#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3lal s ILE 2 N 0.00 1.43 0.29 4.25 1.01 -1.26 -4.17 121.20 122.74 3lal s ILE 2 Ca 0.00 -0.66 -0.29 0.00 0.00 0.00 0.00 60.65 59.70 3lal s ILE 2 Cb 0.00 -1.43 -0.14 0.00 0.01 0.00 0.00 42.46 40.90 3lal s ILE 2 CO 0.00 0.33 1.12 -0.24 0.00 0.00 0.00 174.94 176.14 3lal n SER 3 N 4.80 1.74 0.00 3.58 2.88 0.19 -4.80 113.62 122.00 3lal n SER 3 Ca -0.15 1.18 0.11 0.00 -1.33 0.00 0.00 58.87 58.68 3lal n SER 3 Cb 0.49 -1.34 0.61 0.00 -0.75 0.00 0.00 64.21 63.22 3lal n SER 3 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3lal n PRO 4 N 0.88 0.54 -2.00 -1.46 -0.04 -1.26 -4.47 135.00 127.19 3lal n PRO 4 Ca 0.09 0.03 -0.41 0.00 -0.04 0.00 0.00 63.50 63.18 3lal n PRO 4 Cb 0.32 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.27 3lal n PRO 4 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 3lal s ILE 5 N -2.22 2.48 0.67 0.52 2.07 -1.26 -4.95 121.20 118.51 3lal s ILE 5 Ca 0.28 0.48 -0.17 0.00 -1.41 0.00 0.00 60.65 59.83 3lal s ILE 5 Cb 0.15 -3.31 -0.00 0.00 0.13 0.00 0.00 42.46 39.43 3lal s ILE 5 CO 0.28 0.11 1.14 -1.84 -1.91 0.00 0.00 174.94 172.73 3lal n GLU 6 N 0.68 0.83 -2.21 3.50 0.28 -1.26 -4.82 120.64 117.65 3lal n GLU 6 Ca 0.00 0.34 -0.29 0.00 -0.16 0.00 0.00 57.16 57.05 3lal n GLU 6 Cb 0.41 -2.38 0.01 0.00 1.43 0.00 0.00 31.44 30.91 3lal n GLU 6 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 3lal s THR 7 N -1.58 4.71 -0.24 3.84 -4.23 -1.26 -5.02 115.64 111.85 3lal s THR 7 Ca 0.79 0.55 -0.19 0.00 -1.18 0.00 0.00 61.69 61.66 3lal s THR 7 Cb -0.37 -3.84 -0.03 0.00 1.34 0.00 0.00 72.50 69.61 3lal s THR 7 CO 0.45 -0.98 0.54 -0.69 -0.54 0.00 0.00 174.62 173.40 3lal s VAL 8 N -3.00 5.06 0.15 2.29 1.01 -1.26 -4.97 120.40 119.68 3lal s VAL 8 Ca 0.52 0.96 -0.31 0.00 0.00 0.00 0.00 61.98 63.15 3lal s VAL 8 Cb -0.11 -3.86 -0.10 0.00 0.00 0.00 0.00 36.38 32.31 3lal s VAL 8 CO 0.50 0.10 1.62 -2.16 0.00 0.00 0.00 175.10 175.16 3lal s PRO 9 N 2.17 4.19 0.13 2.72 0.04 -1.26 -4.22 135.00 138.78 3lal s PRO 9 Ca 0.23 2.41 0.08 0.00 0.04 0.00 0.00 61.00 63.77 3lal s PRO 9 Cb -0.16 -3.24 -0.04 0.00 0.04 0.00 0.00 34.50 31.10 3lal s PRO 9 CO 0.09 -0.67 -0.20 0.08 0.04 0.00 0.00 177.00 176.35 3lal s VAL 10 N 1.50 1.76 0.15 -0.36 1.01 -1.26 -5.08 120.40 118.11 3lal s VAL 10 Ca 0.72 -1.71 -0.13 0.00 0.00 0.00 0.00 61.98 60.86 3lal s VAL 10 Cb -0.44 -1.69 0.01 0.00 0.00 0.00 0.00 36.38 34.27 3lal s VAL 10 CO 0.32 -0.18 0.36 -1.59 0.00 0.00 0.00 175.10 174.01 3lal s LYS 11 N -2.31 1.13 0.70 2.72 -2.85 -1.26 -4.77 119.74 113.10 3lal s LYS 11 Ca 0.11 -0.92 -0.10 0.00 -1.00 0.00 0.00 55.97 54.05 3lal s LYS 11 Cb -0.08 0.43 0.02 0.00 -2.06 0.00 0.00 37.83 36.14 3lal s LYS 11 CO 0.05 -0.43 1.07 -0.51 0.10 0.00 0.00 175.35 175.63 3lal s LEU 12 N -2.88 2.91 0.51 2.77 1.43 -1.26 -2.36 118.68 119.81 3lal s LEU 12 Ca 0.09 1.01 -0.23 0.00 -1.03 0.00 0.00 54.13 53.97 3lal s LEU 12 Cb 0.02 -3.78 -0.07 0.00 0.03 0.00 0.00 46.19 42.40 3lal s LEU 12 CO -0.06 -1.36 1.28 0.29 0.23 0.00 0.00 176.35 176.72 3lal n LYS 13 N -2.97 1.67 -0.24 1.70 5.02 -0.02 -4.57 118.16 118.76 3lal n LYS 13 Ca 0.07 0.61 0.06 0.00 -2.02 0.00 0.00 58.31 57.03 3lal n LYS 13 Cb 0.58 -2.46 0.31 0.00 -0.02 0.00 0.00 35.03 33.45 3lal n LYS 13 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 3lal h PRO 14 N 1.54 0.82 0.00 1.97 0.13 -1.95 -0.71 132.00 133.80 3lal h PRO 14 Ca -0.49 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.59 3lal h PRO 14 Cb 1.31 -0.19 0.00 0.00 0.13 0.00 0.00 31.00 32.25 3lal h PRO 14 CO 0.57 0.54 0.00 0.41 -0.23 0.00 0.00 178.00 179.30 3lal n GLY 15 N -1.43 -1.32 3.83 1.56 0.00 -1.26 -4.95 105.19 101.62 3lal n GLY 15 Ca 0.13 -0.07 -0.23 0.00 0.00 0.00 0.00 46.02 45.84 3lal n GLY 15 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3lal s MET 16 N -3.02 2.37 0.16 1.61 -1.94 -0.28 -5.14 119.30 113.06 3lal s MET 16 Ca 0.11 -1.73 0.03 0.00 -1.71 0.00 0.00 55.69 52.39 3lal s MET 16 Cb 0.15 -2.18 -0.05 0.00 2.01 0.00 0.00 34.83 34.77 3lal s MET 16 CO 0.43 -0.23 -0.05 0.34 -0.01 0.00 0.00 175.02 175.50 3lal s ASP 17 N -4.07 1.54 0.93 3.03 2.15 -1.26 -4.85 116.67 114.15 3lal s ASP 17 Ca 0.43 -1.08 -0.11 0.00 0.43 0.00 0.00 52.55 52.22 3lal s ASP 17 Cb -0.00 0.04 0.15 0.00 -0.30 0.00 0.00 42.92 42.81 3lal s ASP 17 CO 0.25 -0.44 1.10 -0.83 -0.17 0.00 0.00 175.17 175.07 3lal s GLY 18 N -3.17 1.64 0.58 2.66 0.00 -1.26 -4.96 107.32 102.81 3lal s GLY 18 Ca 0.19 0.22 -0.18 0.00 0.00 0.00 0.00 44.72 44.95 3lal s GLY 18 CO 0.02 0.70 1.11 2.56 0.00 0.00 0.00 173.10 177.49 3lal s PRO 19 N -4.74 3.22 -0.28 2.90 0.04 -1.26 -4.97 135.00 129.91 3lal s PRO 19 Ca 0.65 1.49 0.20 0.00 0.04 0.00 0.00 61.00 63.38 3lal s PRO 19 Cb -0.21 -2.00 0.49 0.00 0.04 0.00 0.00 34.50 32.82 3lal s PRO 19 CO 0.59 -0.94 1.08 1.63 0.04 0.00 0.00 177.00 179.40 3lal n LYS 20 N -1.68 1.80 -1.65 4.56 5.02 -1.25 -2.30 118.16 122.66 3lal n LYS 20 Ca 0.11 -3.53 -0.34 0.00 -2.02 0.00 0.00 58.31 52.53 3lal n LYS 20 Cb 0.52 -1.60 0.06 0.00 -0.02 0.00 0.00 35.03 33.99 3lal n LYS 20 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3lal s VAL 21 N -3.77 2.82 0.03 -0.18 1.01 -1.02 -4.74 120.40 114.55 3lal s VAL 21 Ca 0.30 0.40 -0.13 0.00 0.00 0.00 0.00 61.98 62.54 3lal s VAL 21 Cb 0.36 -2.95 -0.06 0.00 0.00 0.00 0.00 36.38 33.74 3lal s VAL 21 CO -0.02 -0.22 0.41 -0.75 0.00 0.00 0.00 175.10 174.52 3lal s LYS 22 N -3.94 3.87 -0.08 2.72 2.20 -1.26 -4.40 119.74 118.85 3lal s LYS 22 Ca 0.71 0.34 -0.30 0.00 -0.36 0.00 0.00 55.97 56.36 3lal s LYS 22 Cb -0.25 -3.14 -0.03 0.00 -1.51 0.00 0.00 37.83 32.90 3lal s LYS 22 CO 0.42 0.64 1.25 -1.14 -0.36 0.00 0.00 175.35 176.17 3lal s GLN 23 N -1.36 4.30 0.26 4.03 2.00 -1.26 -4.72 119.66 122.91 3lal s GLN 23 Ca 0.27 1.72 -0.30 0.00 -2.00 0.00 0.00 55.36 55.05 3lal s GLN 23 Cb -0.16 -3.63 -0.10 0.00 0.80 0.00 0.00 33.01 29.92 3lal s GLN 23 CO 0.15 -0.55 1.40 -0.46 -0.50 0.00 0.00 175.29 175.33 3lal s TRP 24 N 2.66 3.04 0.46 1.67 -0.11 -1.26 -4.97 118.94 120.43 3lal s TRP 24 Ca 0.57 1.13 -0.24 0.00 1.22 0.00 0.00 56.10 58.78 3lal s TRP 24 Cb -0.25 -3.77 -0.07 0.00 -1.50 0.00 0.00 