9i h SER 149 Cb 0.52 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.62 1u9i h SER 149 CO -0.71 0.00 -0.27 1.62 -0.87 0.00 0.00 176.83 176.60 1u9i h VAL 150 N 0.00 0.19 -0.11 0.95 3.04 -1.09 -2.89 116.25 116.34 1u9i h VAL 150 Ca 0.00 -0.41 0.00 0.00 -1.01 0.00 0.00 66.70 65.28 1u9i h VAL 150 Cb 0.07 0.27 0.00 0.00 -2.01 0.00 0.00 31.29 29.62 1u9i h VAL 150 CO -0.00 0.03 0.00 2.22 -1.01 0.00 0.00 177.57 178.81 1u9i n PHE 151 N -5.30 0.25 0.25 3.17 1.16 -1.21 -3.61 117.46 112.17 1u9i n PHE 151 Ca -0.11 -0.10 -0.05 0.00 -1.87 0.00 0.00 57.45 55.32 1u9i n PHE 151 Cb 0.33 -0.08 0.03 0.00 -1.61 0.00 0.00 39.48 38.14 1u9i n PHE 151 CO 0.00 0.00 0.00 1.04 -1.87 0.00 0.00 176.76 175.93 1u9i n GLN 152 N -0.02 1.26 -0.11 3.97 1.13 -1.09 -3.38 117.38 119.13 1u9i n GLN 152 Ca 0.04 -0.58 -0.13 0.00 -1.94 0.00 0.00 57.00 54.39 1u9i n GLN 152 Cb 0.25 -1.23 -0.14 0.00 0.11 0.00 0.00 30.24 29.23 1u9i n GLN 152 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 1u9i n GLN 153 N 0.42 0.71 0.00 -1.09 6.02 -1.24 -4.95 117.38 117.25 1u9i n GLN 153 Ca 0.11 0.06 0.00 0.00 -0.01 0.00 0.00 57.00 57.16 1u9i n GLN 153 Cb 0.67 -1.51 0.00 0.00 1.02 0.00 0.00 30.24 30.42 1u9i n GLN 153 CO 0.00 0.00 0.00 2.48 -1.01 0.00 0.00 177.06 178.53 1u9i n TYR 154 N -2.94 0.00 -4.46 1.08 0.18 -1.23 -5.03 117.16 104.76 1u9i n TYR 154 Ca -0.38 0.00 -0.24 0.00 1.88 0.00 0.00 57.90 59.16 1u9i n TYR 154 Cb 1.08 0.00 -0.10 0.00 -0.38 0.00 0.00 39.34 39.94 1u9i n TYR 154 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 1u9i s ASP 155 N 0.00 3.69 0.22 9.48 1.01 -1.22 -5.15 116.67 124.70 1u9i s ASP 155 Ca 0.00 -1.01 0.06 0.00 0.71 0.00 0.00 52.55 52.32 1u9i s ASP 155 Cb 0.00 -0.35 -0.04 0.00 1.01 0.00 0.00 42.92 43.54 1u9i s ASP 155 CO 0.00 0.01 0.16 0.00 0.21 0.00 0.00 175.17 175.55 1u9i s ALA 156 N -2.50 3.55 0.39 5.23 0.00 -1.26 -4.99 121.76 122.17 1u9i s ALA 156 Ca 0.30 -1.35 0.23 0.00 0.00 0.00 0.00 51.96 51.14 1u9i s ALA 156 Cb -0.04 -1.29 1.32 0.00 0.00 0.00 0.00 23.12 23.11 1u9i s ALA 156 CO 0.16 0.36 1.61 0.66 0.00 0.00 0.00 175.76 178.55 1u9i h SER 157 N 1.91 0.34 -0.32 0.00 4.64 -2.00 -0.11 113.55 118.00 1u9i h SER 157 Ca -0.48 0.20 -0.08 0.00 -0.47 0.00 0.00 61.79 60.96 1u9i h SER 157 Cb 1.22 0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 63.49 1u9i h SER 157 CO 0.61 -0.28 -0.10 0.77 -0.87 0.00 0.00 176.83 176.97 1u9i h SER 158 N 0.10 0.64 -0.12 4.97 4.64 -1.95 -2.51 113.55 119.32 1u9i h SER 158 Ca 0.82 -0.38 -0.08 0.00 -0.47 0.00 0.00 61.79 61.68 1u9i h SER 158 Cb 2.25 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 64.15 1u9i h SER 158 CO -0.60 0.87 -0.16 0.58 -0.87 0.00 0.00 176.83 176.65 1u9i h VAL 159 N 0.40 1.24 -0.11 0.95 2.07 -1.43 -3.04 116.25 116.34 1u9i h VAL 159 Ca 0.08 -1.10 -0.02 0.00 0.82 0.00 0.00 66.70 66.48 1u9i h VAL 159 Cb 0.60 1.20 -0.00 0.00 -1.52 0.00 0.00 31.29 31.57 1u9i h VAL 159 CO 0.04 0.36 -0.01 0.58 0.02 0.00 0.00 177.57 178.55 1u9i h VAL 160 N 0.46 1.27 -0.91 2.57 2.07 -1.39 -2.84 116.25 117.49 1u9i h VAL 160 Ca 0.08 -0.89 0.10 0.00 0.82 0.00 0.00 66.70 66.81 1u9i h VAL 160 Cb 0.55 1.65 -0.07 0.00 -1.52 0.00 0.00 31.29 31.91 1u9i h VAL 160 CO 0.04 0.25 0.59 -0.09 0.02 0.00 0.00 177.57 178.37 1u9i h ARG 161 N -0.10 0.87 0.22 1.57 2.43 -1.34 -1.01 114.38 117.01 1u9i h ARG 161 Ca 0.03 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 1u9i h ARG 161 Cb 0.40 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.75 1u9i h ARG 161 CO 0.01 0.58 -0.10 0.00 -1.51 0.00 0.00 179.97 178.94 1u9i h ARG 162 N 0.90 -0.28 -0.35 0.20 3.08 -1.50 -2.14 114.38 114.29 1u9i h ARG 162 Ca 0.43 0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.56 1u9i h ARG 162 Cb 0.43 0.06 -0.06 0.00 0.08 0.00 0.00 29.97 30.48 1u9i h ARG 162 CO -0.19 0.05 0.00 0.93 -1.07 0.00 0.00 179.97 179.70 1u9i h GLU 163 N -0.65 0.10 0.94 0.04 4.39 -1.23 0.14 114.58 118.30 1u9i h GLU 163 Ca -0.03 -0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.62 1u9i h GLU 163 Cb 0.47 -0.02 0.01 0.00 -0.10 0.00 0.00 28.75 29.10 1u9i h GLU 163 CO 0.05 0.07 -0.49 -0.07 -1.16 0.00 0.00 179.01 177.41 1u9i h LEU 164 N 0.10 -1.18 -0.91 1.33 3.38 -1.25 -0.84 115.31 115.94 1u9i h LEU 164 Ca 0.17 0.05 0.26 0.00 0.09 0.00 0.00 57.88 58.45 1u9i h LEU 164 Cb 0.23 0.32 -0.14 0.00 0.09 0.00 0.00 40.66 41.16 1u9i h LEU 164 CO -0.28 -0.80 0.32 0.15 0.09 0.00 0.00 178.44 177.92 1u9i h PHE 165 N -1.31 0.50 0.95 1.13 3.57 -1.14 0.25 116.94 120.89 1u9i h PHE 165 Ca -0.13 0.05 -0.05 0.00 3.53 0.00 0.00 57.97 61.37 1u9i h PHE 165 Cb 1.02 -0.07 0.01 0.00 2.79 0.00 0.00 35.95 39.69 1u9i h PHE 165 CO -0.03 -0.20 -0.48 -0.09 -2.23 0.00 0.00 178.31 175.28 1u9i h ARG 166 N 0.24 -1.25 -0.20 1.11 2.43 -0.31 -0.07 114.38 116.33 1u9i h ARG 166 Ca 0.60 0.09 0.05 0.00 -0.81 0.00 0.00 59.98 59.90 1u9i h ARG 166 Cb 1.25 0.28 -0.07 0.00 -0.42 0.00 0.00 29.97 31.01 1u9i h ARG 166 CO -0.64 -0.83 -0.43 1.25 -1.51 0.00 0.00 179.97 177.80 1u9i h LEU 167 N -1.30 -1.37 -0.06 3.80 5.85 0.49 -1.09 115.31 121.64 1u9i h LEU 167 Ca -0.13 0.19 0.03 0.00 0.84 0.00 0.00 57.88 58.80 1u9i h LEU 167 Cb 1.00 0.57 -0.06 0.00 0.37 0.00 0.00 40.66 42.54 1u9i h LEU 167 CO 0.20 -0.41 -0.53 0.58 -0.34 0.00 0.00 178.44 177.93 1u9i h VAL 168 N -0.45 0.01 -0.71 1.05 2.07 -0.61 -1.72 116.25 115.89 1u9i h VAL 168 Ca 0.09 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.75 1u9i h VAL 168 Cb 0.62 0.01 -0.13 0.00 -1.52 0.00 0.00 31.29 30.26 1u9i h VAL 168 CO -0.45 0.00 -0.17 0.00 0.02 0.00 0.00 177.57 176.98 1u9i h ALA 169 N -0.33 0.49 -0.52 1.67 0.00 -0.40 -0.67 119.26 119.50 1u9i h ALA 169 Ca 0.02 0.27 -0.04 0.00 0.00 0.00 0.00 54.91 55.17 1u9i h ALA 169 Cb 0.70 0.53 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 1u9i h ALA 169 CO -0.39 -0.42 0.18 0.00 0.00 0.00 0.00 179.25 178.62 1u9i h ARG 170 N 0.01 0.80 -0.84 0.00 2.47 -0.94 -1.71 114.38 114.17 1u9i h ARG 170 Ca 0.34 -0.16 0.05 0.00 -1.26 0.00 0.00 59.98 58.95 1u9i h ARG 170 Cb 0.53 -0.12 -0.05 0.00 -1.65 0.00 0.00 29.97 28.68 1u9i h ARG 170 CO -0.73 0.73 0.55 -0.07 0.56 0.00 0.00 179.97 181.01 1u9i h LEU 171 N 0.71 0.84 -0.26 3.04 3.38 -0.28 -0.28 115.31 122.46 1u9i h LEU 171 Ca 0.17 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.10 1u9i h LEU 171 Cb 0.25 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1u9i h LEU 171 CO -0.01 0.56 0.00 0.50 0.09 0.00 0.00 178.44 179.58 1u9i h LYS 172 N 0.96 0.45 -0.03 1.13 3.64 -0.74 -2.03 116.57 119.95 1u9i h LYS 172 Ca 0.35 -0.14 0.02 0.00 -1.27 0.00 0.00 60.65 59.61 1u9i h LYS 172 Cb 0.15 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.90 1u9i h LYS 172 CO -0.12 0.62 -0.12 1.96 -2.27 0.00 0.00 179.45 179.51 1u9i h GLN 173 N 0.23 -0.19 0.00 1.90 4.20 -0.40 0.86 115.11 121.71 1u9i h GLN 173 Ca 0.07 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.80 1u9i h GLN 173 Cb 0.41 0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.23 1u9i h GLN 173 CO 0.01 -0.12 0.16 0.82 -0.67 0.00 0.00 178.83 179.03 1u9i h ILE 174 N -0.19 0.00 0.00 2.54 1.08 -0.91 -3.45 117.51 116.58 1u9i h ILE 174 Ca 0.05 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.52 1u9i h ILE 174 Cb 0.27 0.77 0.00 0.00 -3.07 0.00 0.00 36.82 34.79 1u9i h ILE 174 CO -0.15 0.00 0.00 0.61 -0.69 0.00 0.00 178.15 177.92 1u9i n GLY 175 N -1.17 0.63 3.77 5.37 0.00 0.29 -5.04 105.19 109.04 1u9i n GLY 175 Ca -0.02 -0.05 -0.38 0.00 0.00 0.00 0.00 46.02 45.56 1u9i n GLY 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u9i s ALA 176 N -2.00 3.27 -0.38 4.61 0.00 -0.90 -4.31 121.76 122.05 1u9i s ALA 176 Ca 0.00 0.55 -0.17 0.00 0.00 0.00 0.00 51.96 52.33 1u9i s ALA 176 Cb 0.00 -3.18 0.00 0.00 0.00 0.00 0.00 23.12 19.95 1u9i s ALA 176 CO 0.00 0.20 0.46 0.99 0.00 0.00 0.00 175.76 177.40 1u9i s THR 177 N -1.43 5.07 0.18 0.00 2.01 -1.09 -3.67 115.64 116.70 1u9i s THR 177 Ca 0.46 0.02 0.07 0.00 0.31 0.00 0.00 61.69 62.56 1u9i s THR 177 Cb -0.21 -3.97 -0.04 0.00 0.01 0.00 0.00 72.50 68.29 1u9i s THR 177 CO 0.27 -0.28 0.00 -0.89 -0.69 0.00 0.00 174.62 173.03 1u9i s THR 178 N 2.24 3.73 -0.17 -0.82 2.01 -0.41 -1.66 115.64 120.56 1u9i s THR 178 Ca 0.15 -1.43 0.00 0.00 0.31 0.00 0.00 61.69 60.72 1u9i s THR 178 Cb -0.16 -2.88 0.04 0.00 0.01 0.00 0.00 72.50 69.51 1u9i s THR 178 CO 0.13 -0.12 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.17 1u9i s VAL 179 N -1.75 1.34 -0.16 3.82 1.01 0.86 -1.40 120.40 124.12 1u9i s VAL 179 Ca 0.28 -0.76 -0.02 0.00 0.00 0.00 0.00 61.98 61.47 1u9i s VAL 179 Cb -0.09 -1.45 -0.02 0.00 0.00 0.00 0.00 36.38 34.82 1u9i s VAL 179 CO 0.19 0.18 -0.07 -0.04 0.00 0.00 0.00 175.10 175.35 1u9i s MET 180 N 1.54 3.51 0.05 2.72 -1.94 -0.07 -1.05 119.30 124.06 1u9i s MET 180 Ca 0.00 -0.60 -0.14 0.00 -1.71 0.00 0.00 55.69 53.24 1u9i s MET 180 Cb -0.15 -2.83 -0.06 0.00 2.01 0.00 0.00 34.83 33.80 1u9i s MET 180 CO -0.08 0.15 0.45 0.99 -0.01 0.00 0.00 175.02 176.51 1u9i s THR 181 N 0.57 4.98 0.03 2.05 2.01 -0.62 0.35 115.64 125.02 1u9i s THR 181 Ca -0.05 0.80 -0.01 0.00 0.31 0.00 0.00 61.69 62.74 1u9i s THR 181 Cb -0.15 -3.72 -0.03 0.00 0.01 0.00 0.00 72.50 68.61 1u9i s THR 181 CO 0.03 0.46 -0.02 -0.89 -0.69 0.00 0.00 174.62 173.51 1u9i s THR 182 N -1.21 0.16 0.05 -0.82 2.01 -0.56 -2.92 115.64 112.35 1u9i s THR 182 Ca 0.28 -1.29 0.02 0.00 0.31 0.00 0.00 61.69 61.02 1u9i s THR 182 Cb -0.16 -0.81 -0.04 0.00 0.01 0.00 0.00 72.50 71.50 1u9i s THR 182 CO 0.16 -0.71 0.04 -1.83 -0.69 0.00 0.00 174.62 171.59 1u9i s GLU 183 N -2.52 2.81 0.22 4.92 -1.05 -1.26 -1.93 118.70 119.90 1u9i s GLU 183 Ca -0.06 -0.67 0.07 0.00 -0.15 0.00 0.00 54.97 54.16 1u9i s GLU 183 Cb -0.02 -2.69 -0.05 0.00 -0.44 0.00 0.00 34.13 30.93 1u9i s GLU 183 CO -0.05 0.59 -0.11 1.03 0.95 0.00 0.00 175.26 177.67 1u9i s ARG 184 N -2.05 1.38 -0.10 -4.83 0.52 -0.84 -2.23 118.95 110.79 1u9i s ARG 184 Ca 0.25 -1.64 0.09 0.00 -0.52 0.00 0.00 55.73 53.90 1u9i s ARG 184 Cb -0.12 -1.06 -0.12 0.00 0.52 0.00 0.00 34.95 34.17 1u9i s ARG 184 CO 0.17 0.11 0.03 -0.89 0.02 0.00 0.00 175.30 174.74 1u9i n ILE 185 N -0.43 0.69 -4.59 1.52 -0.00 -1.26 -4.12 119.36 111.17 1u9i n ILE 185 Ca -0.07 -0.42 -0.34 0.00 -0.00 0.00 0.00 62.75 61.92 1u9i n ILE 185 Cb 0.61 -0.74 -0.12 0.00 -0.00 0.00 0.00 39.64 39.40 1u9i n ILE 185 CO 0.00 0.00 0.00 -0.70 -0.00 0.00 0.00 176.55 175.85 1u9i s GLU 186 N -2.24 3.02 0.49 0.38 -6.30 -1.26 -5.00 118.70 107.78 1u9i s GLU 186 Ca -0.05 -0.55 0.16 0.00 -2.50 0.00 0.00 54.97 52.03 1u9i s GLU 186 Cb 0.03 -2.67 1.17 0.00 0.00 0.00 0.00 34.13 32.66 1u9i s GLU 186 CO 0.41 0.53 2.07 1.49 0.02 0.00 0.00 175.26 179.77 1u9i h GLU 187 N 5.72 0.00 0.00 4.30 4.57 -1.94 -3.19 114.58 124.04 1u9i h GLU 187 Ca -0.42 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.76 1u9i h GLU 187 Cb 1.18 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.77 1u9i h GLU 187 CO 0.55 0.10 0.00 0.66 -1.18 0.00 0.00 179.01 179.14 1u9i n TYR 188 N -4.36 0.00 0.00 0.92 4.02 -1.26 -4.97 117.16 111.50 1u9i n TYR 188 Ca -0.03 -0.25 0.00 0.00 -0.01 0.00 0.00 57.90 57.61 1u9i n TYR 188 Cb 0.17 -0.03 0.00 0.00 -0.02 0.00 0.00 39.34 39.47 1u9i n TYR 188 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1u9i n GLY 189 N -0.25 0.59 3.72 2.72 0.00 -1.21 -4.98 105.19 105.79 1u9i n GLY 189 Ca 0.00 -0.94 -0.32 0.00 0.00 0.00 0.00 46.02 44.76 1u9i n GLY 189 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1u9i s PRO 190 N 0.00 1.82 0.15 1.61 0.04 -1.26 -4.93 135.00 132.42 1u9i s PRO 190 Ca 0.00 1.55 -0.12 0.00 0.04 0.00 0.00 61.00 62.47 1u9i s PRO 190 Cb 0.00 -1.82 0.01 0.00 0.04 0.00 0.00 34.50 32.73 1u9i s PRO 190 CO 0.00 -2.04 1.58 0.82 0.04 0.00 0.00 177.00 177.40 1u9i h ILE 191 N -0.98 1.27 -4.43 0.56 1.08 -1.94 -3.46 117.51 109.62 1u9i h ILE 191 Ca -0.45 -1.15 -0.19 0.00 -0.39 0.00 0.00 64.86 62.68 1u9i h ILE 191 Cb 1.27 1.04 -0.15 0.00 -3.07 0.00 0.00 36.82 35.91 1u9i h ILE 191 CO 0.47 0.40 -0.62 