#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ktt n GLY 2 N 0.00 1.04 3.67 0.00 0.00 -1.26 -4.97 105.19 103.67 3ktt n GLY 2 Ca 0.00 -0.58 -0.46 0.00 0.00 0.00 0.00 46.02 44.98 3ktt n GLY 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ktt n ALA 3 N 0.94 1.23 -2.54 4.61 0.00 -1.26 -3.99 120.51 119.49 3ktt n ALA 3 Ca 0.18 0.44 -0.43 0.00 0.00 0.00 0.00 53.44 53.63 3ktt n ALA 3 Cb 0.47 -2.33 -0.05 0.00 0.00 0.00 0.00 19.45 17.54 3ktt n ALA 3 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3ktt s ASP 4 N 0.78 6.42 -0.10 0.00 -1.08 0.32 -4.87 116.67 118.14 3ktt s ASP 4 Ca 0.77 -0.08 0.03 0.00 -0.52 0.00 0.00 52.55 52.75 3ktt s ASP 4 Cb -0.68 -2.39 -0.00 0.00 -1.46 0.00 0.00 42.92 38.39 3ktt s ASP 4 CO 0.40 -0.90 -0.22 -0.70 0.52 0.00 0.00 175.17 174.27 3ktt s GLU 5 N 3.28 3.06 -0.01 4.34 2.12 -1.26 -0.77 118.70 129.45 3ktt s GLU 5 Ca 0.30 -0.84 0.05 0.00 0.36 0.00 0.00 54.97 54.84 3ktt s GLU 5 Cb -0.12 -2.36 -0.01 0.00 0.26 0.00 0.00 34.13 31.90 3ktt s GLU 5 CO 0.22 0.22 -0.16 -1.21 -0.54 0.00 0.00 175.26 173.79 3ktt s GLU 6 N 0.26 1.31 0.10 4.30 2.02 0.04 -4.99 118.70 121.74 3ktt s GLU 6 Ca -0.15 -0.62 0.05 0.00 0.02 0.00 0.00 54.97 54.28 3ktt s GLU 6 Cb -0.17 -1.28 -0.03 0.00 0.10 0.00 0.00 34.13 32.75 3ktt s GLU 6 CO 0.08 0.35 -0.14 1.03 0.02 0.00 0.00 175.26 176.59 3ktt s ARG 7 N -0.48 0.94 7.41 1.61 0.52 -1.26 -0.05 118.95 127.64 3ktt s ARG 7 Ca 0.06 -1.14 0.00 0.00 -0.52 0.00 0.00 55.73 54.13 3ktt s ARG 7 Cb -0.07 -0.85 0.00 0.00 0.52 0.00 0.00 34.95 34.55 3ktt s ARG 7 CO -0.00 0.17 0.00 0.00 0.02 0.00 0.00 175.30 175.49 3ktt n ALA 8 N 0.78 0.00 -0.32 2.13 0.00 -1.22 -2.99 120.51 118.89 3ktt n ALA 8 Ca -0.17 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.24 3ktt n ALA 8 Cb 0.56 0.00 0.13 0.00 0.00 0.00 0.00 19.45 20.14 3ktt n ALA 8 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 3ktt h GLU 9 N 0.00 1.22 -0.59 0.00 9.09 -1.98 -0.48 114.58 121.84 3ktt h GLU 9 Ca 0.00 -0.11 -0.03 0.00 0.05 0.00 0.00 59.36 59.28 3ktt h GLU 9 Cb 0.00 -0.26 -0.03 0.00 -1.65 0.00 0.00 28.75 26.82 3ktt h GLU 9 CO 0.00 0.85 0.27 1.79 0.05 0.00 0.00 179.01 181.97 3ktt h THR 10 N 1.24 1.22 -0.78 -1.06 1.35 -1.94 -0.25 112.91 112.69 3ktt h THR 10 Ca 0.32 -0.63 -0.05 0.00 -0.55 0.00 0.00 66.41 65.50 3ktt h THR 10 Cb -0.06 0.54 -0.03 0.00 -1.73 0.00 0.00 68.15 66.87 3ktt h THR 10 CO -0.06 0.25 0.29 0.00 -0.25 0.00 0.00 175.52 175.75 3ktt h ALA 11 N 1.11 1.01 -0.71 6.62 0.00 -1.48 -2.47 119.26 123.34 3ktt h ALA 11 Ca 0.20 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 3ktt h ALA 11 Cb 0.14 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 3ktt h ALA 11 CO -0.02 0.66 0.30 -0.09 0.00 0.00 0.00 179.25 180.09 3ktt h ARG 12 N 1.14 1.03 -0.86 0.00 2.43 -0.59 -2.58 114.38 114.95 3ktt h ARG 12 Ca 0.26 -0.17 -0.02 0.00 -0.81 0.00 0.00 59.98 59.25 3ktt h ARG 12 Cb 0.24 -0.18 -0.04 0.00 -0.42 0.00 0.00 29.97 29.57 3ktt h ARG 12 CO -0.02 0.83 0.47 1.25 -1.51 0.00 0.00 179.97 180.99 3ktt h LEU 13 N 1.01 1.08 -1.03 3.80 6.46 -0.60 0.67 115.31 126.70 3ktt h LEU 13 Ca 0.24 -0.10 0.13 0.00 -0.12 0.00 0.00 57.88 58.03 3ktt h LEU 13 Cb 0.17 -0.27 -0.09 0.00 -0.73 0.00 0.00 40.66 39.74 3ktt h LEU 13 CO -0.02 0.87 0.63 0.28 -0.62 0.00 0.00 178.44 179.57 3ktt h SER 14 N 1.21 0.90 0.39 1.25 0.02 -1.20 1.09 113.55 117.20 3ktt h SER 14 Ca 0.30 0.05 -0.22 0.00 -0.84 0.00 0.00 61.79 61.09 3ktt h SER 14 Cb 0.03 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 62.44 3ktt h SER 14 CO -0.05 0.46 -0.92 0.28 -1.14 0.00 0.00 176.83 175.46 3ktt h SER 15 N 0.95 0.47 -0.22 3.07 0.02 -1.20 -2.84 113.55 113.80 3ktt h SER 15 Ca 0.51 -0.37 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 3ktt h SER 15 Cb 0.55 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.94 3ktt h SER 15 CO -0.28 1.17 0.10 0.15 -1.14 0.00 0.00 176.83 176.84 3ktt h PHE 16 N 0.21 0.32 -0.58 3.45 3.57 0.45 -3.03 116.94 121.33 3ktt h PHE 16 Ca -0.07 -0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.31 3ktt h PHE 16 Cb 1.55 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 40.17 3ktt h PHE 16 CO 0.05 0.33 -0.03 0.97 -2.23 0.00 0.00 178.31 177.40 3ktt h ILE 17 N 0.22 1.26 -0.66 1.41 6.09 0.99 -3.22 117.51 123.60 3ktt h ILE 17 Ca 0.07 -1.17 -0.01 0.00 -1.37 0.00 0.00 64.86 62.38 3ktt h ILE 17 Cb 0.13 0.85 -0.03 0.00 0.47 0.00 0.00 36.82 38.24 3ktt h ILE 17 CO -0.01 0.42 0.36 1.23 -3.07 0.00 0.00 178.15 177.08 3ktt h GLY 18 N 0.98 0.98 1.09 8.18 0.00 -1.38 -2.86 103.07 110.06 3ktt h GLY 18 Ca 0.16 -0.44 -0.08 0.00 0.00 0.00 0.00 47.33 46.96 3ktt h GLY 18 CO 0.03 0.42 0.08 0.00 0.00 0.00 0.00 176.54 177.08 3ktt h ALA 19 N 1.18 0.89 -0.54 3.60 0.00 -1.56 -3.17 119.26 119.67 3ktt h ALA 19 Ca 0.23 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 3ktt h ALA 19 Cb 0.04 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 3ktt h ALA 19 CO -0.04 0.67 0.13 0.97 0.00 0.00 0.00 179.25 180.98 3ktt h ILE 20 N 1.03 1.24 -0.67 0.00 2.10 -1.56 -2.93 117.51 116.73 3ktt h ILE 20 Ca 0.20 -0.87 -0.02 0.00 1.08 0.00 0.00 64.86 65.25 3ktt h ILE 20 Cb 0.48 0.78 -0.03 0.00 -1.09 0.00 0.00 36.82 36.96 3ktt h ILE 20 CO 0.02 0.32 0.33 0.00 -1.08 0.00 0.00 178.15 177.74 3ktt h ALA 21 N 1.01 0.86 -0.57 0.18 0.00 -1.50 -2.83 119.26 116.41 3ktt h ALA 21 Ca 0.17 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 3ktt h ALA 21 Cb 0.34 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3ktt h ALA 21 CO 0.00 0.41 0.03 -0.84 0.00 0.00 0.00 179.25 178.85 3ktt h ILE 22 N 0.92 1.25 -0.81 0.00 3.07 -1.55 -3.25 117.51 117.15 3ktt h ILE 22 Ca 0.23 -1.05 -0.02 0.00 1.55 0.00 0.00 64.86 65.56 3ktt h ILE 22 Cb 0.10 0.78 -0.04 0.00 -0.27 0.00 0.00 36.82 37.39 3ktt h ILE 22 CO -0.03 0.38 0.40 1.23 -1.05 0.00 0.00 178.15 179.08 3ktt h GLY 23 N 1.01 1.22 0.84 0.16 0.00 -1.31 0.12 103.07 105.10 3ktt h GLY 23 Ca 0.17 -0.58 -0.02 0.00 0.00 0.00 0.00 47.33 46.89 3ktt h GLY 23 CO 0.02 0.56 0.03 -0.55 0.00 0.00 0.00 176.54 176.60 3ktt h ASP 24 N 1.14 0.31 -0.42 0.19 3.32 -1.61 0.95 116.42 120.30 3ktt h ASP 24 Ca 0.28 -0.26 -0.10 0.00 0.02 0.00 0.00 57.03 56.97 3ktt h ASP 24 Cb 0.08 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 3ktt h ASP 24 CO -0.04 0.50 -0.13 -0.07 -1.72 0.00 0.00 179.24 177.78 3ktt h LEU 25 N 0.12 0.83 -0.57 1.55 -0.00 -1.68 -2.44 115.31 113.12 3ktt h LEU 25 Ca 0.06 -0.37 -0.12 0.00 -0.00 0.00 0.00 57.88 57.45 3ktt h LEU 25 Cb 0.32 -0.23 -0.02 0.00 -0.00 0.00 0.00 40.66 40.73 3ktt h LEU 25 CO 0.00 1.02 -0.12 -0.37 -0.00 0.00 0.00 178.44 178.97 3ktt h VAL 26 N 0.64 1.27 -0.68 1.22 -1.51 -0.59 -2.97 116.25 113.63 3ktt h VAL 26 Ca 0.10 -1.28 -0.05 0.00 -1.23 0.00 0.00 66.70 64.24 3ktt h VAL 26 Cb 0.67 0.98 -0.03 0.00 -2.13 0.00 0.00 31.29 30.78 3ktt h VAL 26 CO 0.05 0.45 0.22 0.07 -1.23 0.00 0.00 177.57 177.12 3ktt h LYS 27 N 0.90 1.03 0.00 5.19 2.10 0.11 -2.36 116.57 123.54 3ktt h LYS 27 Ca 0.14 -0.21 -0.05 0.00 -2.00 0.00 0.00 60.65 58.53 3ktt h LYS 27 Cb 0.69 -0.16 -0.01 0.00 -0.90 0.00 0.00 32.23 31.85 3ktt h LYS 27 CO 0.05 0.88 -0.24 0.66 -2.00 0.00 0.00 179.45 178.80 3ktt h SER 28 N 1.00 0.00 1.01 7.07 4.64 -1.27 -2.89 113.55 123.10 3ktt h SER 28 Ca 0.22 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.54 3ktt h SER 28 Cb 0.28 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.37 3ktt h SER 28 CO -0.01 0.24 -0.01 0.74 -0.87 0.00 0.00 176.83 176.92 3ktt h THR 29 N 0.00 0.03 -2.75 2.95 2.02 -1.41 -1.11 112.91 112.64 3ktt h THR 29 Ca -0.00 -0.53 -0.53 0.00 0.77 0.00 0.00 66.41 66.11 3ktt h THR 29 Cb 0.44 1.52 0.02 0.00 -1.74 0.00 0.00 68.15 68.38 3ktt h THR 29 CO 0.03 0.01 0.95 -0.76 0.37 0.00 0.00 175.52 176.12 3ktt s LEU 30 N -6.21 4.36 0.00 2.58 1.02 -1.09 -3.45 118.68 115.88 3ktt s LEU 30 Ca 0.01 2.42 0.00 0.00 0.02 0.00 0.00 54.13 56.58 3ktt s LEU 30 Cb 0.09 -3.57 0.00 0.00 0.02 0.00 0.00 46.19 42.73 3ktt s LEU 30 CO 0.55 -0.84 0.00 0.61 0.02 0.00 0.00 176.35 176.68 3ktt n GLY 31 N 3.89 1.47 0.36 -3.19 0.00 -1.26 -0.08 105.19 106.38 3ktt n GLY 31 Ca 0.15 -0.52 0.10 0.00 0.00 0.00 0.00 46.02 45.75 3ktt n GLY 31 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3ktt h PRO 32 N 0.00 0.60 -0.12 1.61 0.11 -1.83 0.74 132.00 133.11 3ktt h PRO 32 Ca 0.00 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.07 3ktt h PRO 32 Cb 0.00 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 30.97 3ktt h PRO 32 CO 0.00 0.40 0.00 1.63 -0.21 0.00 0.00 178.00 179.82 3ktt n LYS 33 N -4.50 1.66 -0.80 1.05 4.01 -1.17 -4.65 118.16 113.76 3ktt n LYS 33 Ca 0.13 -0.98 -0.31 0.00 -0.51 0.00 0.00 58.31 56.64 3ktt n LYS 33 Cb 0.37 -1.41 0.16 0.00 -0.51 0.00 0.00 35.03 33.64 3ktt n LYS 33 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 3ktt s GLY 34 N -1.66 1.67 0.19 0.72 0.00 0.24 -4.75 107.32 103.73 3ktt s GLY 34 Ca 0.33 0.45 0.08 0.00 0.00 0.00 0.00 44.72 45.58 3ktt s GLY 34 CO 0.28 0.88 -0.15 1.06 0.00 0.00 0.00 173.10 175.17 3ktt s MET 35 N -4.69 1.29 -0.06 2.90 -1.94 -0.42 -4.79 119.30 111.60 3ktt s MET 35 Ca 0.66 -1.52 -0.05 0.00 -1.71 0.00 0.00 55.69 53.07 3ktt s MET 35 Cb -0.22 -1.15 -0.04 0.00 2.01 0.00 0.00 34.83 35.43 3ktt s MET 35 CO 0.58 0.20 0.18 -0.51 -0.01 0.00 0.00 175.02 175.46 3ktt s ASP 36 N -3.09 6.40 0.16 3.03 1.11 -1.26 -4.35 116.67 118.67 3ktt s ASP 36 Ca 0.20 0.44 0.09 0.00 0.18 0.00 0.00 52.55 53.45 3ktt s ASP 36 Cb -0.02 -2.05 -0.04 0.00 1.07 0.00 0.00 42.92 41.88 3ktt s ASP 36 CO 0.06 0.33 -0.19 -0.54 1.18 0.00 0.00 175.17 176.01 3ktt s LYS 37 N -1.49 1.30 -0.10 8.23 -0.14 -1.26 -5.00 119.74 121.27 3ktt s LYS 37 Ca 0.22 -1.41 0.02 0.00 -1.36 0.00 0.00 55.97 53.44 3ktt s LYS 37 Cb -0.12 -1.40 -0.01 0.00 -1.68 0.00 0.00 37.83 34.61 3ktt s LYS 37 CO 0.12 0.29 -0.17 0.96 -0.76 0.00 0.00 175.35 175.79 3ktt s ILE 38 N -1.94 2.74 -0.19 2.17 -5.25 -1.26 -2.40 121.20 115.06 3ktt s ILE 38 Ca 0.16 -0.79 0.01 0.00 -0.99 0.00 0.00 60.65 59.04 3ktt s ILE 38 Cb -0.06 -2.10 0.03 0.00 2.95 0.00 0.00 42.46 43.27 3ktt s ILE 38 CO 0.07 0.55 -0.18 -0.76 -1.79 0.00 0.00 174.94 172.82 3ktt s LEU 39 N 0.09 2.26 -0.13 0.37 1.43 -1.18 -4.91 118.68 116.61 3ktt s LEU 39 Ca -0.08 -0.73 -0.03 0.00 -1.03 0.00 0.00 54.13 52.26 3ktt s LEU 39 Cb -0.15 -1.46 -0.03 0.00 0.03 0.00 0.00 46.19 44.58 3ktt s LEU 39 CO 0.05 -0.03 -0.03 -0.22 0.23 0.00 0.00 176.35 176.35 3ktt s LEU 40 N 1.28 3.34 0.11 1.79 1.98 -1.26 -0.07 118.68 125.85 3ktt s LEU 40 Ca 0.03 -0.04 0.02 0.00 -2.89 0.00 0.00 54.13 51.26 3ktt s LEU 40 Cb -0.14 -1.78 -0.04 0.00 0.66 0.00 0.00 46.19 44.89 3ktt s LEU 40 CO -0.12 0.25 -0.08 -0.55 -1.89 0.00 0.00 176.35 173.97 3ktt s SER 41 N -0.12 1.28 0.79 3.68 0.15 -1.19 -4.96 113.70 113.33 3ktt s SER 41 Ca 0.03 -0.98 -0.09 0.00 0.70 0.00 0.00 55.95 55.61 3ktt s SER 41 Cb -0.13 0.07 0.11 0.00 -1.71 0.00 0.00 66.02 64.36 3ktt s SER 41 CO 0.02 -0.42 1.12 -0.55 1.20 0.00 0.00 173.24 174.62 3ktt s SER 42 N -2.98 4.24 0.35 5.45 0.15 -1.26 -4.10 113.70 115.55 3ktt s SER 42 Ca 0.12 0.35 -0.28 0.00 0.70 0.00 0.00 55.95 56.84 3ktt s SER 42 Cb 0.04 -0.78 -0.12 0.00 -1.71 0.00 0.00 66.02 63.45 3ktt s SER 42 CO -0.03 -1.99 1.24 0.61 1.20 0.00 0.00 173.24 174.26 3ktt n GLY 43 N -3.21 0.44 3.46 9.45 0.00 -1.26 -0.89 105.19 113.18 3ktt n GLY 43 Ca 0.11 0.30 -0.43 0.00 0.00 0.00 0.00 46.02 45.99 3ktt n GLY 43 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ktt s ARG 44 N -1.87 3.42 -0.21 1.61 3.00 -1.26 -5.10 118.95 118.53 3ktt s ARG 44 Ca 0.57 -1.37 -0.06 0.00 0.00 0.00 0.00 55.73 54.87 3ktt s ARG 44 Cb -0.58 -4.70 0.10 0.00 0.00 0.00 0.00 34.95 29.77 3ktt s ARG 44 CO 0.61 -1.82 0.42 -0.51 0.00 0.00 0.00 175.30 174.00 3ktt s ASP 45 N 3.76 -0.20 0.10 0.23 1.01 -0.07 -5.04 116.67 116.47 3ktt s ASP 45 Ca 0.30 0.85 -0.13 0.00 0.71 0.00 0.00 52.55 54.28 3ktt s ASP 45 Cb -0.09 1.33 -0.17 0.00 1.01 0.00 0.00 42.92 45.01 3ktt s ASP 45 CO -0.02 -0.25 1.29 0.00 0.21 0.00 0.00 175.17 176.40 3ktt h ALA 46 N 8.17 0.28 -3.00 5.23 0.00 -1.86 -3.38 119.26 124.69 3ktt h ALA 46 Ca -0.17 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.13 3ktt h ALA 46 Cb 1.12 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3ktt h ALA 46 CO 0.15 0.69 0.00 -1.13 0.00 0.00 0.00 179.25 178.96 3ktt n SER 47 N -3.92 0.00 -4.40 0.00 3.41 -1.26 -4.99 113.62 102.46 3ktt n SER 47 Ca -0.08 0.00 -0.40 0.00 -0.26 0.00 0.00 58.87 58.13 3ktt n SER 47 Cb 0.77 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.61 3ktt n SER 47 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3ktt s LEU 48 N 0.00 4.54 -0.47 1.04 1.02 -1.24 -3.19 118.68 120.38 3ktt s LEU 48 Ca 0.00 -0.85 -0.24 0.00 0.02 0.00 0.00 54.13 53.06 3ktt s LEU 48 Cb 0.00 -2.02 0.03 0.00 0.02 0.00 0.00 46.19 44.22 3ktt s LEU 48 CO 0.00 -0.33 0.84 -0.04 0.02 0.00 0.00 176.35 176.84 3ktt s MET 49 N 1.57 3.42 0.04 1.70 -1.94 0.90 -4.60 119.30 120.39 3ktt s MET 49 Ca 0.03 -0.08 -0.27 0.00 -1.71 0.00 0.00 55.69 53.65 3ktt s MET 49 Cb -0.18 -3.96 -0.05 0.00 2.01 0.00 0.00 34.83 32.65 3ktt s MET 49 CO 0.07 -1.20 0.84 0.54 -0.01 0.00 0.00 175.02 175.26 3ktt s VAL 50 N 3.49 4.73 -0.05 -6.03 0.11 -1.26 -3.11 120.40 118.28 3ktt s VAL 50 Ca 0.31 1.79 -0.01 0.00 -2.93 0.00 0.00 61.98 61.14 3ktt s VAL 50 Cb -0.12 -4.19 0.03 0.00 -1.53 0.00 0.00 36.38 30.57 3ktt s VAL 50 CO 0.23 0.31 0.04 -0.89 -3.33 0.00 0.00 175.10 171.45 3ktt s THR 51 N 0.22 0.05 0.16 5.04 2.01 -1.01 -4.91 115.64 117.20 3ktt s THR 51 Ca 0.43 0.30 -0.02 0.00 0.31 0.00 0.00 61.69 62.70 3ktt s THR 51 Cb -0.21 -0.26 -0.13 0.00 0.01 0.00 0.00 72.50 71.91 3ktt s THR 51 CO 0.25 0.19 1.39 -1.13 -0.69 0.00 0.00 174.62 174.63 3ktt h ASN 52 N 8.21 0.50 -3.10 3.53 -0.73 -1.90 -3.37 115.58 118.72 3ktt h ASN 52 Ca -0.20 -0.35 -0.55 0.00 1.87 0.00 0.00 56.30 57.08 3ktt h ASN 52 Cb 1.12 -0.15 -0.02 0.00 0.27 0.00 0.00 38.32 39.55 3ktt h ASN 52 CO 0.24 1.11 0.68 -0.62 -0.37 0.00 0.00 177.43 178.47 3ktt s ASP 53 N -7.00 7.05 0.16 1.15 -1.08 -1.26 -4.84 116.67 110.85 3ktt s ASP 53 Ca -0.06 1.86 -0.10 0.00 -0.52 0.00 0.00 52.55 53.73 3ktt s ASP 53 Cb 0.10 -2.56 0.02 0.00 -1.46 0.00 0.00 42.92 39.02 3ktt s ASP 53 CO 0.85 -0.57 1.56 1.23 0.52 0.00 0.00 175.17 178.76 3ktt h GLY 54 N 7.97 1.09 1.13 2.66 0.00 -1.97 -3.30 103.07 110.64 3ktt h GLY 54 Ca -0.36 -0.95 -0.01 0.00 0.00 0.00 0.00 47.33 46.01 3ktt h GLY 54 CO 0.87 0.87 0.48 0.00 0.00 0.00 0.00 176.54 178.75 3ktt h ALA 55 N 0.89 1.27 -0.13 3.60 0.00 -1.97 -2.79 119.26 120.13 3ktt h ALA 55 Ca 0.11 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.92 3ktt h ALA 55 Cb 0.78 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3ktt h ALA 55 CO 0.06 0.61 0.06 1.15 0.00 0.00 0.00 179.25 181.14 3ktt h THR 56 N 1.16 1.00 -0.60 0.00 2.02 -1.99 0.80 112.91 115.31 3ktt h THR 56 Ca 0.30 -0.05 -0.05 0.00 0.77 0.00 0.00 66.41 67.38 3ktt h THR 56 Cb -0.01 0.85 -0.02 0.00 -1.74 0.00 0.00 68.15 67.23 3ktt h THR 56 CO -0.05 0.03 0.16 -0.29 0.37 0.00 0.00 175.52 175.74 3ktt h ILE 57 N 0.14 1.25 -0.69 3.11 -0.00 -1.68 -0.93 117.51 118.71 3ktt h ILE 57 Ca 0.05 -0.87 0.01 0.00 -0.00 0.00 0.00 64.86 64.05 3ktt h ILE 57 Cb 0.01 0.68 -0.04 0.00 -0.00 0.00 0.00 36.82 37.47 3ktt h ILE 57 CO -0.03 0.33 0.45 -0.07 -0.00 0.00 0.00 178.15 178.82 3ktt h LEU 58 N 0.86 0.77 -0.89 2.19 -0.00 -1.13 -1.48 115.31 115.63 3ktt h LEU 58 Ca 0.19 -0.02 -0.05 0.00 -0.00 0.00 0.00 57.88 58.00 3ktt h LEU 58 Cb 0.32 -0.19 -0.03 0.00 -0.00 0.00 0.00 40.66 40.76 3ktt h LEU 58 CO -0.00 0.56 0.23 0.11 -0.00 0.00 0.00 178.44 179.34 3ktt h LYS 59 N 0.92 1.05 -0.56 1.13 1.79 -0.29 -3.14 116.57 117.47 3ktt h LYS 59 Ca 0.26 -0.21 -0.07 0.00 -2.18 0.00 0.00 60.65 58.45 3ktt h LYS 59 Cb -0.09 -0.16 -0.02 0.00 -1.58 0.00 0.00 32.23 30.38 3ktt h LYS 59 CO -0.06 0.89 0.05 -0.91 -1.08 0.00 0.00 179.45 178.34 3ktt h ASN 60 N 1.02 0.88 -4.31 0.86 2.35 -0.13 -3.44 115.58 112.81 3ktt h ASN 60 Ca 0.23 -0.21 -0.54 0.00 -0.55 0.00 0.00 56.30 55.23 3ktt h ASN 60 Cb 0.26 -0.23 -0.28 0.00 0.05 0.00 0.00 38.32 38.12 3ktt h ASN 60 CO -0.01 0.91 -0.83 -0.51 -1.65 0.00 0.00 177.43 175.34 3ktt s ILE 61 N -5.09 1.40 -0.65 2.81 1.10 -0.98 -5.01 121.20 114.78 3ktt s ILE 61 Ca -0.10 -0.88 0.05 0.00 -0.51 0.00 0.00 60.65 59.21 3ktt s ILE 61 Cb 0.15 -1.19 0.19 0.00 0.15 0.00 0.00 42.46 41.76 3ktt s ILE 61 CO 0.83 0.29 0.55 0.61 -2.11 0.00 0.00 174.94 175.10 3ktt n GLY 62 N 2.36 4.02 0.12 1.50 0.00 -1.26 -4.85 105.19 107.07 3ktt n GLY 62 Ca -0.16 -2.48 -0.13 0.00 0.00 0.00 0.00 46.02 43.25 3ktt n GLY 62 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3ktt h VAL 63 N 3.99 0.95 -4.33 1.61 2.07 -1.95 -3.48 116.25 115.12 3ktt h VAL 63 Ca 0.17 -0.43 -0.40 0.00 0.82 0.00 0.00 66.70 66.87 3ktt h VAL 63 Cb 0.75 1.22 -0.10 0.00 -1.52 0.00 0.00 31.29 31.64 3ktt h VAL 63 CO 0.71 0.10 -0.37 -0.90 0.02 0.00 0.00 177.57 177.13 3ktt n ASP 64 N -5.08 0.02 0.21 0.57 5.68 -1.26 -5.03 116.55 111.65 3ktt n ASP 64 Ca -0.09 -2.72 0.14 0.00 -0.50 0.00 0.00 54.79 51.62 3ktt n ASP 64 Cb 0.18 1.15 0.76 0.00 -1.14 0.00 0.00 41.12 42.06 3ktt n ASP 64 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 3ktt h ASN 65 N 1.50 0.00 -3.93 -1.12 7.08 -2.06 -3.43 115.58 113.62 3ktt h ASN 65 Ca -0.21 0.00 -0.53 0.00 -3.08 0.00 0.00 56.30 52.48 3ktt h ASN 65 Cb 0.95 0.00 0.09 0.00 -2.08 0.00 0.00 38.32 37.28 3ktt h ASN 65 CO 0.31 0.00 0.69 -2.84 -2.08 0.00 0.00 177.43 173.51 3ktt s PRO 66 N -4.86 4.10 0.44 4.14 0.02 -1.26 -4.95 135.00 132.63 3ktt s PRO 66 Ca -0.05 2.34 -0.22 0.00 0.02 0.00 0.00 61.00 63.09 3ktt s PRO 66 Cb 0.17 -2.91 -0.09 0.00 0.02 0.00 0.00 34.50 31.69 3ktt s PRO 66 CO 0.62 -0.45 1.06 0.00 -0.33 0.00 0.00 177.00 177.90 3ktt s ALA 67 N -1.17 2.98 0.00 -1.55 0.00 -1.26 -4.65 121.76 116.11 3ktt s ALA 67 Ca 0.53 0.69 0.00 0.00 0.00 0.00 0.00 51.96 53.19 3ktt s ALA 67 Cb -0.42 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.42 3ktt s ALA 67 CO 0.56 -0.31 0.00 0.00 0.00 0.00 0.00 175.76 176.01 3ktt n ALA 68 N -0.48 0.00 -0.31 0.00 0.00 -1.26 -4.74 120.51 113.72 3ktt n ALA 68 Ca 0.07 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.57 3ktt n ALA 68 Cb 0.51 0.00 0.27 0.00 0.00 0.00 0.00 19.45 20.22 3ktt n ALA 68 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3ktt h LYS 69 N 0.00 0.93 -0.73 0.00 3.64 -1.94 0.85 116.57 119.32 3ktt h LYS 69 Ca 0.00 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.27 3ktt h LYS 69 Cb 0.00 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 31.58 3ktt h LYS 69 CO 0.00 0.62 0.25 -0.39 -2.27 0.00 0.00 179.45 177.66 3ktt h VAL 70 N 0.96 1.26 -0.45 2.00 -1.51 -1.98 0.67 116.25 117.19 3ktt h VAL 70 Ca 0.42 -0.86 0.00 0.00 -1.23 0.00 0.00 66.70 65.03 3ktt h VAL 70 Cb 0.35 0.45 -0.02 0.00 -2.13 0.00 0.00 31.29 29.94 3ktt h VAL 70 CO -0.18 0.34 0.29 0.25 -1.23 0.00 0.00 177.57 177.04 3ktt h LEU 71 N 1.06 0.53 -0.86 4.19 6.46 0.13 -1.47 115.31 125.35 3ktt h LEU 71 Ca 0.24 -0.03 0.04 0.00 -0.12 0.00 0.00 57.88 58.01 3ktt h LEU 71 Cb 0.27 -0.13 -0.05 0.00 -0.73 0.00 0.00 40.66 40.02 3ktt h LEU 71 CO -0.01 0.40 0.55 0.58 -0.62 0.00 0.00 178.44 179.34 3ktt h VAL 72 N 0.61 1.13 -0.70 1.05 2.07 -0.04 -2.98 116.25 117.39 3ktt h VAL 72 Ca 0.16 -0.37 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 3ktt h VAL 72 Cb -0.05 -0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 29.66 3ktt h VAL 72 CO -0.03 0.19 0.34 -0.78 0.02 0.00 0.00 177.57 177.31 3ktt h ASP 73 N 1.07 0.90 -0.74 0.57 3.58 0.20 -3.19 116.42 118.81 3ktt h ASP 73 Ca 0.34 -0.10 -0.03 0.00 0.42 0.00 0.00 57.03 57.67 3ktt h ASP 73 Cb 0.02 -0.23 -0.04 0.00 1.72 0.00 0.00 39.33 40.80 3ktt h ASP 73 CO -0.12 0.76 0.37 -0.03 -2.88 0.00 0.00 179.24 177.34 3ktt h MET 74 N 0.99 1.07 -0.39 0.28 4.05 -1.33 -2.87 114.93 116.74 3ktt h MET 74 Ca 0.24 -0.14 0.11 0.00 -0.28 0.00 0.00 59.70 59.63 3ktt h MET 74 Cb 0.10 -0.20 -0.02 0.00 -0.80 0.00 0.00 31.60 30.68 3ktt h MET 74 CO -0.03 0.82 0.44 1.03 0.23 0.00 0.00 176.91 179.40 3ktt h SER 75 N 1.07 0.00 -0.83 1.39 0.87 -1.73 0.57 113.55 114.89 3ktt h SER 75 Ca 0.26 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.83 3ktt h SER 75 Cb 0.10 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.01 3ktt h SER 75 CO -0.03 0.00 0.54 -0.09 -0.53 0.00 0.00 176.83 176.71 3ktt h ARG 76 N 0.00 1.10 -0.73 2.24 2.43 -1.73 -1.81 114.38 115.88 3ktt h ARG 76 Ca 0.18 -0.07 -0.03 0.00 -0.81 0.00 0.00 59.98 59.25 3ktt h ARG 76 Cb 1.07 -0.24 -0.03 0.00 -0.42 0.00 0.00 29.97 30.34 3ktt h ARG 76 CO -0.00 0.74 0.32 -0.24 -1.51 0.00 0.00 179.97 179.27 3ktt h VAL 77 N 1.13 1.24 -0.94 0.20 3.04 -1.09 0.39 116.25 120.21 3ktt h VAL 77 Ca 0.30 -0.72 0.01 0.00 -1.01 0.00 0.00 66.70 65.28 3ktt h VAL 77 Cb -0.11 0.34 -0.05 0.00 -2.01 0.00 0.00 31.29 29.46 3ktt h VAL 77 CO -0.06 0.30 0.62 -0.61 -1.01 0.00 0.00 177.57 176.81 3ktt h GLN 78 N 1.05 1.23 -0.18 4.17 5.75 -1.43 0.09 115.11 125.79 3ktt h GLN 78 Ca 0.25 -0.07 -0.13 0.00 -0.15 0.00 0.00 58.65 58.55 3ktt h GLN 78 Cb 0.16 -0.28 -0.01 0.00 1.07 0.00 0.00 27.48 28.42 3ktt h GLN 78 CO -0.03 0.81 -0.42 0.22 -2.65 0.00 0.00 178.83 176.76 3ktt h ASP 79 N 1.26 0.46 -0.38 -0.69 3.58 0.14 1.20 116.42 121.99 3ktt h ASP 79 Ca 0.35 -0.20 -0.06 0.00 0.42 0.00 0.00 57.03 57.53 3ktt h ASP 79 Cb -0.13 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 40.78 3ktt h ASP 79 CO -0.08 0.83 -0.00 -0.78 -2.88 0.00 0.00 179.24 176.33 3ktt h ASP 80 N 0.35 0.65 -0.56 2.28 3.58 0.72 -2.57 116.42 120.88 3ktt h ASP 80 Ca 0.03 -0.31 -0.10 0.00 0.42 0.00 0.00 57.03 57.07 3ktt h ASP 80 Cb 0.89 -0.18 -0.02 0.00 1.72 0.00 0.00 39.33 41.75 3ktt h ASP 80 CO 0.08 0.80 -0.05 -0.33 -2.88 0.00 0.00 179.24 176.85 3ktt h GLU 81 N 0.48 1.03 0.00 0.28 4.39 -0.89 -3.46 114.58 116.40 3ktt h GLU 81 Ca 0.11 -0.35 0.00 0.00 0.34 0.00 0.00 59.36 59.45 3ktt h GLU 81 Cb 0.47 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.04 3ktt h GLU 81 CO 0.02 1.04 0.00 1.55 -1.16 0.00 0.00 179.01 180.46 3ktt n VAL 82 N -4.19 0.00 0.00 3.13 3.14 0.40 -4.81 118.33 116.01 3ktt n VAL 82 Ca 0.02 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.40 3ktt n VAL 82 Cb 0.37 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.15 3ktt n VAL 82 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3ktt n GLY 83 N 0.00 3.44 0.75 7.55 0.00 -0.69 -4.40 105.19 111.84 3ktt n GLY 83 Ca 0.00 -0.13 0.10 0.00 0.00 0.00 0.00 46.02 45.99 3ktt n GLY 83 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3ktt n ASP 84 N 0.00 -4.44 -0.04 1.61 5.75 -1.26 0.36 116.55 118.53 3ktt n ASP 84 Ca 0.00 0.35 -0.10 0.00 -0.01 0.00 0.00 54.79 55.02 3ktt n ASP 84 Cb 0.00 -2.29 -0.04 0.00 -1.03 0.00 0.00 41.12 37.76 3ktt n ASP 84 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 3ktt h GLY 85 N -0.70 0.27 -4.58 6.12 0.00 -1.97 -3.44 103.07 98.78 3ktt h GLY 85 Ca 0.00 -0.12 -0.60 0.00 0.00 0.00 0.00 47.33 46.61 3ktt h GLY 85 CO 0.01 0.11 -0.85 -0.51 0.00 0.00 0.00 176.54 175.30 3ktt s THR 86 N -5.97 1.71 0.30 4.70 -4.23 -1.26 -4.88 115.64 106.02 3ktt s THR 86 Ca -0.13 -1.12 -0.29 0.00 -1.18 0.00 0.00 61.69 58.97 3ktt s THR 86 Cb 0.08 -1.47 -0.10 0.00 1.34 0.00 0.00 72.50 72.35 3ktt s THR 86 CO 0.69 0.31 1.38 0.42 -0.54 0.00 0.00 174.62 176.89 3ktt s THR 87 N -0.70 2.63 0.00 3.99 -4.23 -1.26 -4.74 115.64 111.33 3ktt s THR 87 Ca 0.08 0.58 0.00 0.00 -1.18 0.00 0.00 61.69 61.18 3ktt s THR 87 Cb -0.09 -3.37 0.00 0.00 1.34 0.00 0.00 72.50 70.38 3ktt s THR 87 CO 0.01 0.12 0.00 -1.20 -0.54 0.00 0.00 174.62 173.01 3ktt n SER 88 N 1.40 0.00 -0.34 3.99 7.64 -1.26 -4.79 113.62 120.26 3ktt n SER 88 Ca 0.03 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 59.88 3ktt n SER 88 Cb 0.41 0.00 0.09 0.00 -1.01 0.00 0.00 64.21 63.70 3ktt n SER 88 CO 0.00 0.00 0.00 -0.37 -3.01 0.00 0.00 175.04 171.66 3ktt h VAL 89 N 0.00 1.25 -0.48 0.44 -1.51 -1.97 -2.85 116.25 111.13 3ktt h VAL 89 Ca 0.00 -0.50 -0.05 0.00 -1.23 0.00 0.00 66.70 64.93 3ktt h VAL 89 Cb 0.00 -0.07 -0.02 0.00 -2.13 0.00 0.00 31.29 29.07 3ktt h VAL 89 CO 0.00 0.25 0.12 0.74 -1.23 0.00 0.00 177.57 177.45 3ktt h THR 90 N 1.25 1.24 -0.46 7.19 2.02 -1.98 -1.49 112.91 120.68 3ktt h THR 90 Ca 0.33 -0.82 -0.02 0.00 0.77 0.00 0.00 66.41 66.67 3ktt h THR 90 Cb -0.09 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 67.16 3ktt h THR 90 CO -0.07 0.30 0.20 0.58 0.37 0.00 0.00 175.52 176.90 3ktt h VAL 91 N 0.65 1.20 -0.75 3.16 2.07 -1.90 0.15 116.25 120.82 3ktt h VAL 91 Ca 0.15 -0.59 -0.05 0.00 0.82 0.00 0.00 66.70 67.03 3ktt h VAL 91 Cb 0.32 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 3ktt h VAL 91 CO 0.00 0.22 0.29 -0.07 0.02 0.00 0.00 177.57 178.03 3ktt h LEU 92 N 0.59 1.06 -0.97 2.57 4.07 -1.42 -1.33 115.31 119.87 3ktt h LEU 92 Ca 0.15 -0.18 0.00 0.00 0.08 0.00 0.00 57.88 57.93 3ktt h LEU 92 Cb 0.16 -0.27 -0.05 0.00 1.08 0.00 0.00 40.66 41.58 3ktt h LEU 92 CO -0.02 0.95 0.61 0.00 -1.08 0.00 0.00 178.44 178.90 3ktt h ALA 93 N 1.15 1.24 -0.71 1.53 0.00 -0.59 -2.12 119.26 119.74 3ktt h ALA 93 Ca 0.25 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3ktt h ALA 93 Cb 0.24 -0.39 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 3ktt h ALA 93 CO -0.02 0.67 0.40 0.00 0.00 0.00 0.00 179.25 180.30 3ktt h ALA 94 N 1.33 0.91 -0.00 0.00 0.00 0.10 -1.97 119.26 119.64 3ktt h ALA 94 Ca 0.35 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 3ktt h ALA 94 Cb -0.09 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 3ktt h ALA 94 CO -0.07 0.42 -0.17 1.05 0.00 0.00 0.00 179.25 180.48 3ktt h GLU 95 N 0.98 0.00 0.00 0.00 4.11 -0.68 0.72 114.58 119.71 3ktt h GLU 95 Ca 0.25 -0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.64 3ktt h GLU 95 Cb 0.03 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 3ktt h GLU 95 CO -0.04 0.18 -0.17 1.37 0.07 0.00 0.00 179.01 180.41 3ktt h LEU 96 N 0.00 0.00 -2.30 3.06 -0.00 -1.09 0.27 115.31 115.26 3ktt h LEU 96 Ca -0.00 0.00 0.02 0.00 -0.00 0.00 0.00 57.88 57.90 3ktt h LEU 96 Cb 0.31 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.97 3ktt h LEU 96 CO 0.02 0.17 0.05 -0.07 -0.00 0.00 0.00 178.44 178.62 3ktt h LEU 97 N 0.00 0.00 -0.32 0.17 4.07 -0.82 -3.26 115.31 115.14 3ktt h LEU 97 Ca -0.00 0.00 0.05 0.00 0.08 0.00 0.00 57.88 58.00 3ktt h LEU 97 Cb 0.32 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.02 3ktt h LEU 97 CO 0.02 0.00 0.07 0.03 -1.08 0.00 0.00 178.44 177.48 3ktt h ARG 98 N 0.00 0.18 0.00 1.13 -0.00 -0.52 -3.16 114.38 112.01 3ktt h ARG 98 Ca 0.03 -0.01 -0.00 0.00 -0.50 0.00 0.00 59.98 59.49 3ktt h ARG 98 Cb 0.13 -0.04 -0.00 0.00 0.00 0.00 0.00 29.97 30.06 3ktt h ARG 98 CO -0.00 0.12 -0.02 0.93 0.00 0.00 0.00 179.97 181.01 3ktt h GLU 99 N 0.19 0.00 -0.44 0.04 3.07 -1.73 -3.22 114.58 112.50 3ktt h GLU 99 Ca 0.15 0.00 0.11 0.00 -0.50 0.00 0.00 59.36 59.12 3ktt h GLU 99 Cb 0.16 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.05 3ktt h GLU 99 CO -0.19 0.02 0.31 0.00 -1.40 0.00 0.00 179.01 177.74 3ktt h ALA 100 N 1.98 2.26 -0.42 3.43 0.00 -1.78 0.95 119.26 125.69 3ktt h ALA 100 Ca -0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3ktt h ALA 100 Cb 0.43 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 3ktt h ALA 100 CO 0.00 -0.38 0.22 1.49 0.00 0.00 0.00 179.25 180.58 3ktt h GLU 101 N 0.11 0.59 0.00 0.00 4.57 -1.81 1.03 114.58 119.08 3ktt h GLU 101 Ca 0.20 -0.08 -0.01 0.00 -1.18 0.00 0.00 59.36 58.30 3ktt h GLU 101 Cb 0.67 -0.11 -0.00 0.00 -0.16 0.00 0.00 28.75 29.15 3ktt h GLU 101 CO -0.02 0.49 -0.04 0.77 -1.18 0.00 0.00 179.01 179.03 3ktt h SER 102 N 0.54 0.00 0.40 1.04 0.02 0.43 0.66 113.55 116.64 3ktt h SER 102 Ca 0.15 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 61.00 3ktt h SER 102 Cb 0.08 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 3ktt h SER 102 CO -0.02 0.04 -0.43 -0.07 -1.14 0.00 0.00 176.83 175.21 3ktt h LEU 103 N 0.00 0.05 -1.39 5.07 4.07 0.45 0.63 115.31 124.19 3ktt h LEU 103 Ca -0.00 -0.02 -0.03 0.00 0.08 0.00 0.00 57.88 57.91 3ktt h LEU 103 Cb 0.14 -0.01 -0.02 0.00 1.08 0.00 0.00 40.66 41.85 3ktt h LEU 103 CO 0.01 0.48 0.10 0.16 -1.08 0.00 0.00 178.44 178.11 3ktt h ILE 104 N 0.04 1.16 -0.09 1.22 3.07 0.69 0.83 117.51 124.44 3ktt h ILE 104 Ca 0.00 -0.54 -0.06 0.00 1.55 0.00 0.00 64.86 65.81 3ktt h ILE 104 Cb 0.79 0.78 -0.01 0.00 -0.27 0.00 0.00 36.82 38.11 3ktt h ILE 104 CO 0.06 0.20 -0.23 0.00 -1.05 0.00 0.00 178.15 177.13 3ktt h ALA 105 N 1.61 1.46 -0.56 0.16 0.00 -0.61 -1.62 119.26 119.69 3ktt h ALA 105 Ca 0.12 -0.26 0.07 0.00 0.00 0.00 0.00 54.91 54.84 3ktt h ALA 105 Cb 0.17 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.83 3ktt h ALA 105 CO -0.01 0.39 0.26 -0.22 0.00 0.00 0.00 179.25 179.67 3ktt h LYS 106 N 0.13 0.47 -6.70 0.00 3.11 0.28 -3.45 116.57 110.41 3ktt h LYS 106 Ca 0.02 -0.03 -0.54 0.00 -2.81 0.00 0.00 60.65 57.29 3ktt h LYS 106 Cb 0.49 -0.11 -0.17 0.00 -1.00 0.00 0.00 32.23 31.44 3ktt h LYS 106 CO 0.03 0.31 -0.85 0.36 -2.81 0.00 0.00 179.45 176.49 3ktt n LYS 107 N -4.92 -3.13 0.00 1.90 2.85 -0.40 -4.82 118.16 109.65 3ktt n LYS 107 Ca 0.07 0.37 0.00 0.00 -1.05 0.00 0.00 58.31 57.70 3ktt n LYS 107 Cb 0.20 -4.92 0.00 0.00 -0.65 0.00 0.00 35.03 29.66 3ktt n LYS 107 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 177.40 176.46 3ktt n ILE 108 N -4.40 0.00 -3.80 0.58 5.41 -1.26 -5.07 119.36 110.82 3ktt n ILE 108 Ca -0.02 0.00 -0.37 0.00 1.00 0.00 0.00 62.75 63.36 3ktt n ILE 108 Cb 0.54 0.00 -0.13 0.00 -0.71 0.00 0.00 39.64 39.34 3ktt n ILE 108 CO 0.00 0.00 0.00 -2.28 0.00 0.00 0.00 176.55 174.27 3ktt s HIS 109 N 3.31 3.22 0.32 1.39 2.46 -1.26 -4.92 115.29 119.81 3ktt s HIS 109 Ca 0.00 -1.41 0.01 0.00 0.47 0.00 0.00 55.06 54.13 3ktt s HIS 109 Cb 0.00 -2.22 0.56 0.00 -0.13 0.00 0.00 32.58 30.78 3ktt s HIS 109 CO 0.00 -0.71 1.96 -1.00 -2.47 0.00 0.00 174.74 172.52 3ktt h PRO 110 N 8.17 0.95 -0.11 2.88 0.13 -1.97 0.68 132.00 142.73 3ktt h PRO 110 Ca -0.25 -0.06 -0.07 0.00 -0.87 0.00 0.00 66.00 64.75 3ktt h PRO 110 Cb 1.09 -0.21 -0.01 0.00 0.13 0.00 0.00 31.00 31.99 3ktt h PRO 110 CO 0.59 0.63 -0.26 1.96 -0.23 0.00 0.00 178.00 180.69 3ktt h GLN 111 N 0.98 0.19 -0.45 0.86 7.50 -1.96 0.34 115.11 122.57 3ktt h GLN 111 Ca 0.32 -0.06 -0.02 0.00 0.50 0.00 0.00 58.65 59.39 3ktt h GLN 111 Cb 0.04 -0.02 -0.02 0.00 0.05 0.00 0.00 27.48 27.53 3ktt h GLN 111 CO -0.09 0.44 0.21 1.15 -1.50 0.00 0.00 178.83 179.04 3ktt h THR 112 N 0.17 1.15 -0.52 -0.54 2.02 -1.31 -2.07 112.91 111.82 3ktt h THR 112 Ca 0.03 -0.44 -0.05 0.00 0.77 0.00 0.00 66.41 66.72 3ktt h THR 112 Cb 0.56 0.59 -0.02 0.00 -1.74 0.00 0.00 68.15 67.53 3ktt h THR 112 CO 0.04 0.18 0.11 0.40 0.37 0.00 0.00 175.52 176.62 3ktt h ILE 113 N 0.62 1.22 0.00 3.11 2.04 0.75 -2.86 117.51 122.40 3ktt h ILE 113 Ca 0.16 -0.82 0.00 0.00 1.00 0.00 0.00 64.86 65.20 3ktt h ILE 113 Cb 0.07 0.71 0.00 0.00 -0.74 0.00 0.00 36.82 36.86 3ktt h ILE 113 CO -0.02 0.30 0.06 0.40 0.00 0.00 0.00 178.15 178.89 3ktt h ILE 114 N 0.76 0.00 0.00 -0.67 1.08 -0.52 -0.86 117.51 117.31 3ktt h ILE 114 Ca 0.17 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.64 3ktt h ILE 114 Cb 0.31 0.63 0.00 0.00 -3.07 0.00 0.00 36.82 34.68 3ktt h ILE 114 CO 0.00 0.00 0.40 0.00 -0.69 0.00 0.00 178.15 177.86 3ktt h ALA 115 N 1.86 1.27 -0.84 1.87 0.00 -1.57 0.43 119.26 122.29 3ktt h ALA 115 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 54.91 55.03 3ktt h ALA 115 Cb 0.11 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.82 3ktt h ALA 115 CO 0.00 -0.27 0.46 0.78 0.00 0.00 0.00 179.25 180.22 3ktt h GLY 116 N 0.00 1.33 1.48 0.00 0.00 -1.42 -2.26 103.07 102.20 3ktt h GLY 116 Ca 0.00 -0.29 -0.10 0.00 0.00 0.00 0.00 47.33 46.94 3ktt h GLY 116 CO 0.00 0.06 -0.21 1.49 0.00 0.00 0.00 176.54 177.89 3ktt h TRP 117 N 0.73 0.68 -0.37 5.60 6.55 -0.40 0.84 115.95 129.57 3ktt h TRP 117 Ca 0.43 -0.14 -0.10 0.00 0.95 0.00 0.00 58.89 60.03 3ktt h TRP 117 Cb 0.48 -0.17 -0.02 0.00 -0.86 0.00 0.00 29.16 28.60 3ktt h TRP 117 CO -0.07 0.77 -0.16 -0.09 -1.05 0.00 0.00 178.44 177.83 3ktt h ARG 118 N 0.54 0.67 -0.62 0.49 2.43 -1.59 0.89 114.38 117.20 3ktt h ARG 118 Ca 0.08 -0.24 -0.09 0.00 -0.81 0.00 0.00 59.98 58.93 3ktt h ARG 118 Cb 0.65 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.13 3ktt h ARG 118 CO 0.05 0.80 0.03 0.93 -1.51 0.00 0.00 179.97 180.27 3ktt h GLU 119 N 0.60 1.07 -0.33 0.20 4.39 -0.73 0.75 114.58 120.54 3ktt h GLU 119 Ca 0.10 -0.33 -0.08 0.00 0.34 0.00 0.00 59.36 59.39 3ktt h GLU 119 Cb 0.62 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 29.15 3ktt h GLU 119 CO 0.04 1.03 -0.13 0.00 -1.16 0.00 0.00 179.01 178.80 3ktt h ALA 120 N 1.00 1.17 -0.57 3.43 0.00 0.12 1.12 119.26 125.53 3ktt h ALA 120 Ca 0.18 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 3ktt h ALA 120 Cb 0.53 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 3ktt h ALA 120 CO 0.03 0.53 0.31 1.15 0.00 0.00 0.00 179.25 181.26 3ktt h THR 121 N 0.53 1.19 0.01 0.00 2.02 0.24 1.03 112.91 117.92 3ktt h THR 121 Ca 0.09 -0.49 -0.00 0.00 0.77 0.00 0.00 66.41 66.78 3ktt h THR 121 Cb 0.53 0.48 0.00 0.00 -1.74 0.00 0.00 68.15 67.42 3ktt h THR 121 CO 0.03 0.21 -0.00 0.50 0.37 0.00 0.00 175.52 176.63 3ktt h LYS 122 N 0.77 -0.01 -0.71 6.66 1.63 0.20 -0.80 116.57 124.30 3ktt h LYS 122 Ca 0.20 0.00 0.07 0.00 -0.85 0.00 0.00 60.65 60.07 3ktt h LYS 122 Cb 0.06 0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 31.63 3ktt h LYS 122 CO -0.03 0.30 0.39 0.00 -3.45 0.00 0.00 179.45 176.66 3ktt h ALA 123 N 0.67 0.97 -0.31 5.00 0.00 0.25 0.21 119.26 126.05 3ktt h ALA 123 Ca -0.00 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 3ktt h ALA 123 Cb 0.32 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3ktt h ALA 123 CO 0.00 0.05 -0.02 0.00 0.00 0.00 0.00 179.25 179.28 3ktt h ALA 124 N 1.39 0.42 -0.49 0.00 0.00 0.10 -3.05 119.26 117.63 3ktt h ALA 124 Ca 0.33 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 3ktt h ALA 124 Cb 0.25 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3ktt h ALA 124 CO -0.21 0.19 -0.08 0.07 0.00 0.00 0.00 179.25 179.22 3ktt h ARG 125 N 0.35 0.87 -0.20 0.00 0.11 0.84 -2.27 114.38 114.09 3ktt h ARG 125 Ca 0.09 -0.29 -0.02 0.00 0.10 0.00 0.00 59.98 59.86 3ktt h ARG 125 Cb 0.47 -0.07 -0.01 0.00 1.11 0.00 0.00 29.97 31.47 3ktt h ARG 125 CO 0.02 0.92 0.03 1.96 0.10 0.00 0.00 179.97 183.00 3ktt h GLN 126 N 0.79 0.32 -0.28 0.08 4.20 -0.82 -1.13 115.11 118.28 3ktt h GLN 126 Ca 0.14 -0.09 -0.08 0.00 0.06 0.00 0.00 58.65 58.68 3ktt h GLN 126 Cb 0.59 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.31 3ktt h GLN 126 CO 0.04 0.48 -0.15 0.00 -0.67 0.00 0.00 178.83 178.52 3ktt h ALA 127 N 0.83 1.22 -2.80 3.87 0.00 -1.54 -2.29 119.26 118.55 3ktt h ALA 127 Ca 0.06 -0.28 -0.52 0.00 0.00 0.00 0.00 54.91 54.16 3ktt h ALA 127 Cb 0.31 -0.13 0.09 0.00 0.00 0.00 0.00 17.79 18.06 3ktt h ALA 127 CO 0.00 0.50 0.52 -0.51 0.00 0.00 0.00 179.25 179.77 3ktt s LEU 128 N -8.81 3.93 0.00 0.00 1.43 -0.43 0.87 118.68 115.67 3ktt s LEU 128 Ca -0.07 2.45 0.00 0.00 -1.03 0.00 0.00 54.13 55.48 3ktt s LEU 128 Cb 0.14 -4.29 0.00 0.00 0.03 0.00 0.00 46.19 42.07 3ktt s LEU 128 CO 0.78 -1.18 0.00 0.00 0.23 0.00 0.00 176.35 176.17 3ktt n LEU 129 N -0.77 0.96 -4.02 1.79 -0.00 -1.26 -4.82 117.00 108.89 3ktt n LEU 129 Ca 0.09 0.00 -0.15 0.00 -0.00 0.00 0.00 56.01 55.95 3ktt n LEU 129 Cb 0.47 -1.82 -0.13 0.00 -0.00 0.00 0.00 