33.47 27.88 3lal s TRP 24 CO 0.20 -2.42 1.26 -1.25 -4.62 0.00 0.00 176.95 170.12 3lal s PRO 25 N -0.67 3.70 0.21 5.86 0.04 -1.26 -4.91 135.00 137.97 3lal s PRO 25 Ca 0.57 2.01 0.10 0.00 0.04 0.00 0.00 61.00 63.72 3lal s PRO 25 Cb -0.41 -2.50 -0.05 0.00 0.04 0.00 0.00 34.50 31.58 3lal s PRO 25 CO 0.45 -0.67 -0.20 -0.51 0.04 0.00 0.00 177.00 176.11 3lal s LEU 26 N -2.91 2.49 1.27 -3.56 1.43 -1.26 -5.12 118.68 111.01 3lal s LEU 26 Ca 0.63 -0.92 -0.18 0.00 -1.03 0.00 0.00 54.13 52.63 3lal s LEU 26 Cb -0.35 -1.01 0.31 0.00 0.03 0.00 0.00 46.19 45.18 3lal s LEU 26 CO 0.43 0.03 1.00 0.42 0.23 0.00 0.00 176.35 178.45 3lal s THR 27 N -2.11 1.62 0.06 5.49 -4.23 -1.26 -4.61 115.64 110.60 3lal s THR 27 Ca 0.22 0.00 -0.15 0.00 -1.18 0.00 0.00 61.69 60.58 3lal s THR 27 Cb -0.06 -2.15 -0.27 0.00 1.34 0.00 0.00 72.50 71.36 3lal s THR 27 CO 0.10 0.00 1.13 -0.33 -0.54 0.00 0.00 174.62 174.98 3lal h GLU 28 N -2.91 0.64 -0.42 3.99 5.08 -1.99 -1.25 114.58 117.71 3lal h GLU 28 Ca -0.52 -0.79 -0.03 0.00 -1.00 0.00 0.00 59.36 57.02 3lal h GLU 28 Cb 1.33 0.25 -0.02 0.00 0.50 0.00 0.00 28.75 30.81 3lal h GLU 28 CO 0.40 1.35 0.13 1.05 -1.00 0.00 0.00 179.01 180.94 3lal h GLU 29 N 0.28 0.61 -0.09 2.33 4.11 -1.99 0.33 114.58 120.16 3lal h GLU 29 Ca -0.16 -0.09 -0.10 0.00 0.07 0.00 0.00 59.36 59.08 3lal h GLU 29 Cb 1.81 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.95 3lal h GLU 29 CO 0.22 0.54 -0.32 0.87 0.07 0.00 0.00 179.01 180.39 3lal h LYS 30 N 0.60 0.38 -0.92 1.06 1.57 -1.91 -0.80 116.57 116.55 3lal h LYS 30 Ca 0.14 -0.28 0.05 0.00 -1.87 0.00 0.00 60.65 58.69 3lal h LYS 30 Cb 0.18 0.05 -0.06 0.00 0.08 0.00 0.00 32.23 32.49 3lal h LYS 30 CO -0.01 0.91 0.59 0.82 -0.57 0.00 0.00 179.45 181.19 3lal h ILE 31 N -0.08 1.11 0.07 1.86 2.04 -1.03 -0.11 117.51 121.36 3lal h ILE 31 Ca -0.01 -0.38 -0.00 0.00 1.00 0.00 0.00 64.86 65.46 3lal h ILE 31 Cb 0.95 -0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.93 3lal h ILE 31 CO 0.07 0.20 -0.03 0.50 0.00 0.00 0.00 178.15 178.89 3lal h LYS 32 N 1.11 -0.09 -0.81 2.37 3.64 -0.83 -1.34 116.57 120.62 3lal h LYS 32 Ca 0.38 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.75 3lal h LYS 32 Cb 0.08 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.88 3lal h LYS 32 CO -0.14 0.04 0.44 0.00 -2.27 0.00 0.00 179.45 177.51 3lal h ALA 33 N 0.72 1.04 -0.74 5.00 0.00 -0.73 -0.92 119.26 123.62 3lal h ALA 33 Ca -0.01 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 3lal h ALA 33 Cb 0.17 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 3lal h ALA 33 CO 0.02 0.55 0.23 -0.07 0.00 0.00 0.00 179.25 179.98 3lal h LEU 34 N 1.12 1.08 -0.72 0.00 3.38 -0.91 -1.25 115.31 118.03 3lal h LEU 34 Ca 0.28 -0.21 -0.08 0.00 0.09 0.00 0.00 57.88 57.97 3lal h LEU 34 Cb 0.04 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.48 3lal h LEU 34 CO -0.04 1.00 0.10 0.58 0.09 0.00 0.00 178.44 180.17 3lal h VAL 35 N 1.11 1.26 -0.37 1.22 2.07 -0.67 -0.34 116.25 120.52 3lal h VAL 35 Ca 0.24 -1.04 -0.05 0.00 0.82 0.00 0.00 66.70 66.67 3lal h VAL 35 