0.00 -0.69 0.00 0.00 178.15 177.71 1u9i s ALA 192 N -4.92 0.87 0.05 1.87 0.00 -1.26 -4.67 121.76 113.70 1u9i s ALA 192 Ca -0.12 -1.48 -0.10 0.00 0.00 0.00 0.00 51.96 50.25 1u9i s ALA 192 Cb 0.11 0.96 -0.02 0.00 0.00 0.00 0.00 23.12 24.17 1u9i s ALA 192 CO 0.83 -0.52 1.18 0.00 0.00 0.00 0.00 175.76 177.26 1u9i h ARG 193 N 2.81 -0.02 -0.11 0.00 3.08 -1.78 -1.51 114.38 116.85 1u9i h ARG 193 Ca -0.35 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.70 1u9i h ARG 193 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.26 1u9i h ARG 193 CO 0.57 -0.01 0.00 0.66 -1.07 0.00 0.00 179.97 180.12 1u9i n TYR 194 N -3.73 0.01 -3.13 3.04 4.02 -1.26 -4.86 117.16 111.25 1u9i n TYR 194 Ca 0.00 -0.01 -0.17 0.00 -0.01 0.00 0.00 57.90 57.72 1u9i n TYR 194 Cb 0.09 -0.01 -0.02 0.00 -0.02 0.00 0.00 39.34 39.38 1u9i n TYR 194 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1u9i n GLY 195 N 0.46 -0.48 0.00 2.72 0.00 -0.57 -4.70 105.19 102.62 1u9i n GLY 195 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1u9i n GLY 195 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1u9i n VAL 196 N -3.35 0.00 -0.38 1.61 0.31 -1.26 -4.81 118.33 110.45 1u9i n VAL 196 Ca -0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 64.34 64.31 1u9i n VAL 196 Cb 0.52 -0.31 0.11 0.00 -0.91 0.00 0.00 33.84 33.25 1u9i n VAL 196 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1u9i h GLU 197 N 0.00 1.33 -0.89 5.55 3.07 -1.92 -3.13 114.58 118.59 1u9i h GLU 197 Ca 0.00 -0.08 0.24 0.00 -0.50 0.00 0.00 59.36 59.02 1u9i h GLU 197 Cb 0.40 -0.30 -0.15 0.00 -0.84 0.00 0.00 28.75 27.86 1u9i h GLU 197 CO 0.00 0.88 0.14 0.93 -1.40 0.00 0.00 179.01 179.56 1u9i h GLU 198 N 1.37 0.12 0.00 2.33 3.07 -1.95 -1.75 114.58 117.77 1u9i h GLU 198 Ca 0.37 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.22 1u9i h GLU 198 Cb -0.16 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 27.73 1u9i h GLU 198 CO -0.08 0.08 -0.87 1.19 -1.40 0.00 0.00 179.01 177.93 1u9i n PHE 199 N -5.32 0.68 0.06 4.33 3.72 -1.19 -4.10 117.46 115.64 1u9i n PHE 199 Ca 0.21 0.20 -0.07 0.00 -0.05 0.00 0.00 57.45 57.74 1u9i n PHE 199 Cb 0.68 -0.75 -0.11 0.00 -0.94 0.00 0.00 39.48 38.36 1u9i n PHE 199 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 1u9i h VAL 200 N 0.00 1.59 -3.93 -4.37 2.07 -1.34 -3.46 116.25 106.81 1u9i h VAL 200 Ca 0.00 -3.29 -0.49 0.00 0.82 0.00 0.00 66.70 63.74 1u9i h VAL 200 Cb 0.85 2.78 0.01 0.00 -1.52 0.00 0.00 31.29 33.42 1u9i h VAL 200 CO 0.00 0.90 0.24 -0.44 0.02 0.00 0.00 177.57 178.29 1u9i s SER 201 N -6.64 6.54 0.10 0.57 0.01 -1.06 -4.92 113.70 108.31 1u9i s SER 201 Ca 0.01 1.32 -0.06 0.00 1.31 0.00 0.00 55.95 58.53 1u9i s SER 201 Cb 0.10 -2.40 -0.18 0.00 0.21 0.00 0.00 66.02 63.74 1u9i s SER 201 CO 0.82 -0.50 1.22 0.44 0.41 0.00 0.00 173.24 175.63 1u9i h ASP 202 N 1.02 0.54 -4.50 2.44 3.32 -1.88 -3.46 116.42 113.89 1u9i h ASP 202 Ca -0.47 -0.49 -0.36 0.00 0.02 0.00 0.00 57.03 55.73 1u9i h ASP 202 Cb 1.19 -0.17 -0.23 0.00 0.22 0.00 0.00 39.33 40.34 1u9i h ASP 202 CO 0.63 1.32 -0.76 0.20 -1.72 0.00 0.00 179.24 178.90 1u9i s ASN 203 N -7.15 1.31 -0.07 6.45 0.01 -1.13 -1.90 114.94 112.46 1u9i s ASN 203 Ca -0.06 -0.52 0.01 0.00 -0.71 0.00 0.00 52.86 51.58 1u9i s ASN 203 Cb 0.08 -0.03 0.02 0.00 0.41 0.00 0.00 41.25 41.73 1u9i s ASN 203 CO 0.88 -0.09 -0.06 -0.69 -1.51 0.00 0.00 177.10 175.63 1u9i s VAL 204 N -1.13 0.76 -0.07 1.60 1.01 -0.76 -0.22 120.40 121.59 1u9i s VAL 204 Ca -0.04 -0.21 0.05 0.00 0.00 0.00 0.00 61.98 61.78 1u9i s VAL 204 Cb -0.09 -0.78 -0.01 0.00 0.00 0.00 0.00 36.38 35.51 1u9i s VAL 204 CO 0.01 0.29 -0.24 -0.69 0.00 0.00 0.00 175.10 174.48 1u9i s VAL 205 N 1.16 1.97 -0.22 2.92 1.01 0.21 -1.40 120.40 126.06 1u9i s VAL 205 Ca -0.06 -1.00 -0.02 0.00 0.00 0.00 0.00 61.98 60.90 1u9i s VAL 205 Cb -0.14 -1.68 0.01 0.00 0.00 0.00 0.00 36.38 34.57 1u9i s VAL 205 CO -0.01 0.55 -0.10 -0.63 0.00 0.00 0.00 175.10 174.90 1u9i s ILE 206 N 0.03 2.82 -0.26 2.22 -1.09 0.73 -1.32 121.20 124.34 1u9i s ILE 206 Ca -0.09 -0.79 -0.14 0.00 -2.23 0.00 0.00 60.65 57.41 1u9i s ILE 206 Cb -0.15 -2.30 -0.04 0.00 -1.58 0.00 0.00 42.46 38.39 1u9i s ILE 206 CO 0.05 0.39 0.33 -0.76 -1.23 0.00 0.00 174.94 173.73 1u9i s LEU 207 N 1.38 4.05 0.21 2.97 1.43 0.09 -1.30 118.68 127.51 1u9i s LEU 207 Ca 0.04 0.25 0.09 0.00 -1.03 0.00 0.00 54.13 53.49 1u9i s LEU 207 Cb -0.15 -2.37 -0.04 0.00 0.03 0.00 0.00 46.19 43.66 1u9i s LEU 207 CO -0.07 -0.14 -0.07 -0.13 0.23 0.00 0.00 176.35 176.17 1u9i s ARG 208 N 1.89 2.11 -0.42 1.70 0.52 0.04 -4.08 118.95 120.71 1u9i s ARG 208 Ca 0.14 -1.35 0.07 0.00 -0.52 0.00 0.00 55.73 54.07 1u9i s ARG 208 Cb -0.16 -2.13 0.23 0.00 0.52 0.00 0.00 34.95 33.41 1u9i s ARG 208 CO 0.10 0.40 0.51 -1.71 0.02 0.00 0.00 175.30 174.62 1u9i n ASN 209 N -0.31 0.39 -4.74 0.23 4.05 -1.26 -1.60 115.26 112.02 1u9i n ASN 209 Ca -0.09 -2.70 -0.41 0.00 0.45 0.00 0.00 54.58 51.83 1u9i n ASN 209 Cb 0.57 -0.63 -0.03 0.00 1.23 0.00 0.00 39.78 40.92 1u9i n ASN 209 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1u9i s VAL 210 N -1.07 3.30 0.00 3.44 1.01 0.41 -4.71 120.40 122.79 1u9i s VAL 210 Ca 0.35 1.09 0.00 0.00 0.00 0.00 0.00 61.98 63.42 1u9i s VAL 210 Cb 0.14 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.83 1u9i s VAL 210 CO -0.12 0.17 0.00 -0.11 0.00 0.00 0.00 175.10 175.04 1u9i n LEU 211 N 2.52 0.00 -1.83 3.92 7.94 -1.26 -0.34 117.00 127.95 1u9i n LEU 211 Ca 0.05 0.00 -0.02 0.00 -1.11 0.00 0.00 56.01 54.94 1u9i n LEU 211 Cb 0.43 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.37 1u9i n LEU 211 CO 0.57 0.00 -0.26 1.21 -1.11 0.00 0.00 177.39 177.80 1u9i n GLU 212 N 0.00 -2.02 -3.32 1.96 0.00 -1.26 -4.41 120.64 111.60 1u9i n GLU 212 Ca 0.00 1.79 -0.18 0.00 0.00 0.00 0.00 57.16 58.77 1u9i n GLU 212 Cb 0.00 -2.57 0.07 0.00 0.00 0.00 0.00 31.44 28.94 1u9i n GLU 212 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1u9i n GLY 213 N 0.73 -0.26 3.83 8.31 0.00 -1.26 -3.08 105.19 113.46 1u9i n GLY 213 Ca -0.12 0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1u9i n GLY 213 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1u9i n GLU 214 N -3.99 -0.02 -4.18 1.61 1.02 -1.26 -4.95 120.64 108.87 1u9i n GLU 214 Ca -0.07 0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 56.85 1u9i n GLU 214 Cb 0.58 -4.18 -0.06 0.00 -0.02 0.00 0.00 31.44 27.76 1u9i n GLU 214 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1u9i s ARG 215 N -0.85 2.66 -0.09 3.49 1.81 -1.18 -5.12 118.95 119.68 1u9i s ARG 215 Ca 0.00 -1.22 0.03 0.00 -1.72 0.00 0.00 55.73 52.82 1u9i s ARG 215 Cb 0.00 -2.39 -0.01 0.00 -0.45 0.00 0.00 34.95 32.10 1u9i s ARG 215 CO 0.00 0.37 -0.19 1.03 -0.68 0.00 0.00 175.30 175.83 1u9i s ARG 216 N -3.78 2.90 -0.15 3.54 1.81 -1.26 -3.98 118.95 118.03 1u9i s ARG 216 Ca 0.33 -0.78 0.00 0.00 -1.72 0.00 0.00 55.73 53.55 1u9i s ARG 216 Cb -0.07 -2.38 0.02 0.00 -0.45 0.00 0.00 34.95 32.07 1u9i s ARG 216 CO 0.23 0.35 -0.13 0.50 -0.68 0.00 0.00 175.30 175.57 1u9i s ARG 217 N -0.04 2.16 -0.00 3.54 3.52 0.54 -4.88 118.95 123.79 1u9i s ARG 217 Ca -0.05 -0.54 -0.15 0.00 -0.13 0.00 0.00 55.73 54.85 1u9i s ARG 217 Cb -0.14 -2.07 -0.06 0.00 -1.56 0.00 0.00 34.95 31.12 1u9i s ARG 217 CO 0.04 -0.26 0.43 1.03 -0.81 0.00 0.00 175.30 175.73 1u9i s ARG 218 N 1.51 3.99 0.06 5.12 0.52 -1.26 -0.45 118.95 128.44 1u9i s ARG 218 Ca 0.04 0.45 0.01 0.00 -0.52 0.00 0.00 55.73 55.71 1u9i s ARG 218 Cb -0.13 -3.24 -0.03 0.00 0.52 0.00 0.00 34.95 32.06 1u9i s ARG 218 CO -0.10 0.64 -0.05 0.95 0.02 0.00 0.00 175.30 176.76 1u9i s THR 219 N -0.93 0.42 -0.02 0.02 -4.23 -0.63 -2.13 115.64 108.15 1u9i s THR 219 Ca 0.24 -1.56 0.05 0.00 -1.18 0.00 0.00 61.69 59.24 1u9i s THR 219 Cb -0.17 -1.19 -0.01 0.00 1.34 0.00 0.00 72.50 72.47 1u9i s THR 219 CO 0.14 -0.76 -0.17 -0.22 -0.54 0.00 0.00 174.62 173.07 1u9i s LEU 220 N -2.46 2.02 -0.00 4.79 0.20 0.30 -0.78 118.68 122.75 1u9i s LEU 220 Ca 0.01 -0.31 0.00 0.00 0.69 0.00 0.00 54.13 54.53 1u9i s LEU 220 Cb 0.01 -0.87 0.00 0.00 -0.43 0.00 0.00 46.19 44.90 1u9i s LEU 220 CO -0.05 0.20 -0.01 -0.70 -0.29 0.00 0.00 176.35 175.50 1u9i s GLU 221 N -0.36 0.11 -0.46 1.98 2.12 -0.42 -0.38 118.70 121.29 1u9i s GLU 221 Ca 0.06 -0.04 -0.12 0.00 0.36 0.00 0.00 54.97 55.23 1u9i s GLU 221 Cb -0.07 -0.12 0.09 0.00 0.26 0.00 0.00 34.13 34.29 1u9i s GLU 221 CO -0.00 0.02 0.34 0.42 -0.54 0.00 0.00 175.26 175.49 1u9i s ILE 222 N 0.04 4.64 0.06 -3.70 -1.09 -1.26 -0.19 121.20 119.69 1u9i s ILE 222 Ca -0.00 -1.36 -0.19 0.00 -2.23 0.00 0.00 60.65 56.87 1u9i s ILE 222 Cb -0.01 -3.86 -0.12 0.00 -1.58 0.00 0.00 42.46 36.89 1u9i s ILE 222 CO -0.00 -0.61 1.38 0.25 -1.23 0.00 0.00 174.94 174.73 1u9i h LEU 223 N 8.57 0.49 -7.43 2.97 6.46 -1.59 -3.43 115.31 121.36 1u9i h LEU 223 Ca -0.25 -0.47 -0.06 0.00 -0.12 0.00 0.00 57.88 56.98 1u9i h LEU 223 Cb 1.09 -0.14 -0.14 0.00 -0.73 0.00 0.00 40.66 40.75 1u9i h LEU 223 CO 0.84 0.86 -0.11 -1.59 -0.62 0.00 0.00 178.44 177.82 1u9i s LYS 224 N -4.36 1.02 -0.33 1.25 -2.85 -1.19 -4.98 119.74 108.29 1u9i s LYS 224 Ca -0.14 -0.68 0.03 0.00 -1.00 0.00 0.00 55.97 54.18 1u9i s LYS 224 Cb 0.06 0.45 0.16 0.00 -2.06 0.00 0.00 37.83 36.44 1u9i s LYS 224 CO 0.78 -0.39 0.40 -0.51 0.10 0.00 0.00 175.35 175.73 1u9i s LEU 225 N -2.69 -0.50 -0.10 2.77 1.43 -1.26 -1.83 118.68 116.49 1u9i s LEU 225 Ca 0.02 -0.94 -0.35 0.00 -1.03 0.00 0.00 54.13 51.83 1u9i s LEU 225 Cb 0.02 0.89 -0.12 0.00 0.03 0.00 0.00 46.19 47.01 1u9i s LEU 225 CO -0.11 -0.30 1.86 0.54 0.23 0.00 0.00 176.35 178.57 1u9i n ARG 226 N 4.82 2.08 0.00 1.70 1.74 -0.80 -2.62 116.66 123.59 1u9i n ARG 226 Ca 0.05 0.76 0.00 0.00 -0.77 0.00 0.00 57.85 57.89 1u9i n ARG 226 Cb 0.48 -2.59 0.00 0.00 -1.02 0.00 0.00 32.46 29.33 1u9i n ARG 226 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1u9i n GLY 227 N 4.36 2.51 3.36 -0.13 0.00 -1.26 -5.02 105.19 109.00 1u9i n GLY 227 Ca 0.23 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.05 1u9i n GLY 227 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1u9i s THR 228 N -2.47 0.30 0.66 2.61 -4.23 -1.08 -4.38 115.64 107.05 1u9i s THR 228 Ca 0.00 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.55 1u9i s THR 228 Cb 0.00 -2.48 0.11 0.00 1.34 0.00 0.00 72.50 71.48 1u9i s THR 228 CO 0.00 0.00 0.91 -0.94 -0.54 0.00 0.00 174.62 174.05 1u9i s SER 229 N -3.41 4.63 0.00 3.99 1.04 -1.26 -4.70 113.70 114.00 1u9i s SER 229 Ca 0.35 -0.60 -0.29 0.00 0.48 0.00 0.00 55.95 55.89 1u9i s SER 229 Cb 0.04 0.17 0.10 0.00 0.10 0.00 0.00 66.02 66.44 1u9i s SER 229 CO 0.19 -1.67 1.26 -1.38 0.98 0.00 0.00 173.24 172.62 1u9i s HIS 230 N -2.95 0.00 0.06 5.02 -0.00 -1.26 -4.60 115.29 111.56 1u9i s HIS 230 Ca 0.65 -0.14 -0.28 0.00 -0.00 0.00 0.00 55.06 55.28 1u9i s HIS 230 Cb -0.05 0.57 -0.05 0.00 -0.00 0.00 0.00 32.58 33.05 1u9i s HIS 230 CO 0.42 -0.34 0.90 -1.64 -0.00 0.00 0.00 174.74 174.08 1u9i s MET 231 N -2.20 4.60 0.35 -0.38 -1.94 0.76 -4.99 119.30 115.49 1u9i s MET 231 Ca 0.23 1.31 -0.05 0.00 -1.71 0.00 0.00 55.69 55.46 1u9i s MET 231 Cb 0.01 -3.39 -0.05 0.00 2.01 0.00 0.00 34.83 33.41 1u9i s MET 231 CO -0.01 0.17 0.63 0.15 -0.01 0.00 0.00 175.02 175.95 1u9i s LYS 232 N 0.22 3.63 0.23 2.03 3.01 -1.26 -4.49 119.74 123.11 1u9i s LYS 232 Ca 0.45 0.08 0.00 0.00 -1.01 0.00 0.00 55.97 55.49 1u9i s LYS 232 Cb -0.22 -2.56 0.00 0.00 -1.01 0.00 0.00 37.83 34.05 1u9i s LYS 232 CO 0.27 0.09 0.00 0.41 0.51 0.00 0.00 175.35 176.63 1u9i n GLY 233 N -1.32 -2.68 3.84 -3.33 0.00 -1.26 -4.97 105.19 95.46 1u9i n GLY 233 Ca -0.01 -1.75 -0.34 0.00 0.00 0.00 0.00 46.02 43.92 1u9i n GLY 233 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1u9i s GLU 234 N -0.61 4.04 -0.03 1.61 2.02 -1.26 -4.19 118.70 120.28 1u9i s GLU 234 Ca 0.00 0.63 0.01 0.00 0.02 0.00 0.00 54.97 55.62 1u9i s GLU 234 Cb 0.00 -2.69 0.03 0.00 0.10 0.00 0.00 34.13 31.56 1u9i s GLU 234 CO 0.00 0.31 -0.01 0.71 0.02 0.00 0.00 175.26 176.29 