43.42 41.95 3ktt n LEU 129 CO 0.49 -0.66 -0.41 0.20 -0.00 0.00 0.00 177.39 177.01 3ktt s ASN 130 N -2.02 0.80 0.00 1.45 -0.87 0.25 -5.06 114.94 109.48 3ktt s ASN 130 Ca 0.00 -0.31 0.00 0.00 -1.57 0.00 0.00 52.86 50.98 3ktt s ASN 130 Cb 0.00 -0.03 0.00 0.00 -0.02 0.00 0.00 41.25 41.20 3ktt s ASN 130 CO 0.00 -0.05 0.00 -0.24 -2.57 0.00 0.00 177.10 174.24 3ktt n SER 131 N 2.25 0.00 -3.72 -1.22 2.88 -1.26 -4.61 113.62 107.94 3ktt n SER 131 Ca -0.17 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.25 3ktt n SER 131 Cb 0.56 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.91 3ktt n SER 131 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3ktt s ALA 132 N -1.07 -0.93 -0.04 -1.46 0.00 -1.26 -5.03 121.76 111.97 3ktt s ALA 132 Ca 0.00 1.27 -0.03 0.00 0.00 0.00 0.00 51.96 53.20 3ktt s ALA 132 Cb 0.00 -0.76 -0.02 0.00 0.00 0.00 0.00 23.12 22.34 3ktt s ALA 132 CO 0.00 -0.22 0.20 -0.39 0.00 0.00 0.00 175.76 175.34 3ktt h VAL 133 N 5.21 0.00 -1.55 0.00 -1.51 -1.92 -3.41 116.25 113.08 3ktt h VAL 133 Ca -0.33 -0.44 0.08 0.00 -1.23 0.00 0.00 66.70 64.78 3ktt h VAL 133 Cb 1.18 0.00 -0.27 0.00 -2.13 0.00 0.00 31.29 30.07 3ktt h VAL 133 CO 0.30 0.00 0.45 1.51 -1.23 0.00 0.00 177.57 178.60 3ktt s ASP 134 N -4.11 -0.45 0.00 4.19 -4.77 -1.26 -2.55 116.67 107.71 3ktt s ASP 134 Ca -0.02 0.82 0.00 0.00 -3.30 0.00 0.00 52.55 50.05 3ktt s ASP 134 Cb 0.00 0.95 0.00 0.00 -1.09 0.00 0.00 42.92 42.78 3ktt s ASP 134 CO 0.05 -0.14 0.00 1.57 0.70 0.00 0.00 175.17 177.35 3ktt n HIS 135 N 2.69 0.00 0.00 2.11 -0.00 -1.26 -4.79 115.22 113.97 3ktt n HIS 135 Ca -0.14 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.04 3ktt n HIS 135 Cb 0.56 -0.03 0.00 0.00 -0.12 0.00 0.00 29.99 30.41 3ktt n HIS 135 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 3ktt n GLY 136 N 2.39 -0.16 3.82 1.57 0.00 -1.26 -5.01 105.19 106.54 3ktt n GLY 136 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 3ktt n GLY 136 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3ktt n SER 137 N -1.84 -4.92 -0.33 1.61 2.88 -1.26 -4.80 113.62 104.96 3ktt n SER 137 Ca 0.00 -1.03 0.15 0.00 -1.33 0.00 0.00 58.87 56.66 3ktt n SER 137 Cb 0.00 -2.28 0.37 0.00 -0.75 0.00 0.00 64.21 61.55 3ktt n SER 137 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 3ktt h ASP 138 N -1.40 0.70 -1.92 -3.46 5.19 -1.97 -3.46 116.42 110.10 3ktt h ASP 138 Ca -0.62 0.09 0.00 0.00 -0.62 0.00 0.00 57.03 55.88 3ktt h ASP 138 Cb 1.37 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 40.84 3ktt h ASP 138 CO 0.44 0.23 0.00 1.21 -3.12 0.00 0.00 179.24 178.00 3ktt n GLU 139 N -4.72 0.00 0.13 3.56 0.00 -1.26 -4.79 120.64 113.57 3ktt n GLU 139 Ca 0.23 0.00 0.05 0.00 0.00 0.00 0.00 57.16 57.44 3ktt n GLU 139 Cb 0.63 0.00 0.48 0.00 0.00 0.00 0.00 31.44 32.55 3ktt n GLU 139 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.13 176.89 3ktt h VAL 140 N 0.00 1.10 0.00 6.31 3.04 -1.98 -3.46 116.25 121.27 3ktt h VAL 140 Ca 0.00 -0.38 0.00 0.00 -1.01 0.00 0.00 66.70 65.31 3ktt h VAL 140 Cb 0.00 0.96 0.00 0.00 -2.01 0.00 0.00 31.29 30.24 3ktt h VAL 140 CO 0.00 0.13 0.00 1.17 -1.01 0.00 0.00 177.57 177.86 3ktt n LYS 141 N -4.41 0.00 0.00 4.17 3.00 -1.26 -4.71 118.16 114.95 3ktt n LYS 141 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 3ktt n LYS 141 Cb 0.16 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.19 3ktt n LYS 141 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 3ktt n PHE 142 N 2.43 0.00 0.08 5.64 3.01 -1.26 -3.41 117.46 123.95 3ktt n PHE 142 Ca 0.00 0.00 -0.18 0.00 1.01 0.00 0.00 57.45 58.28 3ktt n PHE 142 Cb 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 39.48 39.33 3ktt n PHE 142 CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 3ktt h ARG 143 N 0.00 0.29 0.00 -1.08 9.65 -1.98 -3.33 114.38 117.92 3ktt h ARG 143 Ca 0.00 -0.49 0.00 0.00 -1.10 0.00 0.00 59.98 58.39 3ktt h ARG 143 Cb 0.00 0.18 0.00 0.00 -1.39 0.00 0.00 29.97 28.76 3ktt h ARG 143 CO 0.00 1.18 0.00 1.96 2.80 0.00 0.00 179.97 185.91 3ktt h GLN 144 N 0.08 0.00 -0.69 0.20 1.08 -1.93 -2.96 115.11 110.89 3ktt h GLN 144 Ca -0.23 0.00 0.14 0.00 -1.45 0.00 0.00 58.65 57.11 3ktt h GLN 144 Cb 2.03 0.00 -0.13 0.00 -0.05 0.00 0.00 27.48 29.33 3ktt h GLN 144 CO 0.18 0.00 -0.10 0.22 -0.95 0.00 0.00 178.83 178.18 3ktt h ASP 145 N 0.00 -0.50 0.00 1.46 3.58 -1.67 -3.46 116.42 115.83 3ktt h ASP 145 Ca 0.00 0.19 0.00 0.00 0.42 0.00 0.00 57.03 57.64 3ktt h ASP 145 Cb 0.16 0.38 0.00 0.00 1.72 0.00 0.00 39.33 41.59 3ktt h ASP 145 CO 0.00 -0.20 0.00 -0.11 -2.88 0.00 0.00 179.24 176.05 3ktt n LEU 146 N -5.40 0.00 -3.76 2.28 0.00 -1.12 -4.66 117.00 104.34 3ktt n LEU 146 Ca 0.10 0.00 -0.25 0.00 0.00 0.00 0.00 56.01 55.86 3ktt n LEU 146 Cb 0.38 0.00 0.04 0.00 0.00 0.00 0.00 43.42 43.84 3ktt n LEU 146 CO 0.04 0.00 0.06 0.23 0.00 0.00 0.00 177.39 177.72 3ktt n MET 147 N 0.00 -5.69 0.00 1.96 2.81 -1.26 -4.91 117.12 110.03 3ktt n MET 147 Ca 0.00 0.65 0.00 0.00 -1.81 0.00 0.00 57.70 56.54 3ktt n MET 147 Cb 0.00 -5.45 0.00 0.00 -0.71 0.00 0.00 33.22 27.06 3ktt n MET 147 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 3ktt n ASN 148 N -2.96 0.00 -0.05 7.83 3.02 -1.26 -4.87 115.26 116.97 3ktt n ASN 148 Ca -0.11 0.00 0.06 0.00 -0.03 0.00 0.00 54.58 54.49 3ktt n ASN 148 Cb 0.60 0.00 0.42 0.00 -0.61 0.00 0.00 39.78 40.19 3ktt n ASN 148 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 3ktt h ILE 149 N 0.00 1.06 -0.72 2.41 2.10 -1.87 0.17 117.51 120.66 3ktt h ILE 149 Ca 0.00 -0.20 0.02 0.00 1.08 0.00 0.00 64.86 65.76 3ktt h ILE 149 Cb 0.00 0.43 -0.04 0.00 -1.09 0.00 0.00 36.82 36.12 3ktt h ILE 149 CO 0.00 0.11 0.46 0.00 -1.08 0.00 0.00 178.15 177.64 3ktt h ALA 150 N 1.71 0.94 -0.03 0.18 0.00 -1.93 0.33 119.26 120.46 3ktt h ALA 150 Ca 0.20 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.97 3ktt h ALA 150 Cb 0.08 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3ktt h ALA 150 CO -0.05 0.27 -0.48 0.78 0.00 0.00 0.00 179.25 179.77 3ktt h GLY 151 N 0.92 0.07 1.18 0.00 0.00 -1.06 -1.41 103.07 102.77 3ktt h GLY 151 Ca 0.28 -0.07 -0.21 0.00 0.00 0.00 0.00 47.33 47.33 3ktt h GLY 151 CO -0.09 0.06 -0.71 0.00 0.00 0.00 0.00 176.54 175.80 3ktt h THR 152 N 0.05 1.28 -0.38 4.70 1.03 0.62 0.49 112.91 120.70 3ktt h THR 152 Ca -0.00 -1.90 -0.02 0.00 -0.01 0.00 0.00 66.41 64.48 3ktt h THR 152 Cb 0.87 1.87 -0.02 0.00 -1.07 0.00 0.00 68.15 69.81 3ktt h THR 152 CO 0.07 0.61 0.16 0.74 -0.01 0.00 0.00 175.52 177.08 3ktt h THR 153 N 0.58 1.19 0.00 0.00 2.02 -0.34 0.11 112.91 116.47 3ktt h THR 153 Ca -0.03 -0.57 -0.01 0.00 0.77 0.00 0.00 66.41 66.57 3ktt h THR 153 Cb 1.34 0.85 -0.00 0.00 -1.74 0.00 0.00 68.15 68.60 3ktt h THR 153 CO 0.15 0.21 -0.04 -0.07 0.37 0.00 0.00 175.52 176.14 3ktt h LEU 154 N 0.47 0.00 -0.06 2.58 4.07 -1.23 -3.24 115.31 117.90 3ktt h LEU 154 Ca 0.13 0.00 0.03 0.00 0.08 0.00 0.00 57.88 58.11 3ktt h LEU 154 Cb 0.18 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 41.86 3ktt h LEU 154 CO -0.01 0.04 -0.53 0.28 -1.08 0.00 0.00 178.44 177.13 3ktt h SER 155 N 0.00 -1.66 0.11 -0.43 0.02 0.27 0.67 113.55 112.53 3ktt h SER 155 Ca -0.00 0.19 -0.01 0.00 -0.84 0.00 0.00 61.79 61.13 3ktt h SER 155 Cb 0.09 0.64 -0.00 0.00 0.14 0.00 0.00 62.40 63.27 3ktt h SER 155 CO 0.00 -0.50 -0.05 0.77 -1.14 0.00 0.00 176.83 175.91 3ktt h SER 156 N -0.63 0.00 -3.89 3.07 4.64 -1.11 -3.40 113.55 112.24 3ktt h SER 156 Ca 0.03 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.82 3ktt h SER 156 Cb 0.70 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 62.86 3ktt h SER 156 CO -0.39 0.05 0.64 -0.54 -0.87 0.00 0.00 176.83 175.72 3ktt s LYS 157 N -4.60 4.31 0.28 4.77 -0.14 0.23 -4.30 119.74 120.30 3ktt s LYS 157 Ca -0.04 2.23 0.03 0.00 -1.36 0.00 0.00 55.97 56.83 3ktt s LYS 157 Cb 0.15 -3.04 0.41 0.00 -1.68 0.00 0.00 37.83 33.67 3ktt s LYS 157 CO 0.59 -0.23 1.71 1.25 -0.76 0.00 0.00 175.35 177.91 3ktt h LEU 158 N 3.30 0.42 -1.90 3.17 5.85 -1.83 -3.19 115.31 121.13 3ktt h LEU 158 Ca -0.49 -0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.07 3ktt h LEU 158 Cb 1.23 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 42.14 3ktt h LEU 158 CO 0.65 0.72 0.03 0.17 -0.34 0.00 0.00 178.44 179.67 3ktt h LEU 159 N 0.36 0.08 -3.72 2.25 -0.00 -1.91 -3.36 115.31 109.01 3ktt h LEU 159 Ca 0.05 -0.00 -0.04 0.00 -0.00 0.00 0.00 57.88 57.88 3ktt h LEU 159 Cb 0.72 -0.02 -0.02 0.00 -0.00 0.00 0.00 40.66 41.35 3ktt h LEU 159 CO 0.06 0.07 -0.02 0.41 -0.00 0.00 0.00 178.44 178.96 3ktt n THR 160 N -4.51 1.48 -0.03 0.15 -1.04 -1.21 0.90 114.28 110.01 3ktt n THR 160 Ca -0.02 -0.53 -0.01 0.00 -2.04 0.00 0.00 64.05 61.45 3ktt n THR 160 Cb 0.10 -1.49 -0.00 0.00 -1.82 0.00 0.00 70.33 67.12 3ktt n THR 160 CO 0.00 0.00 0.00 1.12 -0.64 0.00 0.00 175.07 175.55 3ktt h HIS 161 N 2.80 0.00 0.00 -1.42 2.07 -1.90 -3.38 115.15 113.33 3ktt h HIS 161 Ca 0.04 0.00 -0.14 0.00 -2.85 0.00 0.00 60.37 57.42 3ktt h HIS 161 Cb 0.74 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.70 3ktt h HIS 161 CO 0.73 0.00 -0.65 0.45 -3.07 0.00 0.00 177.93 175.39 3ktt h HIS 162 N -0.59 0.00 -0.26 6.12 3.86 -1.87 -3.35 115.15 119.07 3ktt h HIS 162 Ca 0.00 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.19 3ktt h HIS 162 Cb 0.07 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.53 3ktt h HIS 162 CO -0.03 0.65 0.07 -0.22 0.86 0.00 0.00 177.93 179.26 3ktt h LYS 163 N 0.00 0.36 -0.45 2.45 1.63 0.33 -0.92 116.57 119.97 3ktt h LYS 163 Ca -0.01 -0.05 0.03 0.00 -0.85 0.00 0.00 60.65 59.77 3ktt h LYS 163 Cb 1.33 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 32.87 3ktt h LYS 163 CO 0.08 0.33 0.30 0.38 -3.45 0.00 0.00 179.45 177.10 3ktt h ASP 164 N 0.36 0.45 -0.63 4.20 3.04 -1.73 0.38 116.42 122.48 3ktt h ASP 164 Ca 0.09 -0.01 -0.05 0.00 -3.24 0.00 0.00 57.03 53.82 3ktt h ASP 164 Cb 0.13 -0.11 -0.03 0.00 -1.04 0.00 0.00 39.33 38.29 3ktt h ASP 164 CO -0.00 0.32 0.19 -0.74 -2.04 0.00 0.00 179.24 176.96 3ktt h HIS 165 N 0.53 1.03 -0.54 4.15 2.76 -1.43 0.13 115.15 121.78 3ktt h HIS 165 Ca 0.18 -0.11 -0.02 0.00 -2.20 0.00 0.00 60.37 58.23 3ktt h HIS 165 Cb 0.07 -0.29 -0.02 0.00 1.55 0.00 0.00 27.41 28.71 3ktt h HIS 165 CO -0.00 0.84 0.27 0.74 -1.30 0.00 0.00 177.93 178.49 3ktt h PHE 166 N 0.91 0.76 -0.20 5.26 -1.00 -0.57 -1.46 116.94 120.64 3ktt h PHE 166 Ca 0.20 -0.03 -0.08 0.00 2.81 0.00 0.00 57.97 60.87 3ktt h PHE 166 Cb 0.31 -0.24 -0.01 0.00 3.61 0.00 0.00 35.95 39.62 3ktt h PHE 166 CO 0.02 0.57 -0.23 0.00 -1.61 0.00 0.00 178.31 177.06 3ktt h THR 167 N 0.72 1.25 -0.72 -1.55 1.03 0.15 -2.43 112.91 111.36 3ktt h THR 167 Ca 0.19 -1.16 -0.02 0.00 -0.01 0.00 0.00 66.41 65.40 3ktt h THR 167 Cb 0.09 1.35 -0.03 0.00 -1.07 0.00 0.00 68.15 68.49 3ktt h THR 167 CO -0.03 0.36 0.35 0.50 -0.01 0.00 0.00 175.52 176.70 3ktt h LYS 168 N 0.33 1.02 -0.04 0.00 3.64 0.03 -2.49 116.57 119.06 3ktt h LYS 168 Ca 0.05 -0.13 -0.03 0.00 -1.27 0.00 0.00 60.65 59.27 3ktt h LYS 168 Cb 0.60 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 3ktt h LYS 168 CO 0.04 0.78 -0.11 1.25 -2.27 0.00 0.00 179.45 179.13 3ktt h LEU 169 N 1.01 0.05 -1.47 5.20 5.85 -0.86 -2.71 115.31 122.39 3ktt h LEU 169 Ca 0.25 -0.01 0.19 0.00 0.84 0.00 0.00 57.88 59.15 3ktt h LEU 169 Cb 0.09 -0.01 -0.07 0.00 0.37 0.00 0.00 40.66 41.04 3ktt h LEU 169 CO -0.03 0.17 0.58 0.00 -0.34 0.00 0.00 178.44 178.82 3ktt h ALA 170 N 1.83 2.11 -0.13 1.25 0.00 -1.45 0.79 119.26 123.67 3ktt h ALA 170 Ca 0.01 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 3ktt h ALA 170 Cb 0.24 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3ktt h ALA 170 CO 0.02 -0.39 -0.27 -0.39 0.00 0.00 0.00 179.25 178.22 3ktt h VAL 171 N 0.46 1.24 -0.77 0.00 -1.51 -1.65 -0.09 116.25 113.94 3ktt h VAL 171 Ca 0.46 -1.15 -0.03 0.00 -1.23 0.00 0.00 66.70 64.74 3ktt h VAL 171 Cb 1.04 1.44 -0.04 0.00 -2.13 0.00 0.00 31.29 31.61 3ktt h VAL 171 CO -0.18 0.35 0.35 -0.33 -1.23 0.00 0.00 177.57 176.53 3ktt h GLU 172 N 0.22 1.13 -0.78 5.19 5.08 0.43 -0.26 114.58 125.59 3ktt h GLU 172 Ca 0.03 -0.18 -0.03 0.00 -1.00 0.00 0.00 59.36 58.18 3ktt h GLU 172 Cb 0.59 -0.20 -0.04 0.00 0.50 0.00 0.00 28.75 29.61 3ktt h GLU 172 CO 0.04 0.89 0.36 0.00 -1.00 0.00 0.00 179.01 179.30 3ktt h ALA 173 N 1.18 1.01 -0.58 3.43 0.00 -0.95 -0.56 119.26 122.79 3ktt h ALA 173 Ca 0.26 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 3ktt h ALA 173 Cb 0.15 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3ktt h ALA 173 CO -0.03 0.58 0.09 -0.39 0.00 0.00 0.00 179.25 179.50 3ktt h VAL 174 N 1.11 1.25 -0.58 0.00 -1.51 -0.47 -1.02 116.25 115.01 3ktt h VAL 174 Ca 0.27 -0.95 -0.02 0.00 -1.23 0.00 0.00 66.70 64.76 3ktt h VAL 174 Cb 0.14 0.70 -0.03 0.00 -2.13 0.00 0.00 31.29 29.97 3ktt h VAL 174 CO -0.03 0.35 0.29 -0.07 -1.23 0.00 0.00 177.57 176.88 3ktt h LEU 175 N 0.88 0.75 -0.96 4.19 3.38 -0.26 0.14 115.31 123.43 3ktt h LEU 175 Ca 0.18 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 57.95 3ktt h LEU 175 Cb 0.39 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 3ktt h LEU 175 CO 0.01 0.66 -0.10 0.08 0.09 0.00 0.00 178.44 179.18 3ktt h ARG 176 N 0.79 0.64 -0.02 1.13 0.11 -0.43 -2.80 114.38 113.79 3ktt h ARG 176 Ca 0.20 -0.19 -0.09 0.00 0.10 0.00 0.00 59.98 60.00 3ktt h ARG 176 Cb 0.10 -0.06 -0.01 0.00 1.11 0.00 0.00 29.97 31.10 3ktt h ARG 176 CO -0.03 0.73 -0.39 1.25 0.10 0.00 0.00 179.97 181.63 3ktt h LEU 177 N 0.59 0.04 -9.74 0.08 7.12 -0.39 -3.46 115.31 109.55 3ktt h LEU 177 Ca 0.11 -0.02 -0.57 0.00 0.13 0.00 0.00 57.88 57.53 3ktt h LEU 177 Cb 0.52 -0.01 0.12 0.00 -0.53 0.00 0.00 40.66 40.76 3ktt h LEU 177 CO 0.03 0.43 0.41 2.29 -0.13 0.00 0.00 178.44 181.47 3ktt n LYS 178 N -4.07 1.84 0.00 1.25 2.85 -0.04 -4.68 118.16 115.32 3ktt n LYS 178 Ca -0.02 0.65 0.00 0.00 -1.05 0.00 0.00 58.31 57.90 3ktt n LYS 178 Cb 0.43 -2.26 0.00 0.00 -0.65 0.00 0.00 35.03 32.55 3ktt n LYS 178 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3ktt n GLY 179 N 0.90 0.99 0.29 2.58 0.00 -1.26 -4.84 105.19 103.84 3ktt n GLY 179 Ca 0.07 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 44.06 3ktt n GLY 179 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3ktt n SER 180 N 2.40 0.50 0.25 1.61 3.41 -1.26 -4.03 113.62 116.51 3ktt n SER 180 Ca 0.00 -1.75 0.09 0.00 -0.26 0.00 0.00 58.87 56.94 3ktt n SER 180 Cb 0.00 -0.25 0.64 0.00 -0.26 0.00 0.00 64.21 64.34 3ktt n SER 180 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3ktt h GLY 181 N 4.82 0.00 0.00 5.00 0.00 -1.88 -3.49 103.07 107.53 3ktt h GLY 181 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3ktt h GLY 181 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 176.54 174.53 3ktt n ASN 182 N -4.28 0.00 -4.48 0.19 4.05 -1.26 -4.69 115.26 104.79 3ktt n ASN 182 Ca -0.03 0.00 -0.39 0.00 0.45 0.00 0.00 54.58 54.62 3ktt n ASN 182 Cb 0.15 0.00 -0.11 0.00 1.23 0.00 0.00 39.78 41.05 3ktt n ASN 182 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 177.26 173.99 3ktt s LEU 183 N 0.00 4.14 0.02 1.20 2.96 -1.26 -4.98 118.68 120.76 3ktt s LEU 183 Ca 0.00 -0.40 -0.29 0.00 -0.22 0.00 0.00 54.13 53.23 3ktt s LEU 183 Cb 0.00 -2.05 0.10 0.00 0.50 0.00 0.00 46.19 44.74 3ktt s LEU 183 CO 0.00 -0.17 1.01 -1.61 -1.32 0.00 0.00 176.35 174.26 3ktt s GLU 184 N 1.66 0.81 -1.09 1.98 2.02 -1.26 -5.02 118.70 117.80 3ktt s GLU 184 Ca 0.05 -0.38 0.00 0.00 0.02 0.00 0.00 54.97 54.67 3ktt s GLU 184 Cb -0.17 0.32 0.00 0.00 0.10 0.00 0.00 34.13 34.38 3ktt s GLU 184 CO 0.08 -0.36 0.00 0.00 0.02 0.00 0.00 175.26 175.00 3ktt n ALA 185 N -0.33 -0.16 -2.93 5.21 0.00 -1.26 -4.96 120.51 116.09 3ktt n ALA 185 Ca -0.07 0.17 -0.34 0.00 0.00 0.00 0.00 53.44 53.20 3ktt n ALA 185 Cb 0.61 -1.27 -0.12 0.00 0.00 0.00 0.00 19.45 18.67 3ktt n ALA 185 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3ktt s ILE 186 N -2.37 3.96 -0.02 0.00 1.01 -1.26 -3.87 121.20 118.65 3ktt s ILE 186 Ca 0.00 -0.34 0.07 0.00 0.00 0.00 0.00 60.65 60.38 3ktt s ILE 186 Cb 0.00 -2.73 -0.02 0.00 0.01 0.00 0.00 42.46 39.72 3ktt s ILE 186 CO 0.00 0.50 -0.23 -2.28 0.00 0.00 0.00 174.94 172.93 3ktt s HIS 187 N 0.29 2.11 0.06 3.97 2.46 -1.16 -5.06 115.29 117.95 3ktt s HIS 187 Ca -0.03 -0.43 0.03 0.00 0.47 0.00 0.00 55.06 55.10 3ktt s HIS 187 Cb -0.14 -1.36 -0.03 0.00 -0.13 0.00 0.00 32.58 30.92 3ktt s HIS 187 CO 0.03 -0.06 -0.09 0.54 -2.47 0.00 0.00 174.74 172.69 3ktt s VAL 188 N -0.48 0.70 0.21 0.89 0.11 -1.26 -1.33 120.40 119.24 3ktt s VAL 188 Ca 0.07 -1.30 -0.23 0.00 -2.93 0.00 0.00 61.98 57.59 3ktt s VAL 188 Cb -0.10 -0.92 0.04 0.00 -1.53 0.00 0.00 36.38 33.88 3ktt s VAL 188 CO -0.00 -0.45 0.78 -0.63 -3.33 0.00 0.00 175.10 171.47 3ktt s ILE 189 N -1.80 0.00 0.39 7.04 -1.09 -0.84 -4.97 121.20 119.94 3ktt s ILE 189 Ca -0.04 -0.72 0.07 0.00 -2.23 0.00 0.00 60.65 57.74 3ktt s ILE 189 Cb -0.07 -1.81 -0.08 0.00 -1.58 0.00 0.00 42.46 38.92 3ktt s ILE 189 CO -0.00 0.00 -0.01 -1.59 -1.23 0.00 0.00 174.94 172.11 3ktt s LYS 190 N -3.67 1.92 0.04 2.79 0.00 -1.26 0.13 119.74 119.68 3ktt s LYS 190 Ca 0.10 -2.07 0.02 0.00 0.00 0.00 0.00 55.97 54.02 3ktt s LYS 190 Cb -0.04 -1.61 -0.02 0.00 0.00 0.00 0.00 37.83 36.16 3ktt s LYS 190 CO 0.02 -0.02 -0.07 0.21 0.00 0.00 0.00 175.35 175.50 3ktt s LYS 191 N -3.70 0.49 -1.25 1.78 2.47 0.43 -4.64 119.74 115.32 3ktt s LYS 191 Ca 0.35 -0.75 -0.11 0.00 -1.56 0.00 0.00 55.97 53.89 3ktt s LYS 191 Cb 0.09 -0.18 0.17 0.00 -1.46 0.00 0.00 37.83 36.44 3ktt s LYS 191 CO 0.18 0.02 1.69 1.28 0.16 0.00 0.00 175.35 178.67 3ktt n LEU 192 N 1.42 6.04 -3.46 5.43 4.32 -1.26 0.11 117.00 129.61 3ktt n LEU 192 Ca -0.23 -4.57 -0.11 0.00 -0.02 0.00 0.00 56.01 51.08 3ktt n LEU 192 Cb 0.55 -1.54 -0.02 0.00 -1.62 0.00 0.00 43.42 40.79 3ktt n LEU 192 CO 0.21 1.10 0.44 -0.83 -1.22 0.00 0.00 177.39 177.10 3ktt s GLY 193 N 1.67 -0.57 -0.06 -0.72 0.00 0.18 -4.91 107.32 102.91 3ktt s GLY 193 Ca 0.41 0.52 -0.02 0.00 0.00 0.00 0.00 44.72 45.62 3ktt s GLY 193 CO 0.00 0.17 0.05 -0.32 0.00 0.00 0.00 173.10 173.01 3ktt s GLY 194 N -2.72 1.96 -0.28 0.20 0.00 -1.26 -1.69 107.32 103.53 3ktt s GLY 194 Ca 0.02 -0.80 -0.25 0.00 0.00 0.00 0.00 44.72 43.69 3ktt s GLY 194 CO -0.11 -0.61 0.87 -1.35 0.00 0.00 0.00 173.10 171.90 3ktt s SER 195 N -1.23 -0.60 0.43 1.64 1.04 -1.26 -4.99 113.70 108.73 3ktt s SER 195 Ca 0.17 1.16 0.17 0.00 0.48 0.00 0.00 55.95 57.93 3ktt s SER 195 Cb -0.12 1.18 0.97 0.00 0.10 0.00 0.00 66.02 68.15 3ktt s SER 195 CO 0.07 -0.20 1.93 0.25 0.98 0.00 0.00 173.24 176.27 3ktt h LEU 196 N 4.60 0.00 -0.64 2.42 7.12 -1.97 -1.35 115.31 125.49 3ktt h LEU 196 Ca -0.29 0.00 0.07 0.00 0.13 0.00 0.00 57.88 57.80 3ktt h LEU 196 Cb 1.17 0.00 -0.06 0.00 -0.53 0.00 0.00 40.66 41.24 3ktt h LEU 196 CO 0.08 0.25 0.32 0.00 -0.13 0.00 0.00 178.44 178.96 3ktt h ALA 197 N 1.75 0.85 0.00 1.25 0.00 -1.97 -3.45 119.26 117.69 3ktt h ALA 197 Ca -0.00 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3ktt h ALA 197 Cb 0.49 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3ktt h ALA 197 CO 0.03 -0.06 0.00 -0.25 0.00 0.00 0.00 179.25 178.98 3ktt n ASP 198 N -4.87 0.00 0.00 0.00 8.00 -0.51 -4.93 116.55 114.24 3ktt n ASP 198 Ca 0.08 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.58 3ktt n ASP 198 Cb 0.22 -0.39 0.00 0.00 -0.02 0.00 0.00 41.12 40.93 3ktt n ASP 198 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3ktt n SER 199 N 0.00 0.00 -4.08 -2.24 3.41 -1.26 0.41 113.62 109.86 3ktt n SER 199 Ca 0.00 0.00 -0.16 0.00 -0.26 0.00 0.00 58.87 58.45 3ktt n SER 199 Cb 0.00 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 63.82 3ktt n SER 199 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 3ktt s TYR 200 N -2.00 0.86 -0.24 7.33 2.02 0.64 -4.91 117.35 121.04 3ktt s TYR 200 Ca 0.00 -0.37 -0.06 0.00 -0.37 0.00 0.00 57.07 56.27 3ktt s TYR 200 Cb 0.00 -0.51 -0.02 0.00 -0.40 0.00 0.00 41.96 41.03 3ktt s TYR 200 CO 0.00 -0.02 0.03 -1.17 -1.57 0.00 0.00 175.55 172.82 3ktt s LEU 201 N -1.17 3.24 -0.14 -1.29 1.98 -1.26 -0.28 118.68 119.76 3ktt s LEU 201 Ca -0.03 -0.28 -0.08 0.00 -2.89 0.00 0.00 54.13 50.84 3ktt s LEU 201 Cb -0.08 -1.85 -0.04 0.00 0.66 0.00 0.00 46.19 44.87 3ktt s LEU 201 CO 0.01 -0.03 0.15 -1.81 -1.89 0.00 0.00 176.35 172.78 3ktt s ASP 202 N 1.56 6.36 0.01 3.68 1.01 0.62 -4.95 116.67 124.97 3ktt s ASP 202 Ca 0.06 0.43 0.11 0.00 0.71 0.00 0.00 52.55 53.86 3ktt s ASP 202 Cb -0.15 -2.09 0.46 0.00 1.01 0.00 0.00 42.92 42.15 3ktt s ASP 202 CO 0.01 0.34 1.34 -1.84 0.21 0.00 0.00 175.17 175.23 3ktt n GLU 203 N 2.42 0.01 0.00 8.23 0.00 -1.26 -1.87 120.64 128.17 3ktt n GLU 203 Ca -0.18 0.33 0.00 0.00 0.00 0.00 0.00 57.16 57.31 3ktt n GLU 203 Cb 0.54 -1.51 0.00 0.00 0.00 0.00 0.00 31.44 30.47 3ktt n GLU 203 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3ktt n GLY 204 N -0.44 5.49 3.57 -1.84 0.00 -1.26 -4.33 105.19 106.38 3ktt n GLY 204 Ca 0.02 -0.82 -0.32 0.00 0.00 0.00 0.00 46.02 44.91 3ktt n GLY 204 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3ktt s PHE 205 N 2.06 2.82 -0.08 1.61 5.36 -0.32 -1.92 117.98 127.51 3ktt s PHE 205 Ca 0.00 -0.08 0.02 0.00 -0.96 0.00 0.00 56.93 55.91 3ktt s PHE 205 Cb 0.00 -1.58 -0.02 0.00 -0.34 0.00 0.00 43.02 41.08 3ktt s PHE 205 CO 0.00 0.35 -0.13 -1.17 -1.46 0.00 0.00 175.22 172.81 3ktt s LEU 206 N -1.44 2.79 0.18 6.12 1.98 -1.26 -0.86 118.68 126.19 3ktt s LEU 206 Ca 0.17 -0.21 -0.03 0.00 -2.89 0.00 0.00 54.13 51.17 3ktt s LEU 206 Cb -0.11 -1.59 -0.03 0.00 0.66 0.00 0.00 46.19 45.12 3ktt s LEU 206 CO 0.07 0.29 0.16 -0.22 -1.89 0.00 0.00 176.35 174.76 3ktt s LEU 207 N -0.40 1.22 -0.31 -0.68 1.98 -0.41 -5.00 118.68 115.07 3ktt s LEU 207 Ca 0.05 -1.26 -0.02 0.00 -2.89 0.00 0.00 54.13 50.01 3ktt s LEU 207 Cb -0.12 0.55 0.11 0.00 0.66 0.00 0.00 46.19 47.39 3ktt s LEU 207 CO 0.02 -0.84 0.15 -0.62 -1.89 0.00 0.00 176.35 173.16 3ktt s ASP 208 N -3.10 3.51 0.15 3.68 -1.08 -1.26 0.81 116.67 119.37 3ktt s ASP 208 Ca 0.32 -1.62 -0.24 0.00 -0.52 0.00 0.00 52.55 50.49 3ktt s ASP 208 Cb 0.06 -0.49 0.08 0.00 -1.46 0.00 0.00 42.92 41.11 3ktt s ASP 208 CO 0.08 -0.40 1.06 -0.54 0.52 0.00 0.00 175.17 175.90 3ktt s LYS 209 N 1.70 1.14 -0.04 4.34 1.02 -1.26 -4.93 119.74 121.70 3ktt s LYS 209 Ca 0.12 -0.71 -0.02 0.00 0.02 0.00 0.00 55.97 55.38 3ktt s LYS 209 Cb -0.18 0.34 0.02 0.00 -0.52 0.00 0.00 37.83 37.49 3ktt s LYS 209 CO -0.25 -0.53 0.09 0.21 -0.92 0.00 0.00 175.35 173.95 3ktt s LYS 210 N -2.42 0.06 0.08 1.68 2.20 -1.26 -4.63 119.74 115.44 3ktt s LYS 210 Ca 0.20 0.21 -0.31 0.00 -0.36 0.00 0.00 55.97 55.71 3ktt s LYS 210 Cb -0.02 -0.10 -0.18 0.00 -1.51 0.00 0.00 37.83 36.03 3ktt s LYS 210 CO 0.03 -0.10 1.65 0.82 -0.36 0.00 0.00 175.35 177.39 3ktt h ILE 211 N 5.65 0.45 -2.06 5.43 5.03 -1.26 -3.41 117.51 127.34 3ktt h ILE 211 Ca -0.35 0.00 -0.06 0.00 -0.12 0.00 0.00 64.86 64.32 3ktt h ILE 211 Cb 1.16 0.45 -0.19 0.00 -3.03 0.00 0.00 36.82 35.21 3ktt h ILE 211 CO 0.45 0.00 0.17 -0.83 -0.68 0.00 0.00 178.15 177.26 3ktt s GLY 212 N -2.10 -0.56 0.18 5.37 0.00 -1.26 -4.74 107.32 104.21 3ktt s GLY 212 Ca -0.17 1.26 -0.09 0.00 0.00 0.00 0.00 44.72 45.73 3ktt s GLY 212 CO 0.63 0.91 1.62 -2.08 0.00 0.00 0.00 173.10 174.18 3ktt h VAL 213 N 3.03 1.27 -4.17 1.40 2.07 -2.00 -3.40 116.25 114.45 3ktt h VAL 213 Ca -0.27 -1.23 -0.50 0.00 0.82 0.00 0.00 66.70 65.53 3ktt h VAL 213 Cb 1.14 0.89 0.14 0.00 -1.52 0.00 0.00 31.29 31.95 3ktt h VAL 213 CO 0.39 0.44 0.27 0.54 0.02 0.00 0.00 177.57 179.23 3ktt s ASN 214 N -6.63 3.83 0.00 0.57 2.20 -1.26 -4.84 114.94 108.82 3ktt s ASN 214 Ca -0.12 1.64 0.00 0.00 -0.94 0.00 0.00 52.86 53.44 3ktt s ASN 214 Cb 0.13 -2.32 0.00 0.00 -2.00 0.00 0.00 41.25 37.07 3ktt s ASN 214 CO 0.86 -2.43 0.00 0.00 -2.94 0.00 0.00 177.10 172.59 3ktt n GLN 215 N -3.76 0.00 -2.54 3.55 3.00 -1.26 -4.86 117.38 111.51 3ktt n GLN 215 Ca 0.08 0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.78 3ktt n GLN 215 Cb 0.54 0.00 -0.01 0.00 0.00 0.00 0.00 30.24 30.77 3ktt n GLN 215 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.06 174.92 3ktt s PRO 216 N -1.12 3.65 -0.00 -1.09 0.02 -1.25 -5.01 135.00 130.19 3ktt s PRO 216 Ca 0.00 0.43 -0.23 0.00 0.02 0.00 0.00 61.00 61.22 3ktt s PRO 216 Cb 0.00 -2.31 -0.14 0.00 0.02 0.00 0.00 34.50 32.07 3ktt s PRO 216 CO 0.00 -0.23 1.04 -0.22 -0.33 0.00 0.00 177.00 177.26 3ktt h LYS 217 N 0.48 -0.60 -4.55 5.54 1.63 -1.95 -3.46 116.57 113.65 3ktt h LYS 217 Ca -0.46 0.04 -0.21 0.00 -0.85 0.00 0.00 60.65 59.17 3ktt h LYS 217 Cb 1.20 0.14 -0.15 0.00 -0.60 0.00 0.00 32.23 32.81 3ktt h LYS 217 CO 0.62 -0.30 -0.68 0.50 -3.45 0.00 0.00 179.45 176.14 3ktt s ARG 218 N -4.30 0.87 -0.03 1.90 3.52 -1.26 -4.11 118.95 115.54 3ktt s ARG 218 Ca -0.13 -1.38 0.03 0.00 -0.13 0.00 0.00 55.73 54.13 3ktt s ARG 218 Cb 0.01 -0.04 -0.00 0.00 -1.56 0.00 0.00 34.95 33.36 3ktt s ARG 218 CO 0.43 -0.11 -0.12 0.96 -0.81 0.00 0.00 175.30 175.65 3ktt s ILE 219 N -3.78 1.00 0.15 4.11 -4.36 0.13 -5.01 121.20 113.44 3ktt s ILE 219 Ca 0.16 -0.49 0.10 0.00 -0.26 0.00 0.00 60.65 60.17 3ktt s ILE 219 Cb 0.06 -0.87 -0.04 0.00 1.25 0.00 0.00 42.46 42.87 3ktt s ILE 219 CO -0.03 0.30 -0.24 -1.61 0.24 0.00 0.00 174.94 173.60 3ktt s GLU 220 N 0.08 1.37 -1.49 0.37 2.02 -1.26 -0.64 118.70 119.14 3ktt s GLU 220 Ca -0.02 -1.37 -0.12 0.00 0.02 0.00 0.00 54.97 53.48 3ktt s GLU 220 Cb -0.09 -1.72 0.07 0.00 0.10 0.00 0.00 34.13 32.49 3ktt s GLU 220 CO 0.01 0.39 0.95 0.09 0.02 0.00 0.00 175.26 176.72 3ktt n ASN 221 N 0.69 -5.13 -4.75 -0.19 3.02 -1.26 -4.76 115.26 102.88 3ktt n ASN 221 Ca -0.16 -0.67 -0.42 0.00 -0.03 0.00 0.00 54.58 53.30 3ktt n ASN 221 Cb 0.54 -4.09 -0.01 0.00 -0.61 0.00 0.00 39.78 35.62 3ktt n ASN 221 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ktt n ALA 222 N -4.57 2.31 -2.67 5.41 0.00 -1.26 -4.76 120.51 114.97 3ktt n ALA 222 Ca 0.02 0.36 -0.40 0.00 0.00 0.00 0.00 53.44 53.42 3ktt n ALA 222 Cb 0.54 -2.42 -0.11 0.00 0.00 0.00 0.00 19.45 17.46 3ktt n ALA 222 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3ktt s LYS 223 N -1.43 3.24 -0.20 0.00 3.01 -1.26 -3.51 119.74 119.59 3ktt s LYS 223 Ca 0.58 -0.81 -0.08 0.00 -1.01 0.00 0.00 55.97 54.65 3ktt s LYS 223 Cb -0.50 -3.75 -0.04 0.00 -1.01 0.00 0.00 37.83 32.53 3ktt s LYS 223 CO 0.57 -0.53 0.08 0.42 0.51 0.00 0.00 175.35 176.40 3ktt s ILE 224 N 1.65 4.90 -0.13 2.17 1.09 -1.26 -2.43 121.20 127.20 3ktt s ILE 224 Ca 0.05 0.01 0.03 0.00 -1.10 0.00 0.00 60.65 59.64 3ktt s ILE 224 Cb -0.18 -3.23 0.01 0.00 -1.06 0.00 0.00 42.46 38.00 3ktt s ILE 224 CO 0.08 0.43 -0.23 -0.22 -0.10 0.00 0.00 174.94 174.91 3ktt s LEU 225 N 0.57 2.10 -0.03 2.97 1.98 -1.13 -4.19 118.68 120.95 3ktt s LEU 225 Ca 0.04 -0.59 0.00 0.00 -2.89 0.00 0.00 54.13 50.70 3ktt s LEU 225 Cb -0.13 -1.43 -0.03 0.00 0.66 0.00 0.00 46.19 45.26 3ktt s LEU 225 CO 0.01 0.11 0.01 -0.63 -1.89 0.00 0.00 176.35 173.95 3ktt s ILE 226 N 0.66 4.26 -0.05 6.68 1.01 -1.26 -0.94 121.20 131.56 3ktt s ILE 226 Ca -0.11 -0.45 0.03 0.00 0.00 0.00 0.00 60.65 60.11 3ktt s ILE 226 Cb -0.16 -2.86 0.01 0.00 0.01 0.00 0.00 42.46 39.45 3ktt s ILE 226 CO 0.02 0.46 -0.12 0.00 0.00 0.00 0.00 174.94 175.29 3ktt s ALA 227 N -1.02 1.19 0.11 9.38 0.00 -0.19 -4.54 121.76 126.68 3ktt s ALA 227 Ca 0.18 -0.44 -0.10 0.00 0.00 0.00 0.00 51.96 51.60 3ktt s ALA 227 Cb -0.11 -0.48 -0.15 0.00 0.00 0.00 0.00 23.12 22.38 3ktt s ALA 227 CO 0.08 0.15 1.27 -0.91 0.00 0.00 0.00 175.76 176.35 3ktt h ASN 228 N 6.65 0.80 -3.76 0.00 2.35 -1.82 -3.20 115.58 116.60 3ktt h ASN 228 Ca -0.32 -0.59 -0.65 0.00 -0.55 0.00 0.00 56.30 54.18 3ktt h ASN 228 Cb 1.18 -0.24 -0.17 0.00 0.05 0.00 0.00 38.32 39.14 3ktt h ASN 228 CO 0.48 1.39 -0.40 0.28 -1.65 0.00 0.00 177.43 177.53 3ktt s THR 229 N -3.46 5.24 0.89 2.81 -1.32 -1.26 -4.88 115.64 113.66 3ktt s THR 229 Ca -0.09 0.11 -0.11 0.00 -1.21 0.00 0.00 61.69 60.39 3ktt s THR 229 Cb 0.08 -3.68 0.12 0.00 -1.51 0.00 0.00 72.50 67.51 3ktt s THR 229 CO 0.90 0.08 1.09 -0.83 -2.21 0.00 0.00 174.62 173.65 3ktt s GLY 230 N 1.72 1.63 0.49 6.08 0.00 -1.26 -4.94 107.32 111.05 3ktt s GLY 230 Ca 0.09 0.08 0.28 0.00 0.00 0.00 0.00 44.72 45.17 3ktt s GLY 230 CO 0.11 0.55 1.89 -0.33 0.00 0.00 0.00 173.10 175.32 3ktt h MET 231 N -1.56 0.00 -6.13 2.90 2.86 -1.83 -3.45 114.93 107.72 3ktt h MET 231 Ca -0.48 0.00 -0.64 0.00 -2.06 0.00 0.00 59.70 56.52 3ktt h MET 231 Cb 1.27 0.00 0.12 0.00 0.06 0.00 0.00 31.60 33.05 3ktt h MET 231 CO 0.52 0.13 -0.46 -0.25 1.06 0.00 0.00 176.91 177.90 3ktt n ASP 232 N -3.28 -1.01 -4.14 1.22 9.92 -1.26 -3.78 116.55 114.23 3ktt n ASP 232 Ca 0.00 1.06 -0.09 0.00 -0.53 0.00 0.00 54.79 55.23 3ktt n ASP 232 Cb 0.38 -1.02 -0.10 0.00 -0.64 0.00 0.00 41.12 39.74 3ktt n ASP 232 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 3ktt s THR 233 N -1.18 0.12 0.00 -3.53 2.01 -1.26 -4.83 115.64 106.97 3ktt s THR 233 Ca 0.62 -1.88 0.00 0.00 0.31 0.00 0.00 61.69 60.74 3ktt s THR 233 Cb -0.80 -1.95 0.00 0.00 0.01 0.00 0.00 72.50 69.75 3ktt s THR 233 CO 0.58 -0.55 0.00 -0.90 -0.69 0.00 0.00 174.62 173.06 3ktt n ASP 234 N -0.06 0.00 -0.16 3.53 5.75 -1.26 -5.11 116.55 119.24 3ktt n ASP 234 Ca -0.07 0.00 -0.05 0.00 -0.01 0.00 0.00 54.79 54.66 3ktt n ASP 234 Cb 0.63 0.00 0.04 0.00 -1.03 0.00 0.00 41.12 40.76 3ktt n ASP 234 CO 0.00 0.00 0.00 0.07 -0.11 0.00 0.00 177.20 177.16 3ktt h LYS 235 N 0.00 0.48 0.00 0.11 2.10 -1.95 -3.51 116.57 113.80 3ktt h LYS 235 Ca 0.00 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.62 3ktt h LYS 235 Cb 0.00 -0.11 0.00 0.00 -0.90 0.00 0.00 32.23 31.22 3ktt h LYS 235 CO 0.00 0.32 0.00 1.51 -2.00 0.00 0.00 179.45 179.28 3ktt n ILE 236 N -4.88 0.00 -2.51 0.07 3.06 -1.26 -4.25 119.36 109.58 3ktt n ILE 236 Ca 0.04 0.00 -0.13 0.00 -2.50 0.00 0.00 62.75 60.15 3ktt n ILE 236 Cb 0.12 0.00 0.03 0.00 0.54 0.00 0.00 39.64 40.32 3ktt n ILE 236 CO 0.00 0.00 0.00 1.17 -2.50 0.00 0.00 176.55 175.22 3ktt n LYS 237 N -0.03 2.42 -3.28 9.51 0.00 -1.26 -4.70 118.16 120.81 3ktt n LYS 237 Ca 0.00 -3.81 0.03 0.00 0.00 0.00 0.00 58.31 54.53 3ktt n LYS 237 Cb 0.00 -1.82 -0.02 0.00 0.00 0.00 0.00 35.03 33.19 3ktt n LYS 237 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 3ktt s ILE 238 N -4.18 -0.86 0.17 3.15 1.09 -1.26 -5.09 121.20 114.21 3ktt s ILE 238 Ca 0.37 0.00 -0.15 0.00 -1.10 0.00 0.00 60.65 59.77 3ktt s ILE 238 Cb 0.39 -1.00 0.05 0.00 -1.06 0.00 0.00 42.46 40.84 3ktt s ILE 238 CO -0.03 0.00 1.82 -0.26 -0.10 0.00 0.00 174.94 176.38 3ktt h PHE 239 N 7.96 0.59 -6.40 3.97 -1.00 -1.84 -3.46 116.94 116.74 3ktt h PHE 239 Ca -0.20 0.01 -0.48 0.00 2.81 0.00 0.00 57.97 60.11 3ktt h PHE 239 Cb 1.14 -0.20 -0.04 0.00 3.61 0.00 0.00 35.95 40.47 3ktt h PHE 239 CO 0.12 0.36 -0.86 0.41 -1.61 0.00 0.00 178.31 176.73 3ktt n GLY 240 N -1.23 -0.27 1.89 -1.45 0.00 -1.26 -4.78 105.19 98.09 3ktt n GLY 240 Ca 0.02 0.14 -0.00 0.00 0.00 0.00 0.00 46.02 46.18 3ktt n GLY 240 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3ktt n SER 241 N -2.98 -0.71 -4.69 1.61 7.64 -1.26 -5.04 113.62 108.19 3ktt n SER 241 Ca -0.27 -1.29 -0.44 0.00 1.01 0.00 0.00 58.87 57.89 3ktt n SER 241 Cb 0.66 1.14 -0.03 0.00 -1.01 0.00 0.00 64.21 64.97 3ktt n SER 241 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3ktt n ARG 242 N -0.39 2.57 -4.21 1.43 1.74 -1.26 -4.88 116.66 111.65 3ktt n ARG 242 Ca 0.00 0.93 -0.13 0.00 -0.77 0.00 0.00 57.85 57.89 3ktt n ARG 242 Cb 0.28 -2.77 -0.10 0.00 -1.02 0.00 0.00 32.46 28.85 3ktt n ARG 242 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3ktt s VAL 243 N 1.72 0.03 0.13 1.55 1.01 -1.26 -5.17 120.40 118.40 3ktt s VAL 243 Ca 0.79 -2.00 0.02 0.00 0.00 0.00 0.00 61.98 60.79 3ktt s VAL 243 Cb -0.56 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.27 3ktt s VAL 243 CO 0.36 0.00 -0.04 -0.60 0.00 0.00 0.00 175.10 174.82 3ktt s ARG 244 N -4.11 0.96 0.05 2.72 3.00 -1.26 -5.18 118.95 115.13 3ktt s ARG 244 Ca 0.39 -1.42 -0.02 0.00 -1.00 0.00 0.00 55.73 53.68 3ktt s ARG 244 Cb 0.07 -0.27 -0.03 0.00 0.00 0.00 0.00 34.95 34.71 3ktt s ARG 244 CO 0.13 -0.05 0.01 0.08 0.00 0.00 0.00 175.30 175.47 3ktt s VAL 245 N -3.61 0.20 -1.53 7.11 1.01 -1.26 -4.99 120.40 117.33 3ktt s VAL 245 Ca 0.17 -1.62 -0.12 0.00 0.00 0.00 0.00 61.98 60.41 3ktt s VAL 245 Cb 0.05 -1.36 -0.02 0.00 0.00 0.00 0.00 36.38 35.05 3ktt s VAL 245 CO -0.01 -0.89 2.56 -0.90 0.00 0.00 0.00 175.10 175.86 3ktt n ASP 246 N 0.24 6.17 0.00 3.32 5.75 -1.26 -4.66 116.55 126.11 3ktt n ASP 246 Ca -0.15 -2.72 0.00 0.00 -0.01 0.00 0.00 54.79 51.90 3ktt n ASP 246 Cb 0.61 -1.61 0.00 0.00 -1.03 0.00 0.00 41.12 39.09 3ktt n ASP 246 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 3ktt n SER 247 N 4.87 0.00 0.27 -1.12 3.41 -1.26 -4.38 113.62 115.40 3ktt n SER 247 Ca 0.64 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 59.36 3ktt n SER 247 Cb 0.32 0.19 0.74 0.00 -0.26 0.00 0.00 64.21 65.19 3ktt n SER 247 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 3ktt h THR 248 N 0.00 0.75 -0.75 6.66 2.02 -2.01 -1.36 112.91 118.22 3ktt h THR 248 Ca 0.00 -0.24 0.08 0.00 0.77 0.00 0.00 66.41 67.01 3ktt h THR 248 Cb 0.00 1.14 -0.05 0.00 -1.74 0.00 0.00 68.15 67.51 3ktt h THR 248 CO 0.00 0.06 0.49 0.00 0.37 0.00 0.00 175.52 176.45 3ktt h ALA 249 N 1.94 1.74 -0.61 6.16 0.00 -1.97 0.34 119.26 126.86 3ktt h ALA 249 Ca -0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3ktt h ALA 249 Cb 0.14 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 3ktt h ALA 249 CO 0.01 0.12 0.33 -0.22 0.00 0.00 0.00 179.25 179.49 3ktt h LYS 250 N 0.73 0.84 0.00 0.00 1.63 -1.44 -1.30 116.57 117.03 3ktt h LYS 250 Ca 0.34 -0.09 -0.03 0.00 -0.85 0.00 0.00 60.65 60.02 3ktt h LYS 250 Cb 0.35 -0.17 -0.00 0.00 -0.60 0.00 0.00 32.23 31.81 3ktt h LYS 250 CO -0.12 0.62 -0.15 -0.24 -3.45 0.00 0.00 179.45 176.12 3ktt h VAL 251 N 0.85 0.94 -0.95 2.00 3.04 -0.43 -2.40 116.25 119.29 3ktt h VAL 251 Ca 0.22 -0.53 0.08 0.00 -1.01 0.00 0.00 66.70 65.45 3ktt h VAL 251 Cb 0.03 1.30 -0.07 0.00 -2.01 0.00 0.00 31.29 30.54 3ktt h VAL 251 CO -0.04 0.14 0.62 0.00 -1.01 0.00 0.00 177.57 177.28 3ktt h ALA 252 N 1.85 1.49 -0.61 3.17 0.00 -1.05 0.25 119.26 124.37 3ktt h ALA 252 Ca -0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 3ktt h ALA 252 Cb 0.29 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 3ktt h ALA 252 CO 0.02 0.35 0.14 1.05 0.00 0.00 0.00 179.25 180.81 3ktt h GLU 253 N 1.06 0.95 -0.67 0.00 4.11 -1.55 -1.49 114.58 116.98 3ktt h GLU 253 Ca 0.42 -0.21 -0.02 0.00 0.07 0.00 0.00 59.36 59.62 3ktt h GLU 253 Cb 0.25 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 3ktt h GLU 253 CO -0.17 0.85 0.35 0.82 0.07 0.00 0.00 179.01 180.92 3ktt h ILE 254 N 0.91 1.22 -0.59 -1.06 1.08 -1.06 0.93 117.51 118.93 3ktt h ILE 254 Ca 0.19 -0.57 -0.02 0.00 -0.39 0.00 0.00 64.86 64.07 3ktt h ILE 254 Cb 0.33 0.36 -0.03 0.00 -3.07 0.00 0.00 36.82 34.42 3ktt h ILE 254 CO 0.00 0.24 0.30 -0.08 -0.69 0.00 0.00 178.15 177.92 3ktt h GLU 255 N 0.93 0.82 -0.57 2.37 4.22 -0.90 -2.10 114.58 119.35 3ktt h GLU 255 Ca 0.23 -0.09 -0.04 0.00 0.08 0.00 0.00 59.36 59.54 3ktt h GLU 255 Cb 0.07 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 3ktt h GLU 255 CO -0.03 0.62 0.21 1.25 -2.18 0.00 0.00 179.01 178.88 3ktt h HIS 256 N 0.82 0.85 -0.89 0.92 2.76 0.17 -2.88 115.15 116.91 3ktt h HIS 256 Ca 0.21 -0.05 -0.01 0.00 -2.20 0.00 0.00 60.37 58.31 3ktt h HIS 256 Cb 0.06 -0.26 -0.04 0.00 