Cb 0.31 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 3lal h VAL 35 CO -0.01 0.39 0.02 -0.33 0.02 0.00 0.00 177.57 177.66 3lal h GLU 36 N 1.01 0.64 -0.29 1.57 5.08 -0.83 -2.00 114.58 119.77 3lal h GLU 36 Ca 0.20 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 3lal h GLU 36 Cb 0.45 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 3lal h GLU 36 CO 0.01 0.73 0.09 0.82 -1.00 0.00 0.00 179.01 179.67 3lal h ILE 37 N 0.47 1.20 -0.18 3.13 2.04 -1.10 -2.96 117.51 120.10 3lal h ILE 37 Ca 0.11 -0.64 -0.09 0.00 1.00 0.00 0.00 64.86 65.24 3lal h ILE 37 Cb 0.43 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.58 3lal h ILE 37 CO 0.02 0.21 -0.27 0.00 0.00 0.00 0.00 178.15 178.11 3lal h THR 39 N 0.30 1.27 0.22 0.00 2.02 -1.36 0.23 112.91 115.59 3lal h THR 39 Ca 0.04 -1.44 -0.01 0.00 0.77 0.00 0.00 66.41 65.78 3lal h THR 39 Cb 0.64 1.26 0.00 0.00 -1.74 0.00 0.00 68.15 68.31 3lal h THR 39 CO 0.05 0.49 -0.11 -0.08 0.37 0.00 0.00 175.52 176.24 3lal h GLU 40 N 0.77 -0.29 -0.66 6.66 4.57 -1.31 -2.34 114.58 121.98 3lal h GLU 40 Ca 0.09 0.02 0.12 0.00 -1.18 0.00 0.00 59.36 58.41 3lal h GLU 40 Cb 0.85 0.06 -0.09 0.00 -0.16 0.00 0.00 28.75 29.42 3lal h GLU 40 CO 0.08 -0.02 0.22 0.52 -1.18 0.00 0.00 179.01 178.62 3lal h MET 41 N -0.53 0.35 -0.04 1.92 2.86 -1.06 -1.74 114.93 116.70 3lal h MET 41 Ca -0.03 -0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.57 3lal h MET 41 Cb 0.40 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 31.97 3lal h MET 41 CO 0.05 0.23 -0.07 1.49 1.06 0.00 0.00 176.91 179.68 3lal h GLU 42 N 0.37 0.06 0.00 1.72 4.81 -0.37 -1.25 114.58 119.92 3lal h GLU 42 Ca 0.35 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.57 3lal h GLU 42 Cb 0.51 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.88 3lal h GLU 42 CO -0.38 0.13 -0.10 1.63 -0.73 0.00 0.00 179.01 179.56 3lal n LYS 43 N -4.42 0.25 0.00 1.92 5.02 -0.68 -2.47 118.16 117.78 3lal n LYS 43 Ca -0.02 0.18 0.12 0.00 -2.02 0.00 0.00 58.31 56.57 3lal n LYS 43 Cb 0.17 -1.77 0.22 0.00 -0.02 0.00 0.00 35.03 33.63 3lal n LYS 43 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3lal n GLU 44 N -2.19 1.94 -0.07 1.97 1.02 -0.55 -4.95 120.64 117.81 3lal n GLU 44 Ca 0.05 -1.48 0.00 0.00 -0.02 0.00 0.00 57.16 55.71 3lal n GLU 44 Cb 0.43 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.38 3lal n GLU 44 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3lal n GLY 45 N 1.31 1.14 0.35 0.62 0.00 -0.98 -4.87 105.19 102.77 3lal n GLY 45 Ca 0.15 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.16 3lal n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3lal h LYS 46 N 3.35 1.15 -4.91 1.61 1.79 -1.57 -3.42 116.57 114.58 3lal h LYS 46 Ca 0.00 -0.07 -0.29 0.00 -2.18 0.00 0.00 60.65 58.11 3lal h LYS 46 Cb 0.00 -0.26 -0.15 0.00 -1.58 0.00 0.00 32.23 30.24 3lal h LYS 46 CO 0.00 0.76 -0.70 0.96 -1.08 0.00 0.00 179.45 179.39 3lal s ILE 47 N -6.09 0.95 -0.02 1.86 -4.36 -1.25 -1.01 121.20 111.28 3lal s ILE 47 Ca -0.13 -2.01 0.05 0.00 -0.26 0.00 0.00 60.65 58.30 3lal s ILE 47 Cb 