1u9i s TYR 235 N -1.72 0.40 0.30 1.61 1.51 0.49 -4.91 117.35 115.03 1u9i s TYR 235 Ca 0.47 -0.04 -0.29 0.00 -1.01 0.00 0.00 57.07 56.19 1u9i s TYR 235 Cb -0.13 -0.46 -0.10 0.00 -0.11 0.00 0.00 41.96 41.16 1u9i s TYR 235 CO 0.19 -0.14 1.21 -1.25 -1.11 0.00 0.00 175.55 174.45 1u9i s PRO 236 N 0.98 4.50 0.15 -1.71 0.04 -1.26 0.11 135.00 137.81 1u9i s PRO 236 Ca -0.10 2.01 -0.08 0.00 0.04 0.00 0.00 61.00 62.87 1u9i s PRO 236 Cb -0.14 -3.13 -0.01 0.00 0.04 0.00 0.00 34.50 31.26 1u9i s PRO 236 CO -0.01 0.01 0.24 -0.59 0.04 0.00 0.00 177.00 176.69 1u9i s PHE 237 N -1.12 0.46 0.07 0.56 -0.12 -0.90 -2.51 117.98 114.41 1u9i s PHE 237 Ca 0.47 -0.83 0.05 0.00 -0.05 0.00 0.00 56.93 56.57 1u9i s PHE 237 Cb -0.36 -0.12 -0.03 0.00 -0.63 0.00 0.00 43.02 41.88 1u9i s PHE 237 CO 0.47 -0.68 -0.13 0.99 -0.05 0.00 0.00 175.22 175.82 1u9i s THR 238 N -3.97 1.01 -0.23 -4.49 2.01 0.55 -4.41 115.64 106.11 1u9i s THR 238 Ca 0.18 -1.29 -0.08 0.00 0.31 0.00 0.00 61.69 60.81 1u9i s THR 238 Cb 0.04 -1.01 -0.04 0.00 0.01 0.00 0.00 72.50 71.51 1u9i s THR 238 CO -0.00 -0.27 0.08 -0.63 -0.69 0.00 0.00 174.62 173.11 1u9i s ILE 239 N -1.35 4.58 0.00 1.82 1.01 -1.26 -0.05 121.20 125.95 1u9i s ILE 239 Ca -0.03 -0.09 0.00 0.00 0.00 0.00 0.00 60.65 60.53 1u9i s ILE 239 Cb -0.10 -3.12 0.00 0.00 0.01 0.00 0.00 42.46 39.25 1u9i s ILE 239 CO 0.02 0.37 0.00 0.35 0.00 0.00 0.00 174.94 175.68 1u9i n THR 240 N 4.46 0.00 0.68 2.92 -2.24 0.44 -4.93 114.28 115.61 1u9i n THR 240 Ca -0.16 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.70 1u9i n THR 240 Cb 0.52 0.00 0.38 0.00 -2.10 0.00 0.00 70.33 69.12 1u9i n THR 240 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1u9i n ASP 241 N -1.15 0.00 -0.64 3.42 8.00 -1.26 -1.51 116.55 123.40 1u9i n ASP 241 Ca 0.00 0.22 0.06 0.00 0.71 0.00 0.00 54.79 55.77 1u9i n ASP 241 Cb 0.00 -0.36 0.16 0.00 -0.02 0.00 0.00 41.12 40.90 1u9i n ASP 241 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1u9i n HIS 242 N -1.36 0.51 -1.91 1.24 8.25 -1.26 -4.32 115.22 116.37 1u9i n HIS 242 Ca 0.06 -0.55 0.00 0.00 -0.26 0.00 0.00 57.72 56.97 1u9i n HIS 242 Cb 0.15 -0.07 0.00 0.00 1.12 0.00 0.00 29.99 31.19 1u9i n HIS 242 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1u9i n GLY 243 N 0.33 -0.42 3.72 -1.41 0.00 -0.57 -4.90 105.19 101.94 1u9i n GLY 243 Ca 0.12 -1.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.22 1u9i n GLY 243 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1u9i s ILE 244 N 0.00 4.01 -0.15 -0.61 1.01 -1.26 -0.42 121.20 123.78 1u9i s ILE 244 Ca 0.00 1.55 -0.01 0.00 0.00 0.00 0.00 60.65 62.20 1u9i s ILE 244 Cb 0.00 -3.99 0.04 0.00 0.01 0.00 0.00 42.46 38.51 1u9i s ILE 244 CO 0.00 0.18 -0.04 0.21 0.00 0.00 0.00 174.94 175.30 1u9i s ASN 245 N 0.56 2.54 -0.03 3.58 2.47 0.92 -4.27 114.94 120.72 1u9i s ASN 245 Ca 0.54 -0.53 0.02 0.00 0.42 0.00 0.00 52.86 53.31 1u9i s ASN 245 Cb -0.29 -0.79 -0.03 0.00 -1.45 0.00 0.00 41.25 38.69 1u9i s ASN 245 CO 0.32 -0.19 -0.05 -0.63 -3.72 0.00 0.00 177.10 172.83 1u9i s ILE 246 N 1.72 3.79 -0.37 -5.21 1.01 -0.51 -0.33 121.20 121.30 1u9i s ILE 246 Ca 0.02 -0.61 0.01 0.00 0.00 0.00 0.00 60.65 60.07 1u9i s ILE 246 Cb -0.15 -2.61 0.10 0.00 0.01 0.00 0.00 42.46 39.81 1u9i s ILE 246 CO -0.07 0.48 0.12 -0.36 0.00 0.00 0.00 174.94 175.11 1u9i s PHE 247 N -0.94 3.68 -1.35 3.97 0.40 -1.04 -4.23 117.98 118.47 1u9i s PHE 247 Ca 0.15 -2.72 -0.15 0.00 -0.60 0.00 0.00 56.93 53.62 1u9i s PHE 247 Cb -0.11 -3.05 -0.01 0.00 0.51 0.00 0.00 43.02 40.36 1u9i s PHE 247 CO 0.05 -0.96 2.25 -2.30 0.70 0.00 0.00 175.22 174.97 1u9i n PRO 248 N 4.41 2.70 0.27 0.24 -0.02 -1.26 -4.47 135.00 136.87 1u9i n PRO 248 Ca 0.01 -2.40 0.14 0.00 -2.02 0.00 0.00 63.50 59.23 1u9i n PRO 248 Cb 0.42 -3.15 0.66 0.00 -0.02 0.00 0.00 33.50 31.40 1u9i n PRO 248 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1u9i h LEU 249 N 10.27 0.00 -1.93 2.45 3.38 -1.95 0.99 115.31 128.52 1u9i h LEU 249 Ca 0.58 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.55 1u9i h LEU 249 Cb 0.59 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1u9i h LEU 249 CO 1.88 0.00 0.00 0.61 0.09 0.00 0.00 178.44 181.02 1u9i n GLY 250 N -1.33 1.19 0.22 0.83 0.00 -1.26 -3.89 105.19 100.95 1u9i n GLY 250 Ca 0.01 -0.66 0.09 0.00 0.00 0.00 0.00 46.02 45.46 1u9i n GLY 250 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u9i n ALA 251 N 1.18 3.86 -2.05 4.61 0.00 0.34 -4.92 120.51 123.52 1u9i n ALA 251 Ca 0.17 -0.55 -0.43 0.00 0.00 0.00 0.00 53.44 52.64 1u9i n ALA 251 Cb 0.54 -0.67 -0.03 0.00 0.00 0.00 0.00 19.45 19.30 1u9i n ALA 251 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 1u9i s MET 252 N -2.44 3.90 0.41 0.00 0.00 -1.18 -4.97 119.30 115.01 1u9i s MET 252 Ca 0.11 1.86 -0.23 0.00 0.00 0.00 0.00 55.69 57.44 1u9i s MET 252 Cb 0.15 -4.03 -0.10 0.00 0.00 0.00 0.00 34.83 30.85 1u9i s MET 252 CO 0.61 -1.17 0.99 1.03 0.00 0.00 0.00 175.02 176.48 1u9i s ARG 253 N 4.53 4.22 -1.36 4.11 0.52 -1.26 -4.96 118.95 124.74 1u9i s ARG 253 Ca 0.73 1.33 -0.06 0.00 -0.52 0.00 0.00 55.73 57.21 1u9i s ARG 253 Cb -0.28 -2.42 0.10 0.00 0.52 0.00 0.00 34.95 32.87 1u9i s ARG 253 CO 0.29 -0.06 2.44 -0.11 0.02 0.00 0.00 175.30 177.88 1u9i n LEU 254 N -0.25 8.10 -2.54 2.53 7.94 -1.26 -4.55 117.00 126.97 1u9i n LEU 254 Ca 0.06 -4.82 -0.18 0.00 -1.11 0.00 0.00 56.01 49.96 1u9i n LEU 254 Cb 0.51 -1.39 0.02 0.00 0.53 0.00 0.00 43.42 43.09 1u9i n LEU 254 CO 0.42 2.04 0.05 0.41 -1.11 0.00 0.00 177.39 179.20 1u9i n THR 255 N 2.02 1.77 -2.59 1.96 -1.04 -1.26 -5.08 114.28 110.05 1u9i n THR 255 Ca 0.64 -4.00 -0.37 0.00 -2.04 0.00 0.00 64.05 58.28 1u9i n THR 255 Cb 0.25 -0.32 -0.05 0.00 -1.82 0.00 0.00 70.33 68.39 1u9i n THR 255 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 1u9i s GLN 256 N -3.40 4.33 0.29 -2.82 -1.52 -1.26 -5.00 119.66 110.27 1u9i s GLN 256 Ca 0.39 1.51 -0.28 0.00 -1.95 0.00 0.00 55.36 55.02 1u9i s GLN 256 Cb 0.42 -2.69 -0.09 0.00 -0.22 0.00 0.00 33.01 30.43 1u9i s GLN 256 CO -0.07 0.01 1.01 1.03 -0.25 0.00 0.00 175.29 177.02 1u9i s ARG 257 N -2.25 4.65 -0.03 2.91 0.52 -1.26 -5.02 118.95 118.46 1u9i s ARG 257 Ca 0.54 1.58 0.03 0.00 -0.52 0.00 0.00 55.73 57.36 1u9i s ARG 257 Cb -0.23 -3.07 -0.00 0.00 0.52 0.00 0.00 34.95 32.17 1u9i s ARG 257 CO 0.28 0.29 -0.13 0.45 0.02 0.00 0.00 175.30 176.21 1u9i s SER 258 N -1.19 1.65 0.17 0.23 0.15 -1.26 -4.92 113.70 108.53 1u9i s SER 258 Ca 0.46 -0.26 0.03 0.00 0.70 0.00 0.00 55.95 56.87 1u9i s SER 258 Cb -0.26 -0.44 -0.05 0.00 -1.71 0.00 0.00 66.02 63.56 1u9i s SER 258 CO 0.33 0.11 -0.03 -0.94 1.20 0.00 0.00 173.24 173.91 1u9i s SER 259 N 0.10 1.44 0.00 5.45 1.04 -1.26 -5.04 113.70 115.43 1u9i s SER 259 Ca -0.03 -1.13 0.25 0.00 0.48 0.00 0.00 55.95 55.52 1u9i s SER 259 Cb -0.10 0.07 0.62 0.00 0.10 0.00 0.00 66.02 66.72 1u9i s SER 259 CO 0.01 -0.50 1.50 0.59 0.98 0.00 0.00 173.24 175.83 1u9i n ASN 260 N -0.24 2.32 -4.72 7.02 3.02 -1.26 -4.59 115.26 116.81 1u9i n ASN 260 Ca -0.08 -1.78 -0.42 0.00 -0.03 0.00 0.00 54.58 52.28 1u9i n ASN 260 Cb 0.62 -0.06 -0.00 0.00 -0.61 0.00 0.00 39.78 39.73 1u9i n ASN 260 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1u9i n VAL 261 N 0.78 2.09 -4.12 2.41 0.31 -1.26 -4.88 118.33 113.66 1u9i n VAL 261 Ca 0.17 -0.50 -0.22 0.00 -0.01 0.00 0.00 64.34 63.78 1u9i n VAL 261 Cb 0.47 -1.66 -0.06 0.00 -0.91 0.00 0.00 33.84 31.68 1u9i n VAL 261 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 1u9i s ARG 262 N -1.98 2.56 0.02 5.55 1.81 -1.26 -0.87 118.95 124.77 1u9i s ARG 262 Ca 0.56 -1.33 -0.11 0.00 -1.72 0.00 0.00 55.73 53.13 1u9i s ARG 262 Cb -0.54 -2.33 0.01 0.00 -0.45 0.00 0.00 34.95 31.64 1u9i s ARG 262 CO 0.62 0.27 0.23 0.08 -0.68 0.00 0.00 175.30 175.82 1u9i s VAL 263 N -2.29 0.08 0.60 3.52 1.01 0.15 -4.68 120.40 118.80 1u9i s VAL 263 Ca 0.35 -0.70 -0.13 0.00 0.00 0.00 0.00 61.98 61.50 1u9i s VAL 263 Cb -0.06 -0.71 -0.04 0.00 0.00 0.00 0.00 36.38 35.57 1u9i s VAL 263 CO 0.23 -0.38 1.03 -0.55 0.00 0.00 0.00 175.10 175.42 1u9i s SER 264 N -1.69 6.13 0.00 3.32 0.15 -1.26 -1.12 113.70 119.22 1u9i s SER 264 Ca -0.10 1.54 0.22 0.00 0.70 0.00 0.00 55.95 58.31 1u9i s SER 264 Cb -0.04 -2.49 -0.08 0.00 -1.71 0.00 0.00 66.02 61.70 1u9i s SER 264 CO -0.00 -0.93 0.99 -1.54 1.20 0.00 0.00 173.24 172.96 1u9i n SER 265 N -2.43 0.86 0.00 5.45 3.41 -1.26 -4.80 113.62 114.86 1u9i n SER 265 Ca 0.07 -0.80 0.00 0.00 -0.26 0.00 0.00 58.87 57.88 1u9i n SER 265 Cb 0.54 0.87 0.00 0.00 -0.26 0.00 0.00 64.21 65.36 1u9i n SER 265 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1u9i n GLY 266 N 1.49 0.13 2.89 5.00 0.00 -1.26 -2.97 105.19 110.48 1u9i n GLY 266 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 1u9i n GLY 266 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1u9i s VAL 267 N -2.00 1.15 0.11 1.61 1.01 -1.26 -4.90 120.40 116.13 1u9i s VAL 267 Ca 0.00 -0.74 -0.22 0.00 0.00 0.00 0.00 61.98 61.02 1u9i s VAL 267 Cb 0.00 -1.37 -0.09 0.00 0.00 0.00 0.00 36.38 34.93 1u9i s VAL 267 CO 0.00 0.07 1.71 0.58 0.00 0.00 0.00 175.10 177.46 1u9i h VAL 268 N 6.44 0.84 -0.78 2.92 2.07 -1.96 -1.94 116.25 123.84 1u9i h VAL 268 Ca -0.23 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.38 1u9i h VAL 268 Cb 1.11 0.84 -0.07 0.00 -1.52 0.00 0.00 31.29 31.65 1u9i h VAL 268 CO 0.40 0.00 0.44 -0.09 0.02 0.00 0.00 177.57 178.34 1u9i h ARG 269 N -0.06 0.73 0.24 1.57 9.65 -1.96 -1.99 114.38 122.56 1u9i h ARG 269 Ca 0.05 -0.04 -0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1u9i h ARG 269 Cb 0.13 -0.16 -0.01 0.00 -1.39 0.00 0.00 29.97 28.53 1u9i h ARG 269 CO -0.11 0.48 -0.19 1.25 2.80 0.00 0.00 179.97 184.21 1u9i h LEU 270 N 0.75 -0.49 -0.91 3.80 6.46 -1.91 -1.46 115.31 121.56 1u9i h LEU 270 Ca 0.37 0.04 0.25 0.00 -0.12 0.00 0.00 57.88 58.42 1u9i h LEU 270 Cb 0.32 0.16 -0.14 0.00 -0.73 0.00 0.00 40.66 40.27 1u9i h LEU 270 CO -0.23 -0.29 0.36 0.44 -0.62 0.00 0.00 178.44 178.10 1u9i h ASP 271 N -0.44 0.23 -0.12 1.25 3.32 -0.68 0.73 116.42 120.71 1u9i h ASP 271 Ca -0.01 0.18 -0.00 0.00 0.02 0.00 0.00 57.03 57.22 1u9i h ASP 271 Cb 0.39 0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.12 1u9i h ASP 271 CO -0.01 -0.09 0.07 -0.33 -1.72 0.00 0.00 179.24 177.16 1u9i h GLU 272 N 0.30 0.16 -0.75 3.56 5.08 -0.68 0.35 114.58 122.61 1u9i h GLU 272 Ca 0.59 -0.01 0.10 0.00 -1.00 0.00 0.00 59.36 59.04 1u9i h GLU 272 Cb 1.21 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 30.38 1u9i h GLU 272 CO -0.60 0.15 0.49 0.52 -1.00 0.00 0.00 179.01 178.58 1u9i h MET 273 N 0.12 0.65 -0.81 2.33 2.86 0.13 0.20 114.93 120.41 1u9i h MET 273 Ca 0.04 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1u9i h MET 273 Cb 0.04 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 31.55 1u9i h MET 273 CO -0.01 0.43 0.00 0.00 1.06 0.00 0.00 176.91 178.39 1u9i n GLY 275 N 0.23 -0.38 0.00 0.00 0.00 0.71 -3.83 105.19 101.92 1u9i n GLY 275 Ca 0.07 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1u9i n GLY 275 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u9i n GLY 276 N -1.39 1.71 0.00 -0.02 0.00 0.96 -4.87 105.19 101.59 1u9i n GLY 276 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1u9i n GLY 276 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u9i n GLY 277 N -0.50 1.01 3.74 -0.02 0.00 0.39 -4.62 105.19 105.19 1u9i n GLY 277 Ca 0.00 -1.88 -0.31 0.00 0.00 0.00 0.00 46.02 43.83 1u9i n GLY 277 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1u9i s PHE 278 N -2.40 2.30 0.19 1.61 2.99 -0.28 -4.65 117.98 117.75 1u9i s PHE 278 Ca 0.00 1.61 -0.20 0.00 0.00 0.00 0.00 56.93 58.33 1u9i s PHE 278 Cb 0.00 -3.13 -0.08 0.00 0.00 0.00 0.00 43.02 39.81 1u9i s PHE 278 CO 0.00 -2.10 0.71 -0.06 -0.00 0.00 0.00 175.22 173.76 1u9i s PHE 279 N -2.84 3.71 0.10 0.36 0.40 -1.26 0.32 117.98 118.77 1u9i s PHE 279 Ca 0.63 1.40 -0.29 0.00 -0.60 0.00 0.00 56.93 58.07 1u9i s PHE 279 Cb -0.19 -2.62 -0.13 0.00 0.51 0.00 0.00 43.02 