1.55 0.00 0.00 27.41 28.72 3ktt h HIS 256 CO 0.01 0.68 0.51 0.00 -1.30 0.00 0.00 177.93 177.82 3ktt h ALA 257 N 1.40 1.14 -0.42 5.26 0.00 -0.52 -0.10 119.26 126.02 3ktt h ALA 257 Ca 0.19 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 55.02 3ktt h ALA 257 Cb 0.20 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3ktt h ALA 257 CO -0.01 0.62 0.28 1.49 0.00 0.00 0.00 179.25 181.62 3ktt h GLU 258 N 1.23 0.45 -0.50 0.00 4.57 -1.54 0.59 114.58 119.38 3ktt h GLU 258 Ca 0.32 -0.03 -0.05 0.00 -1.18 0.00 0.00 59.36 58.42 3ktt h GLU 258 Cb -0.01 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.45 3ktt h GLU 258 CO -0.06 0.30 0.12 0.87 -1.18 0.00 0.00 179.01 179.06 3ktt h LYS 259 N 0.46 0.75 -0.64 1.92 1.79 -1.05 -0.54 116.57 119.27 3ktt h LYS 259 Ca 0.17 -0.14 -0.04 0.00 -2.18 0.00 0.00 60.65 58.46 3ktt h LYS 259 Cb 0.10 -0.12 -0.03 0.00 -1.58 0.00 0.00 32.23 30.60 3ktt h LYS 259 CO -0.04 0.68 0.26 1.49 -1.08 0.00 0.00 179.45 180.76 3ktt h GLU 260 N 0.73 0.96 -0.65 3.15 4.57 0.54 0.87 114.58 124.75 3ktt h GLU 260 Ca 0.16 -0.17 -0.03 0.00 -1.18 0.00 0.00 59.36 58.14 3ktt h GLU 260 Cb 0.27 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 28.67 3ktt h GLU 260 CO -0.00 0.80 0.28 0.87 -1.18 0.00 0.00 179.01 179.78 3ktt h LYS 261 N 0.90 0.96 -0.30 1.92 6.56 -0.74 -0.06 116.57 125.81 3ktt h LYS 261 Ca 0.21 -0.16 -0.02 0.00 -1.06 0.00 0.00 60.65 59.62 3ktt h LYS 261 Cb 0.20 -0.16 -0.01 0.00 -0.57 0.00 0.00 32.23 31.69 3ktt h LYS 261 CO -0.02 0.79 0.10 1.98 -2.06 0.00 0.00 179.45 180.25 3ktt h MET 262 N 0.91 0.46 -0.63 3.15 4.05 -0.02 -2.55 114.93 120.30 3ktt h MET 262 Ca 0.22 -0.09 -0.08 0.00 -0.28 0.00 0.00 59.70 59.47 3ktt h MET 262 Cb 0.18 -0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 30.88 3ktt h MET 262 CO -0.02 0.50 0.10 0.87 0.23 0.00 0.00 176.91 178.58 3ktt h LYS 263 N 0.33 1.05 -0.75 0.39 1.79 0.10 -0.21 116.57 119.26 3ktt h LYS 263 Ca 0.10 -0.28 -0.04 0.00 -2.18 0.00 0.00 60.65 58.25 3ktt h LYS 263 Cb 0.22 -0.12 -0.03 0.00 -1.58 0.00 0.00 32.23 30.72 3ktt h LYS 263 CO -0.01 0.98 0.32 1.05 -1.08 0.00 0.00 179.45 180.71 3ktt h GLU 264 N 0.96 1.11 -0.52 3.15 4.11 -0.89 0.18 114.58 122.69 3ktt h GLU 264 Ca 0.19 -0.19 -0.04 0.00 0.07 0.00 0.00 59.36 59.40 3ktt h GLU 264 Cb 0.44 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 3ktt h GLU 264 CO 0.01 0.89 0.18 0.87 0.07 0.00 0.00 179.01 181.04 3ktt h LYS 265 N 1.08 0.79 -0.42 1.06 1.57 -0.95 -2.95 116.57 116.75 3ktt h LYS 265 Ca 0.25 -0.16 -0.12 0.00 -1.87 0.00 0.00 60.65 58.76 3ktt h LYS 265 Cb 0.18 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 3ktt h LYS 265 CO -0.02 0.72 -0.21 -0.24 -0.57 0.00 0.00 179.45 179.12 3ktt h VAL 266 N 0.70 1.27 0.44 0.50 3.04 -0.38 -2.99 116.25 118.83 3ktt h VAL 266 Ca 0.17 -1.34 -0.02 0.00 -1.01 0.00 0.00 66.70 64.50 3ktt h VAL 266 Cb 0.24 1.18 0.00 0.00 -2.01 0.00 0.00 31.29 30.70 3ktt h VAL 266 CO -0.01 0.45 -0.21 -0.33 -1.01 0.00 0.00 177.57 176.46 3ktt h GLU 267 N 0.72 -0.57 0.00 4.17 4.39 -0.48 -3.12 114.58 119.69 3ktt h GLU 267 Ca 0.10 0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.84 3ktt h GLU 267 Cb 0.74 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.52 3ktt h GLU 267 CO 0.06 -0.33 -0.34 0.00 -1.16 0.00 0.00 179.01 177.23 3ktt h ARG 268 N -0.68 0.00 -0.45 2.33 2.47 -1.70 -3.30 114.38 113.05 3ktt h ARG 268 Ca -0.06 0.00 -0.14 0.00 -1.26 0.00 0.00 59.98 58.52 3ktt h ARG 268 Cb 0.50 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.81 3ktt h ARG 268 CO 0.10 0.00 -0.27 0.97 0.56 0.00 0.00 179.97 181.33 3ktt h ILE 269 N 0.00 1.27 -0.64 2.04 2.10 -1.53 -2.97 117.51 117.78 3ktt h ILE 269 Ca 0.00 -1.43 -0.09 0.00 1.08 0.00 0.00 64.86 64.42 3ktt h ILE 269 Cb 0.95 1.20 -0.02 0.00 -1.09 0.00 0.00 36.82 37.85 3ktt h ILE 269 CO 0.00 0.49 0.06 0.25 -1.08 0.00 0.00 178.15 177.88 3ktt h LEU 270 N 0.82 1.05 -1.08 2.19 5.85 -1.63 0.08 115.31 122.59 3ktt h LEU 270 Ca 0.10 -0.27 0.01 0.00 0.84 0.00 0.00 57.88 58.56 3ktt h LEU 270 Cb 0.85 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 41.55 3ktt h LEU 270 CO 0.07 1.06 0.63 0.07 -0.34 0.00 0.00 178.44 179.93 3ktt h LYS 271 N 1.01 1.24 -0.47 1.25 2.10 -1.62 0.68 116.57 120.75 3ktt h LYS 271 Ca 0.19 -0.07 -0.08 0.00 -2.00 0.00 0.00 60.65 58.69 3ktt h LYS 271 Cb 0.49 -0.28 -0.02 0.00 -0.90 0.00 0.00 32.23 31.52 3ktt h LYS 271 CO 0.02 0.82 -0.03 1.25 -2.00 0.00 0.00 179.45 179.51 3ktt h HIS 272 N 1.27 0.87 0.00 0.07 2.76 -1.26 -3.45 115.15 115.40 3ktt h HIS 272 Ca 0.35 -0.13 0.00 0.00 -2.20 0.00 0.00 60.37 58.39 3ktt h HIS 272 Cb -0.14 -0.23 0.00 0.00 1.55 0.00 0.00 27.41 28.59 3ktt h HIS 272 CO -0.00 0.81 0.00 0.41 -1.30 0.00 0.00 177.93 177.85 3ktt n GLY 273 N -0.57 0.81 0.00 5.26 0.00 0.24 -4.95 105.19 105.97 3ktt n GLY 273 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3ktt n GLY 273 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3ktt n ILE 274 N -2.26 0.00 -0.00 -0.61 0.13 -0.15 -4.94 119.36 111.53 3ktt n ILE 274 Ca 0.00 0.00 -0.01 0.00 -1.10 0.00 0.00 62.75 61.64 3ktt n ILE 274 Cb 0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 39.64 38.80 3ktt n ILE 274 CO 0.00 0.00 0.00 0.59 2.80 0.00 0.00 176.55 179.94 3ktt n ASN 275 N 0.00 1.19 -3.94 9.51 4.13 -1.25 -4.39 115.26 120.51 3ktt n ASN 275 Ca 0.00 0.01 -0.10 0.00 1.68 0.00 0.00 54.58 56.17 3ktt n ASN 275 Cb 0.00 -0.02 -0.10 0.00 -1.54 0.00 0.00 39.78 38.12 3ktt n ASN 275 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3ktt s PHE 277 N -1.73 1.34 -0.27 0.00 5.36 0.12 -2.83 117.98 119.96 3ktt s PHE 277 Ca -0.13 -0.63 -0.02 0.00 -0.96 0.00 0.00 56.93 55.20 3ktt s PHE 277 Cb -0.07 -1.14 0.03 0.00 -0.34 0.00 0.00 43.02 41.50 3ktt s PHE 277 CO -0.01 -0.46 -0.03 -1.50 -1.46 0.00 0.00 175.22 171.76 3ktt s ILE 278 N 1.67 3.00 -0.27 3.12 2.07 -0.12 -0.28 121.20 130.39 3ktt s ILE 278 Ca 0.03 -1.11 -0.02 0.00 -1.41 0.00 0.00 60.65 58.15 3ktt s ILE 278 Cb -0.13 -2.59 0.03 0.00 0.13 0.00 0.00 42.46 39.91 3ktt s ILE 278 CO -0.07 0.09 -0.04 0.21 -1.91 0.00 0.00 174.94 173.23 3ktt s ASN 279 N 1.32 4.54 -1.42 4.50 3.84 -0.96 -1.03 114.94 125.72 3ktt s ASN 279 Ca -0.01 -1.00 -0.14 0.00 0.21 0.00 0.00 52.86 51.92 3ktt s ASN 279 Cb -0.18 -1.69 0.06 0.00 -0.55 0.00 0.00 41.25 38.90 3ktt s ASN 279 CO -0.03 -0.17 2.14 -1.14 -2.79 0.00 0.00 177.10 175.11 3ktt n ARG 280 N 4.66 2.98 0.00 0.43 0.00 -1.19 0.80 116.66 124.33 3ktt n ARG 280 Ca -0.15 -2.78 0.00 0.00 -0.00 0.00 0.00 57.85 54.91 3ktt n ARG 280 Cb 0.46 -3.25 0.00 0.00 0.00 0.00 0.00 32.46 29.66 3ktt n ARG 280 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3ktt n GLN 281 N 5.96 0.00 -1.29 -0.14 10.64 -1.26 -4.79 117.38 126.50 3ktt n GLN 281 Ca 0.50 0.00 -0.35 0.00 -1.83 0.00 0.00 57.00 55.32 3ktt n GLN 281 Cb 0.39 0.00 0.11 0.00 -0.86 0.00 0.00 30.24 29.88 3ktt n GLN 281 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 3ktt n LEU 282 N 0.00 4.57 -4.46 2.61 7.99 -1.26 -2.61 117.00 123.84 3ktt n LEU 282 Ca 0.00 0.65 -0.25 0.00 -0.01 0.00 0.00 56.01 56.40 3ktt n LEU 282 Cb 0.00 -1.50 -0.11 0.00 -0.11 0.00 0.00 43.42 41.71 3ktt n LEU 282 CO 0.00 -1.62 -0.49 -0.51 -1.51 0.00 0.00 177.39 173.25 3ktt s ILE 283 N -1.90 2.47 -0.17 -0.08 2.07 -1.26 -3.30 121.20 119.03 3ktt s ILE 283 Ca 0.75 -2.24 -0.05 0.00 -1.41 0.00 0.00 60.65 57.70 3ktt s ILE 283 Cb -0.32 -2.25 -0.03 0.00 0.13 0.00 0.00 42.46 39.98 3ktt s ILE 283 CO 0.48 -0.29 0.00 -0.47 -1.91 0.00 0.00 174.94 172.76 3ktt s TYR 284 N -2.18 3.11 0.54 3.50 5.04 -1.25 -4.31 117.35 121.80 3ktt s TYR 284 Ca 0.26 -0.19 0.22 0.00 -2.44 0.00 0.00 57.07 54.92 3ktt s TYR 284 Cb -0.06 -2.02 1.49 0.00 0.35 0.00 0.00 41.96 41.72 3ktt s TYR 284 CO 0.13 -0.00 2.18 -0.91 -1.34 0.00 0.00 175.55 175.61 3ktt h ASN 285 N 6.84 0.00 -0.72 4.32 2.35 -2.00 -3.21 115.58 123.16 3ktt h ASN 285 Ca -0.34 0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.43 3ktt h ASN 285 Cb 1.18 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.51 3ktt h ASN 285 CO 0.65 0.02 0.48 1.88 -1.65 0.00 0.00 177.43 178.80 3ktt h TYR 286 N 0.00 0.89 0.00 1.19 0.05 -1.96 0.79 116.97 117.93 3ktt h TYR 286 Ca -0.00 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.79 3ktt h TYR 286 Cb 0.03 -0.30 -0.00 0.00 1.01 0.00 0.00 36.73 37.47 3ktt h TYR 286 CO 0.00 0.54 -0.07 -1.35 -1.05 0.00 0.00 178.16 176.23 3ktt h PRO 287 N 0.94 0.00 -0.86 4.88 0.11 -1.92 -2.22 132.00 132.94 3ktt h PRO 287 Ca 0.27 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.39 3ktt h PRO 287 Cb -0.05 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.02 3ktt h PRO 287 CO -0.07 0.07 0.56 0.93 -0.21 0.00 0.00 178.00 179.29 3ktt h GLU 288 N 0.00 1.13 -0.21 1.05 4.39 0.41 0.49 114.58 121.83 3ktt h GLU 288 Ca -0.00 -0.07 -0.12 0.00 0.34 0.00 0.00 59.36 59.51 3ktt h GLU 288 Cb 0.20 -0.25 -0.00 0.00 -0.10 0.00 0.00 28.75 28.59 3ktt h GLU 288 CO 0.01 0.75 -0.34 1.96 -1.16 0.00 0.00 179.01 180.23 3ktt h GLN 289 N 1.16 0.60 -0.41 2.33 4.20 -1.19 -3.02 115.11 118.78 3ktt h GLN 289 Ca 0.31 -0.36 -0.06 0.00 0.06 0.00 0.00 58.65 58.59 3ktt h GLN 289 Cb -0.13 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 3ktt h GLN 289 CO -0.07 0.97 0.01 1.25 -0.67 0.00 0.00 178.83 180.32 3ktt h LEU 290 N 0.29 0.71 -0.20 1.46 5.85 -0.96 -1.97 115.31 120.49 3ktt h LEU 290 Ca 0.02 -0.30 -0.02 0.00 0.84 0.00 0.00 57.88 58.41 3ktt h LEU 290 Cb 0.92 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 3ktt h LEU 290 CO 0.08 0.84 0.04 -0.26 -0.34 0.00 0.00 178.44 178.80 3ktt h PHE 291 N 0.56 0.35 -0.69 1.25 -1.00 -0.13 0.17 116.94 117.47 3ktt h PHE 291 Ca 0.12 -0.05 -0.00 0.00 2.81 0.00 0.00 57.97 60.85 3ktt h PHE 291 Cb 0.47 -0.10 -0.03 0.00 3.61 0.00 0.00 35.95 39.90 3ktt h PHE 291 CO 0.04 0.47 0.41 0.78 -1.61 0.00 0.00 178.31 178.39 3ktt h GLY 292 N 0.14 0.99 1.59 -1.45 0.00 -1.46 0.54 103.07 103.41 3ktt h GLY 292 Ca 0.06 -0.41 -0.08 0.00 0.00 0.00 0.00 47.33 46.90 3ktt h GLY 292 CO 0.00 0.40 -0.18 0.00 0.00 0.00 0.00 176.54 176.76 3ktt h ALA 293 N 1.50 1.18 0.17 3.60 0.00 -1.03 -3.37 119.26 121.32 3ktt h ALA 293 Ca 0.25 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 3ktt h ALA 293 Cb -0.03 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.63 3ktt h ALA 293 CO -0.05 0.52 -0.08 0.00 0.00 0.00 0.00 179.25 179.65 3ktt h ALA 294 N 1.37 -0.23 0.00 0.00 0.00 0.31 -3.47 119.26 117.24 3ktt h ALA 294 Ca 0.08 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3ktt h ALA 294 Cb 0.57 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.45 3ktt h ALA 294 CO 0.04 -0.48 0.00 0.41 0.00 0.00 0.00 179.25 179.22 3ktt n GLY 295 N -0.37 1.43 3.53 0.00 0.00 -1.05 -5.08 105.19 103.66 3ktt n GLY 295 Ca -0.09 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.69 3ktt n GLY 295 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ktt s VAL 296 N -2.00 2.85 -0.04 1.61 1.01 -1.20 -4.64 120.40 118.00 3ktt s VAL 296 Ca 0.00 -2.19 0.03 0.00 0.00 0.00 0.00 61.98 59.82 3ktt s VAL 296 Cb 0.00 -2.50 0.01 0.00 0.00 0.00 0.00 36.38 33.89 3ktt s VAL 296 CO 0.00 -0.37 -0.10 -0.32 0.00 0.00 0.00 175.10 174.31 3ktt s MET 297 N -3.51 1.16 0.15 2.72 -2.45 0.16 -3.93 119.30 113.60 3ktt s MET 297 Ca 0.30 -0.34 0.06 0.00 -1.25 0.00 0.00 55.69 54.47 3ktt s MET 297 Cb -0.06 -1.05 -0.04 0.00 1.25 0.00 0.00 34.83 34.93 3ktt s MET 297 CO 0.17 0.10 0.03 0.00 1.05 0.00 0.00 175.02 176.36 3ktt s ALA 298 N 0.32 3.30 -0.33 4.11 0.00 -1.26 0.11 121.76 128.01 3ktt s ALA 298 Ca -0.06 -1.28 0.04 0.00 0.00 0.00 0.00 51.96 50.66 3ktt s ALA 298 Cb -0.11 -1.12 0.10 0.00 0.00 0.00 0.00 23.12 22.00 3ktt s ALA 298 CO 0.01 0.53 0.05 0.42 0.00 0.00 0.00 175.76 176.77 3ktt s ILE 299 N -1.64 2.16 0.14 0.00 1.09 0.61 -0.71 121.20 122.86 3ktt s ILE 299 Ca 0.28 -2.24 -0.30 0.00 -1.10 0.00 0.00 60.65 57.29 3ktt s ILE 299 Cb -0.10 -2.59 -0.08 0.00 -1.06 0.00 0.00 42.46 38.64 3ktt s ILE 299 CO 0.19 -0.58 1.27 -0.70 -0.10 0.00 0.00 174.94 175.03 3ktt s GLU 300 N 0.97 4.42 -1.19 2.79 -6.30 -1.26 -2.27 118.70 115.85 3ktt s GLU 300 Ca 0.10 1.93 -0.06 0.00 -2.50 0.00 0.00 54.97 54.44 3ktt s GLU 300 Cb -0.19 -3.26 -0.02 0.00 0.00 0.00 0.00 34.13 30.66 3ktt s GLU 300 CO -0.09 -0.24 0.81 1.58 0.02 0.00 0.00 175.26 177.34 3ktt n HIS 301 N 3.19 -2.09 -2.57 5.30 -0.00 -0.13 -4.89 115.22 114.03 3ktt n HIS 301 Ca 0.07 0.77 -0.43 0.00 -0.00 0.00 0.00 57.72 58.13 3ktt n HIS 301 Cb 0.44 -4.18 -0.02 0.00 -0.00 0.00 0.00 29.99 26.23 3ktt n HIS 301 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3ktt s ALA 302 N -3.51 3.28 0.78 1.57 0.00 0.24 -4.56 121.76 119.55 3ktt s ALA 302 Ca 0.23 -0.24 -0.14 0.00 0.00 0.00 0.00 51.96 51.81 3ktt s ALA 302 Cb -0.06 -3.82 0.04 0.00 0.00 0.00 0.00 23.12 19.29 3ktt s ALA 302 CO 0.79 -1.97 0.97 -0.25 0.00 0.00 0.00 175.76 175.31 3ktt n ASP 303 N 7.60 0.31 -0.14 0.00 9.92 -1.26 -3.20 116.55 129.78 3ktt n ASP 303 Ca 0.13 0.59 -0.10 0.00 -0.53 0.00 0.00 54.79 54.87 3ktt n ASP 303 Cb 0.48 -1.41 -0.01 0.00 -0.64 0.00 0.00 41.12 39.53 3ktt n ASP 303 CO 0.00 0.00 0.00 0.15 0.13 0.00 0.00 177.20 177.48 3ktt h PHE 304 N -0.68 0.83 -0.37 1.24 3.57 -1.92 -3.27 116.94 116.33 3ktt h PHE 304 Ca -0.46 -0.15 0.04 0.00 3.53 0.00 0.00 57.97 60.92 3ktt h PHE 304 Cb 1.31 -0.21 -0.04 0.00 2.79 0.00 0.00 35.95 39.81 3ktt h PHE 304 CO 0.42 0.84 0.16 -0.24 -2.23 0.00 0.00 178.31 177.26 3ktt h VAL 305 N 0.59 0.93 0.00 1.41 3.04 -2.01 0.28 116.25 120.49 3ktt h VAL 305 Ca 0.12 -0.11 -0.03 0.00 -1.01 0.00 0.00 66.70 65.66 3ktt h VAL 305 Cb 0.52 0.58 -0.00 0.00 -2.01 0.00 0.00 31.29 30.38 3ktt h VAL 305 CO 0.03 0.06 -0.16 1.23 -1.01 0.00 0.00 177.57 177.71 3ktt h GLY 306 N 0.33 0.00 0.95 3.17 0.00 -1.95 -2.58 103.07 102.99 3ktt h GLY 306 Ca 0.16 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.40 3ktt h GLY 306 CO -0.14 0.00 -0.17 -2.08 0.00 0.00 0.00 176.54 174.15 3ktt h VAL 307 N 0.00 1.29 -0.48 4.60 2.07 -0.54 -2.18 116.25 121.01 3ktt h VAL 307 Ca -0.00 -1.28 -0.09 0.00 0.82 0.00 0.00 66.70 66.14 3ktt h VAL 307 Cb 0.54 1.41 -0.02 0.00 -1.52 0.00 0.00 31.29 31.70 3ktt h VAL 307 CO 0.02 0.42 -0.06 -0.33 0.02 0.00 0.00 177.57 177.64 3ktt h GLU 308 N 0.47 0.89 -0.59 1.57 4.39 -0.95 -0.37 114.58 119.98 3ktt h GLU 308 Ca 0.07 -0.31 -0.08 0.00 0.34 0.00 0.00 59.36 59.38 3ktt h GLU 308 Cb 0.70 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.26 3ktt h GLU 308 CO 0.05 0.95 0.06 0.00 -1.16 0.00 0.00 179.01 178.92 3ktt h ARG 309 N 0.74 0.99 0.00 2.33 3.08 -1.53 -1.28 114.38 118.71 3ktt h ARG 309 Ca 0.13 -0.26 -0.05 0.00 0.07 0.00 0.00 59.98 59.87 3ktt h ARG 309 Cb 0.59 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 3ktt h ARG 309 CO 0.04 0.93 -0.21 1.25 -1.07 0.00 0.00 179.97 180.90 3ktt h LEU 310 N 0.92 0.00 -0.48 3.04 7.12 -1.03 0.21 115.31 125.08 3ktt h LEU 310 Ca 0.18 0.00 -0.08 0.00 0.13 0.00 0.00 57.88 58.11 3ktt h LEU 310 Cb 0.45 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 40.56 3ktt h LEU 310 CO 0.02 0.21 -0.02 0.00 -0.13 0.00 0.00 178.44 178.52 3ktt h ALA 311 N 1.79 0.66 -0.61 1.25 0.00 0.11 -0.41 119.26 122.04 3ktt h ALA 311 Ca -0.00 -0.29 -0.10 0.00 0.00 0.00 0.00 54.91 54.52 3ktt h ALA 311 Cb 0.51 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 3ktt h ALA 311 CO 0.03 0.48 -0.00 1.25 0.00 0.00 0.00 179.25 181.01 3ktt h LEU 312 N 0.73 1.06 0.12 0.00 7.12 -0.26 -3.12 115.31 120.96 3ktt h LEU 312 Ca 0.13 -0.31 -0.01 0.00 0.13 0.00 0.00 57.88 57.83 3ktt h LEU 312 Cb 0.54 -0.29 0.00 0.00 -0.53 0.00 0.00 40.66 40.39 3ktt h LEU 312 CO 0.03 1.11 -0.06 0.58 -0.13 0.00 0.00 178.44 179.97 3ktt h VAL 313 N 0.99 1.05 0.02 1.05 2.07 -0.93 -3.42 116.25 117.08 3ktt h VAL 313 Ca 0.17 -0.76 -0.00 0.00 0.82 0.00 0.00 66.70 66.94 3ktt h VAL 313 Cb 0.57 1.