0.18 -1.86 -0.01 0.00 1.25 0.00 0.00 42.46 42.02 3lal s ILE 47 CO 0.81 -0.73 -0.18 -0.44 0.24 0.00 0.00 174.94 174.65 3lal s SER 48 N -3.14 2.11 0.25 4.36 0.01 0.31 -4.37 113.70 113.24 3lal s SER 48 Ca 0.17 -0.33 -0.31 0.00 1.31 0.00 0.00 55.95 56.79 3lal s SER 48 Cb 0.04 -0.33 -0.12 0.00 0.21 0.00 0.00 66.02 65.81 3lal s SER 48 CO -0.00 0.20 1.59 0.29 0.41 0.00 0.00 173.24 175.73 3lal n LYS 49 N 2.78 2.55 -4.43 12.44 5.02 -1.26 -0.83 118.16 134.43 3lal n LYS 49 Ca -0.16 0.91 -0.21 0.00 -2.02 0.00 0.00 58.31 56.83 3lal n LYS 49 Cb 0.54 -2.68 -0.10 0.00 -0.02 0.00 0.00 35.03 32.77 3lal n LYS 49 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 3lal s ILE 50 N 0.32 0.80 0.09 -0.18 -4.36 0.11 -4.88 121.20 113.10 3lal s ILE 50 Ca 0.69 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 59.09 3lal s ILE 50 Cb -0.54 -2.60 -0.04 0.00 1.25 0.00 0.00 42.46 40.52 3lal s ILE 50 CO 0.44 0.00 -0.07 -0.83 0.24 0.00 0.00 174.94 174.72 3lal s GLY 51 N -3.47 0.74 0.26 6.27 0.00 -1.26 -4.26 107.32 105.60 3lal s GLY 51 Ca 0.33 -1.28 -0.30 0.00 0.00 0.00 0.00 44.72 43.47 3lal s GLY 51 CO 0.15 -1.38 1.25 -1.55 0.00 0.00 0.00 173.10 171.57 3lal n PRO 52 N 0.13 1.77 0.20 2.90 -0.04 -1.26 -3.44 135.00 135.26 3lal n PRO 52 Ca -0.13 0.62 0.07 0.00 -0.04 0.00 0.00 63.50 64.02 3lal n PRO 52 Cb 0.60 -2.17 0.35 0.00 -0.04 0.00 0.00 33.50 32.24 3lal n PRO 52 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3lal h GLU 53 N 3.19 0.00 -5.85 0.54 5.08 -2.05 -3.51 114.58 111.98 3lal h GLU 53 Ca -0.44 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.28 3lal h GLU 53 Cb 1.30 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.53 3lal h GLU 53 CO 0.68 0.32 1.47 -1.71 -1.00 0.00 0.00 179.01 178.77 3lal n ASN 54 N -3.44 1.84 0.08 1.42 2.85 -1.22 -4.80 115.26 112.00 3lal n ASN 54 Ca 0.00 0.32 0.13 0.00 -0.11 0.00 0.00 54.58 54.92 3lal n ASN 54 Cb 0.50 -1.23 0.46 0.00 1.24 0.00 0.00 39.78 40.75 3lal n ASN 54 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 3lal n PRO 55 N 8.25 0.20 -2.75 1.20 -0.04 -1.26 -4.91 135.00 135.68 3lal n PRO 55 Ca 0.45 0.18 -0.28 0.00 -0.04 0.00 0.00 63.50 63.80 3lal n PRO 55 Cb 0.22 -1.74 -0.01 0.00 -0.04 0.00 0.00 33.50 31.93 3lal n PRO 55 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3lal s TYR 56 N -3.09 3.54 -0.05 0.54 2.02 -1.26 -4.80 117.35 114.24 3lal s TYR 56 Ca 0.11 0.84 -0.25 0.00 -0.37 0.00 0.00 57.07 57.39 3lal s TYR 56 Cb 0.14 -2.30 0.05 0.00 -0.40 0.00 0.00 41.96 39.45 3lal s TYR 56 CO 0.56 -0.20 0.56 1.21 -1.57 0.00 0.00 175.55 176.11 3lal s ASN 57 N -3.84 -0.51 -0.04 2.29 2.47 -0.97 -4.72 114.94 109.61 3lal s ASN 57 Ca 0.48 0.56 0.01 0.00 0.42 0.00 0.00 52.86 54.32 3lal s ASN 57 Cb -0.10 0.53 0.02 0.00 -1.45 0.00 0.00 41.25 40.25 3lal s ASN 57 CO 0.41 -0.52 -0.03 -0.89 -3.72 0.00 0.00 177.10 172.34 3lal s THR 58 N -1.10 0.44 0.46 -5.21 2.01 -0.65 -2.42 115.64 109.16 3lal s THR 58 Ca -0.11 -0.04 -0.25 0.00 0.31 0.00 0.00 61.69 61.60 3lal s THR 58 Cb -0.02 -0.50 -0.08 0.00 0.01 0.00 0.00 72.50 71.92 3lal s THR 58 CO 0.07 