40.60 1u9i s PHE 279 CO 0.57 0.40 1.64 -0.22 0.70 0.00 0.00 175.22 178.31 1u9i h LYS 280 N 3.72 -0.55 -5.28 0.44 3.64 -1.28 -3.21 116.57 114.05 1u9i h LYS 280 Ca -0.48 0.04 -0.71 0.00 -1.27 0.00 0.00 60.65 58.23 1u9i h LYS 280 Cb 1.20 0.13 -0.13 0.00 -0.41 0.00 0.00 32.23 33.01 1u9i h LYS 280 CO 0.65 -0.37 1.75 -0.51 -2.27 0.00 0.00 179.45 178.70 1u9i s ASP 281 N -4.71 6.96 0.05 4.20 1.01 -1.26 -3.71 116.67 119.20 1u9i s ASP 281 Ca -0.16 -2.72 -0.27 0.00 0.71 0.00 0.00 52.55 50.11 1u9i s ASP 281 Cb 0.06 -2.49 0.09 0.00 1.01 0.00 0.00 42.92 41.59 1u9i s ASP 281 CO 0.64 -0.95 0.75 -0.94 0.21 0.00 0.00 175.17 174.88 1u9i s SER 282 N 3.51 -0.48 -0.18 0.27 1.04 -1.21 -4.73 113.70 111.92 1u9i s SER 282 Ca 0.48 0.08 -0.00 0.00 0.48 0.00 0.00 55.95 56.99 1u9i s SER 282 Cb 0.00 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.61 1u9i s SER 282 CO 0.04 -0.75 -0.14 -0.63 0.98 0.00 0.00 173.24 172.73 1u9i s ILE 283 N -3.11 2.66 -0.02 -1.02 -1.09 -1.26 -2.87 121.20 114.48 1u9i s ILE 283 Ca 0.02 -0.75 -0.00 0.00 -2.23 0.00 0.00 60.65 57.68 1u9i s ILE 283 Cb -0.01 -2.14 -0.04 0.00 -1.58 0.00 0.00 42.46 38.69 1u9i s ILE 283 CO -0.09 0.50 0.03 -0.63 -1.23 0.00 0.00 174.94 173.53 1u9i s ILE 284 N 1.09 4.42 -0.12 2.92 1.09 0.65 -1.80 121.20 129.45 1u9i s ILE 284 Ca 0.00 -0.45 0.02 0.00 -1.10 0.00 0.00 60.65 59.12 1u9i s ILE 284 Cb -0.14 -2.97 0.02 0.00 -1.06 0.00 0.00 42.46 38.30 1u9i s ILE 284 CO -0.04 0.41 -0.16 -0.22 -0.10 0.00 0.00 174.94 174.83 1u9i s LEU 285 N -1.49 1.78 -0.27 2.97 2.96 0.64 -0.35 118.68 124.92 1u9i s LEU 285 Ca 0.19 -0.47 -0.04 0.00 -0.22 0.00 0.00 54.13 53.60 1u9i s LEU 285 Cb -0.12 -1.17 0.02 0.00 0.50 0.00 0.00 46.19 45.43 1u9i s LEU 285 CO 0.10 0.01 -0.00 0.00 -1.32 0.00 0.00 176.35 175.14 1u9i s ALA 286 N 1.06 2.85 0.08 5.97 0.00 -0.27 0.90 121.76 132.35 1u9i s ALA 286 Ca -0.04 -1.51 0.09 0.00 0.00 0.00 0.00 51.96 50.50 1u9i s ALA 286 Cb -0.15 -1.89 -0.03 0.00 0.00 0.00 0.00 23.12 21.05 1u9i s ALA 286 CO -0.04 -0.93 -0.24 0.99 0.00 0.00 0.00 175.76 175.54 1u9i s THR 287 N 1.38 2.00 0.00 0.00 2.01 -0.50 -0.92 115.64 119.61 1u9i s THR 287 Ca 0.00 -1.48 0.00 0.00 0.31 0.00 0.00 61.69 60.52 1u9i s THR 287 Cb -0.17 -1.75 0.00 0.00 0.01 0.00 0.00 72.50 70.58 1u9i s THR 287 CO -0.01 0.18 0.00 0.61 -0.69 0.00 0.00 174.62 174.71 1u9i n GLY 288 N 1.43 1.40 3.75 4.40 0.00 -1.00 -0.57 105.19 114.60 1u9i n GLY 288 Ca -0.18 -0.89 -0.30 0.00 0.00 0.00 0.00 46.02 44.65 1u9i n GLY 288 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u9i s ALA 289 N -2.00 1.88 0.46 4.61 0.00 -1.26 -2.05 121.76 123.40 1u9i s ALA 289 Ca 0.00 -0.07 -0.23 0.00 0.00 0.00 0.00 51.96 51.66 1u9i s ALA 289 Cb 0.00 -3.17 -0.09 0.00 0.00 0.00 0.00 23.12 19.85 1u9i s ALA 289 CO 0.00 -2.06 1.06 -2.37 0.00 0.00 0.00 175.76 172.38 1u9i n THR 290 N -3.68 2.71 0.00 0.00 5.66 -1.26 -1.96 114.28 115.75 1u9i n THR 290 Ca 0.07 -0.50 0.00 0.00 -3.05 0.00 0.00 64.05 60.57 1u9i n THR 290 Cb 0.55 -1.24 0.00 0.00 -1.55 0.00 0.00 70.33 68.09 1u9i n THR 290 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1u9i n GLY 291 N 1.13 2.97 0.28 1.09 0.00 -1.26 -4.90 105.19 104.50 1u9i n GLY 291 Ca 0.10 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.25 1u9i n GLY 291 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1u9i h THR 292 N 0.00 0.54 0.00 2.61 1.35 -1.74 -3.47 112.91 112.20 1u9i h THR 292 Ca 0.00 -0.35 0.00 0.00 -0.55 0.00 0.00 66.41 65.51 1u9i h THR 292 Cb 0.00 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 67.65 1u9i h THR 292 CO 0.00 0.08 0.00 0.61 -0.25 0.00 0.00 175.52 175.96 1u9i n GLY 293 N -0.90 1.44 0.15 5.82 0.00 -1.26 -4.89 105.19 105.56 1u9i n GLY 293 Ca -0.02 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.93 1u9i n GLY 293 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1u9i h LYS 294 N 0.87 0.29 -0.78 1.61 6.56 -1.91 -0.88 116.57 122.33 1u9i h LYS 294 Ca 0.00 -0.02 0.13 0.00 -1.06 0.00 0.00 60.65 59.71 1u9i h LYS 294 Cb 0.00 -0.06 -0.05 0.00 -0.57 0.00 0.00 32.23 31.54 1u9i h LYS 294 CO 0.00 0.19 0.51 1.15 -2.06 0.00 0.00 179.45 179.24 1u9i h THR 295 N 0.29 0.84 0.39 -0.16 2.02 -1.97 -1.76 112.91 112.56 1u9i h THR 295 Ca 0.15 -0.18 -0.02 0.00 0.77 0.00 0.00 66.41 67.13 1u9i h THR 295 Cb 0.11 0.26 0.00 0.00 -1.74 0.00 0.00 68.15 66.78 1u9i h THR 295 CO -0.14 0.10 -0.19 0.25 0.37 0.00 0.00 175.52 175.91 1u9i h LEU 296 N 0.54 -0.44 -1.34 2.58 5.85 -1.59 -2.48 115.31 118.43 1u9i h LEU 296 Ca 0.38 -0.09 0.18 0.00 0.84 0.00 0.00 57.88 59.19 1u9i h LEU 296 Cb 0.72 0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.79 1u9i h LEU 296 CO -0.14 -0.16 0.59 -0.07 -0.34 0.00 0.00 178.44 178.32 1u9i h LEU 297 N -0.72 0.57 0.15 2.25 3.38 -0.67 -1.07 115.31 119.19 1u9i h LEU 297 Ca -0.05 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1u9i h LEU 297 Cb 0.50 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1u9i h LEU 297 CO 0.09 0.25 -0.07 0.58 0.09 0.00 0.00 178.44 179.38 1u9i h VAL 298 N 0.58 0.90 -0.10 1.22 2.07 -1.22 0.40 116.25 120.11 1u9i h VAL 298 Ca 0.48 -0.19 0.04 0.00 0.82 0.00 0.00 66.70 67.85 1u9i h VAL 298 Cb 0.95 1.02 -0.06 0.00 -1.52 0.00 0.00 31.29 31.67 1u9i h VAL 298 CO -0.22 0.05 -0.41 0.28 0.02 0.00 0.00 177.57 177.28 1u9i h SER 299 N -0.29 -1.27 -0.39 0.57 0.02 -0.76 0.94 113.55 112.38 1u9i h SER 299 Ca -0.02 0.17 0.09 0.00 -0.84 0.00 0.00 61.79 61.19 1u9i h SER 299 Cb 0.23 0.51 -0.02 0.00 0.14 0.00 0.00 62.40 63.26 1u9i h SER 299 CO 0.03 -0.43 0.27 -0.09 -1.14 0.00 0.00 176.83 175.48 1u9i h ARG 300 N -0.50 0.11 -0.14 3.45 9.65 -1.24 0.27 114.38 125.98 1u9i h ARG 300 Ca 0.07 -0.01 -0.19 0.00 -1.10 0.00 0.00 59.98 58.75 1u9i h ARG 300 Cb 0.62 -0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 29.18 1u9i h ARG 300 CO -0.37 0.08 -0.69 0.35 2.80 0.00 0.00 179.97 182.14 1u9i h PHE 301 N 0.12 0.76 0.28 2.20 3.57 0.55 -2.48 116.94 121.94 1u9i h PHE 301 Ca 0.18 -0.32 -0.01 0.00 3.53 0.00 0.00 57.97 61.35 1u9i h PHE 301 Cb 0.56 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.18 1u9i h PHE 301 CO -0.00 1.09 -0.13 0.28 -2.23 0.00 0.00 178.31 177.32 1u9i h VAL 302 N 0.41 0.52 -0.81 1.41 2.07 0.87 -3.25 116.25 117.47 1u9i h VAL 302 Ca -0.02 -0.86 0.18 0.00 0.82 0.00 0.00 66.70 66.82 1u9i h VAL 302 Cb 1.27 0.85 -0.12 0.00 -1.52 0.00 0.00 31.29 31.77 1u9i h VAL 302 CO 0.13 0.13 0.28 -0.08 0.02 0.00 0.00 177.57 178.04 1u9i h GLU 303 N -0.95 0.33 0.00 1.57 4.81 -0.64 -0.88 114.58 118.82 1u9i h GLU 303 Ca -0.04 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 1u9i h GLU 303 Cb 0.49 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.79 1u9i h GLU 303 CO 0.06 0.22 -0.04 -0.97 -0.73 0.00 0.00 179.01 177.55 1u9i h ASN 304 N 0.34 0.00 0.63 1.04 -0.73 -1.50 -0.51 115.58 114.85 1u9i h ASN 304 Ca 0.48 0.00 -0.14 0.00 1.87 0.00 0.00 56.30 58.51 1u9i h ASN 304 Cb 0.85 0.00 -0.02 0.00 0.27 0.00 0.00 38.32 39.43 1u9i h ASN 304 CO -0.52 0.04 -0.65 0.00 -0.37 0.00 0.00 177.43 175.93 1u9i h ALA 305 N 1.96 0.92 0.24 1.57 0.00 -1.19 -3.04 119.26 119.72 1u9i h ALA 305 Ca -0.00 -0.59 -0.33 0.00 0.00 0.00 0.00 54.91 53.99 1u9i h ALA 305 Cb 0.06 -0.10 0.03 0.00 0.00 0.00 0.00 17.79 17.79 1u9i h ALA 305 CO 0.00 0.80 -1.45 0.00 0.00 0.00 0.00 179.25 178.61 1u9i h ALA 307 N 0.22 1.46 -0.41 0.00 0.00 -1.09 0.60 119.26 120.04 1u9i h ALA 307 Ca -0.24 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.61 1u9i h ALA 307 Cb 2.14 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.91 1u9i h ALA 307 CO 0.27 -0.19 0.04 0.09 0.00 0.00 0.00 179.25 179.46 1u9i n ASN 308 N -3.43 4.26 -3.73 0.00 3.02 -1.15 -4.97 115.26 109.26 1u9i n ASN 308 Ca -0.01 -3.12 -0.26 0.00 -0.03 0.00 0.00 54.58 51.16 1u9i n ASN 308 Cb 0.24 -0.62 0.03 0.00 -0.61 0.00 0.00 39.78 38.82 1u9i n ASN 308 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1u9i n LYS 309 N -0.30 -2.84 -4.32 3.52 5.02 0.21 -5.00 118.16 114.44 1u9i n LYS 309 Ca 0.27 0.52 -0.20 0.00 -2.02 0.00 0.00 58.31 56.88 1u9i n LYS 309 Cb 1.05 -4.63 -0.13 0.00 -0.02 0.00 0.00 35.03 31.30 1u9i n LYS 309 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1u9i s GLU 310 N -6.02 0.92 0.12 1.97 2.02 0.17 -4.99 118.70 112.88 1u9i s GLU 310 Ca 0.22 -0.80 -0.25 0.00 0.02 0.00 0.00 54.97 54.16 1u9i s GLU 310 Cb -0.07 -0.93 -0.07 0.00 0.10 0.00 0.00 34.13 33.16 1u9i s GLU 310 CO 0.85 0.23 0.78 1.03 0.02 0.00 0.00 175.26 178.16 1u9i s ARG 311 N -1.26 4.55 -0.02 1.61 0.52 -1.25 -3.56 118.95 119.53 1u9i s ARG 311 Ca 0.01 1.14 -0.05 0.00 -0.52 0.00 0.00 55.73 56.30 1u9i s ARG 311 Cb -0.08 -3.31 0.00 0.00 0.52 0.00 0.00 34.95 32.08 1u9i s ARG 311 CO 0.01 0.44 0.12 0.00 0.02 0.00 0.00 175.30 175.89 1u9i s ALA 312 N -0.66 -0.28 -0.10 2.13 0.00 0.27 0.62 121.76 123.74 1u9i s ALA 312 Ca 0.37 0.01 0.01 0.00 0.00 0.00 0.00 51.96 52.35 1u9i s ALA 312 Cb -0.22 -0.01 -0.02 0.00 0.00 0.00 0.00 23.12 22.87 1u9i s ALA 312 CO 0.25 -0.15 -0.13 0.42 0.00 0.00 0.00 175.76 176.15 1u9i s ILE 313 N -0.84 3.05 -0.36 0.00 1.01 -0.68 -1.17 121.20 122.21 1u9i s ILE 313 Ca -0.09 -0.68 -0.03 0.00 0.00 0.00 0.00 60.65 59.84 1u9i s ILE 313 Cb -0.05 -2.25 0.08 0.00 0.01 0.00 0.00 42.46 40.24 1u9i s ILE 313 CO 0.01 0.55 0.12 -0.22 0.00 0.00 0.00 174.94 175.39 1u9i s LEU 314 N 0.01 4.63 -0.46 2.97 2.96 0.06 -1.18 118.68 127.67 1u9i s LEU 314 Ca -0.04 -1.59 -0.21 0.00 -0.22 0.00 0.00 54.13 52.07 1u9i s LEU 314 Cb -0.14 -1.80 0.03 0.00 0.50 0.00 0.00 46.19 44.77 1u9i s LEU 314 CO 0.04 -0.41 0.68 -0.36 -1.32 0.00 0.00 176.35 174.98 1u9i s PHE 315 N 1.24 3.03 -0.18 5.38 0.40 -0.49 -1.21 117.98 126.14 1u9i s PHE 315 Ca 0.02 -0.09 -0.06 0.00 -0.60 0.00 0.00 56.93 56.20 1u9i s PHE 315 Cb -0.21 -3.47 -0.03 0.00 0.51 0.00 0.00 43.02 39.81 1u9i s PHE 315 CO -0.02 -0.95 0.03 0.00 0.70 0.00 0.00 175.22 174.98 1u9i s ALA 316 N 2.95 3.21 -0.15 5.36 0.00 -1.26 -1.11 121.76 130.76 1u9i s ALA 316 Ca 0.23 -0.84 0.06 0.00 0.00 0.00 0.00 51.96 51.41 1u9i s ALA 316 Cb -0.14 -1.82 0.13 0.00 0.00 0.00 0.00 23.12 21.29 1u9i s ALA 316 CO 0.19 0.07 1.08 0.66 0.00 0.00 0.00 175.76 177.76 1u9i n TYR 317 N 3.79 0.10 0.00 0.00 4.02 -1.22 -1.55 117.16 122.30 1u9i n TYR 317 Ca -0.17 -0.63 0.00 0.00 -0.01 0.00 0.00 57.90 57.09 1u9i n TYR 317 Cb 0.52 -0.08 0.00 0.00 -0.02 0.00 0.00 39.34 39.76 1u9i n TYR 317 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1u9i n GLU 318 N -0.59 0.93 -4.30 -0.72 1.02 -1.26 -4.55 120.64 111.17 1u9i n GLU 318 Ca 0.06 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.90 1u9i n GLU 318 Cb 0.39 -0.78 -0.10 0.00 -0.02 0.00 0.00 31.44 30.93 1u9i n GLU 318 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1u9i s GLU 319 N -1.56 2.17 0.97 3.49 2.02 -1.26 -5.12 118.70 119.41 1u9i s GLU 319 Ca 0.00 -0.98 -0.12 0.00 0.02 0.00 0.00 54.97 53.89 1u9i s GLU 319 Cb 0.00 -2.32 0.17 0.00 0.10 0.00 0.00 34.13 32.08 1u9i s GLU 319 CO 0.00 0.52 1.09 -1.54 0.02 0.00 0.00 175.26 175.35 1u9i s SER 320 N -2.03 2.84 0.30 -0.19 1.04 -1.26 -4.80 113.70 109.59 1u9i s SER 320 Ca 0.20 1.37 0.02 0.00 0.48 0.00 0.00 55.95 58.01 1u9i s SER 320 Cb -0.11 -2.04 0.48 0.00 0.10 0.00 0.00 66.02 64.45 1u9i s SER 320 CO 0.12 -3.02 1.82 0.03 0.98 0.00 0.00 173.24 173.17 1u9i h ARG 321 N -1.82 0.64 0.21 4.02 3.08 -1.96 -1.86 114.38 116.69 1u9i h ARG 321 Ca -0.53 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 59.36 1u9i h ARG 321 Cb 1.31 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.28 1u9i h ARG 321 CO 0.55 0.66 -0.10 0.00 -1.07 0.00 0.00 179.97 180.01 1u9i h ALA 322 N 1.40 -0.28 -0.51 0.04 0.00 -2.00 -3.10 119.26 114.81 1u9i h ALA 322 Ca 0.13 -0.21 0.08 0.00 0.00 0.00 0.00 54.91 54.91 1u9i h ALA 322 Cb 0.38 0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.22 1u9i h ALA 322 CO 0.01 -0.41 0.15 0.37 0.00 0.00 0.00 179.25 179.37 1u9i h GLN 323 N -0.77 0.30 -0.94 0.00 4.15 -1.90 -0.09 115.11 115.85 1u9i h GLN 323 Ca -0.03 -0.02 0.19 0.00 0.77 