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.86 3ktt h VAL 313 CO 0.03 0.18 -0.01 0.00 0.02 0.00 0.00 177.57 177.79 3ktt h THR 314 N -0.52 0.72 0.00 2.57 1.03 -1.03 -3.20 112.91 112.48 3ktt h THR 314 Ca -0.02 -1.50 0.00 0.00 -0.01 0.00 0.00 66.41 64.88 3ktt h THR 314 Cb 0.42 1.36 0.00 0.00 -1.07 0.00 0.00 68.15 68.85 3ktt h THR 314 CO 0.03 0.24 0.00 0.61 -0.01 0.00 0.00 175.52 176.39 3ktt n GLY 315 N 1.61 2.28 7.00 2.99 0.00 -1.18 -4.43 105.19 113.45 3ktt n GLY 315 Ca -0.04 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.53 3ktt n GLY 315 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ktt n GLY 316 N 0.00 1.82 0.00 -0.02 0.00 0.24 -4.09 105.19 103.14 3ktt n GLY 316 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.86 3ktt n GLY 316 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3ktt n GLU 317 N 0.00 -0.22 -3.62 1.61 0.28 -1.25 0.23 120.64 117.67 3ktt n GLU 317 Ca 0.00 0.00 -0.28 0.00 -0.16 0.00 0.00 57.16 56.72 3ktt n GLU 317 Cb 0.00 0.00 -0.16 0.00 1.43 0.00 0.00 31.44 32.71 3ktt n GLU 317 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 3ktt s ILE 318 N -2.50 0.12 -0.13 3.84 -1.09 0.36 -4.77 121.20 117.03 3ktt s ILE 318 Ca 0.00 -0.59 -0.01 0.00 -2.23 0.00 0.00 60.65 57.82 3ktt s ILE 318 Cb 0.00 -0.92 0.04 0.00 -1.58 0.00 0.00 42.46 39.99 3ktt s ILE 318 CO 0.00 -0.49 -0.04 0.00 -1.23 0.00 0.00 174.94 173.18 3ktt s ALA 319 N 2.02 1.24 0.00 9.38 0.00 -1.26 -4.53 121.76 128.61 3ktt s ALA 319 Ca 0.05 -0.60 0.00 0.00 0.00 0.00 0.00 51.96 51.41 3ktt s ALA 319 Cb -0.16 -0.99 0.00 0.00 0.00 0.00 0.00 23.12 21.97 3ktt s ALA 319 CO -0.21 -0.64 0.00 0.43 0.00 0.00 0.00 175.76 175.33 3ktt n SER 320 N 4.96 -0.37 -3.72 0.00 7.64 -1.26 -3.07 113.62 117.80 3ktt n SER 320 Ca -0.11 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.51 3ktt n SER 320 Cb 0.49 0.02 0.22 0.00 -1.01 0.00 0.00 64.21 63.94 3ktt n SER 320 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 3ktt n THR 321 N 2.40 0.00 0.00 0.44 -2.24 -1.26 -3.93 114.28 109.69 3ktt n THR 321 Ca 0.00 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 3ktt n THR 321 Cb 0.00 -0.77 0.00 0.00 -2.10 0.00 0.00 70.33 67.46 3ktt n THR 321 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3ktt n PHE 322 N -5.03 0.00 0.53 4.78 3.72 -1.26 0.99 117.46 121.19 3ktt n PHE 322 Ca 0.07 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.54 3ktt n PHE 322 Cb 0.51 -0.11 0.32 0.00 -0.94 0.00 0.00 39.48 39.26 3ktt n PHE 322 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 3ktt n ASP 323 N -1.05 0.00 0.19 4.37 8.00 -1.26 -4.23 116.55 122.57 3ktt n ASP 323 Ca 0.00 0.40 0.13 0.00 0.71 0.00 0.00 54.79 56.03 3ktt n ASP 323 Cb 0.02 -0.45 0.67 0.00 -0.02 0.00 0.00 41.12 41.34 3ktt n ASP 323 CO 0.00 0.00 0.00 1.12 -0.39 0.00 0.00 177.20 177.93 3ktt h HIS 324 N 0.00 0.00 -2.10 1.24 2.07 0.52 -3.45 115.15 113.44 3ktt h HIS 324 Ca 0.00 0.00 -0.18 0.00 -2.85 0.00 0.00 60.37 57.34 3ktt h HIS 324 Cb 0.22 0.00 0.10 0.00 2.57 0.00 0.00 27.41 30.30 3ktt h HIS 324 CO 0.00 0.00 -0.04 -2.30 -3.07 0.00 0.00 177.93 172.52 3ktt n PRO 325 N -2.42 -2.94 0.00 5.12 -0.02 -1.26 -3.29 135.00 130.20 3ktt n PRO 325 Ca -0.01 -0.76 0.00 0.00 -2.02 0.00 0.00 63.50 60.72 3ktt n PRO 325 Cb 0.10 -0.88 0.00 0.00 -0.02 0.00 0.00 33.50 32.70 3ktt n PRO 325 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 3ktt n GLU 326 N -3.60 0.00 0.30 -0.52 -0.00 -1.26 -1.83 120.64 113.74 3ktt n GLU 326 Ca 0.07 0.00 0.19 0.00 -0.00 0.00 0.00 57.16 57.41 3ktt n GLU 326 Cb 0.29 0.00 0.96 0.00 -0.00 0.00 0.00 31.44 32.69 3ktt n GLU 326 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.13 177.06 3ktt h LEU 327 N 0.00 0.00 -1.10 -1.84 4.07 -1.95 0.71 115.31 115.19 3ktt h LEU 327 Ca 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.94 3ktt h LEU 327 Cb 0.00 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 41.71 3ktt h LEU 327 CO 0.00 0.03 0.33 -0.37 -1.08 0.00 0.00 178.44 177.34 3ktt h VAL 328 N 0.00 1.22 -2.92 1.22 -1.51 -1.58 -3.40 116.25 109.27 3ktt h VAL 328 Ca -0.00 -0.61 -0.45 0.00 -1.23 0.00 0.00 66.70 64.41 3ktt h VAL 328 Cb 0.19 0.35 0.05 0.00 -2.13 0.00 0.00 31.29 29.75 3ktt h VAL 328 CO 0.00 0.26 0.02 -0.54 -1.23 0.00 0.00 177.57 176.08 3ktt s LYS 329 N -5.55 2.68 -0.11 5.19 -0.14 0.25 0.14 119.74 122.19 3ktt s LYS 329 Ca -0.11 -0.52 -0.01 0.00 -1.36 0.00 0.00 55.97 53.98 3ktt s LYS 329 Cb 0.17 -2.43 0.03 0.00 -1.68 0.00 0.00 37.83 33.92 3ktt s LYS 329 CO 0.80 -0.67 -0.03 -0.51 -0.76 0.00 0.00 175.35 174.18 3ktt s LEU 330 N -4.81 0.96 -0.08 3.17 2.01 0.63 -4.46 118.68 116.10 3ktt s LEU 330 Ca 0.55 -0.30 -0.01 0.00 0.01 0.00 0.00 54.13 54.37 3ktt s LEU 330 Cb -0.10 -0.64 -0.03 0.00 0.01 0.00 0.00 46.19 45.42 3ktt s LEU 330 CO 0.40 -0.18 -0.02 -0.83 1.01 0.00 0.00 176.35 176.73 3ktt s GLY 331 N 1.84 1.81 -0.10 -3.19 0.00 -1.26 0.80 107.32 107.21 3ktt s GLY 331 Ca 0.04 -0.83 -0.00 0.00 0.00 0.00 0.00 44.72 43.93 3ktt s GLY 331 CO -0.07 -0.60 -0.07 -1.35 0.00 0.00 0.00 173.10 171.01 3ktt s SER 332 N -0.86 4.56 -0.51 1.64 1.04 -1.25 -4.74 113.70 113.57 3ktt s SER 332 Ca 0.13 -0.11 0.04 0.00 0.48 0.00 0.00 55.95 56.49 3ktt s SER 332 Cb -0.11 -1.39 0.13 0.00 0.10 0.00 0.00 66.02 64.75 3ktt s SER 332 CO 0.02 0.28 0.27 0.00 0.98 0.00 0.00 173.24 174.79 3ktt n LYS 334 N 3.13 0.53 0.00 0.00 0.00 -1.19 -4.57 118.16 116.05 3ktt n LYS 334 Ca 0.07 0.23 0.00 0.00 0.00 0.00 0.00 58.31 58.61 3ktt n LYS 334 Cb 0.33 -1.39 0.00 0.00 0.00 0.00 0.00 35.03 33.96 3ktt n LYS 334 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 3ktt n LEU 335 N -4.20 0.00 -4.06 3.14 7.94 -1.01 -4.28 117.00 114.54 3ktt n LEU 335 Ca -0.42 0.00 -0.32 0.00 -1.11 0.00 0.00 56.01 54.16 3ktt n LEU 335 Cb 0.77 0.00 -0.15 0.00 0.53 0.00 0.00 43.42 44.57 3ktt n LEU 335 CO 0.06 0.00 -0.47 -0.63 -1.11 0.00 0.00 177.39 175.25 3ktt s ILE 336 N 0.00 2.02 0.05 1.96 1.01 0.19 -1.75 121.20 124.68 3ktt s ILE 336 Ca 0.00 -1.41 0.02 0.00 0.00 0.00 0.00 60.65 59.26 3ktt s ILE 336 Cb 0.00 -2.09 -0.03 0.00 0.01 0.00 0.00 42.46 40.35 3ktt s ILE 336 CO 0.00 0.08 -0.07 -1.83 0.00 0.00 0.00 174.94 173.12 3ktt s GLU 337 N 1.20 0.56 -0.16 2.79 -1.05 -0.95 0.19 118.70 121.27 3ktt s GLU 337 Ca -0.06 -0.87 -0.18 0.00 -0.15 0.00 0.00 54.97 53.72 3ktt s GLU 337 Cb -0.18 -0.20 -0.04 0.00 -0.44 0.00 0.00 34.13 33.27 3ktt s GLU 337 CO -0.07 0.02 0.50 -2.00 0.95 0.00 0.00 175.26 174.65 3ktt s GLU 338 N -2.09 4.26 0.24 -4.83 2.12 -1.26 0.08 118.70 117.22 3ktt s GLU 338 Ca -0.06 0.42 0.05 0.00 0.36 0.00 0.00 54.97 55.74 3ktt s GLU 338 Cb -0.06 -3.51 -0.05 0.00 0.26 0.00 0.00 34.13 30.77 3ktt s GLU 338 CO -0.01 -0.01 -0.04 0.08 -0.54 0.00 0.00 175.26 174.74 3ktt s VAL 339 N 1.18 1.29 -0.24 3.70 1.01 0.05 -4.97 120.40 122.43 3ktt s VAL 339 Ca 0.25 -2.07 -0.09 0.00 0.00 0.00 0.00 61.98 60.06 3ktt s VAL 339 Cb -0.15 -2.32 -0.04 0.00 0.00 0.00 0.00 36.38 33.86 3ktt s VAL 339 CO 0.10 -0.36 0.12 -0.04 0.00 0.00 0.00 175.10 174.91 3ktt s MET 340 N -3.80 3.91 -0.40 2.72 1.00 -1.26 -1.66 119.30 119.81 3ktt s MET 340 Ca 0.27 -0.35 -0.14 0.00 0.00 0.00 0.00 55.69 55.47 3ktt s MET 340 Cb 0.04 -3.42 0.03 0.00 0.00 0.00 0.00 34.83 31.48 3ktt s MET 340 CO 0.09 0.00 0.28 0.42 0.00 0.00 0.00 175.02 175.81 3ktt s ILE 341 N 1.17 5.03 0.00 2.53 -1.09 -0.89 -4.77 121.20 123.18 3ktt s ILE 341 Ca 0.06 -0.77 0.00 0.00 -2.23 0.00 0.00 60.65 57.71 3ktt s ILE 341 Cb -0.14 -3.82 0.00 0.00 -1.58 0.00 0.00 42.46 36.92 3ktt s ILE 341 CO 0.05 -0.31 0.00 0.61 -1.23 0.00 0.00 174.94 174.05 3ktt n GLY 342 N 5.11 1.94 0.00 6.18 0.00 -1.26 -2.50 105.19 114.66 3ktt n GLY 342 Ca -0.11 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.72 3ktt n GLY 342 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3ktt n GLU 343 N 0.00 0.00 -1.94 1.61 4.07 -1.26 -5.09 120.64 118.03 3ktt n GLU 343 Ca 0.00 0.00 -0.37 0.00 -0.06 0.00 0.00 57.16 56.73 3ktt n GLU 343 Cb 0.00 0.00 0.03 0.00 -0.06 0.00 0.00 31.44 31.41 3ktt n GLU 343 CO 0.00 0.00 0.00 0.34 -0.06 0.00 0.00 177.13 177.41 3ktt s ASP 344 N -4.00 5.42 -0.13 4.31 2.15 -1.04 -4.88 116.67 118.50 3ktt s ASP 344 Ca 0.00 2.57 -0.16 0.00 0.43 0.00 0.00 52.55 55.40 3ktt s ASP 344 Cb 0.00 -2.62 -0.05 0.00 -0.30 0.00 0.00 42.92 39.96 3ktt s ASP 344 CO 0.00 -1.45 0.38 -0.54 -0.17 0.00 0.00 175.17 173.39 3ktt s LYS 345 N -2.97 4.25 0.34 4.34 1.02 -1.26 -2.10 119.74 123.36 3ktt s LYS 345 Ca 0.72 0.26 0.05 0.00 0.02 0.00 0.00 55.97 57.02 3ktt s LYS 345 Cb -0.35 -3.41 -0.07 0.00 -0.52 0.00 0.00 37.83 33.48 3ktt s LYS 345 CO 0.41 0.25 0.04 -0.51 -0.92 0.00 0.00 175.35 174.62 3ktt s LEU 346 N 0.39 2.36 -0.12 3.17 1.02 -0.66 -4.52 118.68 120.31 3ktt s LEU 346 Ca 0.21 -1.37 -0.00 0.00 0.02 0.00 0.00 54.13 52.99 3ktt s LEU 346 Cb -0.14 -0.52 -0.02 0.00 0.02 0.00 0.00 46.19 45.53 3ktt s LEU 346 CO 0.07 -0.56 -0.12 -0.51 0.02 0.00 0.00 176.35 175.25 3ktt s ILE 347 N -3.14 3.14 -0.22 -0.59 2.07 0.24 -0.77 121.20 121.93 3ktt s ILE 347 Ca 0.36 -0.63 -0.04 0.00 -1.41 0.00 0.00 60.65 58.92 3ktt s ILE 347 Cb 0.09 -2.32 -0.01 0.00 0.13 0.00 0.00 42.46 40.35 3ktt s ILE 347 CO 0.16 0.53 -0.03 -1.00 -1.91 0.00 0.00 174.94 172.69 3ktt s HIS 348 N 0.24 2.97 -0.34 3.50 3.76 0.11 -1.29 115.29 124.25 3ktt s HIS 348 Ca -0.08 -0.85 -0.14 0.00 -0.15 0.00 0.00 55.06 53.84 3ktt s HIS 348 Cb -0.15 -2.11 -0.01 0.00 1.11 0.00 0.00 32.58 31.41 3ktt s HIS 348 CO 0.05 -0.50 0.31 0.12 -0.85 0.00 0.00 174.74 173.86 3ktt s PHE 349 N 1.45 3.22 0.24 1.40 5.36 -0.04 -2.23 117.98 127.38 3ktt s PHE 349 Ca 0.05 -0.13 -0.02 0.00 -0.96 0.00 0.00 56.93 55.88 3ktt s PHE 349 Cb -0.14 -2.59 -0.03 0.00 -0.34 0.00 0.00 43.02 39.92 3ktt s PHE 349 CO -0.02 -0.41 0.23 -1.54 -1.46 0.00 0.00 175.22 172.02 3ktt s SER 350 N 1.73 0.40 -0.64 6.13 1.04 -0.72 -1.18 113.70 120.46 3ktt s SER 350 Ca 0.09 -1.38 0.00 0.00 0.48 0.00 0.00 55.95 55.14 3ktt s SER 350 Cb -0.17 0.46 0.00 0.00 0.10 0.00 0.00 66.02 66.41 3ktt s SER 350 CO 0.11 -0.96 0.00 0.61 0.98 0.00 0.00 173.24 173.98 3ktt n GLY 351 N -0.36 0.11 3.68 7.32 0.00 -1.26 -2.41 105.19 112.27 3ktt n GLY 351 Ca 0.02 -0.58 -0.44 0.00 0.00 0.00 0.00 46.02 45.02 3ktt n GLY 351 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3ktt n VAL 352 N -3.95 0.37 0.04 1.61 3.14 -1.26 -4.05 118.33 114.24 3ktt n VAL 352 Ca -0.09 -0.07 0.02 0.00 -2.96 0.00 0.00 64.34 61.25 3ktt n VAL 352 Cb 0.55 -2.01 0.37 0.00 -1.06 0.00 0.00 33.84 31.69 3ktt n VAL 352 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3ktt h ALA 353 N 8.41 1.52 0.21 1.55 0.00 -1.88 -3.21 119.26 125.86 3ktt h ALA 353 Ca -0.47 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.29 3ktt h ALA 353 Cb 1.24 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 3ktt h ALA 353 CO 0.94 0.35 -0.24 1.25 0.00 0.00 0.00 179.25 181.55 3ktt h LEU 354 N 0.42 -0.68 0.00 0.00 5.85 -1.85 -3.45 115.31 115.60 3ktt h LEU 354 Ca 0.10 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.87 3ktt h LEU 354 Cb 0.23 0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.48 3ktt h LEU 354 CO 0.00 -0.31 0.00 0.61 -0.34 0.00 0.00 178.44 178.40 3ktt n GLY 355 N -1.26 2.29 0.24 3.75 0.00 -1.22 -4.87 105.19 104.12 3ktt n GLY 355 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 3ktt n GLY 355 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3ktt h GLU 356 N 2.42 0.34 -5.80 1.61 4.57 -1.88 -3.43 114.58 112.42 3ktt h GLU 356 Ca 0.00 -0.09 -0.52 0.00 -1.18 0.00 0.00 59.36 57.56 3ktt h GLU 356 Cb 0.00 -0.04 -0.25 0.00 -0.16 0.00 0.00 28.75 28.30 3ktt h GLU 356 CO 0.00 0.50 -0.82 0.00 -1.18 0.00 0.00 179.01 177.51 3ktt s ALA 357 N -4.68 1.53 0.13 2.92 0.00 -1.26 -4.71 121.76 115.70 3ktt s ALA 357 Ca -0.06 -1.00 0.03 0.00 0.00 0.00 0.00 51.96 50.93 3ktt s ALA 357 Cb 0.15 -0.26 -0.01 0.00 0.00 0.00 0.00 23.12 23.00 3ktt s ALA 357 CO 0.75 0.32 0.12 0.00 0.00 0.00 0.00 175.76 176.95 3ktt s THR 359 N -2.54 0.21 -0.18 0.00 2.01 -0.78 -3.01 115.64 111.35 3ktt s THR 359 Ca 0.16 -1.82 0.00 0.00 0.31 0.00 0.00 61.69 60.35 3ktt s THR 359 Cb 0.01 -1.56 0.04 0.00 0.01 0.00 0.00 72.50 70.99 3ktt s THR 359 CO 0.11 -0.95 -0.09 -0.63 -0.69 0.00 0.00 174.62 172.37 3ktt s ILE 360 N -3.93 1.42 -0.42 1.82 1.01 -0.44 -0.27 121.20 120.40 3ktt s ILE 360 Ca 0.08 -0.82 -0.13 0.00 0.00 0.00 0.00 60.65 59.78 3ktt s ILE 360 Cb 0.08 -1.52 0.04 0.00 0.01 0.00 0.00 42.46 41.07 3ktt s ILE 360 CO -0.09 0.18 0.29 -0.69 0.00 0.00 0.00 174.94 174.63 3ktt s VAL 361 N 1.50 4.95 0.61 2.92 1.01 0.61 -1.98 120.40 130.03 3ktt s VAL 361 Ca 0.00 -0.89 -0.14 0.00 0.00 0.00 0.00 61.98 60.94 3ktt s VAL 361 Cb -0.16 -3.84 -0.03 0.00 0.00 0.00 0.00 36.38 32.36 3ktt s VAL 361 CO -0.08 -0.38 1.05 -0.76 0.00 0.00 0.00 175.10 174.93 3ktt s LEU 362 N 1.61 3.40 -0.02 3.92 1.43 0.35 -0.26 118.68 129.10 3ktt s LEU 362 Ca 0.04 1.71 0.02 0.00 -1.03 0.00 0.00 54.13 54.87 3ktt s LEU 362 Cb -0.21 -4.52 0.01 0.00 0.03 0.00 0.00 46.19 41.50 3ktt s LEU 362 CO 0.07 -1.15 -0.06 -0.13 0.23 0.00 0.00 176.35 175.31 3ktt s ARG 363 N -4.38 0.65 0.16 1.70 0.52 0.16 0.16 118.95 117.92 3ktt s ARG 363 Ca 0.61 -0.18 -0.15 0.00 -0.52 0.00 0.00 55.73 55.49 3ktt s ARG 363 Cb -0.14 -0.65 0.02 0.00 0.52 0.00 0.00 34.95 34.70 3ktt s ARG 363 CO 0.42 0.05 0.42 0.20 0.02 0.00 0.00 175.30 176.40 3ktt s GLY 364 N 0.30 -0.05 0.12 -3.53 0.00 0.30 -4.48 107.32 99.97 3ktt s GLY 364 Ca -0.04 -0.29 -0.20 0.00 0.00 0.00 0.00 44.72 44.19 3ktt s GLY 364 CO -0.00 -0.41 1.76 0.00 0.00 0.00 0.00 173.10 174.44 3ktt h ALA 365 N 2.35 0.27 0.00 3.20 0.00 -1.82 0.51 119.26 123.77 3ktt h ALA 365 Ca -0.32 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3ktt h ALA 365 Cb 1.25 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3ktt h ALA 365 CO 0.44 -0.24 0.00 0.25 0.00 0.00 0.00 179.25 179.70 3ktt n THR 366 N -4.92 0.00 -1.68 0.00 -2.24 -1.26 -4.38 114.28 99.79 3ktt n THR 366 Ca -0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 3ktt n THR 366 Cb 0.04 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.27 3ktt n THR 366 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ktt n GLN 367 N -1.25 -0.83 -0.22 -0.78 0.00 -1.26 -4.58 117.38 108.46 3ktt n GLN 367 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 57.00 56.95 3ktt n GLN 367 Cb 0.00 0.00 0.11 0.00 0.00 0.00 0.00 30.24 30.35 3ktt n GLN 367 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.06 177.43 3ktt h GLN 368 N 4.58 1.04 0.00 2.61 4.15 -1.98 1.07 115.11 126.58 3ktt h GLN 368 Ca 0.00 -0.21 -0.04 0.00 0.77 0.00 0.00 58.65 59.17 3ktt h GLN 368 Cb 0.00 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 27.53 3ktt h GLN 368 CO 0.00 0.89 -0.21 0.82 -1.93 0.00 0.00 178.83 178.40 3ktt h ILE 369 N 1.01 1.03 -0.28 2.39 2.04 -1.95 1.16 117.51 122.91 3ktt h ILE 369 Ca 0.22 -0.74 -0.08 0.00 1.00 0.00 0.00 64.86 65.27 3ktt h ILE 369 Cb 0.28 1.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 3ktt h ILE 369 CO -0.01 0.20 -0.16 0.25 0.00 0.00 0.00 178.15 178.43 3ktt h LEU 370 N 0.00 0.47 -1.10 1.44 5.85 0.18 0.81 115.31 122.97 3ktt h LEU 370 Ca -0.00 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.59 3ktt h LEU 370 Cb 0.39 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.30 3ktt h LEU 370 CO 0.03 0.66 0.00 0.44 -0.34 0.00 0.00 178.44 179.22 3ktt h ASP 371 N 0.44 0.00 0.35 1.25 3.32 0.80 0.83 116.42 123.41 3ktt h ASP 371 Ca 0.08 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.05 3ktt h ASP 371 Cb 0.54 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.08 3ktt h ASP 371 CO 0.03 0.00 -0.35 -0.08 -1.72 0.00 0.00 179.24 177.12 3ktt h GLU 372 N 0.00 0.01 -0.67 3.56 4.81 0.80 0.89 114.58 123.97 3ktt h GLU 372 Ca 0.00 -0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.25 3ktt h GLU 372 Cb 0.26 -0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.61 3ktt h GLU 372 CO 0.00 0.36 0.45 0.00 -0.73 0.00 0.00 179.01 179.09 3ktt h ALA 373 N 1.64 1.58 -0.53 2.92 0.00 0.12 1.06 119.26 126.04 3ktt h ALA 373 Ca -0.00 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 3ktt h ALA 373 Cb 0.63 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3ktt h ALA 373 CO 0.05 0.37 0.04 1.49 0.00 0.00 0.00 179.25 181.19 3ktt h GLU 374 N 0.85 0.87 -0.59 0.00 4.81 0.72 0.77 114.58 122.01 3ktt h GLU 374 Ca 0.26 -0.23 -0.05 0.00 -0.13 0.00 0.00 59.36 59.21 3ktt h GLU 374 Cb -0.01 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.24 3ktt h GLU 374 CO -0.07 0.84 0.18 -0.09 -0.73 0.00 0.00 179.01 179.15 3ktt h ARG 375 N 0.82 0.92 0.30 1.92 2.43 0.18 -3.35 114.38 117.60 3ktt h ARG 375 Ca 0.16 -0.20 -0.01 0.00 -0.81 0.00 0.00 59.98 59.12 3ktt h ARG 375 Cb 0.43 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.85 3ktt h ARG 375 CO 0.02 0.83 -0.15 1.03 -1.51 0.00 0.00 179.97 180.19 3ktt h SER 376 N 0.84 -0.34 -0.83 -3.80 0.87 0.23 -3.34 113.55 107.17 3ktt h SER 376 Ca 0.19 -0.19 -0.00 0.00 -1.23 0.00 0.00 61.79 60.55 3ktt h SER 376 Cb 0.29 0.09 -0.04 0.00 -0.44 0.00 0.00 62.40 62.30 3ktt h SER 376 CO -0.01 0.10 0.51 0.25 -0.53 0.00 0.00 176.83 177.16 3ktt h LEU 377 N -0.89 0.99 -0.86 2.23 5.85 0.36 -1.06 115.31 121.94 3ktt h LEU 377 Ca -0.04 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 3ktt h LEU 377 Cb 0.52 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.26 3ktt h LEU 377 CO 0.07 0.75 0.49 -0.74 -0.34 0.00 0.00 178.44 178.66 3ktt h HIS 378 N 1.15 1.16 -0.60 1.25 2.76 -1.72 -1.49 115.15 117.65 3ktt h HIS 378 Ca 0.30 -0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.45 3ktt h HIS 378 Cb -0.07 -0.37 -0.03 0.00 1.55 0.00 0.00 27.41 28.49 3ktt h HIS 378 CO 0.00 0.80 0.35 -0.44 -1.30 0.00 0.00 177.93 177.34 3ktt h ASP 379 N 1.19 0.72 -0.74 3.26 5.19 -1.33 -2.25 116.42 122.45 3ktt h ASP 379 Ca 0.30 -0.07 -0.05 0.00 -0.62 0.00 0.00 57.03 56.59 3ktt h ASP 379 Cb 0.00 -0.18 -0.03 0.00 0.18 0.00 0.00 39.33 39.30 3ktt h ASP 379 CO -0.05 0.58 0.26 0.00 -3.12 0.00 0.00 179.24 176.91 3ktt h ALA 380 N 1.18 1.04 -0.35 3.45 0.00 -0.92 -3.14 119.26 120.52 3ktt h ALA 380 Ca 0.21 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 3ktt h ALA 380 Cb -0.01 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 3ktt h ALA 380 CO -0.04 0.66 0.05 1.25 0.00 0.00 0.00 179.25 181.17 3ktt h LEU 381 N 1.11 0.56 -0.34 0.00 7.12 -0.70 -3.12 115.31 119.94 3ktt h LEU 381 Ca 0.25 -0.26 -0.08 0.00 0.13 0.00 0.00 57.88 57.92 3ktt h LEU 381 Cb 0.26 -0.15 -0.01 0.00 -0.53 0.00 0.00 40.66 40.23 3ktt h LEU 381 CO -0.01 0.68 -0.08 0.00 -0.13 0.00 0.00 178.44 178.90 3ktt h VAL 383 N 0.44 1.19 -0.74 0.00 2.07 -1.59 -1.21 116.25 116.41 3ktt h VAL 383 Ca 0.09 -0.52 -0.03 0.00 0.82 0.00 0.00 66.70 67.06 3ktt h VAL 383 Cb 0.58 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 3ktt h VAL 383 CO 0.03 0.21 0.35 -0.07 0.02 0.00 0.00 177.57 178.12 3ktt h LEU 384 N 0.69 0.97 -0.70 2.57 -0.00 -1.53 0.32 115.31 117.63 3ktt h LEU 384 Ca 0.18 -0.14 -0.02 0.00 -0.00 0.00 0.00 57.88 57.90 3ktt h LEU 384 Cb 0.10 -0.25 -0.03 0.00 -0.00 0.00 0.00 40.66 40.47 3ktt h LEU 384 CO -0.02 0.84 0.37 0.00 -0.00 0.00 0.00 178.44 179.62 3ktt h ALA 385 N 1.18 0.90 -0.63 1.53 0.00 -1.19 -0.55 119.26 120.50 3ktt h ALA 385 Ca 0.25 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 3ktt h ALA 385 Cb 0.12 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3ktt h ALA 385 CO -0.03 0.43 0.09 1.96 0.00 0.00 0.00 179.25 181.71 3ktt h GLN 386 N 0.97 1.05 -0.61 0.00 1.08 -0.46 -1.48 115.11 115.66 3ktt h GLN 386 Ca 0.24 -0.29 -0.02 0.00 -1.45 0.00 0.00 58.65 57.14 3ktt h GLN 386 Cb 0.07 -0.12 -0.03 0.00 -0.05 0.00 0.00 27.48 27.35 3ktt