0.21 1.41 -2.16 -0.69 0.00 0.00 174.62 173.47 3lal s PRO 59 N 1.09 3.62 0.12 4.92 0.04 -1.26 -4.29 135.00 139.24 3lal s PRO 59 Ca -0.09 2.37 0.09 0.00 0.04 0.00 0.00 61.00 63.42 3lal s PRO 59 Cb -0.14 -2.60 -0.04 0.00 0.04 0.00 0.00 34.50 31.76 3lal s PRO 59 CO -0.01 -0.86 -0.19 0.14 0.04 0.00 0.00 177.00 176.12 3lal s VAL 60 N -1.22 2.77 0.12 -0.36 -7.23 -1.26 -2.50 120.40 110.71 3lal s VAL 60 Ca 0.62 -1.54 -0.01 0.00 -1.81 0.00 0.00 61.98 59.24 3lal s VAL 60 Cb -0.43 -2.27 -0.04 0.00 0.56 0.00 0.00 36.38 34.20 3lal s VAL 60 CO 0.55 0.09 0.03 0.12 -0.31 0.00 0.00 175.10 175.58 3lal s PHE 61 N -1.14 0.83 -0.04 2.82 5.36 0.08 -4.91 117.98 120.99 3lal s PHE 61 Ca 0.18 -1.18 0.03 0.00 -0.96 0.00 0.00 56.93 55.00 3lal s PHE 61 Cb -0.10 -0.49 0.00 0.00 -0.34 0.00 0.00 43.02 42.09 3lal s PHE 61 CO 0.10 -0.46 -0.12 0.00 -1.46 0.00 0.00 175.22 173.28 3lal s ALA 62 N -3.98 1.12 0.19 11.12 0.00 -1.26 -1.68 121.76 127.27 3lal s ALA 62 Ca 0.21 -0.44 0.09 0.00 0.00 0.00 0.00 51.96 51.82 3lal s ALA 62 Cb 0.07 -0.42 -0.04 0.00 0.00 0.00 0.00 23.12 22.73 3lal s ALA 62 CO -0.00 0.17 -0.09 0.42 0.00 0.00 0.00 175.76 176.26 3lal s ILE 63 N 0.26 3.18 -0.46 0.00 -1.09 -0.69 -4.95 121.20 117.44 3lal s ILE 63 Ca -0.06 -1.72 -0.19 0.00 -2.23 0.00 0.00 60.65 56.45 3lal s ILE 63 Cb -0.11 -2.59 0.04 0.00 -1.58 0.00 0.00 42.46 38.22 3lal s ILE 63 CO 0.01 -0.15 0.57 -0.75 -1.23 0.00 0.00 174.94 173.39 3lal s LYS 64 N -2.96 3.15 -0.27 2.79 2.47 -1.26 -1.38 119.74 122.28 3lal s LYS 64 Ca 0.26 -0.74 -0.29 0.00 -1.56 0.00 0.00 55.97 53.64 3lal s LYS 64 Cb -0.08 -4.03 -0.06 0.00 -1.46 0.00 0.00 37.83 32.20 3lal s LYS 64 CO 0.16 -1.06 2.25 1.17 0.16 0.00 0.00 175.35 178.03 3lal n LYS 65 N 5.99 1.75 0.00 4.03 3.00 -0.06 -4.72 118.16 128.16 3lal n LYS 65 Ca -0.06 0.45 0.00 0.00 -0.00 0.00 0.00 58.31 58.70 3lal n LYS 65 Cb 0.46 -3.16 0.00 0.00 0.00 0.00 0.00 35.03 32.33 3lal n LYS 65 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 3lal n LYS 66 N 8.73 0.00 -0.02 1.64 -0.00 -1.26 -1.79 118.16 125.46 3lal n LYS 66 Ca 0.32 0.00 0.08 0.00 -0.00 0.00 0.00 58.31 58.71 3lal n LYS 66 Cb 0.43 0.00 -0.16 0.00 -0.00 0.00 0.00 35.03 35.30 3lal n LYS 66 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 3lal n ASP 67 N 4.71 0.33 -4.51 -5.58 -0.08 -1.26 -5.01 116.55 105.14 3lal n ASP 67 Ca 0.00 0.00 -0.29 0.00 -1.51 0.00 0.00 54.79 52.99 3lal n ASP 67 Cb 0.00 1.83 0.24 0.00 2.34 0.00 0.00 41.12 45.53 3lal n ASP 67 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 3lal s SER 68 N -4.46 1.20 -0.19 1.67 0.15 -0.74 -4.92 113.70 106.41 3lal s SER 68 Ca -0.08 1.68 0.08 0.00 0.70 0.00 0.00 55.95 58.33 3lal s SER 68 Cb 0.12 -2.39 0.52 0.00 -1.71 0.00 0.00 66.02 62.57 3lal s SER 68 CO 0.84 -4.09 1.40 0.35 1.20 0.00 0.00 173.24 172.94 3lal n THR 69 N -4.86 1.98 -3.19 6.45 -2.24 -1.26 -4.41 114.28 106.76 3lal n THR 69 Ca 0.05 -1.01 -0.36 0.00 -2.27 0.00 0.00 64.05 60.45 3lal n THR 69 Cb 0.54 -0.42 -0.06 0.00 -2.10 0.00 0.00 70.33 68.28 3lal n THR 69 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3lal