0.00 0.00 58.65 59.56 1u9i h GLN 323 Cb 0.51 -0.07 -0.08 0.00 0.21 0.00 0.00 27.48 28.05 1u9i h GLN 323 CO 0.05 0.20 0.60 -0.07 -1.93 0.00 0.00 178.83 177.68 1u9i h LEU 324 N 0.31 0.57 -0.06 -2.39 3.38 -1.40 -0.62 115.31 115.10 1u9i h LEU 324 Ca 0.25 0.06 -0.07 0.00 0.09 0.00 0.00 57.88 58.21 1u9i h LEU 324 Cb 0.30 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1u9i h LEU 324 CO -0.28 0.23 -0.24 -0.07 0.09 0.00 0.00 178.44 178.17 1u9i h LEU 325 N 0.57 0.31 -0.06 1.67 3.38 -0.99 -1.26 115.31 118.93 1u9i h LEU 325 Ca 0.50 -0.64 0.02 0.00 0.09 0.00 0.00 57.88 57.85 1u9i h LEU 325 Cb 1.02 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.66 1u9i h LEU 325 CO -0.24 0.90 -0.04 -0.09 0.09 0.00 0.00 178.44 179.05 1u9i h ARG 326 N -0.26 -0.04 -0.56 1.13 2.43 -0.42 -0.68 114.38 115.98 1u9i h ARG 326 Ca -0.01 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.07 1u9i h ARG 326 Cb 0.88 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.42 1u9i h ARG 326 CO 0.05 -0.03 -0.01 -0.91 -1.51 0.00 0.00 179.97 177.56 1u9i h ASN 327 N -0.04 0.95 -0.40 -3.80 2.35 -1.23 -1.49 115.58 111.92 1u9i h ASN 327 Ca 0.04 -0.26 -0.02 0.00 -0.55 0.00 0.00 56.30 55.51 1u9i h ASN 327 Cb 0.10 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.19 1u9i h ASN 327 CO -0.08 1.01 0.19 0.00 -1.65 0.00 0.00 177.43 176.89 1u9i h ALA 328 N 1.08 0.52 -0.76 -0.83 0.00 -0.97 -2.29 119.26 116.01 1u9i h ALA 328 Ca 0.16 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1u9i h ALA 328 Cb 0.54 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1u9i h ALA 328 CO 0.03 0.09 0.29 -0.92 0.00 0.00 0.00 179.25 178.74 1u9i h TYR 329 N 0.50 1.17 0.00 0.00 3.20 -0.99 -1.05 116.97 119.81 1u9i h TYR 329 Ca 0.14 -0.09 -0.00 0.00 3.14 0.00 0.00 58.73 61.91 1u9i h TYR 329 Cb 0.13 -0.35 -0.00 0.00 1.54 0.00 0.00 36.73 38.06 1u9i h TYR 329 CO -0.01 0.90 -0.00 0.77 -1.64 0.00 0.00 178.16 178.18 1u9i h SER 330 N 1.10 0.00 -0.56 -2.11 0.02 -0.86 0.42 113.55 111.57 1u9i h SER 330 Ca 0.25 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 61.12 1u9i h SER 330 Cb 0.23 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.73 1u9i h SER 330 CO -0.02 0.00 0.09 0.79 -1.14 0.00 0.00 176.83 176.55 1u9i n TRP 331 N -3.10 1.94 0.00 3.45 8.01 -0.42 -4.39 117.44 122.93 1u9i n TRP 331 Ca -0.03 -0.95 0.00 0.00 -1.31 0.00 0.00 57.50 55.21 1u9i n TRP 331 Cb 0.10 -0.53 0.00 0.00 -2.01 0.00 0.00 31.31 28.87 1u9i n TRP 331 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1u9i n GLY 332 N 0.06 1.89 0.00 6.99 0.00 0.15 -4.43 105.19 109.85 1u9i n GLY 332 Ca 0.31 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1u9i n GLY 332 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1u9i n MET 333 N 8.65 0.00 -3.01 1.61 0.00 -1.26 -3.50 117.12 119.61 1u9i n MET 333 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 57.70 57.28 1u9i n MET 333 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 33.22 33.16 1u9i n MET 333 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 1u9i s ASP 334 N 0.00 6.45 0.29 3.17 -1.08 -1.26 -3.46 116.67 120.78 1u9i s ASP 334 Ca 0.00 0.08 0.15 0.00 -0.52 0.00 0.00 52.55 52.26 1u9i s ASP 334 Cb 0.00 -2.37 0.23 0.00 -1.46 0.00 0.00 42.92 39.32 1u9i s ASP 334 CO 0.00 -0.77 1.51 -0.26 0.52 0.00 0.00 175.17 176.18 1u9i h PHE 335 N 8.69 0.00 0.07 -5.34 0.05 -1.88 -3.27 116.94 115.26 1u9i h PHE 335 Ca -0.25 0.00 0.01 0.00 3.82 0.00 0.00 57.97 61.55 1u9i h PHE 335 Cb 1.09 0.00 -0.05 0.00 2.00 0.00 0.00 35.95 39.00 1u9i h PHE 335 CO 0.78 0.53 -0.49 0.93 -0.18 0.00 0.00 178.31 179.88 1u9i h GLU 336 N 0.00 -0.64 -0.65 1.51 4.39 -1.94 -2.54 114.58 114.70 1u9i h GLU 336 Ca -0.01 0.04 0.07 0.00 0.34 0.00 0.00 59.36 59.81 1u9i h GLU 336 Cb 1.28 0.15 -0.06 0.00 -0.10 0.00 0.00 28.75 30.02 1u9i h GLU 336 CO 0.07 -0.43 0.33 1.49 -1.16 0.00 0.00 179.01 179.32 1u9i h GLU 337 N -0.66 0.59 -0.80 2.33 4.57 -2.00 -2.13 114.58 116.47 1u9i h GLU 337 Ca -0.00 -0.04 0.19 0.00 -1.18 0.00 0.00 59.36 58.34 1u9i h GLU 337 Cb 0.68 -0.13 -0.13 0.00 -0.16 0.00 0.00 28.75 29.01 1u9i h GLU 337 CO -0.28 0.39 0.18 0.52 -1.18 0.00 0.00 179.01 178.63 1u9i h MET 338 N 0.60 0.22 -0.03 1.92 2.86 -1.51 0.38 114.93 119.37 1u9i h MET 338 Ca 0.30 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.92 1u9i h MET 338 Cb 0.26 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.87 1u9i h MET 338 CO -0.22 0.15 -0.02 0.93 1.06 0.00 0.00 176.91 178.81 1u9i h GLU 339 N 0.23 0.07 0.18 1.72 5.08 -1.01 -2.08 114.58 118.77 1u9i h GLU 339 Ca 0.47 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.81 1u9i h GLU 339 Cb 0.88 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.10 1u9i h GLU 339 CO -0.59 0.48 -0.28 0.00 -1.00 0.00 0.00 179.01 177.62 1u9i h ARG 340 N -0.34 -0.51 0.00 2.33 3.08 -1.01 0.97 114.38 118.90 1u9i h ARG 340 Ca 0.01 0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1u9i h ARG 340 Cb 0.46 0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.63 1u9i h ARG 340 CO 0.01 -0.34 0.04 1.04 -1.07 0.00 0.00 179.97 179.65 1u9i n GLN 341 N -5.39 0.00 -3.59 0.04 6.02 0.04 -4.78 117.38 109.73 1u9i n GLN 341 Ca -0.07 0.26 -0.23 0.00 -0.01 0.00 0.00 57.00 56.95 1u9i n GLN 341 Cb 0.30 -1.54 0.08 0.00 1.02 0.00 0.00 30.24 30.09 1u9i n GLN 341 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1u9i n ASN 342 N -1.23 -4.88 -0.02 1.08 4.13 0.34 -4.90 115.26 109.78 1u9i n ASN 342 Ca 0.00 -0.60 -0.00 0.00 1.68 0.00 0.00 54.58 55.66 1u9i n ASN 342 Cb 0.04 -4.92 -0.04 0.00 -1.54 0.00 0.00 39.78 33.32 1u9i n ASN 342 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1u9i n LEU 343 N -4.72 0.00 -4.14 3.41 4.77 -0.84 -4.89 117.00 110.58 1u9i n LEU 343 Ca -0.08 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.62 1u9i n LEU 343 Cb 0.59 0.08 -0.17 0.00 -2.33 0.00 0.00 43.42 41.59 1u9i n LEU 343 CO 0.65 0.08 -0.52 -0.22 -1.33 0.00 0.00 177.39 176.05 1u9i s LEU 344 N -3.99 1.91 -0.14 2.23 1.98 -0.86 -0.56 118.68 119.25 1u9i s LEU 344 Ca -0.03 -0.43 0.02 0.00 -2.89 0.00 0.00 54.13 50.80 1u9i s LEU 344 Cb 0.03 -1.13 0.02 0.00 0.66 0.00 0.00 46.19 45.76 1u9i s LEU 344 CO 0.24 0.13 -0.18 -0.75 -1.89 0.00 0.00 176.35 173.89 1u9i s LYS 345 N 0.34 2.67 -0.14 1.98 2.20 -0.31 -4.01 119.74 122.46 1u9i s LYS 345 Ca -0.13 -0.72 -0.06 0.00 -0.36 0.00 0.00 55.97 54.70 1u9i s LYS 345 Cb -0.16 -2.26 -0.04 0.00 -1.51 0.00 0.00 37.83 33.86 1u9i s LYS 345 CO 0.05 -0.11 0.06 0.42 -0.36 0.00 0.00 175.35 175.41 1u9i s ILE 346 N 1.10 4.82 0.00 5.43 1.01 -1.26 -0.76 121.20 131.54 1u9i s ILE 346 Ca -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 60.65 60.59 1u9i s ILE 346 Cb -0.14 -3.12 0.00 0.00 0.01 0.00 0.00 42.46 39.21 1u9i s ILE 346 CO -0.06 0.53 0.00 0.52 0.00 0.00 0.00 174.94 175.93 1u9i n VAL 347 N 2.83 0.00 -0.51 2.92 0.31 -0.35 -4.96 118.33 118.56 1u9i n VAL 347 Ca -0.18 0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.23 1u9i n VAL 347 Cb 0.53 -1.02 0.00 0.00 -0.91 0.00 0.00 33.84 32.45 1u9i n VAL 347 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1u9i s ALA 349 N -0.17 -2.13 0.25 0.00 0.00 -0.60 -4.95 121.76 114.16 1u9i s ALA 349 Ca 0.00 1.77 -0.30 0.00 0.00 0.00 0.00 51.96 53.43 1u9i s ALA 349 Cb 0.00 -1.55 -0.09 0.00 0.00 0.00 0.00 23.12 21.48 1u9i s ALA 349 CO 0.00 -0.18 1.10 0.71 0.00 0.00 0.00 175.76 177.39 1u9i s TYR 350 N -0.45 3.58 0.55 0.00 1.51 -1.26 -4.26 117.35 117.02 1u9i s TYR 350 Ca 0.07 1.67 0.35 0.00 -1.01 0.00 0.00 57.07 58.14 1u9i s TYR 350 Cb -0.03 -3.28 1.95 0.00 -0.11 0.00 0.00 41.96 40.48 1u9i s TYR 350 CO -0.10 -0.58 2.25 -1.35 -1.11 0.00 0.00 175.55 174.65 1u9i h PRO 351 N 4.19 0.00 0.00 -1.71 0.11 -1.87 -0.98 132.00 131.75 1u9i h PRO 351 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1u9i h PRO 351 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1u9i h PRO 351 CO 0.69 0.02 0.00 0.39 -0.21 0.00 0.00 178.00 178.89 1u9i n GLU 352 N -3.47 0.10 0.00 1.05 4.71 -1.26 -3.49 120.64 118.27 1u9i n GLU 352 Ca -0.03 0.09 0.11 0.00 -0.01 0.00 0.00 57.16 57.32 1u9i n GLU 352 Cb 0.12 -1.61 0.63 0.00 -1.01 0.00 0.00 31.44 29.57 1u9i n GLU 352 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 1u9i n SER 353 N -1.78 0.00 0.00 1.62 3.41 -0.37 -4.86 113.62 111.63 1u9i n SER 353 Ca 0.06 -0.70 0.00 0.00 -0.26 0.00 0.00 58.87 57.97 1u9i n SER 353 Cb 0.36 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.31 1u9i n SER 353 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1u9i n ALA 354 N -0.98 0.00 -1.94 7.33 0.00 -1.23 -5.07 120.51 118.62 1u9i n ALA 354 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.31 1u9i n ALA 354 Cb 0.07 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.56 1u9i n ALA 354 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1u9i s GLY 355 N 0.00 1.62 0.21 0.00 0.00 -1.26 -4.86 107.32 103.04 1u9i s GLY 355 Ca 0.00 -0.40 -0.11 0.00 0.00 0.00 0.00 44.72 44.21 1u9i s GLY 355 CO 0.00 -0.07 1.66 1.41 0.00 0.00 0.00 173.10 176.10 1u9i h LEU 356 N -0.49 -0.27 -0.50 0.66 4.07 -1.94 -1.98 115.31 114.86 1u9i h LEU 356 Ca -0.45 0.15 0.09 0.00 0.08 0.00 0.00 57.88 57.75 1u9i h LEU 356 Cb 1.25 0.27 -0.10 0.00 1.08 0.00 0.00 40.66 43.16 1u9i h LEU 356 CO 0.63 -0.11 -0.35 1.05 -1.08 0.00 0.00 178.44 178.58 1u9i h GLU 357 N 0.12 -0.21 0.13 1.13 4.11 -1.96 0.23 114.58 118.13 1u9i h GLU 357 Ca 0.32 0.01 0.01 0.00 0.07 0.00 0.00 59.36 59.78 1u9i h GLU 357 Cb 0.52 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.80 1u9i h GLU 357 CO -0.53 -0.14 -0.18 -0.44 0.07 0.00 0.00 179.01 177.79 1u9i h ASP 358 N -0.22 -0.49 -0.34 3.06 3.32 -1.75 -1.55 116.42 118.45 1u9i h ASP 358 Ca 0.20 0.05 0.07 0.00 0.02 0.00 0.00 57.03 57.37 1u9i h ASP 358 Cb 0.55 0.18 -0.08 0.00 0.22 0.00 0.00 39.33 40.20 1u9i h ASP 358 CO -0.62 -0.26 -0.30 0.45 -1.72 0.00 0.00 179.24 176.79 1u9i h HIS 359 N -0.36 -0.81 -0.58 4.55 3.86 -0.78 0.17 115.15 121.19 1u9i h HIS 359 Ca 0.02 0.05 0.11 0.00 -1.16 0.00 0.00 60.37 59.39 1u9i h HIS 359 Cb 0.37 0.41 -0.09 0.00 1.06 0.00 0.00 27.41 29.16 1u9i h HIS 359 CO -0.17 -0.36 0.10 1.25 0.86 0.00 0.00 177.93 179.60 1u9i h LEU 360 N -0.26 -0.06 -0.47 2.43 6.46 -0.22 0.38 115.31 123.58 1u9i h LEU 360 Ca 0.16 0.12 -0.06 0.00 -0.12 0.00 0.00 57.88 57.98 1u9i h LEU 360 Cb 0.52 0.17 -0.02 0.00 -0.73 0.00 0.00 40.66 40.60 1u9i h LEU 360 CO -0.49 -0.02 0.06 -0.61 -0.62 0.00 0.00 178.44 176.77 1u9i h GLN 361 N 0.22 0.78 -0.93 1.25 4.15 -0.31 -1.80 115.11 118.48 1u9i h GLN 361 Ca 0.30 -0.22 -0.00 0.00 0.77 0.00 0.00 58.65 59.50 1u9i h GLN 361 Cb 0.46 -0.09 -0.04 0.00 0.21 0.00 0.00 27.48 28.02 1u9i h GLN 361 CO -0.41 0.80 0.57 0.82 -1.93 0.00 0.00 178.83 178.67 1u9i h ILE 362 N 0.65 1.25 -0.42 2.39 1.08 0.42 -0.63 117.51 122.24 1u9i h ILE 362 Ca 0.14 -0.55 -0.03 0.00 -0.39 0.00 0.00 64.86 64.04 1u9i h ILE 362 Cb 0.41 -0.06 -0.02 0.00 -3.07 0.00 0.00 36.82 34.08 1u9i h ILE 362 CO 0.01 0.27 0.16 0.40 -0.69 0.00 0.00 178.15 178.29 1u9i h ILE 363 N 1.28 1.21 0.60 -0.67 1.08 -0.76 -1.19 117.51 119.06 1u9i h ILE 363 Ca 0.33 -0.65 -0.03 0.00 -0.39 0.00 0.00 64.86 64.12 1u9i h ILE 363 Cb -0.06 0.84 0.00 0.00 -3.07 0.00 0.00 36.82 34.53 1u9i h ILE 363 CO -0.06 0.24 -0.30 0.11 -0.69 0.00 0.00 178.15 177.44 1u9i h LYS 364 N 0.54 -0.80 -0.26 2.37 1.57 -0.82 -1.90 116.57 117.27 1u9i h LYS 364 Ca 0.14 0.05 0.06 0.00 -1.87 0.00 0.00 60.65 59.03 1u9i h LYS 364 Cb 0.21 0.18 -0.06 0.00 0.08 0.00 0.00 32.23 32.65 1u9i h LYS 364 CO -0.01 -0.53 -0.10 0.66 -0.57 0.00 0.00 179.45 178.90 1u9i h SER 365 N -0.83 -0.34 -0.97 0.86 4.64 -1.09 0.31 113.55 116.12 1u9i h SER 365 Ca -0.08 0.09 0.21 0.00 -0.47 0.00 0.00 61.79 61.54 1u9i h SER 365 Cb 0.65 0.20 -0.09 0.00 -0.31 0.00 0.00 62.40 62.85 1u9i h SER 365 CO 0.13 -0.13 0.62 -0.33 -0.87 0.00 0.00 176.83 176.25 1u9i h GLU 366 N -0.05 0.53 -0.39 4.77 5.08 -1.10 0.15 114.58 123.58 1u9i h GLU 366 Ca 0.13 -0.03 -0.14 0.00 -1.00 0.00 0.00 59.36 