h GLN 386 CO -0.04 0.98 0.30 1.15 -0.95 0.00 0.00 178.83 180.28 3ktt h THR 387 N 0.96 1.21 -0.46 -0.54 2.02 -0.26 0.71 112.91 116.55 3ktt h THR 387 Ca 0.19 -0.57 -0.03 0.00 0.77 0.00 0.00 66.41 66.77 3ktt h THR 387 Cb 0.44 0.47 -0.02 0.00 -1.74 0.00 0.00 68.15 67.31 3ktt h THR 387 CO 0.01 0.24 0.17 1.62 0.37 0.00 0.00 175.52 177.93 3ktt h VAL 388 N 0.83 1.21 -0.32 3.16 3.04 -0.88 -3.02 116.25 120.26 3ktt h VAL 388 Ca 0.21 -0.68 -0.09 0.00 -1.01 0.00 0.00 66.70 65.13 3ktt h VAL 388 Cb 0.10 0.80 -0.01 0.00 -2.01 0.00 0.00 31.29 30.17 3ktt h VAL 388 CO -0.03 0.25 -0.15 0.11 -1.01 0.00 0.00 177.57 176.74 3ktt h LYS 389 N 0.60 0.67 -0.67 4.17 1.79 -0.73 -3.29 116.57 119.11 3ktt h LYS 389 Ca 0.15 -0.29 -0.08 0.00 -2.18 0.00 0.00 60.65 58.25 3ktt h LYS 389 Cb 0.22 -0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 30.83 3ktt h LYS 389 CO -0.01 0.88 0.10 0.38 -1.08 0.00 0.00 179.45 179.72 3ktt h ASP 390 N 0.43 1.06 -2.00 0.86 3.04 -0.87 -3.45 116.42 115.49 3ktt h ASP 390 Ca 0.07 -0.26 -0.42 0.00 -3.24 0.00 0.00 57.03 53.18 3ktt h ASP 390 Cb 0.68 -0.28 -0.09 0.00 -1.04 0.00 0.00 39.33 38.59 3ktt h ASP 390 CO 0.05 1.06 -0.46 -0.24 -2.04 0.00 0.00 179.24 177.60 3ktt n SER 391 N -4.21 -5.73 -3.71 4.15 2.88 -1.15 -4.95 113.62 100.91 3ktt n SER 391 Ca 0.04 0.25 -0.14 0.00 -1.33 0.00 0.00 58.87 57.69 3ktt n SER 391 Cb 0.30 -4.90 -0.09 0.00 -0.75 0.00 0.00 64.21 58.78 3ktt n SER 391 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 3ktt s ARG 392 N -4.41 0.69 0.00 -1.46 0.52 -1.26 -4.81 118.95 108.22 3ktt s ARG 392 Ca 0.00 0.12 0.00 0.00 -0.52 0.00 0.00 55.73 55.33 3ktt s ARG 392 Cb 0.00 0.32 0.00 0.00 0.52 0.00 0.00 34.95 35.79 3ktt s ARG 392 CO 0.00 -0.17 0.00 0.25 0.02 0.00 0.00 175.30 175.40 3ktt n THR 393 N 1.68 0.00 -3.64 0.02 -2.24 -1.25 -2.43 114.28 106.42 3ktt n THR 393 Ca -0.19 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.56 3ktt n THR 393 Cb 0.56 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.78 3ktt n THR 393 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 3ktt s VAL 394 N 0.86 0.00 -0.06 2.28 -7.23 0.26 -3.49 120.40 113.03 3ktt s VAL 394 Ca 0.00 -0.29 -0.28 0.00 -1.81 0.00 0.00 61.98 59.60 3ktt s VAL 394 Cb 0.00 -1.63 -0.02 0.00 0.56 0.00 0.00 36.38 35.29 3ktt s VAL 394 CO 0.00 0.00 0.93 -0.31 -0.31 0.00 0.00 175.10 175.41 3ktt s TYR 395 N -2.86 3.58 0.00 2.82 2.02 -1.26 -0.00 117.35 121.65 3ktt s TYR 395 Ca 0.11 1.56 0.00 0.00 -0.37 0.00 0.00 57.07 58.36 3ktt s TYR 395 Cb 0.01 -3.08 0.00 0.00 -0.40 0.00 0.00 41.96 38.48 3ktt s TYR 395 CO -0.03 -0.08 0.00 0.41 -1.57 0.00 0.00 175.55 174.28 3ktt n GLY 396 N 3.04 0.76 2.18 0.71 0.00 0.38 -2.78 105.19 109.47 3ktt n GLY 396 Ca 0.06 -1.94 -0.08 0.00 0.00 0.00 0.00 46.02 44.06 3ktt n GLY 396 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ktt n GLY 397 N 5.00 0.44 2.91 -0.02 0.00 -1.26 -2.99 105.19 109.27 3ktt n GLY 397 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.63 3ktt n GLY 397 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ktt n GLY 398 N -0.99 1.72 0.16 -0.02 0.00 -1.26 0.14 105.19 104.94 3ktt n GLY 398 Ca -0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 3ktt n GLY 398 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ktt h SER 400 N -0.47 0.44 -0.50 0.00 0.02 -1.79 -1.08 113.55 110.17 3ktt h SER 400 Ca -0.03 -0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.88 3ktt h SER 400 Cb 0.36 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.78 3ktt h SER 400 CO 0.05 0.32 0.16 -0.33 -1.14 0.00 0.00 176.83 175.89 3ktt h GLU 401 N 0.53 0.76 -0.73 3.45 3.07 -1.87 -0.13 114.58 119.66 3ktt h GLU 401 Ca 0.16 -0.16 -0.05 0.00 -0.50 0.00 0.00 59.36 58.81 3ktt h GLU 401 Cb -0.03 -0.11 -0.03 0.00 -0.84 0.00 0.00 28.75 27.74 3ktt h GLU 401 CO -0.06 0.71 0.26 1.98 -1.40 0.00 0.00 179.01 180.51 3ktt h MET 402 N 0.67 1.12 -0.44 2.33 4.05 -0.43 0.31 114.93 122.54 3ktt h MET 402 Ca 0.16 -0.22 -0.03 0.00 -0.28 0.00 0.00 59.70 59.32 3ktt h MET 402 Cb 0.26 -0.17 -0.02 0.00 -0.80 0.00 0.00 31.60 30.87 3ktt h MET 402 CO -0.01 0.94 0.14 1.25 0.23 0.00 0.00 176.91 179.46 3ktt h LEU 403 N 1.07 0.64 -0.91 3.39 5.85 -0.73 -0.83 115.31 123.79 3ktt h LEU 403 Ca 0.24 -0.20 -0.07 0.00 0.84 0.00 0.00 57.88 58.69 3ktt h LEU 403 Cb 0.26 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 3ktt h LEU 403 CO -0.01 0.67 0.05 -0.03 -0.34 0.00 0.00 178.44 178.78 3ktt h MET 404 N 0.58 0.85 -0.76 1.25 4.05 -0.21 -0.16 114.93 120.53 3ktt h MET 404 Ca 0.14 -0.22 -0.02 0.00 -0.28 0.00 0.00 59.70 59.33 3ktt h MET 404 Cb 0.26 -0.11 -0.04 0.00 -0.80 0.00 0.00 31.60 30.91 3ktt h MET 404 CO -0.01 0.82 0.41 0.00 0.23 0.00 0.00 176.91 178.37 3ktt h ALA 405 N 1.25 0.97 -0.14 0.39 0.00 0.12 0.66 119.26 122.51 3ktt h ALA 405 Ca 0.16 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3ktt h ALA 405 Cb 0.41 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3ktt h ALA 405 CO 0.01 0.49 0.04 1.25 0.00 0.00 0.00 179.25 181.04 3ktt h HIS 406 N 1.05 0.23 -0.49 0.00 6.17 -0.05 -1.33 115.15 120.72 3ktt h HIS 406 Ca 0.27 -0.02 -0.05 0.00 0.71 0.00 0.00 60.37 61.27 3ktt h HIS 406 Cb 0.04 -0.06 -0.02 0.00 2.52 0.00 0.00 27.41 29.89 3ktt h HIS 406 CO 0.00 0.35 0.12 0.00 0.71 0.00 0.00 177.93 179.11 3ktt h ALA 407 N 0.85 0.65 -0.46 5.26 0.00 -0.61 -2.85 119.26 122.09 3ktt h ALA 407 Ca 0.04 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 3ktt h ALA 407 Cb 0.24 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 3ktt h ALA 407 CO -0.00 0.35 0.12 -0.39 0.00 0.00 0.00 179.25 179.32 3ktt h VAL 408 N 0.68 1.20 -0.40 0.00 -1.51 0.44 -1.49 116.25 115.18 3ktt h VAL 408 Ca 0.15 -0.71 0.03 0.00 -1.23 0.00 0.00 66.70 64.95 3ktt h VAL 408 Cb 0.34 0.72 -0.02 0.00 -2.13 0.00 0.00 31.29 30.20 3ktt h VAL 408 CO 0.00 0.26 0.27 0.00 -1.23 0.00 0.00 177.57 176.87 3ktt h THR 409 N 0.67 1.03 -0.25 7.19 1.03 -0.99 0.69 112.91 122.28 3ktt h THR 409 Ca 0.15 -0.15 -0.03 0.00 -0.01 0.00 0.00 66.41 66.37 3ktt h THR 409 Cb 0.24 0.56 -0.01 0.00 -1.07 0.00 0.00 68.15 67.87 3ktt h THR 409 CO -0.00 0.08 0.01 1.56 -0.01 0.00 0.00 175.52 177.16 3ktt h GLN 410 N 0.43 0.37 -0.71 0.00 4.20 -1.29 -3.32 115.11 114.79 3ktt h GLN 410 Ca 0.16 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.79 3ktt h GLN 410 Cb 0.11 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 27.79 3ktt h GLN 410 CO -0.04 0.39 0.37 -0.07 -0.67 0.00 0.00 178.83 178.81 3ktt h LEU 411 N 0.37 0.91 -0.27 1.46 3.38 0.41 -2.24 115.31 119.33 3ktt h LEU 411 Ca 0.08 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 3ktt h LEU 411 Cb 0.23 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3ktt h LEU 411 CO 0.00 0.76 0.10 0.00 0.09 0.00 0.00 178.44 179.40 3ktt h ALA 412 N 1.18 0.35 0.00 1.53 0.00 -1.66 0.16 119.26 120.82 3ktt h ALA 412 Ca 0.25 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 3ktt h ALA 412 Cb 0.08 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3ktt h ALA 412 CO -0.04 -0.04 -0.52 1.03 0.00 0.00 0.00 179.25 179.69 3ktt h SER 413 N 0.28 0.00 -0.62 0.00 0.87 -1.78 0.14 113.55 112.44 3ktt h SER 413 Ca 0.09 0.00 0.05 0.00 -1.23 0.00 0.00 61.79 60.70 3ktt h SER 413 Cb 0.21 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.13 3ktt h SER 413 CO -0.01 0.52 0.41 -0.09 -0.53 0.00 0.00 176.83 177.13 3ktt h ARG 414 N 0.00 0.64 -7.04 2.24 9.65 -0.75 -3.39 114.38 115.73 3ktt h ARG 414 Ca -0.01 -0.04 -0.45 0.00 -1.10 0.00 0.00 59.98 58.39 3ktt h ARG 414 Cb 1.10 -0.14 0.06 0.00 -1.39 0.00 0.00 29.97 29.60 3ktt h ARG 414 CO 0.07 0.42 0.08 0.95 2.80 0.00 0.00 179.97 184.29 3ktt s THR 415 N -5.58 2.48 0.29 0.20 -4.23 0.49 -5.06 115.64 104.22 3ktt s THR 415 Ca -0.09 -0.50 -0.05 0.00 -1.18 0.00 0.00 61.69 59.87 3ktt s THR 415 Cb 0.19 -2.98 0.07 0.00 1.34 0.00 0.00 72.50 71.12 3ktt s THR 415 CO 0.76 0.00 0.28 -2.65 -0.54 0.00 0.00 174.62 172.47 3ktt n PRO 416 N -2.61 -1.31 0.15 3.99 -0.02 -1.25 -4.31 135.00 129.64 3ktt n PRO 416 Ca 0.08 -0.45 -0.14 0.00 -2.02 0.00 0.00 63.50 60.97 3ktt n PRO 416 Cb 0.60 -0.39 -0.08 0.00 -0.02 0.00 0.00 33.50 33.61 3ktt n PRO 416 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3ktt h GLY 417 N -0.94 -0.33 0.68 -1.23 0.00 -1.93 0.90 103.07 100.23 3ktt h GLY 417 Ca -0.10 0.12 -0.01 0.00 0.00 0.00 0.00 47.33 47.34 3ktt h GLY 417 CO 0.07 -0.12 -0.00 0.50 0.00 0.00 0.00 176.54 176.98 3ktt h LYS 418 N -0.41 0.07 -0.15 4.80 1.79 -1.96 -3.00 116.57 117.70 3ktt h LYS 418 Ca -0.03 -0.02 -0.06 0.00 -2.18 0.00 0.00 60.65 58.35 3ktt h LYS 418 Cb 0.31 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.95 3ktt h LYS 418 CO 0.05 0.39 -0.19 0.93 -1.08 0.00 0.00 179.45 179.55 3ktt h GLU 419 N -0.26 0.25 -0.48 3.15 3.07 -1.90 -2.45 114.58 115.97 3ktt h GLU 419 Ca 0.01 -0.07 -0.00 0.00 -0.50 0.00 0.00 59.36 58.79 3ktt h GLU 419 Cb 0.36 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 28.22 3ktt h GLU 419 CO 0.00 0.45 0.28 0.00 -1.40 0.00 0.00 179.01 178.34 3ktt h ALA 420 N 1.57 0.61 -0.71 3.43 0.00 0.97 0.24 119.26 125.38 3ktt h ALA 420 Ca 0.04 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3ktt h ALA 420 Cb 0.48 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 3ktt h ALA 420 CO 0.03 0.11 0.43 0.28 0.00 0.00 0.00 179.25 180.10 3ktt h VAL 421 N 0.64 1.20 -0.20 0.00 2.07 -1.32 0.55 116.25 119.19 3ktt h VAL 421 Ca 0.17 -0.44 -0.04 0.00 0.82 0.00 0.00 66.70 67.21 3ktt h VAL 421 Cb 0.01 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 29.98 3ktt h VAL 421 CO -0.03 0.21 -0.05 0.00 0.02 0.00 0.00 177.57 177.72 3ktt h ALA 422 N 1.23 0.28 -0.32 1.67 0.00 -1.39 -1.72 119.26 119.01 3ktt h ALA 422 Ca 0.25 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 3ktt h ALA 422 Cb -0.04 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3ktt h ALA 422 CO -0.05 0.05 -0.14 1.98 0.00 0.00 0.00 179.25 181.10 3ktt h MET 423 N 0.11 0.56 -0.39 0.00 -1.53 -0.33 -1.70 114.93 111.65 3ktt h MET 423 Ca 0.05 -0.17 -0.14 0.00 -3.44 0.00 0.00 59.70 56.00 3ktt h MET 423 Cb 0.50 -0.05 -0.01 0.00 -0.55 0.00 0.00 31.60 31.48 3ktt h MET 423 CO 0.02 0.68 -0.30 1.05 0.14 0.00 0.00 176.91 178.50 3ktt h GLU 424 N 0.51 0.85 -0.53 0.39 4.11 0.16 -2.28 114.58 117.79 3ktt h GLU 424 Ca 0.09 -0.39 -0.03 0.00 0.07 0.00 0.00 59.36 59.10 3ktt h GLU 424 Cb 0.54 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.75 3ktt h GLU 424 CO 0.03 1.03 0.21 0.66 0.07 0.00 0.00 179.01 181.01 3ktt h SER 425 N 0.72 0.69 -0.49 3.06 4.64 -0.46 -0.55 113.55 121.15 3ktt h SER 425 Ca 0.08 -0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 3ktt h SER 425 Cb 0.85 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.74 3ktt h SER 425 CO 0.07 0.63 0.28 0.22 -0.87 0.00 0.00 176.83 177.16 3ktt h TYR 426 N 0.75 0.66 -0.50 4.77 5.03 -0.94 -2.22 116.97 124.52 3ktt h TYR 426 Ca 0.18 -0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.46 3ktt h TYR 426 Cb 0.16 -0.21 -0.02 0.00 1.55 0.00 0.00 36.73 38.20 3ktt h TYR 426 CO 0.01 0.47 0.23 0.00 -1.32 0.00 0.00 178.16 177.55 3ktt h ALA 427 N 1.13 0.64 -0.30 1.82 0.00 -0.63 -2.30 119.26 119.62 3ktt h ALA 427 Ca 0.17 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3ktt h ALA 427 Cb 0.02 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3ktt h ALA 427 CO -0.03 0.22 0.05 1.57 0.00 0.00 0.00 179.25 181.05 3ktt h LYS 428 N 0.66 0.43 -0.23 0.00 2.10 -0.88 0.20 116.57 118.85 3ktt h LYS 428 Ca 0.17 -0.07 0.07 0.00 -2.00 0.00 0.00 60.65 58.82 3ktt h LYS 428 Cb 0.14 -0.08 -0.01 0.00 -0.90 0.00 0.00 32.23 31.39 3ktt h LYS 428 CO -0.02 0.43 0.17 0.00 -2.00 0.00 0.00 179.45 178.03 3ktt h ALA 429 N 1.63 2.22 -0.08 0.07 0.00 -0.81 0.36 119.26 122.65 3ktt h ALA 429 Ca 0.10 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.02 3ktt h ALA 429 Cb 0.21 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 3ktt h ALA 429 CO 0.00 -0.29 0.06 -0.07 0.00 0.00 0.00 179.25 178.95 3ktt h LEU 430 N 0.00 0.01 -1.54 0.00 -0.00 -0.55 -3.09 115.31 110.14 3ktt h LEU 430 Ca 0.11 -0.00 0.01 0.00 -0.00 0.00 0.00 57.88 58.00 3ktt h LEU 430 Cb 0.44 -0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.08 3ktt h LEU 430 CO -0.00 0.00 0.31 -0.09 -0.00 0.00 0.00 178.44 178.67 3ktt h ARG 431 N 0.01 0.62 -0.65 1.13 9.65 -0.38 -3.19 114.38 121.57 3ktt h ARG 431 Ca 0.04 -0.04 -0.01 0.00 -1.10 0.00 0.00 59.98 58.87 3ktt h ARG 431 Cb 0.15 -0.14 -0.03 0.00 -1.39 0.00 0.00 29.97 28.56 3ktt h ARG 431 CO -0.00 0.41 0.37 1.98 2.80 0.00 0.00 179.97 185.53 3ktt h MET 432 N 0.63 0.88 -0.65 0.20 4.05 -1.70 -2.39 114.93 115.96 3ktt h MET 432 Ca 0.17 -0.08 0.02 0.00 -0.28 0.00 0.00 59.70 59.53 3ktt h MET 432 Cb -0.06 -0.18 -0.03 0.00 -0.80 0.00 0.00 31.60 30.52 3ktt h MET 432 CO -0.04 0.64 0.43 -0.07 0.23 0.00 0.00 176.91 178.09 3ktt h LEU 433 N 0.89 0.71 -1.19 3.39 4.07 -1.79 0.76 115.31 122.15 3ktt h LEU 433 Ca 0.23 -0.01 -0.08 0.00 0.08 0.00 0.00 57.88 58.10 3ktt h LEU 433 Cb -0.00 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 41.55 3ktt h LEU 433 CO -0.04 0.50 -0.27 -0.65 -1.08 0.00 0.00 178.44 176.90 3ktt h PRO 434 N 0.83 0.21 -0.30 1.13 0.11 -1.63 -2.87 132.00 129.49 3ktt h PRO 434 Ca 0.24 -0.07 -0.08 0.00 0.11 0.00 0.00 66.00 66.20 3ktt h PRO 434 Cb -0.03 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.05 3ktt h PRO 434 CO -0.06 0.48 -0.13 1.15 -0.21 0.00 0.00 178.00 179.23 3ktt h THR 435 N 0.19 1.29 0.04 -1.15 2.02 0.43 -3.26 112.91 112.48 3ktt h THR 435 Ca 0.03 -1.22 -0.00 0.00 0.77 0.00 0.00 66.41 65.98 3ktt h THR 435 Cb 0.59 1.46 0.00 0.00 -1.74 0.00 0.00 68.15 68.46 3ktt h THR 435 CO 0.04 0.39 -0.02 -0.29 0.37 0.00 0.00 175.52 176.01 3ktt h ILE 436 N 0.37 1.23 -0.57 3.11 2.10 -0.56 -0.89 117.51 122.31 3ktt h ILE 436 Ca 0.07 -0.90 -0.01 0.00 1.08 0.00 0.00 64.86 65.10 3ktt h ILE 436 Cb 0.65 1.83 -0.03 0.00 -1.09 0.00 0.00 36.82 38.18 3ktt h ILE 436 CO 0.04 0.23 0.33 0.40 -1.08 0.00 0.00 178.15 178.07 3ktt h ILE 437 N -0.45 1.18 -0.35 2.19 1.08 -1.64 0.12 117.51 119.63 3ktt h ILE 437 Ca -0.01 -0.42 -0.06 0.00 -0.39 0.00 0.00 64.86 63.99 3ktt h ILE 437 Cb 0.41 0.42 -0.02 0.00 -3.07 0.00 0.00 36.82 34.57 3ktt h ILE 437 CO 0.01 0.18 -0.02 0.00 -0.69 0.00 0.00 178.15 177.63 3ktt h ALA 438 N 1.16 1.32 -0.36 1.87 0.00 -1.59 -2.16 119.26 119.49 3ktt h ALA 438 Ca 0.20 -0.22 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 3ktt h ALA 438 Cb 0.01 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3ktt h ALA 438 CO -0.04 0.46 -0.33 0.22 0.00 0.00 0.00 179.25 179.57 3ktt h ASP 439 N 0.52 0.86 0.24 0.00 3.58 0.55 0.33 116.42 122.50 3ktt h ASP 439 Ca 0.11 -0.36 -0.04 0.00 0.42 0.00 0.00 57.03 57.16 3ktt h ASP 439 Cb 0.37 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 41.17 3ktt h ASP 439 CO 0.01 1.11 -0.17 -0.55 -2.88 0.00 0.00 179.24 176.76 3ktt h ASN 440 N 0.69 0.00 -0.63 2.28 7.08 -0.45 -2.84 115.58 121.71 3ktt h ASN 440 Ca 0.07 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.30 3ktt h ASN 440 Cb 0.88 0.00 -0.03 0.00 -2.08 0.00 0.00 38.32 37.09 3ktt h ASN 440 CO 0.08 0.17 0.41 0.00 -2.08 0.00 0.00 177.43 176.01 3ktt h ALA 441 N 1.83 0.80 0.00 4.14 0.00 -0.31 -3.43 119.26 122.28 3ktt h ALA 441 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3ktt h ALA 441 Cb 0.34 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3ktt h ALA 441 CO 0.02 0.24 0.00 0.41 0.00 0.00 0.00 179.25 179.92 3ktt n GLY 442 N -1.25 1.17 3.81 0.00 0.00 -1.04 -5.03 105.19 102.84 3ktt n GLY 442 Ca 0.05 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.85 3ktt n GLY 442 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ktt s TYR 443 N -2.00 3.03 0.15 1.61 1.51 -1.20 -5.05 117.35 115.40 3ktt s TYR 443 Ca 0.00 -0.15 -0.31 0.00 -1.01 0.00 0.00 57.07 55.61 3ktt s TYR 443 Cb 0.00 -1.42 -0.08 0.00 -0.11 0.00 0.00 41.96 40.35 3ktt s TYR 443 CO 0.00 0.49 1.35 0.34 -1.11 0.00 0.00 175.55 176.62 3ktt s ASP 444 N -3.84 6.86 0.04 2.29 -1.08 -1.26 -4.61 116.67 115.08 3ktt s ASP 444 Ca 0.34 2.35 -0.17 0.00 -0.52 0.00 0.00 52.55 54.54 3ktt s ASP 444 Cb -0.07 -2.60 -0.20 0.00 -1.46 0.00 0.00 42.92 38.59 3ktt s ASP 444 CO 0.24 -0.60 1.19 0.28 0.52 0.00 0.00 175.17 176.81 3ktt h SER 445 N 6.20 0.69 -0.62 -0.34 0.02 -1.91 -3.05 113.55 114.55 3ktt h SER 445 Ca -0.43 -0.69 -0.00 0.00 -0.84 0.00 0.00 61.79 59.82 3ktt h SER 445 Cb 1.21 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 63.52 3ktt h SER 445 CO 0.82 1.28 0.37 0.00 -1.14 0.00 0.00 176.83 178.16 3ktt h ALA 446 N 0.42 0.79 -0.23 3.77 0.00 -1.97 0.72 119.26 122.77 3ktt h ALA 446 Ca -0.06 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 3ktt h ALA 446 Cb 1.32 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 3ktt h ALA 446 CO 0.13 0.27 -0.05 0.22 0.00 0.00 0.00 179.25 179.82 3ktt h ASP 447 N 0.84 0.33 -0.59 0.00 3.58 -1.99 -2.41 116.42 116.17 3ktt h ASP 447 Ca 0.22 -0.06 0.01 0.00 0.42 0.00 0.00 57.03 57.62 3ktt h ASP 447 Cb -0.01 -0.08 -0.03 0.00 1.72 0.00 0.00 39.33 40.92 3ktt h ASP 447 CO -0.04 0.43 0.39 0.25 -2.88 0.00 0.00 179.24 177.38 3ktt h LEU 448 N 0.34 0.67 -0.25 2.28 7.12 0.50 -1.56 115.31 124.42 3ktt h LEU 448 Ca 0.07 -0.01 -0.01 0.00 0.13 0.00 0.00 57.88 58.06 3ktt h LEU 448 Cb 0.31 -0.16 -0.01 0.00 -0.53 0.00 0.00 40.66 40.27 3ktt h LEU 448 CO 0.01 0.48 0.12 0.58 -0.13 0.00 0.00 178.44 179.51 3ktt h VAL 449 N 0.79 1.14 -0.16 1.05 2.07 -0.59 -2.54 116.25 118.02 3ktt h VAL 449 Ca 0.22 -0.39 -0.01 0.00 0.82 0.00 0.00 66.70 67.34 3ktt h VAL 449 Cb -0.08 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 3ktt h VAL 449 CO -0.06 0.14 0.07 0.00 0.02 0.00 0.00 177.57 177.74 3ktt h ALA 450 N 0.99 0.20 -0.43 1.67 0.00 -1.25 0.16 119.26 