s LYS 70 N -2.18 4.18 0.09 -0.78 2.47 -1.26 -4.99 119.74 117.27 3lal s LYS 70 Ca 0.37 0.76 0.05 0.00 -1.56 0.00 0.00 55.97 55.58 3lal s LYS 70 Cb 0.29 -2.96 -0.04 0.00 -1.46 0.00 0.00 37.83 33.66 3lal s LYS 70 CO 0.10 0.46 0.01 -1.58 0.16 0.00 0.00 175.35 174.49 3lal s TRP 71 N -1.43 3.01 0.01 4.03 0.52 -1.26 -0.88 118.94 122.94 3lal s TRP 71 Ca 0.39 -0.01 0.06 0.00 0.02 0.00 0.00 56.10 56.56 3lal s TRP 71 Cb -0.17 -1.55 -0.02 0.00 -1.15 0.00 0.00 33.47 30.58 3lal s TRP 71 CO 0.20 0.48 -0.19 1.03 0.02 0.00 0.00 176.95 178.49 3lal s ARG 72 N -2.28 1.44 -0.39 4.98 0.52 -0.48 -4.88 118.95 117.85 3lal s ARG 72 Ca 0.26 -0.78 -0.26 0.00 -0.52 0.00 0.00 55.73 54.43 3lal s ARG 72 Cb -0.12 -1.45 0.02 0.00 0.52 0.00 0.00 34.95 33.92 3lal s ARG 72 CO 0.18 0.39 0.93 0.21 0.02 0.00 0.00 175.30 177.03 3lal s LYS 73 N -0.76 3.76 -0.21 3.54 2.20 -1.26 -1.71 119.74 125.30 3lal s LYS 73 Ca 0.07 0.47 -0.08 0.00 -0.36 0.00 0.00 55.97 56.07 3lal s LYS 73 Cb -0.08 -3.84 -0.04 0.00 -1.51 0.00 0.00 37.83 32.36 3lal s LYS 73 CO 0.00 -1.03 0.09 -1.17 -0.36 0.00 0.00 175.35 172.88 3lal s LEU 74 N 3.57 3.82 -0.14 5.43 0.20 -0.67 -5.00 118.68 125.88 3lal s LEU 74 Ca 0.38 0.04 -0.01 0.00 0.69 0.00 0.00 54.13 55.23 3lal s LEU 74 Cb -0.11 -1.99 -0.02 0.00 -0.43 0.00 0.00 46.19 43.64 3lal s LEU 74 CO 0.21 0.11 -0.12 -0.69 -0.29 0.00 0.00 176.35 175.57 3lal s VAL 75 N 0.76 3.14 -0.63 1.68 1.01 -1.26 -0.74 120.40 124.37 3lal s VAL 75 Ca 0.05 -0.62 -0.22 0.00 0.00 0.00 0.00 61.98 61.18 3lal s VAL 75 Cb -0.13 -2.33 0.07 0.00 0.00 0.00 0.00 36.38 33.99 3lal s VAL 75 CO 0.02 0.51 0.89 -0.62 0.00 0.00 0.00 175.10 175.91 3lal s ASP 76 N 0.44 6.19 0.00 3.32 2.15 -1.04 -4.88 116.67 122.85 3lal s ASP 76 Ca -0.09 -1.02 0.20 0.00 0.43 0.00 0.00 52.55 52.07 3lal s ASP 76 Cb -0.16 -2.39 0.53 0.00 -0.30 0.00 0.00 42.92 40.60 3lal s ASP 76 CO 0.05 -1.33 1.44 0.49 -0.17 0.00 0.00 175.17 175.64 3lal n PHE 77 N 7.34 0.55 -0.22 -5.34 3.72 -1.26 -4.34 117.46 117.91 3lal n PHE 77 Ca -0.05 -0.28 -0.00 0.00 -0.05 0.00 0.00 57.45 57.07 3lal n PHE 77 Cb 0.45 0.00 0.03 0.00 -0.94 0.00 0.00 39.48 39.02 3lal n PHE 77 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3lal n ARG 78 N 1.04 -0.13 0.00 -1.08 3.00 -1.26 -0.28 116.66 117.95 3lal n ARG 78 Ca 0.18 0.87 -0.18 0.00 -0.01 0.00 0.00 57.85 58.72 3lal n ARG 78 Cb 0.47 -1.30 -0.10 0.00 0.00 0.00 0.00 32.46 31.54 3lal n ARG 78 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 3lal h GLU 79 N 0.00 0.55 -0.81 5.56 4.39 -2.00 -2.21 114.58 120.06 3lal h GLU 79 Ca 0.20 -0.53 -0.04 0.00 0.34 0.00 0.00 59.36 59.33 3lal h GLU 79 Cb 0.34 0.14 -0.04 0.00 -0.10 0.00 0.00 28.75 29.09 3lal h GLU 79 CO -0.56 1.16 0.34 1.25 -1.16 0.00 0.00 179.01 180.03 3lal h LEU 80 N 0.13 1.10 -0.79 1.33 5.85 -1.64 -2.37 115.31 118.93 3lal h LEU 80 Ca -0.07 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.48 3lal h LEU 80 Cb 1.37 -0.29 -0.04 0.00 0.37 0.00 0.00 40.66 42.07 3lal h LEU 80 CO 0.14 0.96 0.49 0.78 -0.34 0.00 0.00 178.44 180.47 3lal h ASN 81 N 1.17 0.93 