58.32 1u9i h GLU 366 Cb 0.25 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1u9i h GLU 366 CO -0.30 0.35 -0.32 0.82 -1.00 0.00 0.00 179.01 178.56 1u9i h ILE 367 N 0.55 1.28 -0.25 3.13 1.08 -0.14 -3.00 117.51 120.15 1u9i h ILE 367 Ca 0.54 -1.49 -0.16 0.00 -0.39 0.00 0.00 64.86 63.37 1u9i h ILE 367 Cb 1.13 1.32 0.00 0.00 -3.07 0.00 0.00 36.82 36.20 1u9i h ILE 367 CO -0.28 0.50 -0.45 0.78 -0.69 0.00 0.00 178.15 178.01 1u9i h ASN 368 N 0.72 0.83 0.00 1.72 2.35 0.37 -0.27 115.58 121.31 1u9i h ASN 368 Ca 0.07 -0.53 0.00 0.00 -0.55 0.00 0.00 56.30 55.29 1u9i h ASN 368 Cb 0.89 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 39.02 1u9i h ASN 368 CO 0.08 1.21 0.00 0.47 -1.65 0.00 0.00 177.43 177.54 1u9i n ASP 369 N -4.14 0.27 0.00 5.81 8.00 -0.05 -3.69 116.55 122.74 1u9i n ASP 369 Ca -0.05 -1.91 0.00 0.00 0.71 0.00 0.00 54.79 53.54 1u9i n ASP 369 Cb 0.57 -0.13 0.00 0.00 -0.02 0.00 0.00 41.12 41.53 1u9i n ASP 369 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1u9i n PHE 370 N -0.35 0.00 -4.13 1.24 7.35 -1.14 -5.04 117.46 115.38 1u9i n PHE 370 Ca 0.00 0.00 -0.29 0.00 -0.76 0.00 0.00 57.45 56.40 1u9i n PHE 370 Cb 0.07 0.02 -0.08 0.00 0.35 0.00 0.00 39.48 39.84 1u9i n PHE 370 CO 0.00 0.00 0.00 0.36 -0.76 0.00 0.00 176.76 176.36 1u9i n LYS 371 N 0.00 -0.91 -1.17 -4.13 2.85 -0.13 -4.88 118.16 109.79 1u9i n LYS 371 Ca 0.00 0.08 -0.34 0.00 -1.05 0.00 0.00 58.31 57.00 1u9i n LYS 371 Cb 0.24 -3.16 0.12 0.00 -0.65 0.00 0.00 35.03 31.58 1u9i n LYS 371 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 177.40 175.05 1u9i n PRO 372 N -4.25 0.28 -0.06 -1.58 -0.02 -1.25 -4.75 135.00 123.36 1u9i n PRO 372 Ca -0.29 0.17 -0.06 0.00 -2.02 0.00 0.00 63.50 61.30 1u9i n PRO 372 Cb 0.62 -2.45 -0.10 0.00 -0.02 0.00 0.00 33.50 31.56 1u9i n PRO 372 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1u9i n ALA 373 N -3.15 1.69 -2.68 3.55 0.00 0.20 -4.86 120.51 115.26 1u9i n ALA 373 Ca 0.14 -0.83 -0.19 0.00 0.00 0.00 0.00 53.44 52.56 1u9i n ALA 373 Cb 0.50 -0.02 -0.13 0.00 0.00 0.00 0.00 19.45 19.81 1u9i n ALA 373 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1u9i s ARG 374 N -2.30 0.86 0.00 0.00 0.52 -1.15 -1.84 118.95 115.04 1u9i s ARG 374 Ca -0.06 -0.79 -0.01 0.00 -0.52 0.00 0.00 55.73 54.35 1u9i s ARG 374 Cb 0.04 -0.85 -0.01 0.00 0.52 0.00 0.00 34.95 34.66 1u9i s ARG 374 CO 0.51 0.20 0.01 0.42 0.02 0.00 0.00 175.30 176.46 1u9i s ILE 375 N -0.98 0.04 -0.13 1.52 -1.09 0.37 -1.69 121.20 119.25 1u9i s ILE 375 Ca -0.00 -0.35 -0.04 0.00 -2.23 0.00 0.00 60.65 58.03 1u9i s ILE 375 Cb -0.08 -0.13 0.05 0.00 -1.58 0.00 0.00 42.46 40.71 1u9i s ILE 375 CO 0.01 -0.19 0.07 0.00 -1.23 0.00 0.00 174.94 173.60 1u9i s ALA 376 N -0.57 0.46 -0.52 9.38 0.00 -0.32 -0.58 121.76 129.61 1u9i s ALA 376 Ca -0.06 -0.20 -0.17 0.00 0.00 0.00 0.00 51.96 51.53 1u9i s ALA 376 Cb -0.04 -0.91 0.08 0.00 0.00 0.00 0.00 23.12 22.25 1u9i s ALA 376 CO -0.00 -0.93 0.54 0.42 0.00 0.00 0.00 175.76 175.79 1u9i s ILE 377 N 2.10 5.04 -0.49 0.00 1.01 -0.68 -1.39 121.20 126.79 1u9i s ILE 377 Ca 0.03 -0.95 -0.28 0.00 0.00 0.00 0.00 60.65 59.44 1u9i s ILE 377 Cb -0.15 -4.28 0.02 0.00 0.01 0.00 0.00 42.46 38.06 1u9i s ILE 377 CO -0.07 -0.80 1.35 -0.62 0.00 0.00 0.00 174.94 174.80 1u9i s ASP 378 N 2.99 6.32 -0.04 3.58 -1.08 -0.26 -1.80 116.67 126.37 1u9i s ASP 378 Ca 0.09 0.51 -0.01 0.00 -0.52 0.00 0.00 52.55 52.62 1u9i s ASP 378 Cb -0.24 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 38.68 1u9i s ASP 378 CO 0.08 -1.51 0.02 -0.24 0.52 0.00 0.00 175.17 174.04 1u9i n SER 379 N 8.92 -2.35 0.10 -0.34 2.88 -1.23 -3.44 113.62 118.16 1u9i n SER 379 Ca 0.14 0.23 -0.16 0.00 -1.33 0.00 0.00 58.87 57.75 1u9i n SER 379 Cb 0.49 -1.72 -0.12 0.00 -0.75 0.00 0.00 64.21 62.11 1u9i n SER 379 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1u9i h LEU 380 N 0.60 0.49 -1.25 2.46 3.38 -0.85 -2.99 115.31 117.16 1u9i h LEU 380 Ca -0.05 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.43 1u9i h LEU 380 Cb 0.11 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1u9i h LEU 380 CO 0.01 1.35 0.12 -1.54 0.09 0.00 0.00 178.44 178.47 1u9i n SER 381 N -3.61 0.49 0.04 -0.43 3.41 -1.25 0.03 113.62 112.29 1u9i n SER 381 Ca -0.09 0.69 -0.15 0.00 -0.26 0.00 0.00 58.87 59.06 1u9i n SER 381 Cb 0.98 -0.71 -0.14 0.00 -0.26 0.00 0.00 64.21 64.08 1u9i n SER 381 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1u9i h ALA 382 N 1.68 0.41 0.00 7.33 0.00 -1.87 -3.23 119.26 123.58 1u9i h ALA 382 Ca 0.00 -1.22 0.00 0.00 0.00 0.00 0.00 54.91 53.69 1u9i h ALA 382 Cb 0.24 0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1u9i h ALA 382 CO 0.00 1.27 0.00 1.28 0.00 0.00 0.00 179.25 181.80 1u9i n LEU 383 N -3.36 0.00 -0.39 0.00 4.77 0.10 -2.54 117.00 115.58 1u9i n LEU 383 Ca -0.18 0.33 0.13 0.00 -0.03 0.00 0.00 56.01 56.26 1u9i n LEU 383 Cb 1.04 -0.33 0.45 0.00 -2.33 0.00 0.00 43.42 42.25 1u9i n LEU 383 CO 0.48 -0.06 0.77 0.00 -1.33 0.00 0.00 177.39 177.25 1u9i n ALA 384 N -1.33 2.80 -1.85 -1.18 0.00 -0.69 -4.78 120.51 113.48 1u9i n ALA 384 Ca 0.11 -0.43 -0.42 0.00 0.00 0.00 0.00 53.44 52.69 1u9i n ALA 384 Cb 0.22 -1.14 -0.03 0.00 0.00 0.00 0.00 19.45 18.50 1u9i n ALA 384 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1u9i s ARG 385 N -2.22 4.18 0.00 0.00 0.52 -1.05 -3.88 118.95 116.50 1u9i s ARG 385 Ca 0.32 2.45 0.00 0.00 -0.52 0.00 0.00 55.73 57.98 1u9i s ARG 385 Cb 0.20 -3.23 0.00 0.00 0.52 0.00 0.00 34.95 32.44 1u9i s ARG 385 CO 0.42 -0.69 0.00 0.41 0.02 0.00 0.00 175.30 175.46 1u9i n GLY 386 N 3.90 1.12 3.24 -3.53 0.00 -1.26 -4.94 105.19 103.72 1u9i n GLY 386 Ca 0.15 -0.02 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 1u9i n GLY 386 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1u9i n VAL 387 N 0.00 0.19 -2.66 1.61 0.31 -1.25 -4.92 118.33 111.61 1u9i n VAL 387 Ca 0.00 -0.50 -0.36 0.00 -0.01 0.00 0.00 64.34 63.47 1u9i n VAL 387 Cb 0.00 -0.06 -0.05 0.00 -0.91 0.00 0.00 33.84 32.82 1u9i n VAL 387 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1u9i s SER 388 N -1.02 6.92 0.27 4.52 1.04 -1.26 -4.88 113.70 119.28 1u9i s SER 388 Ca 0.56 1.92 -0.00 0.00 0.48 0.00 0.00 55.95 58.90 1u9i s SER 388 Cb -0.45 -2.57 0.54 0.00 0.10 0.00 0.00 66.02 63.64 1u9i s SER 388 CO 0.67 -0.37 1.78 -1.13 0.98 0.00 0.00 173.24 175.16 1u9i h ASN 389 N 2.52 0.61 -0.33 7.02 -0.73 -1.93 0.13 115.58 122.87 1u9i h ASN 389 Ca -0.48 0.08 -0.08 0.00 1.87 0.00 0.00 56.30 57.69 1u9i h ASN 389 Cb 1.20 -0.02 -0.02 0.00 0.27 0.00 0.00 38.32 39.75 1u9i h ASN 389 CO 0.63 0.27 -0.06 0.78 -0.37 0.00 0.00 177.43 178.67 1u9i h ASN 390 N 0.69 0.71 0.15 1.15 2.35 -1.98 0.24 115.58 118.90 1u9i h ASN 390 Ca 0.47 -0.19 -0.14 0.00 -0.55 0.00 0.00 56.30 55.89 1u9i h ASN 390 Cb 0.64 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.81 1u9i h ASN 390 CO -0.34 0.82 -0.51 0.00 -1.65 0.00 0.00 177.43 175.75 1u9i h ALA 391 N 1.25 0.84 0.31 -0.83 0.00 -1.53 -2.63 119.26 116.67 1u9i h ALA 391 Ca 0.12 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 1u9i h ALA 391 Cb 0.51 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1u9i h ALA 391 CO 0.03 0.67 -0.15 0.35 0.00 0.00 0.00 179.25 180.15 1u9i h PHE 392 N 0.32 -0.38 -1.00 0.00 3.57 -0.12 -2.37 116.94 116.95 1u9i h PHE 392 Ca 0.01 -0.01 0.19 0.00 3.53 0.00 0.00 57.97 61.69 1u9i h PHE 392 Cb 1.01 0.13 -0.10 0.00 2.79 0.00 0.00 35.95 39.78 1u9i h PHE 392 CO 0.03 -0.04 0.61 0.00 -2.23 0.00 0.00 178.31 176.69 1u9i h ARG 393 N -0.83 0.72 -0.53 1.11 3.08 -0.59 0.50 114.38 117.84 1u9i h ARG 393 Ca -0.04 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 1u9i h ARG 393 Cb 0.52 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.38 1u9i h ARG 393 CO 0.07 0.48 0.26 0.37 -1.07 0.00 0.00 179.97 180.08 1u9i h GLN 394 N 0.74 0.73 -0.14 0.04 4.15 -1.40 0.14 115.11 119.38 1u9i h GLN 394 Ca 0.57 -0.08 -0.09 0.00 0.77 0.00 0.00 58.65 59.82 1u9i h GLN 394 Cb 0.92 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 28.47 1u9i h GLN 394 CO -0.37 0.56 -0.26 0.35 -1.93 0.00 0.00 178.83 177.19 1u9i h PHE 395 N 0.74 0.53 -0.45 3.99 3.57 0.43 -2.46 116.94 123.29 1u9i h PHE 395 Ca 0.19 -0.19 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 1u9i h PHE 395 Cb 0.06 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.68 1u9i h PHE 395 CO 0.01 0.88 0.27 0.28 -2.23 0.00 0.00 178.31 177.51 1u9i h VAL 396 N 0.03 1.15 -0.12 1.41 2.07 -0.33 -1.30 116.25 119.17 1u9i h VAL 396 Ca 0.01 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.16 1u9i h VAL 396 Cb 0.84 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.17 1u9i h VAL 396 CO 0.06 0.15 0.00 0.40 0.02 0.00 0.00 177.57 178.20 1u9i h ILE 397 N 0.60 1.08 0.32 4.57 1.08 -0.77 0.98 117.51 125.38 1u9i h ILE 397 Ca 0.16 -0.31 -0.02 0.00 -0.39 0.00 0.00 64.86 64.31 1u9i h ILE 397 Cb 0.01 0.99 0.00 0.00 -3.07 0.00 0.00 36.82 34.76 1u9i h ILE 397 CO -0.03 0.10 -0.16 1.23 -0.69 0.00 0.00 178.15 178.61 1u9i h GLY 398 N 0.36 -0.45 0.54 5.37 0.00 -0.83 -0.89 103.07 107.17 1u9i h GLY 398 Ca 0.04 0.17 0.07 0.00 0.00 0.00 0.00 47.33 47.61 1u9i h GLY 398 CO 0.00 -0.17 0.19 -2.08 0.00 0.00 0.00 176.54 174.48 1u9i h VAL 399 N -0.69 0.84 -0.16 4.60 2.07 -1.21 -0.51 116.25 121.19 1u9i h VAL 399 Ca -0.04 -0.13 0.03 0.00 0.82 0.00 0.00 66.70 67.38 1u9i h VAL 399 Cb 0.33 0.44 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 1u9i h VAL 399 CO 0.07 0.07 -0.01 0.74 0.02 0.00 0.00 177.57 178.46 1u9i h THR 400 N 0.37 0.88 -0.23 2.57 2.02 -0.90 -1.96 112.91 115.66 1u9i h THR 400 Ca 0.24 -0.01 -0.03 0.00 0.77 0.00 0.00 66.41 67.37 1u9i h THR 400 Cb 0.25 0.83 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 1u9i h THR 400 CO -0.24 0.01 0.03 1.23 0.37 0.00 0.00 175.52 176.92 1u9i h GLY 401 N 0.04 0.42 0.24 2.16 0.00 -0.75 -1.89 103.07 103.29 1u9i h GLY 401 Ca 0.08 -0.29 0.06 0.00 0.00 0.00 0.00 47.33 47.18 1u9i h GLY 401 CO -0.14 0.27 -0.18 -1.82 0.00 0.00 0.00 176.54 174.68 1u9i h TYR 402 N 0.18 -0.45 -0.38 5.60 3.20 -1.02 -1.28 116.97 122.82 1u9i h TYR 402 Ca 0.07 0.03 0.07 0.00 3.14 0.00 0.00 58.73 62.05 1u9i h TYR 402 Cb 0.35 0.24 -0.07 0.00 1.54 0.00 0.00 36.73 38.79 1u9i h TYR 402 CO 0.03 -0.25 -0.07 0.00 -1.64 0.00 0.00 178.16 176.22 1u9i h ALA 403 N 0.99 0.28 0.24 1.82 0.00 -1.23 -1.87 119.26 119.50 1u9i h ALA 403 Ca 0.14 0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.20 1u9i h ALA 403 Cb 0.38 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1u9i h ALA 403 CO -0.36 -0.44 -0.27 0.87 0.00 0.00 0.00 179.25 179.05 1u9i h LYS 404 N 0.03 -0.54 0.00 0.00 1.57 -0.45 -1.67 116.57 115.51 1u9i h LYS 404 Ca 0.18 0.04 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 1u9i h LYS 404 Cb 0.28 0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.71 1u9i h LYS 404 CO -0.37 -0.36 0.00 0.00 -0.57 0.00 0.00 179.45 178.15 1u9i n GLN 405 N -5.39 0.01 -0.47 3.15 10.64 -0.59 -2.24 117.38 122.49 1u9i n GLN 405 Ca -0.08 0.31 0.09 0.00 -1.83 0.00 0.00 57.00 55.49 1u9i n GLN 405 Cb 0.30 -1.50 0.30 0.00 -0.86 0.00 0.00 30.24 28.48 1u9i n GLN 405 CO 0.00 0.00 0.00 -1.91 -1.83 0.00 0.00 177.06 173.32 1u9i n GLU 406 N -1.49 3.31 -1.39 2.61 4.07 -0.69 -4.87 120.64 122.19 1u9i n GLU 406 Ca 0.03 -2.68 -0.14 0.00 -0.06 0.00 0.00 57.16 54.31 1u9i n GLU 406 Cb 0.12 -1.71 -0.06 0.00 -0.06 0.00 0.00 31.44 29.73 1u9i n GLU 406 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 1u9i n GLU 407 N 0.87 -1.42 -3.40 5.31 -0.58 -0.95 -4.92 120.64 115.55 1u9i n GLU 407 Ca 0.22 0.88 -0.39 0.00 -0.42 0.00 0.00 57.16 57.46 1u9i n GLU 407 Cb 0.75 -5.15 -0.09 0.00 -0.57 0.00 0.00 31.44 26.39 1u9i n GLU 407 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1u9i s ILE 408 N -2.18 5.19 0.20 -3.67 -1.09 -0.86 -4.82 121.20 113.96 1u9i s ILE 408 Ca 0.00 0.58 -0.30 0.00 -2.23 0.00 0.00 60.65 58.70 1u9i s ILE 408 Cb 0.00 -3.69 -0.08 0.00 -1.58 0.00 0.00 42.46 37.10 1u9i s ILE 408 CO 0.00 