120.59 3ktt h ALA 450 Ca 0.08 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 3ktt h ALA 450 Cb 0.11 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3ktt h ALA 450 CO -0.01 -0.23 -0.06 -0.56 0.00 0.00 0.00 179.25 178.40 3ktt h GLN 451 N 0.11 0.80 -0.64 0.00 3.07 -1.31 -2.12 115.11 115.03 3ktt h GLN 451 Ca 0.05 -0.28 -0.08 0.00 0.09 0.00 0.00 58.65 58.43 3ktt h GLN 451 Cb 0.14 -0.06 -0.03 0.00 0.08 0.00 0.00 27.48 27.61 3ktt h GLN 451 CO -0.01 0.90 0.10 1.25 0.09 0.00 0.00 178.83 181.16 3ktt h LEU 452 N 0.64 1.01 -0.92 0.06 5.85 -1.25 -1.10 115.31 119.59 3ktt h LEU 452 Ca 0.12 -0.23 -0.08 0.00 0.84 0.00 0.00 57.88 58.53 3ktt h LEU 452 Cb 0.57 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 3ktt h LEU 452 CO 0.03 1.00 -0.03 0.03 -0.34 0.00 0.00 178.44 179.13 3ktt h ARG 453 N 0.99 0.76 -0.18 1.25 3.08 -0.45 -2.04 114.38 117.78 3ktt h ARG 453 Ca 0.20 -0.21 -0.03 0.00 0.07 0.00 0.00 59.98 60.00 3ktt h ARG 453 Cb 0.43 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 3ktt h ARG 453 CO 0.01 0.79 -0.01 0.00 -1.07 0.00 0.00 179.97 179.69 3ktt h ALA 454 N 1.26 0.24 -0.53 0.04 0.00 -0.61 -1.45 119.26 118.22 3ktt h ALA 454 Ca 0.13 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 3ktt h ALA 454 Cb 0.48 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3ktt h ALA 454 CO 0.02 -0.04 0.17 0.00 0.00 0.00 0.00 179.25 179.41 3ktt h ALA 455 N 0.77 0.69 -0.39 0.00 0.00 -1.07 -2.38 119.26 116.88 3ktt h ALA 455 Ca 0.05 -0.19 -0.12 0.00 0.00 0.00 0.00 54.91 54.65 3ktt h ALA 455 Cb 0.40 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3ktt h ALA 455 CO 0.01 0.35 -0.22 0.45 0.00 0.00 0.00 179.25 179.83 3ktt h HIS 456 N 0.73 0.97 0.00 0.00 -0.00 -1.41 -2.27 115.15 113.17 3ktt h HIS 456 Ca 0.17 -0.25 -0.00 0.00 -0.00 0.00 0.00 60.37 60.29 3ktt h HIS 456 Cb 0.27 -0.22 -0.00 0.00 -0.00 0.00 0.00 27.41 27.46 3ktt h HIS 456 CO 0.01 1.02 -0.02 0.77 -0.00 0.00 0.00 177.93 179.71 3ktt h SER 457 N 0.64 0.00 -0.44 2.45 0.02 -1.01 0.62 113.55 115.83 3ktt h SER 457 Ca 0.08 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.00 3ktt h SER 457 Cb 0.79 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.30 3ktt h SER 457 CO 0.06 0.02 0.19 -0.08 -1.14 0.00 0.00 176.83 175.89 3ktt h GLU 458 N 0.00 0.70 0.00 3.45 4.57 -0.89 -3.46 114.58 118.96 3ktt h GLU 458 Ca -0.00 -0.10 0.00 0.00 -1.18 0.00 0.00 59.36 58.08 3ktt h GLU 458 Cb 0.10 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 28.56 3ktt h GLU 458 CO 0.00 0.58 0.00 0.41 -1.18 0.00 0.00 179.01 178.83 3ktt n GLY 459 N -1.10 0.48 3.56 1.92 0.00 0.22 -4.97 105.19 105.29 3ktt n GLY 459 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 3ktt n GLY 459 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ktt s LYS 460 N -0.85 2.92 0.25 1.61 1.02 -1.23 -4.72 119.74 118.73 3ktt s LYS 460 Ca 0.00 -0.31 -0.04 0.00 0.02 0.00 0.00 55.97 55.64 3ktt s LYS 460 Cb 0.00 -4.88 0.29 0.00 -0.52 0.00 0.00 37.83 32.72 3ktt s LYS 460 CO 0.00 -2.79 1.83 1.79 -0.92 0.00 0.00 175.35 175.27 3ktt h THR 461 N 6.91 1.24 0.00 2.17 1.35 -1.87 -2.89 112.91 119.82 3ktt h THR 461 Ca -0.00 -0.73 -0.01 0.00 -0.55 0.00 0.00 66.41 65.12 3ktt h THR 461 Cb 1.04 0.34 -0.00 0.00 -1.73 0.00 0.00 68.15 67.81 3ktt h THR 461 CO 1.28 0.30 -0.06 0.71 -0.25 0.00 0.00 175.52 177.50 3ktt h THR 462 N 1.05 0.91 -3.49 6.82 1.35 -1.94 -3.43 112.91 114.18 3ktt h THR 462 Ca 0.25 -0.21 -0.53 0.00 -0.55 0.00 0.00 66.41 65.36 3ktt h THR 462 Cb 0.16 1.12 0.09 0.00 -1.73 0.00 0.00 68.15 67.79 3ktt h THR 462 CO -0.03 0.06 0.87 0.00 -0.25 0.00 0.00 175.52 176.17 3ktt s ALA 463 N -4.80 3.71 0.15 6.62 0.00 -1.09 -0.79 121.76 125.56 3ktt s ALA 463 Ca -0.05 1.59 0.04 0.00 0.00 0.00 0.00 51.96 53.54 3ktt s ALA 463 Cb 0.16 -3.65 -0.01 0.00 0.00 0.00 0.00 23.12 19.62 3ktt s ALA 463 CO 0.65 -1.03 0.13 0.41 0.00 0.00 0.00 175.76 175.92 3ktt n GLY 464 N 1.72 3.52 3.60 0.00 0.00 0.25 -4.15 105.19 110.12 3ktt n GLY 464 Ca 0.06 -1.77 -0.42 0.00 0.00 0.00 0.00 46.02 43.89 3ktt n GLY 464 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ktt s LEU 465 N 0.00 4.02 -0.45 0.99 2.01 0.37 0.90 118.68 126.52 3ktt s LEU 465 Ca 0.18 0.56 -0.17 0.00 0.01 0.00 0.00 54.13 54.71 3ktt s LEU 465 Cb 0.01 -3.22 0.04 0.00 0.01 0.00 0.00 46.19 43.03 3ktt s LEU 465 CO 0.13 -0.83 0.43 -0.62 1.01 0.00 0.00 176.35 176.47 3ktt s ASP 466 N 1.86 6.17 0.17 2.29 2.15 0.31 -4.75 116.67 124.87 3ktt s ASP 466 Ca 0.37 -0.92 -0.10 0.00 0.43 0.00 0.00 52.55 52.33 3ktt s ASP 466 Cb -0.12 -2.21 0.05 0.00 -0.30 0.00 0.00 42.92 40.34 3ktt s ASP 466 CO 0.18 -0.63 1.63 0.24 -0.17 0.00 0.00 175.17 176.42 3ktt h MET 467 N 8.76 1.04 -0.21 4.34 2.86 -1.92 0.82 114.93 130.62 3ktt h MET 467 Ca -0.27 -0.34 0.00 0.00 -2.06 0.00 0.00 59.70 57.03 3ktt h MET 467 Cb 1.11 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.67 3ktt h MET 467 CO 0.83 1.03 0.14 0.87 1.06 0.00 0.00 176.91 180.84 3ktt h LYS 468 N 0.93 0.28 -0.55 1.72 1.57 -1.93 0.90 116.57 119.48 3ktt h LYS 468 Ca 0.16 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.86 3ktt h LYS 468 Cb 0.57 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.79 3ktt h LYS 468 CO 0.03 0.20 0.10 1.49 -0.57 0.00 0.00 179.45 180.70 3ktt h GLU 469 N 0.28 0.87 0.00 3.15 4.57 -1.89 -3.45 114.58 118.10 3ktt h GLU 469 Ca 0.08 -0.20 0.00 0.00 -1.18 0.00 0.00 59.36 58.06 3ktt h GLU 469 Cb -0.02 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 28.45 3ktt h GLU 469 CO -0.02 0.80 0.00 0.41 -1.18 0.00 0.00 179.01 179.03 3ktt n GLY 470 N -0.77 0.74 0.00 1.92 0.00 0.27 -4.96 105.19 102.39 3ktt n GLY 470 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3ktt n GLY 470 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ktt n THR 471 N -2.00 0.00 -4.81 2.61 -2.24 -0.54 -4.80 114.28 102.50 3ktt n THR 471 Ca 0.00 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.45 3ktt n THR 471 Cb 0.00 0.00 -0.13 0.00 -2.10 0.00 0.00 70.33 68.10 3ktt n THR 471 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 3ktt s ILE 472 N 3.53 3.24 0.28 2.28 -4.36 -1.26 -0.53 121.20 124.38 3ktt s ILE 472 Ca 0.00 -0.65 0.05 0.00 -0.26 0.00 0.00 60.65 59.79 3ktt s ILE 472 Cb 0.00 -2.29 -0.02 0.00 1.25 0.00 0.00 42.46 41.40 3ktt s ILE 472 CO 0.00 0.59 0.19 0.61 0.24 0.00 0.00 174.94 176.57 3ktt n GLY 473 N 2.38 3.23 3.56 6.27 0.00 0.26 -4.67 105.19 116.22 3ktt n GLY 473 Ca -0.17 -1.91 -0.43 0.00 0.00 0.00 0.00 46.02 43.51 3ktt n GLY 473 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3ktt s ASP 474 N -2.87 6.49 0.30 1.61 -1.08 -1.26 0.87 116.67 120.72 3ktt s ASP 474 Ca 0.27 0.12 0.05 0.00 -0.52 0.00 0.00 52.55 52.46 3ktt s ASP 474 Cb 0.01 -2.42 0.47 0.00 -1.46 0.00 0.00 42.92 39.52 3ktt s ASP 474 CO 0.19 -0.92 1.74 -0.03 0.52 0.00 0.00 175.17 176.67 3ktt h MET 475 N 8.87 0.38 -0.58 4.34 1.85 -1.27 -2.77 114.93 125.75 3ktt h MET 475 Ca -0.24 -0.15 0.03 0.00 -0.61 0.00 0.00 59.70 58.73 3ktt h MET 475 Cb 1.08 -0.02 -0.04 0.00 0.43 0.00 0.00 31.60 33.05 3ktt h MET 475 CO 0.97 0.64 0.35 0.77 -0.40 0.00 0.00 176.91 179.24 3ktt h SER 476 N 0.33 0.56 -0.38 1.39 0.02 -1.85 0.77 113.55 114.38 3ktt h SER 476 Ca 0.05 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.99 3ktt h SER 476 Cb 0.68 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 63.09 3ktt h SER 476 CO 0.05 0.39 0.20 0.58 -1.14 0.00 0.00 176.83 176.91 3ktt h VAL 477 N 0.68 1.16 -0.69 2.27 2.07 -1.88 -2.09 116.25 117.77 3ktt h VAL 477 Ca 0.24 -0.42 -0.05 0.00 0.82 0.00 0.00 66.70 67.28 3ktt h VAL 477 Cb 0.04 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 3ktt h VAL 477 CO -0.11 0.16 0.23 -0.07 0.02 0.00 0.00 177.57 177.80 3ktt h LEU 478 N 0.49 0.97 0.00 2.57 3.38 -1.08 -3.46 115.31 118.18 3ktt h LEU 478 Ca 0.13 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3ktt h LEU 478 Cb 0.08 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.58 3ktt h LEU 478 CO -0.02 0.90 0.00 0.61 0.09 0.00 0.00 178.44 180.02 3ktt n GLY 479 N -0.85 0.78 3.64 0.83 0.00 0.26 -4.85 105.19 104.99 3ktt n GLY 479 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 3ktt n GLY 479 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ktt s ILE 480 N -2.08 4.07 -0.01 -0.61 1.09 -1.09 -3.97 121.20 118.61 3ktt s ILE 480 Ca 0.00 1.24 0.04 0.00 -1.10 0.00 0.00 60.65 60.83 3ktt s ILE 480 Cb 0.00 -4.00 -0.01 0.00 -1.06 0.00 0.00 42.46 37.39 3ktt s ILE 480 CO 0.00 -0.33 -0.14 0.28 -0.10 0.00 0.00 174.94 174.66 3ktt s THR 481 N 4.27 1.08 -0.05 2.92 -1.32 -1.26 -0.47 115.64 120.80 3ktt s THR 481 Ca 0.59 -0.58 -0.03 0.00 -1.21 0.00 0.00 61.69 60.47 3ktt s THR 481 Cb -0.20 -0.90 -0.04 0.00 -1.51 0.00 0.00 72.50 69.85 3ktt s THR 481 CO 0.22 0.31 0.11 -1.61 -2.21 0.00 0.00 174.62 171.44 3ktt s GLU 482 N -0.27 3.25 0.70 7.08 2.02 1.00 -4.78 118.70 127.70 3ktt s GLU 482 Ca 0.04 -0.33 -0.16 0.00 0.02 0.00 0.00 54.97 54.54 3ktt s GLU 482 Cb -0.06 -3.00 0.02 0.00 0.10 0.00 0.00 34.13 31.19 3ktt s GLU 482 CO -0.00 0.70 1.23 -1.12 0.02 0.00 0.00 175.26 176.08 3ktt s SER 483 N -1.45 4.37 0.30 -0.19 0.01 -1.26 0.93 113.70 116.41 3ktt s SER 483 Ca 0.20 2.42 0.03 0.00 1.31 0.00 0.00 55.95 59.92 3ktt s SER 483 Cb -0.12 -2.60 0.48 0.00 0.21 0.00 0.00 66.02 63.99 3ktt s SER 483 CO 0.10 -2.15 1.77 0.15 0.41 0.00 0.00 173.24 173.53 3ktt h PHE 484 N 0.01 0.53 -0.56 2.43 3.57 -1.61 -2.89 116.94 118.42 3ktt h PHE 484 Ca -0.49 -0.09 0.00 0.00 3.53 0.00 0.00 57.97 60.92 3ktt h PHE 484 Cb 1.31 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.88 3ktt h PHE 484 CO 0.46 0.64 0.35 1.96 -2.23 0.00 0.00 178.31 179.49 3ktt h GLN 485 N 0.44 0.75 -0.50 1.11 7.50 -1.88 -2.34 115.11 120.20 3ktt h GLN 485 Ca 0.07 -0.06 0.01 0.00 0.50 0.00 0.00 58.65 59.18 3ktt h GLN 485 Cb 0.57 -0.16 -0.03 0.00 0.05 0.00 0.00 27.48 27.90 3ktt h GLN 485 CO 0.04 0.52 0.31 -0.39 -1.50 0.00 0.00 178.83 177.82 3ktt h VAL 486 N 0.76 1.09 -0.28 -0.54 -1.51 -1.80 -1.66 116.25 112.29 3ktt h VAL 486 Ca 0.20 -0.22 -0.04 0.00 -1.23 0.00 0.00 66.70 65.41 3ktt h VAL 486 Cb -0.05 0.40 -0.01 0.00 -2.13 0.00 0.00 31.29 29.50 3ktt h VAL 486 CO -0.04 0.12 0.01 0.11 -1.23 0.00 0.00 177.57 176.54 3ktt h LYS 487 N 0.63 0.49 0.21 5.19 1.79 -1.53 -2.45 116.57 120.90 3ktt h LYS 487 Ca 0.19 -0.15 -0.01 0.00 -2.18 0.00 0.00 60.65 58.50 3ktt h LYS 487 Cb -0.03 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 30.58 3ktt h LYS 487 CO -0.07 0.64 -0.10 0.00 -1.08 0.00 0.00 179.45 178.84 3ktt h ARG 488 N 0.29 -0.27 -0.30 3.15 3.08 -0.88 -1.90 114.38 117.54 3ktt h ARG 488 Ca 0.08 0.02 -0.07 0.00 0.07 0.00 0.00 59.98 60.08 3ktt h ARG 488 Cb 0.41 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.50 3ktt h ARG 488 CO 0.01 -0.06 -0.09 1.96 -1.07 0.00 0.00 179.97 180.72 3ktt h GLN 489 N -0.44 0.50 -0.66 0.04 7.50 -1.38 -1.29 115.11 119.37 3ktt h GLN 489 Ca -0.03 -0.13 -0.06 0.00 0.50 0.00 0.00 58.65 58.92 3ktt h GLN 489 Cb 0.34 -0.06 -0.03 0.00 0.05 0.00 0.00 27.48 27.78 3ktt h GLN 489 CO 0.05 0.60 0.15 -0.24 -1.50 0.00 0.00 178.83 177.89 3ktt h VAL 490 N 0.47 1.25 0.17 -0.54 3.04 -1.19 0.18 116.25 119.63 3ktt h VAL 490 Ca 0.09 -0.94 -0.01 0.00 -1.01 0.00 0.00 66.70 64.83 3ktt h VAL 490 Cb 0.45 0.58 0.00 0.00 -2.01 0.00 0.00 31.29 30.31 3ktt h VAL 490 CO 0.02 0.36 -0.08 -0.07 -1.01 0.00 0.00 177.57 176.79 3ktt h LEU 491 N 0.99 -0.20 -0.30 3.16 3.38 -0.43 0.19 115.31 122.10 3ktt h LEU 491 Ca 0.21 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 3ktt h LEU 491 Cb 0.36 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 3ktt h LEU 491 CO 0.00 -0.07 0.12 -0.07 0.09 0.00 0.00 178.44 178.50 3ktt h LEU 492 N -0.30 0.42 -0.85 1.67 3.38 -1.25 -2.40 115.31 115.98 3ktt h LEU 492 Ca -0.02 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.73 3ktt h LEU 492 Cb 0.24 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 3ktt h LEU 492 CO 0.04 0.48 0.37 -1.28 0.09 0.00 0.00 178.44 178.15 3ktt h SER 493 N 0.34 1.10 -0.46 -0.43 0.87 -0.54 -2.83 113.55 111.60 3ktt h SER 493 Ca 0.10 -0.15 -0.02 0.00 -1.23 0.00 0.00 61.79 60.50 3ktt h SER 493 Cb 0.20 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 61.85 3ktt h SER 493 CO -0.01 0.95 0.22 0.00 -0.53 0.00 0.00 176.83 177.46 3ktt h ALA 494 N 1.22 0.59 -0.08 6.23 0.00 -0.48 -1.79 119.26 124.94 3ktt h ALA 494 Ca 0.28 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3ktt h ALA 494 Cb 0.15 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 3ktt h ALA 494 CO -0.03 0.15 0.03 0.00 0.00 0.00 0.00 179.25 179.40 3ktt h ALA 495 N 1.07 0.10 -0.28 0.00 0.00 -1.24 -1.91 119.26 117.00 3ktt h ALA 495 Ca 0.16 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3ktt h ALA 495 Cb 0.11 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3ktt h ALA 495 CO -0.02 -0.30 0.13 0.93 0.00 0.00 0.00 179.25 179.99 3ktt h GLU 496 N -0.04 0.41 -0.79 0.00 4.39 -1.24 -0.73 114.58 116.57 3ktt h GLU 496 Ca 0.03 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.62 3ktt h GLU 496 Cb 0.18 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 28.72 3ktt h GLU 496 CO -0.00 0.39 0.33 0.00 -1.16 0.00 0.00 179.01 178.57 3ktt h ALA 497 N 0.99 1.03 -0.62 3.43 0.00 -1.33 -1.39 119.26 121.37 3ktt h ALA 497 Ca 0.10 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 3ktt h ALA 497 Cb 0.12 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 3ktt h ALA 497 CO -0.01 0.65 0.16 0.00 0.00 0.00 0.00 179.25 180.05 3ktt h ALA 498 N 1.17 0.81 -0.76 0.00 0.00 -0.62 -2.50 119.26 117.36 3ktt h ALA 498 Ca 0.27 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 3ktt h ALA 498 Cb 0.20 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 3ktt h ALA 498 CO -0.02 0.51 0.28 0.93 0.00 0.00 0.00 179.25 180.94 3ktt h GLU 499 N 0.90 1.15 -0.83 0.00 5.08 -0.62 -2.43 114.58 117.82 3ktt h GLU 499 Ca 0.19 -0.22 0.01 0.00 -1.00 0.00 0.00 59.36 58.34 3ktt h GLU 499 Cb 0.34 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.37 3ktt h GLU 499 CO -0.00 0.95 0.55 -0.39 -1.00 0.00 0.00 179.01 179.12 3ktt h VAL 500 N 1.11 1.21 -0.05 3.13 -1.51 -0.83 2.72 116.25 122.04 3ktt h VAL 500 Ca 0.25 -0.38 -0.00 0.00 -1.23 0.00 0.00 66.70 65.34 3ktt h VAL 500 Cb 0.25 -0.01 -0.00 0.00 -2.13 0.00 0.00 31.29 29.40 3ktt h VAL 500 CO -0.02 0.20 0.03 0.40 -1.23 0.00 0.00 177.57 176.96 3ktt h ILE 501 N 1.12 1.06 -0.53 7.19 1.08 -1.28 -1.35 117.51 124.81 3ktt h ILE 501 Ca 0.30 -0.18 -0.10 0.00 -0.39 0.00 0.00 64.86 64.50 3ktt h ILE 501 Cb -0.13 1.09 -0.02 0.00 -3.07 0.00 0.00 36.82 34.70 3ktt h ILE 501 CO -0.07 0.05 -0.05 0.25 -0.69 0.00 0.00 178.15 177.65 3ktt h LEU 502 N 0.01 0.95 -0.65 1.44 6.46 -0.72 -3.24 115.31 119.56 3ktt h LEU 502 Ca 0.02 -0.33 -0.03 0.00 -0.12 0.00 0.00 57.88 57.42 3ktt h LEU 502 Cb 0.06 -0.26 -0.03 0.00 -0.73 0.00 0.00 40.66 39.71 3ktt h LEU 502 CO -0.00 1.05 0.31 0.08 -0.62 0.00 0.00 178.44 179.26 3ktt h ARG 503 N 0.83 0.94 -6.85 1.25 0.11 0.49 -3.42 114.38 107.73 3ktt h ARG 503 Ca 0.14 -0.14 -0.52 0.00 0.10 0.00 0.00 59.98 59.56 3ktt h ARG 503 Cb 0.59 -0.17 0.05 0.00 1.11 0.00 0.00 29.97 31.56 3ktt h ARG 503 CO 0.04 0.75 0.60 0.08 0.10 0.00 0.00 179.97 181.54 3ktt s VAL 504 N -5.69 2.91 0.00 0.08 1.01 -0.52 -4.95 120.40 113.24 3ktt s VAL 504 Ca -0.13 0.90 -0.06 0.00 0.00 0.00 0.00 61.98 62.69 3ktt s VAL 504 Cb 0.14 -3.57 -0.02 0.00 0.00 0.00 0.00 36.38 32.92 3ktt s VAL 504 CO 0.79 0.21 -0.12 -0.67 0.00 0.00 0.00 175.10 175.31 3ktt n ASP 505 N 0.99 1.40 -4.48 3.32 -0.08 -1.26 -4.92 116.55 111.51 3ktt n ASP 505 Ca 0.00 0.21 -0.43 0.00 -1.51 0.00 0.00 54.79 53.05 3ktt n ASP 505 Cb 0.42 -0.48 -0.05 0.00 2.34 0.00 0.00 41.12 43.36 3ktt n ASP 505 CO 0.00 0.00 0.00 0.21 0.12 0.00 0.00 177.20 177.53 3ktt s ASN 506 N -5.97 6.27 -0.23 1.67 2.47 -1.26 -3.46 114.94 114.44 3ktt s ASN 506 Ca -0.10 -0.66 -0.16 0.00 0.42 0.00 0.00 52.86 52.36 3ktt s ASN 506 Cb 0.01 -2.37 -0.04 0.00 -1.45 0.00 0.00 41.25 37.40 3ktt s ASN 506 CO 0.15 -1.12 0.39 -0.63 -3.72 0.00 0.00 177.10 172.18 3ktt s ILE 507 N 3.41 5.18 -0.09 -5.21 1.01 0.93 -4.94 121.20 121.50 3ktt s ILE 507 Ca 0.23 0.66 0.04 0.00 0.00 0.00 0.00 60.65 61.58 3ktt s ILE 507 Cb -0.16 -3.72 0.00 0.00 0.01 0.00 0.00 42.46 38.59 3ktt s ILE 507 CO 0.15 0.21 -0.22 -0.63 0.00 0.00 0.00 174.94 174.45 3ktt s ILE 508 N 1.66 1.89 -0.00 2.92 1.01 -1.26 -0.78 121.20 126.63 3ktt s ILE 508 Ca 0.17 -0.93 -0.16 0.00 0.00 0.00 0.00 60.65 59.74 3ktt s ILE 508 Cb -0.15 -1.64 0.03 0.00 0.01 0.00 0.00 42.46 40.71 3ktt s ILE 508 CO 0.09 0.52 0.34 -1.59 0.00 0.00 0.00 174.94 174.30 3ktt s LYS 509 N 0.32 0.73 0.14 2.79 -2.85 0.05 -5.01 119.74 115.90 3ktt s LYS 509 Ca -0.16 -0.23 -0.13 0.00 -1.00 0.00 0.00 55.97 54.45 3ktt s LYS 509 Cb -0.17 0.32 -0.07 0.00 -2.06 0.00 0.00 37.83 35.86 3ktt s LYS 509 CO 0.07 -0.21 0.52 0.00 0.10 0.00 0.00 175.35 175.83 3ktt s ALA 510 N -1.60 3.60 0.05 0.59 0.00 -1.26 0.12 121.76 123.27 3ktt s ALA 510 Ca -0.11 -0.18 -0.31 0.00 0.00 0.00 0.00 51.96 51.36 3ktt s ALA 510 Cb -0.04 -2.47 -0.08 0.00 0.00 0.00 0.00 23.12 20.53 3ktt s ALA 510 CO 0.03 0.48 1.59 0.00 0.00 0.00 0.00 175.76 177.85 3ktt s ALA 511 N -1.48 3.66 0.20 0.00 0.00 -1.26 -4.77 121.76 118.12 3ktt s ALA 511 Ca 0.38 1.12 -0.12 0.00 0.00 0.00 0.00 51.96 53.33 3ktt s ALA 511 Cb -0.15 -3.67 0.23 0.00 0.00 0.00 0.00 23.12 19.53 3ktt s ALA 511 CO 0.19 -1.05 1.69 -1.35 0.00 0.00 0.00 175.76 175.23 3ktt h PRO 512 N 8.19 0.14 0.00 0.00 0.11 -1.96 -3.48 132.00 135.00 3ktt h PRO 512 Ca -0.41 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.69 3ktt h PRO 512 Cb 1.19 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3ktt h PRO 512 CO 0.92 0.10 0.00 0.54 -0.21 0.00 0.00 178.00 179.35