0.19 1.14 -0.89 -1.23 0.00 0.00 174.94 174.14 1u9i s THR 409 N 1.83 3.68 -0.04 2.92 2.01 -0.77 -4.44 115.64 120.83 1u9i s THR 409 Ca 0.16 1.48 0.02 0.00 0.31 0.00 0.00 61.69 63.66 1u9i s THR 409 Cb -0.15 -3.94 0.01 0.00 0.01 0.00 0.00 72.50 68.42 1u9i s THR 409 CO 0.09 0.27 -0.09 -0.83 -0.69 0.00 0.00 174.62 173.37 1u9i s GLY 410 N -0.19 0.59 -0.26 4.40 0.00 -1.14 -0.47 107.32 110.25 1u9i s GLY 410 Ca 0.50 -0.28 -0.03 0.00 0.00 0.00 0.00 44.72 44.90 1u9i s GLY 410 CO 0.37 0.11 -0.02 -2.27 0.00 0.00 0.00 173.10 171.29 1u9i s LEU 411 N 0.52 3.33 0.06 0.66 2.96 0.25 -0.26 118.68 126.20 1u9i s LEU 411 Ca -0.09 -0.75 0.04 0.00 -0.22 0.00 0.00 54.13 53.11 1u9i s LEU 411 Cb -0.12 -1.74 -0.04 0.00 0.50 0.00 0.00 46.19 44.79 1u9i s LEU 411 CO 0.01 -0.13 -0.04 -0.36 -1.32 0.00 0.00 176.35 174.51 1u9i s PHE 412 N 1.40 2.91 0.14 5.38 0.40 0.53 -1.68 117.98 127.05 1u9i s PHE 412 Ca 0.02 -0.05 0.06 0.00 -0.60 0.00 0.00 56.93 56.35 1u9i s PHE 412 Cb -0.16 -1.55 -0.04 0.00 0.51 0.00 0.00 43.02 41.78 1u9i s PHE 412 CO -0.02 0.43 0.04 0.99 0.70 0.00 0.00 175.22 177.36 1u9i s THR 413 N -1.17 4.05 -0.17 0.64 2.01 -0.74 -1.12 115.64 119.14 1u9i s THR 413 Ca 0.21 -1.17 -0.07 0.00 0.31 0.00 0.00 61.69 60.97 1u9i s THR 413 Cb -0.11 -3.01 0.07 0.00 0.01 0.00 0.00 72.50 69.46 1u9i s THR 413 CO 0.13 -0.03 0.38 0.21 -0.69 0.00 0.00 174.62 174.62 1u9i s ASN 414 N -2.76 -0.28 -0.20 3.53 2.47 -0.10 -0.29 114.94 117.32 1u9i s ASN 414 Ca 0.28 0.86 -0.10 0.00 0.42 0.00 0.00 52.86 54.32 1u9i s ASN 414 Cb -0.10 0.94 -0.05 0.00 -1.45 0.00 0.00 41.25 40.59 1u9i s ASN 414 CO 0.20 -0.21 0.12 -0.89 -3.72 0.00 0.00 177.10 172.60 1u9i s THR 415 N 1.98 5.36 0.09 -5.21 2.01 -1.26 -2.38 115.64 116.23 1u9i s THR 415 Ca -0.05 0.17 -0.25 0.00 0.31 0.00 0.00 61.69 61.87 1u9i s THR 415 Cb -0.10 -3.44 -0.06 0.00 0.01 0.00 0.00 72.50 68.90 1u9i s THR 415 CO -0.12 0.45 0.77 -0.94 -0.69 0.00 0.00 174.62 174.08 1u9i s SER 416 N 0.32 7.28 0.47 3.53 1.04 -0.87 -4.89 113.70 120.58 1u9i s SER 416 Ca 0.08 1.52 0.29 0.00 0.48 0.00 0.00 55.95 58.32 1u9i s SER 416 Cb -0.11 -2.48 1.60 0.00 0.10 0.00 0.00 66.02 65.13 1u9i s SER 416 CO -0.02 0.10 1.89 0.44 0.98 0.00 0.00 173.24 176.63 1u9i h ASP 417 N 5.11 0.00 -3.36 7.02 3.32 -1.98 -3.41 116.42 123.13 1u9i h ASP 417 Ca -0.45 0.00 -0.40 0.00 0.02 0.00 0.00 57.03 56.19 1u9i h ASP 417 Cb 1.21 0.00 -0.36 0.00 0.22 0.00 0.00 39.33 40.39 1u9i h ASP 417 CO 0.69 0.00 -0.76 0.00 -1.72 0.00 0.00 179.24 177.45 1u9i s GLN 418 N -3.77 0.52 0.00 3.56 -2.07 -1.26 -5.10 119.66 111.54 1u9i s GLN 418 Ca -0.03 0.08 -0.30 0.00 -1.82 0.00 0.00 55.36 53.29 1u9i s GLN 418 Cb 0.08 -0.79 -0.03 0.00 -1.09 0.00 0.00 33.01 31.18 1u9i s GLN 418 CO 0.27 -0.22 1.04 -0.59 -1.32 0.00 0.00 175.29 174.46 1u9i s PHE 419 N 1.55 3.58 0.25 9.60 -0.12 -1.26 -4.27 117.98 127.32 1u9i s PHE 419 Ca -0.02 1.59 0.00 0.00 -0.05 0.00 0.00 56.93 58.45 1u9i s PHE 419 Cb -0.13 -3.20 0.00 0.00 -0.63 0.00 0.00 43.02 39.06 1u9i s PHE 419 CO -0.03 -0.35 0.00 -1.33 -0.05 0.00 0.00 175.22 173.45 1u9i n MET 420 N 4.04 -4.10 0.00 1.99 2.81 -1.26 -4.78 117.12 115.82 1u9i n MET 420 Ca 0.07 2.98 0.00 0.00 -1.81 0.00 0.00 57.70 58.94 1u9i n MET 420 Cb 0.50 -3.21 0.00 0.00 -0.71 0.00 0.00 33.22 29.79 1u9i n MET 420 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1u9i n GLY 421 N 0.65 1.91 3.70 3.03 0.00 -1.19 -4.97 105.19 108.31 1u9i n GLY 421 Ca 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 46.02 45.47 1u9i n GLY 421 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u9i n ALA 422 N -1.58 0.07 0.18 4.61 0.00 -1.26 -4.85 120.51 117.68 1u9i n ALA 422 Ca 0.00 0.37 0.12 0.00 0.00 0.00 0.00 53.44 53.92 1u9i n ALA 422 Cb 0.00 -2.29 0.04 0.00 0.00 0.00 0.00 19.45 17.20 1u9i n ALA 422 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1u9i h HIS 423 N 7.57 0.00 -4.29 0.00 3.86 -1.95 -3.46 115.15 116.88 1u9i h HIS 423 Ca -0.47 0.00 -0.67 0.00 -1.16 0.00 0.00 60.37 58.07 1u9i h HIS 423 Cb 1.31 0.00 -0.27 0.00 1.06 0.00 0.00 27.41 29.51 1u9i h HIS 423 CO 0.79 0.00 -0.87 -1.54 0.86 0.00 0.00 177.93 177.17 1u9i s SER 424 N -5.24 2.98 0.12 2.45 1.04 -1.26 -5.04 113.70 108.75 1u9i s SER 424 Ca 0.01 -0.56 -0.20 0.00 0.48 0.00 0.00 55.95 55.67 1u9i s SER 424 Cb 0.10 -0.27 -0.06 0.00 0.10 0.00 0.00 66.02 65.89 1u9i s SER 424 CO 0.77 0.24 1.74 0.40 0.98 0.00 0.00 173.24 177.37 1u9i h ILE 425 N 4.28 0.93 -4.24 -1.02 1.08 -2.03 -3.42 117.51 113.09 1u9i h ILE 425 Ca -0.45 -0.03 -0.50 0.00 -0.39 0.00 0.00 64.86 63.48 1u9i h ILE 425 Cb 1.14 0.82 -0.29 0.00 -3.07 0.00 0.00 36.82 35.43 1u9i h ILE 425 CO 0.44 0.02 -0.82 0.42 -0.69 0.00 0.00 178.15 177.52 1u9i s THR 426 N -6.19 1.21 -0.03 -0.27 -4.23 -1.26 -4.89 115.64 99.99 1u9i s THR 426 Ca -0.13 -0.68 0.16 0.00 -1.18 0.00 0.00 61.69 59.86 1u9i s THR 426 Cb 0.09 -1.01 0.09 0.00 1.34 0.00 0.00 72.50 73.00 1u9i s THR 426 CO 0.68 0.32 1.55 0.44 -0.54 0.00 0.00 174.62 177.08 1u9i h ASP 427 N 5.70 0.00 0.88 3.99 3.32 -1.93 -3.01 116.42 125.37 1u9i h ASP 427 Ca -0.35 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.70 1u9i h ASP 427 Cb 1.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.71 1u9i h ASP 427 CO 0.48 0.46 -0.30 -1.54 -1.72 0.00 0.00 179.24 176.63 1u9i n SER 428 N -3.33 0.44 -2.95 6.45 3.41 -1.26 -4.99 113.62 111.39 1u9i n SER 428 Ca 0.01 0.19 -0.04 0.00 -0.26 0.00 0.00 58.87 58.77 1u9i n SER 428 Cb 0.65 -0.16 0.02 0.00 -0.26 0.00 0.00 64.21 64.47 1u9i n SER 428 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1u9i n HIS 429 N -1.76 -2.52 -4.79 7.33 8.25 -1.14 -4.96 115.22 115.64 1u9i n HIS 429 Ca 0.05 0.94 -0.33 0.00 -0.26 0.00 0.00 57.72 58.12 1u9i n HIS 429 Cb 0.37 -3.88 -0.14 0.00 1.12 0.00 0.00 29.99 27.47 1u9i n HIS 429 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1u9i s ILE 430 N -3.11 3.13 0.00 1.59 -1.09 -1.26 -5.08 121.20 115.37 1u9i s ILE 430 Ca 0.14 -0.66 0.00 0.00 -2.23 0.00 0.00 60.65 57.90 1u9i s ILE 430 Cb -0.02 -2.29 0.00 0.00 -1.58 0.00 0.00 42.46 38.58 1u9i s ILE 430 CO 0.67 0.55 0.00 -0.38 -1.23 0.00 0.00 174.94 174.54 1u9i n ILE 433 N 3.09 0.00 -3.40 2.92 5.41 -1.26 -5.04 119.36 121.08 1u9i n ILE 433 Ca -0.18 0.00 -0.33 0.00 1.00 0.00 0.00 62.75 63.25 1u9i n ILE 433 Cb 0.53 0.00 -0.05 0.00 -0.71 0.00 0.00 39.64 39.40 1u9i n ILE 433 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 1u9i s THR 434 N -1.90 4.92 -0.11 1.39 -1.32 -1.26 -4.99 115.64 112.36 1u9i s THR 434 Ca 0.00 0.55 -0.21 0.00 -1.21 0.00 0.00 61.69 60.81 1u9i s THR 434 Cb 0.00 -3.64 -0.27 0.00 -1.51 0.00 0.00 72.50 67.08 1u9i s THR 434 CO 0.00 -0.01 0.64 0.44 -2.21 0.00 0.00 174.62 173.48 1u9i h ASP 435 N 2.74 0.27 -3.89 8.08 3.32 -1.76 -3.47 116.42 121.71 1u9i h ASP 435 Ca -0.47 -0.86 -0.57 0.00 0.02 0.00 0.00 57.03 55.14 1u9i h ASP 435 Cb 1.17 -0.09 -0.31 0.00 0.22 0.00 0.00 39.33 40.32 1u9i h ASP 435 CO 0.68 1.41 -0.84 -0.89 -1.72 0.00 0.00 179.24 177.88 1u9i s THR 436 N -2.39 1.48 -0.13 0.35 2.01 -0.83 -2.67 115.64 113.46 1u9i s THR 436 Ca -0.19 -0.74 0.02 0.00 0.31 0.00 0.00 61.69 61.09 1u9i s THR 436 Cb 0.02 -1.27 0.01 0.00 0.01 0.00 0.00 72.50 71.27 1u9i s THR 436 CO 0.74 0.42 -0.18 -0.63 -0.69 0.00 0.00 174.62 174.28 1u9i s ILE 437 N 0.04 1.77 -0.22 1.82 1.09 -0.61 -0.26 121.20 124.82 1u9i s ILE 437 Ca -0.04 -0.80 -0.04 0.00 -1.10 0.00 0.00 60.65 58.67 1u9i s ILE 437 Cb -0.12 -1.59 -0.00 0.00 -1.06 0.00 0.00 42.46 39.69 1u9i s ILE 437 CO 0.02 0.49 -0.05 -0.63 -0.10 0.00 0.00 174.94 174.68 1u9i s ILE 438 N 0.93 3.28 -0.20 2.92 1.01 0.26 -1.05 121.20 128.35 1u9i s ILE 438 Ca -0.06 -0.56 -0.06 0.00 0.00 0.00 0.00 60.65 59.96 1u9i s ILE 438 Cb -0.15 -2.51 -0.03 0.00 0.01 0.00 0.00 42.46 39.78 1u9i s ILE 438 CO -0.02 0.40 0.04 -0.22 0.00 0.00 0.00 174.94 175.14 1u9i s LEU 439 N 1.46 3.51 -0.03 2.97 2.96 0.75 -1.40 118.68 128.90 1u9i s LEU 439 Ca 0.05 -0.09 0.03 0.00 -0.22 0.00 0.00 54.13 53.90 1u9i s LEU 439 Cb -0.14 -1.90 -0.03 0.00 0.50 0.00 0.00 46.19 44.61 1u9i s LEU 439 CO -0.04 0.09 -0.09 -0.76 -1.32 0.00 0.00 176.35 174.23 1u9i s LEU 440 N 0.88 3.06 0.04 -0.68 1.43 0.27 -0.50 118.68 123.18 1u9i s LEU 440 Ca 0.03 -0.13 -0.26 0.00 -1.03 0.00 0.00 54.13 52.74 1u9i s LEU 440 Cb -0.14 -1.70 0.06 0.00 0.03 0.00 0.00 46.19 44.44 1u9i s LEU 440 CO 0.02 0.32 0.61 0.00 0.23 0.00 0.00 176.35 177.54 1u9i s GLN 441 N -1.08 1.12 0.16 1.70 -2.07 0.04 -4.13 119.66 115.40 1u9i s GLN 441 Ca 0.14 -0.09 -0.23 0.00 -1.82 0.00 0.00 55.36 53.36 1u9i s GLN 441 Cb -0.11 0.52 -0.08 0.00 -1.09 0.00 0.00 33.01 32.25 1u9i s GLN 441 CO 0.04 -0.41 0.73 0.71 -1.32 0.00 0.00 175.29 175.04 1u9i s TYR 442 N -2.28 3.85 -0.14 9.60 1.51 -1.26 -0.18 117.35 128.45 1u9i s TYR 442 Ca -0.06 1.54 -0.00 0.00 -1.01 0.00 0.00 57.07 57.53 1u9i s TYR 442 Cb -0.01 -2.70 0.03 0.00 -0.11 0.00 0.00 41.96 39.18 1u9i s TYR 442 CO 0.00 0.50 -0.07 0.08 -1.11 0.00 0.00 175.55 174.95 1u9i s VAL 443 N -1.20 1.10 -0.42 0.71 1.01 0.17 -4.57 120.40 117.19 1u9i s VAL 443 Ca 0.36 -0.47 -0.29 0.00 0.00 0.00 0.00 61.98 61.58 1u9i s VAL 443 Cb -0.22 -1.18 0.02 0.00 0.00 0.00 0.00 36.38 35.00 1u9i s VAL 443 CO 0.24 0.26 1.29 -0.70 0.00 0.00 0.00 175.10 176.20 1u9i s GLU 444 N 1.66 3.67 -0.23 2.72 2.12 0.16 -1.15 118.70 127.66 1u9i s GLU 444 Ca 0.03 0.83 -0.02 0.00 0.36 0.00 0.00 54.97 56.17 1u9i s GLU 444 Cb -0.14 -3.96 0.07 0.00 0.26 0.00 0.00 34.13 30.36 1u9i s GLU 444 CO -0.08 -1.44 0.04 0.42 -0.54 0.00 0.00 175.26 173.66 1u9i s ILE 445 N 4.93 0.68 -0.94 -3.70 1.01 0.79 -4.18 121.20 119.79 1u9i s ILE 445 Ca 0.55 -0.82 -0.02 0.00 0.00 0.00 0.00 60.65 60.36 1u9i s ILE 445 Cb -0.11 -1.25 -0.03 0.00 0.01 0.00 0.00 42.46 41.08 1u9i s ILE 445 CO 0.31 -0.32 0.80 0.54 0.00 0.00 0.00 174.94 176.27 1u9i n ARG 446 N 4.97 -3.78 -1.29 2.79 1.74 -1.26 -2.73 116.66 117.10 1u9i n ARG 446 Ca -0.08 0.72 -0.10 0.00 -0.77 0.00 0.00 57.85 57.62 1u9i n ARG 446 Cb 0.45 -5.21 -0.04 0.00 -1.02 0.00 0.00 32.46 26.64 1u9i n ARG 446 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1u9i n GLY 447 N -1.19 1.06 3.11 -0.13 0.00 -1.26 -4.98 105.19 101.80 1u9i n GLY 447 Ca -0.15 -0.22 -0.16 0.00 0.00 0.00 0.00 46.02 45.49 1u9i n GLY 447 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1u9i s GLU 448 N -2.64 0.68 -0.81 1.61 2.02 -1.10 -5.11 118.70 113.34 1u9i s GLU 448 Ca 0.00 -0.83 -0.19 0.00 0.02 0.00 0.00 54.97 53.97 1u9i s GLU 448 Cb 0.00 -0.57 0.13 0.00 0.10 0.00 0.00 34.13 33.79 1u9i s GLU 448 CO 0.00 0.12 0.97 -1.64 0.02 0.00 0.00 175.26 174.73 1u9i s MET 449 N -1.59 3.43 0.29 1.61 -1.94 -1.26 -0.15 119.30 119.69 1u9i s MET 449 Ca -0.06 -1.65 0.03 0.00 -1.71 0.00 0.00 55.69 52.31 1u9i s MET 449 Cb -0.10 -4.63 -0.03 0.00 2.01 0.00 0.00 34.83 32.09 1u9i s MET 449 CO 0.01 -1.67 0.45 -1.54 -0.01 0.00 0.00 175.02 172.26 1u9i s SER 450 N 3.43 6.29 0.20 3.03 1.04 -0.30 -4.87 113.70 122.52 1u9i s SER 450 Ca 0.25 0.22 0.05 0.00 0.48 0.00 0.00 55.95 56.95 1u9i s SER 450 Cb -0.11 -1.90 -0.03 0.00 0.10 0.00 0.00 66.02 64.08 1u9i s SER 450 CO -0.04 -0.19 0.24 -0.13 0.98 0.00 0.00 173.24 174.11 1u9i s ARG 451 N -4.14 3.18 -0.01 4.02 3.00 -1.25 0.41 118.95 124.15 1u9i s ARG 451 Ca 0.37 -0.82 -0.00 0.00 0.00 0.00 0.00 55.73 55.28 1u9i s ARG 451 Cb -0.09 -2.77 0.02 0.00 0.00 0.00 0.00 34.95 32.11 1u9i s ARG 451 CO 0.32 0.46 0.02 0.00 0.00 0.00 0.00 175.30 176.11 1u9i s ALA 452 N -1.90 0.02 0.09 2.13 0.00 0.74 -1.85 121.76 120.99 1u9i s ALA 452 Ca 0.33 0.18 0.07 0.00 0.00 0.00 0.00 51.96 52.54 1u9i s ALA 452 Cb -0.09 -0.14 -0.04 0.00 0.00 0.00 0.00 23.12 22.84 1u9i s ALA 452 CO 0.26 -0.06 -0.10 -1.50 0.00 0.00 0.00 175.76 174.36 1u9i s ILE 453 N 0.56 3.37 -0.25 0.00 2.07 0.26 -0.78 121.20 126.43 1u9i s ILE 453 Ca -0.05 -1.21 -0.15 0.00 -1.41 0.00 0.00 60.65 57.84 1u9i s ILE 453 Cb -0.07 -2.56 0.07 0.00 0.13 0.00 0.00 42.46 40.04 1u9i s ILE 453 CO -0.02 0.16 0.63 0.21 -1.91 0.00 0.00 174.94 174.01 1u9i s ASN 454 N -2.07 -0.84 -0.79 4.50 2.47 0.35 -1.96 114.94 116.59 1u9i s ASN 454 Ca 0.21 1.38 -0.21 0.00 0.42 0.00 0.00 52.86 54.65 1u9i s ASN 454 Cb -0.11 1.26 0.09 0.00 -1.45 0.00 0.00 41.25 41.04 1u9i s ASN 454 CO 0.13 -0.23 1.07 -0.69 -3.72 0.00 0.00 177.10 173.66 1u9i s VAL 455 N 1.49 4.43 0.22 -5.21 1.01 -1.26 -0.18 120.40 120.90 1u9i s VAL 455 Ca -0.09 -0.84 -0.07 0.00 0.00 0.00 0.00 61.98 60.98 1u9i s VAL 455 Cb -0.06 -4.76 0.13 0.00 0.00 0.00 0.00 36.38 31.70 1u9i s VAL 455 CO -0.17 -1.53 1.75 0.15 0.00 0.00 0.00 175.10 175.30 1u9i h PHE 456 N 9.32 1.13 -2.10 5.22 3.57 -1.42 -3.45 116.94 129.22 1u9i h PHE 456 Ca -0.08 -0.12 0.03 0.00 3.53 0.00 0.00 57.97 61.32 1u9i h PHE 456 Cb 1.05 -0.32 -0.18 0.00 2.79 0.00 0.00 35.95 39.28 1u9i h PHE 456 CO 1.07 0.92 0.37 -1.59 -2.23 0.00 0.00 178.31 176.84 1u9i s LYS 457 N -5.31 0.91 -0.17 1.11 -2.85 -1.19 -4.97 119.74 107.27 1u9i s LYS 457 Ca -0.12 -0.02 -0.06 0.00 -1.00 0.00 0.00 55.97 54.78 1u9i s LYS 457 Cb 0.15 0.42 0.08 0.00 -2.06 0.00 0.00 37.83 36.42 1u9i s LYS 457 CO 0.84 -0.33 0.35 -1.64 0.10 0.00 0.00 175.35 174.67 1u9i s MET 458 N -2.02 0.25 0.22 1.78 -1.94 -1.26 -1.58 119.30 114.75 1u9i s MET 458 Ca -0.03 0.89 -0.06 0.00 -1.71 0.00 0.00 55.69 54.78 1u9i s MET 458 Cb -0.01 0.14 0.19 0.00 2.01 0.00 0.00 34.83 37.17 1u9i s MET 458 CO -0.01 -0.28 1.76 0.00 -0.01 0.00 0.00 175.02 176.48 1u9i h ARG 459 N 8.22 1.09 0.00 2.03 3.08 -1.90 -3.32 114.38 123.59 1u9i h ARG 459 Ca -0.15 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 59.66 1u9i h ARG 459 Cb 1.11 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 31.01 1u9i h ARG 459 CO 0.13 0.94 -1.37 0.41 -1.07 0.00 0.00 179.97 179.01 1u9i n GLY 460 N -0.76 -0.75 3.26 0.04 0.00 -1.26 -5.03 105.19 100.69 1u9i n GLY 460 Ca 0.05 -0.46 -0.18 0.00 0.00 0.00 0.00 46.02 45.43 1u9i n GLY 460 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1u9i n SER 461 N -1.80 2.01 -0.07 1.61 2.88 -1.25 -5.07 113.62 111.93 1u9i n SER 461 Ca -0.00 -2.40 -0.22 0.00 -1.33 0.00 0.00 58.87 54.92 1u9i n SER 461 Cb 0.38 -0.25 -0.12 0.00 -0.75 0.00 0.00 64.21 63.47 1u9i n SER 461 CO 0.00 0.00 0.00 1.87 -1.23 0.00 0.00 175.04 175.68 1u9i n TRP 462 N -1.90 1.06 -1.37 0.66 -0.00 -1.26 -4.80 117.44 109.82 1u9i n TRP 462 Ca 0.09 0.37 0.00 0.00 -0.00 0.00 0.00 57.50 57.95 1u9i n TRP 462 Cb 0.51 -1.12 0.00 0.00 -0.00 0.00 0.00 31.31 30.70 1u9i n TRP 462 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 177.69 175.30 1u9i n HIS 463 N -4.11 -2.52 -2.35 5.87 1.44 -1.25 -4.89 115.22 107.41 1u9i n HIS 463 Ca -0.33 1.35 -0.38 0.00 -2.01 0.00 0.00 57.72 56.35 1u9i n HIS 463 Cb 0.81 -2.16 -0.03 0.00 0.12 0.00 0.00 29.99 28.74 1u9i n HIS 463 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 1u9i s ASP 464 N -3.94 6.63 0.00 4.39 2.15 0.31 -4.91 116.67 121.29 1u9i s ASP 464 Ca 0.00 2.29 0.21 0.00 0.43 0.00 0.00 52.55 55.48 1u9i s ASP 464 Cb 0.00 -2.61 0.33 0.00 -0.30 0.00 0.00 42.92 40.34 1u9i s ASP 464 CO 0.00 -0.59 1.29 0.29 -0.17 0.00 0.00 175.17 175.98 1u9i n LYS 465 N 0.16 2.25 -2.11 4.34 4.76 -1.26 -4.43 118.16 121.87 1u9i n LYS 465 Ca 0.04 -2.06 -0.32 0.00 -2.87 0.00 0.00 58.31 53.09 1u9i n LYS 465 Cb 0.47 -1.44 0.00 0.00 -1.84 0.00 0.00 35.03 32.22 1u9i n LYS 465 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1u9i s ALA 466 N -1.46 2.82 -0.88 7.82 0.00 -1.26 -4.98 121.76 123.81 1u9i s ALA 466 Ca 0.32 0.33 -0.04 0.00 0.00 0.00 0.00 51.96 52.57 1u9i s ALA 466 Cb 0.20 -3.20 0.22 0.00 0.00 0.00 0.00 23.12 20.33 1u9i s ALA 466 CO 0.28 -0.69 0.78 0.42 0.00 0.00 0.00 175.76 176.54 1u9i s ILE 467 N -2.52 4.57 0.31 0.00 1.09 -1.26 -4.48 121.20 118.90 1u9i s ILE 467 Ca 0.62 -3.60 -0.28 0.00 -1.10 0.00 0.00 60.65 56.30 1u9i s ILE 467 Cb -0.14 -3.84 -0.09 0.00 -1.06 0.00 0.00 42.46 37.33 1u9i s ILE 467 CO 0.36 -1.07 1.05 -0.13 -0.10 0.00 0.00 174.94 175.05 1u9i s ARG 468 N -1.07 4.56 0.31 2.79 0.52 -0.83 -4.09 118.95 121.15 1u9i s ARG 468 Ca 0.26 1.64 -0.12 0.00 -0.52 0.00 0.00 55.73 56.98 1u9i s ARG 468 Cb -0.10 -3.01 -0.08 0.00 0.52 0.00 0.00 34.95 32.28 1u9i s ARG 468 CO -0.10 0.19 0.69 -1.83 0.02 0.00 0.00 175.30 174.26 1u9i s GLU 469 N -1.71 3.90 0.02 3.54 -1.05 -0.73 0.92 118.70 123.58 1u9i s GLU 469 Ca 0.48 0.51 -0.07 0.00 -0.15 0.00 0.00 54.97 55.73 1u9i s GLU 469 Cb -0.27 -2.49 -0.00 0.00 -0.44 0.00 0.00 34.13 30.93 1u9i s GLU 469 CO 0.35 0.17 0.13 -0.59 0.95 0.00 0.00 175.26 176.26 1u9i s PHE 470 N -2.01 0.10 0.23 4.83 -0.12 -0.77 -1.16 117.98 119.08 1u9i s PHE 470 Ca 0.51 -0.29 0.10 0.00 -0.05 0.00 0.00 56.93 57.21 1u9i s PHE 470 Cb -0.10 -0.08 -0.04 0.00 -0.63 0.00 0.00 43.02 42.16 1u9i s PHE 470 CO 0.21 -0.33 -0.09 0.00 -0.05 0.00 0.00 175.22 174.96 1u9i s MET 471 N -1.96 2.04 -0.09 1.99 0.23 -0.78 -3.95 119.30 116.77 1u9i s MET 471 Ca -0.10 -1.44 0.03 0.00 -1.03 0.00 0.00 55.69 53.15 1u9i s MET 471 Cb -0.05 -2.06 -0.01 0.00 -1.53 0.00 0.00 34.83 31.18 1u9i s MET 471 CO -0.01 0.38 -0.20 0.42 -2.03 0.00 0.00 175.02 173.58 1u9i s ILE 472 N -2.10 2.48 0.02 3.16 1.01 -1.26 -0.82 121.20 123.69 1u9i s ILE 472 Ca 0.28 -0.89 0.00 0.00 0.00 0.00 0.00 60.65 60.05 1u9i s ILE 472 Cb -0.07 -1.97 -0.00 0.00 0.01 0.00 0.00 42.46 40.42 1u9i s ILE 472 CO 0.17 0.55 0.01 -1.54 0.00 0.00 0.00 174.94 174.13 1u9i n SER 473 N 3.27 0.41 0.07 3.58 3.41 0.57 -4.96 113.62 119.98 1u9i n SER 473 Ca -0.18 -1.14 -0.03 0.00 -0.26 0.00 0.00 58.87 57.27 1u9i n SER 473 Cb 0.53 0.09 0.22 0.00 -0.26 0.00 0.00 64.21 64.78 1u9i n SER 473 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1u9i h ASP 474 N 0.11 0.32 0.22 4.04 3.32 -1.94 -1.99 116.42 120.51 1u9i h ASP 474 Ca -0.02 -0.13 -0.11 0.00 0.02 0.00 0.00 57.03 56.79 1u9i h ASP 474 Cb 0.07 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1u9i h ASP 474 CO 0.03 0.67 -0.43 0.11 -1.72 0.00 0.00 179.24 177.90 1u9i h LYS 475 N 0.27 0.27 0.00 3.56 1.57 -1.83 -2.86 116.57 117.54 1u9i h LYS 475 Ca 0.03 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1u9i h LYS 475 Cb 0.78 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.09 1u9i h LYS 475 CO 0.06 0.65 0.00 0.41 -0.57 0.00 0.00 179.45 180.00 1u9i n GLY 476 N -0.13 0.34 3.70 3.86 0.00 -0.75 -4.75 105.19 107.46 1u9i n GLY 476 Ca -0.02 -1.47 -0.38 0.00 0.00 0.00 0.00 46.02 44.15 1u9i n GLY 476 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1u9i s PRO 477 N -1.39 4.24 -0.29 1.61 0.04 -1.26 -0.31 135.00 137.64 1u9i s PRO 477 Ca 0.00 0.28 -0.01 0.00 0.04 0.00 0.00 61.00 61.32 1u9i s PRO 477 Cb 0.00 -3.49 0.05 0.00 0.04 0.00 0.00 34.50 31.10 1u9i s PRO 477 CO 0.00 0.06 -0.02 0.34 0.04 0.00 0.00 177.00 177.42 1u9i s ASP 478 N 0.82 4.80 -0.33 6.66 2.15 -0.00 -4.98 116.67 125.79 1u9i s ASP 478 Ca 0.21 -1.31 -0.24 0.00 0.43 0.00 0.00 52.55 51.65 1u9i s ASP 478 Cb -0.15 -1.68 0.01 0.00 -0.30 0.00 0.00 42.92 40.80 1u9i s ASP 478 CO 0.08 -0.25 0.82 -0.63 -0.17 0.00 0.00 175.17 175.02 1u9i s ILE 479 N 1.22 4.73 0.00 4.11 1.09 -1.26 -1.86 121.20 129.23 1u9i s ILE 479 Ca -0.06 1.12 0.00 0.00 -1.10 0.00 0.00 60.65 60.61 1u9i s ILE 479 Cb -0.20 -4.20 0.00 0.00 -1.06 0.00 0.00 42.46 37.00 1u9i s ILE 479 CO -0.02 -0.35 0.00 0.29 -0.10 0.00 0.00 174.94 174.76 1u9i n LYS 480 N 6.37 1.95 -3.36 2.79 5.02 -0.31 -5.02 118.16 125.61 1u9i n LYS 480 Ca 0.04 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.14 1u9i n LYS 480 Cb 0.48 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.48 1u9i n LYS 480 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1u9i s ASP 481 N -1.00 5.25 0.71 4.39 1.01 -1.26 -4.60 116.67 121.17 1u9i s ASP 481 Ca 0.00 -0.66 -0.11 0.00 0.71 0.00 0.00 52.55 52.49 1u9i s ASP 481 Cb 0.00 -0.52 0.03 0.00 1.01 0.00 0.00 42.92 43.44 1u9i s ASP 481 CO 0.00 -0.74 1.09 -0.94 0.21 0.00 0.00 175.17 174.79 1u9i s SER 482 N -4.24 5.30 -1.15 0.27 1.04 -1.26 -1.78 113.70 111.88 1u9i s SER 482 Ca 0.51 1.03 -0.06 0.00 0.48 0.00 0.00 55.95 57.91 1u9i s SER 482 Cb -0.06 -1.79 0.26 0.00 0.10 0.00 0.00 66.02 64.54 1u9i s SER 482 CO 0.30 -1.41 1.63 0.49 0.98 0.00 0.00 173.24 175.23 1u9i n PHE 483 N -3.02 2.45 -0.15 5.02 3.01 -1.26 -4.83 117.46 118.68 1u9i n PHE 483 Ca 0.07 -2.64 0.14 0.00 1.01 0.00 0.00 57.45 56.03 1u9i n PHE 483 Cb 0.58 -1.48 0.48 0.00 -0.01 0.00 0.00 39.48 39.05 1u9i n PHE 483 CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 1u9i h ARG 484 N 5.49 0.44 -1.10 -1.08 2.43 -1.95 -2.21 114.38 116.40 1u9i h ARG 484 Ca 0.28 -0.03 -0.32 0.00 -0.81 0.00 0.00 59.98 59.09 1u9i h ARG 484 Cb 0.61 -0.10 -0.18 0.00 -0.42 0.00 0.00 29.97 29.88 1u9i h ARG 484 CO 1.43 0.29 0.41 0.27 -1.51 0.00 0.00 179.97 180.87 1u9i n ASN 485 N -4.48 4.25 -4.17 -3.80 6.94 -1.26 -4.90 115.26 107.83 1u9i n ASN 485 Ca 0.13 -3.00 -0.18 0.00 -0.02 0.00 0.00 54.58 51.51 1u9i n ASN 485 Cb 0.46 -0.78 -0.12 0.00 -2.36 0.00 0.00 39.78 36.98 1u9i n ASN 485 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 1u9i s PHE 486 N -1.99 1.19 0.08 -2.53 0.40 -0.83 -2.65 117.98 111.65 1u9i s PHE 486 Ca 0.34 -0.48 0.09 0.00 -0.60 0.00 0.00 56.93 56.28 1u9i s PHE 486 Cb 0.28 -0.67 -0.03 0.00 0.51 0.00 0.00 43.02 43.11 1u9i s PHE 486 CO 0.05 0.05 -0.23 -2.00 0.70 0.00 0.00 175.22 173.79 1u9i s GLU 487 N -1.84 1.32 -1.01 0.44 2.12 -0.75 -4.75 118.70 114.23 1u9i s GLU 487 Ca -0.01 -1.13 -0.04 0.00 0.36 0.00 0.00 54.97 54.15 1u9i s GLU 487 Cb -0.09 -1.58 0.00 0.00 0.26 0.00 0.00 34.13 32.72 1u9i s GLU 487 CO 0.02 0.38 0.56 0.54 -0.54 0.00 0.00 175.26 176.22 1u9i n ARG 488 N 1.35 -4.11 -0.01 4.30 1.74 -1.26 -0.82 116.66 117.85 1u9i n ARG 488 Ca -0.18 0.60 -0.11 0.00 -0.77 0.00 0.00 57.85 57.38 1u9i n ARG 488 Cb 0.53 -4.85 -0.06 0.00 -1.02 0.00 0.00 32.46 27.06 1u9i n ARG 488 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 1u9i h ILE 489 N -1.28 1.12 -0.41 0.55 1.08 -1.91 -2.55 117.51 114.11 1u9i h ILE 489 Ca -0.37 -0.34 0.09 0.00 -0.39 0.00 0.00 64.86 63.85 1u9i h ILE 489 Cb 1.25 1.17 -0.02 0.00 -3.07 0.00 0.00 36.82 36.15 1u9i h ILE 489 CO 0.39 0.10 0.29 0.40 -0.69 0.00 0.00 178.15 178.63 1u9i h ILE 490 N 0.03 0.86 -0.08 -0.67 1.08 -1.96 -1.05 117.51 115.71 1u9i h ILE 490 Ca 0.03 -0.05 0.02 0.00 -0.39 0.00 0.00 64.86 64.48 1u9i h ILE 490 Cb 0.12 0.71 -0.00 0.00 -3.07 0.00 0.00 36.82 34.58 1u9i h ILE 490 CO -0.00 0.03 0.07 0.77 -0.69 0.00 0.00 178.15 178.33 1u9i h SER 491 N 0.14 0.00 0.00 1.72 4.64 -1.85 -3.35 113.55 114.86 1u9i h SER 491 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1u9i h SER 491 Cb 0.57 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 1u9i h SER 491 CO -0.03 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.54 1u9i n GLY 492 N -1.45 2.59 2.65 -0.77 0.00 -0.40 -3.18 105.19 104.62 1u9i n GLY 492 Ca -0.01 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.73 1u9i n GLY 492 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1u9i s SER 493 N 0.17 3.16 1.37 1.61 0.01 -1.26 0.40 113.70 119.15 1u9i s SER 493 Ca 0.00 -3.30 -0.22 0.00 1.31 0.00 0.00 55.95 53.74 1u9i s SER 493 Cb 0.00 -1.01 0.35 0.00 0.21 0.00 0.00 66.02 65.57 1u9i s SER 493 CO 0.00 -0.15 0.98 -2.84 0.41 0.00 0.00 173.24 171.64 1u9i s PRO 494 N -0.48 -2.49 -0.07 12.44 0.02 -1.23 -4.92 135.00 138.27 1u9i s PRO 494 Ca 0.27 0.07 0.03 0.00 0.02 0.00 0.00 61.00 61.39 1u9i s PRO 494 Cb -0.04 -1.43 0.00 0.00 0.02 0.00 0.00 34.50 33.05 1u9i s PRO 494 CO -0.15 -4.58 -0.17 0.99 -0.33 0.00 0.00 177.00 172.76 1u9i s THR 495 N -2.49 1.51 -0.31 0.99 2.01 -0.00 -4.96 115.64 112.40 1u9i s THR 495 Ca 0.69 -0.72 -0.26 0.00 0.31 0.00 0.00 61.69 61.71 1u9i s THR 495 Cb -0.12 -1.33 0.01 0.00 0.01 0.00 0.00 72.50 71.07 1u9i s THR 495 CO 0.57 0.44 0.94 -0.13 -0.69 0.00 0.00 174.62 175.75 1u9i s ARG 496 N 0.37 4.03 0.00 4.92 1.81 -1.26 -1.81 118.95 127.00 1u9i s ARG 496 Ca -0.12 0.86 0.20 0.00 -1.72 0.00 0.00 55.73 54.95 1u9i s ARG 496 Cb -0.15 -3.73 0.16 0.00 -0.45 0.00 0.00 34.95 30.78 1u9i s ARG 496 CO 0.05 -0.77 1.14 0.44 -0.68 0.00 0.00 175.30 175.48