0.22 1.25 2.35 -0.63 0.12 115.58 121.01 3lal h ASN 81 Ca 0.27 -0.05 -0.02 0.00 -0.55 0.00 0.00 56.30 55.95 3lal h ASN 81 Cb 0.19 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.32 3lal h ASN 81 CO -0.03 0.71 -0.10 0.11 -1.65 0.00 0.00 177.43 176.48 3lal h LYS 82 N 1.08 0.00 -0.01 0.81 1.57 -0.97 -2.90 116.57 116.15 3lal h LYS 82 Ca 0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 3lal h LYS 82 Cb -0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.24 3lal h LYS 82 CO -0.06 0.10 -0.59 0.54 -0.57 0.00 0.00 179.45 178.87 3lal n ARG 83 N -3.84 1.16 -3.02 3.15 1.74 -0.57 -4.94 116.66 110.34 3lal n ARG 83 Ca -0.02 -0.60 -0.37 0.00 -0.77 0.00 0.00 57.85 56.09 3lal n ARG 83 Cb 0.19 -1.40 -0.06 0.00 -1.02 0.00 0.00 32.46 30.17 3lal n ARG 83 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 3lal s THR 84 N -2.45 4.46 0.78 0.55 2.01 0.33 -0.84 115.64 120.48 3lal s THR 84 Ca 0.13 1.48 -0.15 0.00 0.31 0.00 0.00 61.69 63.47 3lal s THR 84 Cb 0.16 -3.96 0.00 0.00 0.01 0.00 0.00 72.50 68.71 3lal s THR 84 CO 0.61 0.28 0.69 0.00 -0.69 0.00 0.00 174.62 175.50 3lal n GLN 85 N 0.93 0.19 -2.42 4.92 10.64 -0.99 -4.55 117.38 126.10 3lal n GLN 85 Ca -0.03 0.12 -0.34 0.00 -1.83 0.00 0.00 57.00 54.92 3lal n GLN 85 Cb 0.50 -2.00 -0.02 0.00 -0.86 0.00 0.00 30.24 27.86 3lal n GLN 85 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 3lal s ASP 86 N -1.72 6.13 0.38 2.61 -0.00 -1.26 -4.93 116.67 117.87 3lal s ASP 86 Ca 0.66 1.98 0.08 0.00 -0.00 0.00 0.00 52.55 55.27 3lal s ASP 86 Cb -0.31 -2.56 -0.06 0.00 -0.00 0.00 0.00 42.92 39.99 3lal s ASP 86 CO 0.57 -0.93 0.06 -0.36 -0.00 0.00 0.00 175.17 174.51 3lal s PHE 87 N -1.98 2.56 0.53 4.23 0.08 -1.26 -5.12 117.98 117.03 3lal s PHE 87 Ca 0.68 -0.53 -0.20 0.00 0.12 0.00 0.00 56.93 57.01 3lal s PHE 87 Cb -0.18 -1.69 -0.06 0.00 -0.57 0.00 0.00 43.02 40.52 3lal s PHE 87 CO 0.23 0.38 1.12 -0.46 -0.10 0.00 0.00 175.22 176.40 3lal s TRP 88 N -2.58 2.72 0.10 0.36 -0.00 -1.26 -4.94 118.94 113.35 3lal s TRP 88 Ca 0.37 1.55 -0.35 0.00 -0.00 0.00 0.00 56.10 57.66 3lal s TRP 88 Cb 0.03 -3.26 -0.15 0.00 -0.00 0.00 0.00 33.47 30.08 3lal s TRP 88 CO 0.20 -1.47 1.48 -1.91 -0.00 0.00 0.00 176.95 175.25 3lal n GLU 89 N -1.21 1.64 0.00 5.86 4.07 -1.26 -4.91 120.64 124.83 3lal n GLU 89 Ca 0.11 0.59 -0.02 0.00 -0.06 0.00 0.00 57.16 57.78 3lal n GLU 89 Cb 0.51 -2.30 -0.01 0.00 -0.06 0.00 0.00 31.44 29.58 3lal n GLU 89 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 3lal h VAL 90 N 3.59 0.00 -2.41 6.31 2.07 -1.94 -3.42 116.25 120.45 3lal h VAL 90 Ca -0.46 0.00 -0.25 0.00 0.82 0.00 0.00 66.70 66.81 3lal h VAL 90 Cb 1.30 0.00 -0.33 0.00 -1.52 0.00 0.00 31.29 30.73 3lal h VAL 90 CO 0.84 0.00 -0.56 -1.58 0.02 0.00 0.00 177.57 176.29 3lal s GLN 91 N -3.34 0.23 -0.50 1.57 2.00 -1.26 -5.05 119.66 113.31 3lal s GLN 91 Ca -0.02 0.42 -0.17 0.00 -2.00 0.00 0.00 55.36 53.59 3lal s GLN 91 Cb 0.01 -0.74 0.07 0.00 0.80 0.00 0.00 33.01 33.15 3lal s GLN 91 CO 0.08 -0.57 0.51 -0.51 -0.50 0.00 0.00 175.29 174.29 3lal s LEU 92 N 2.41 5.37 0.00 3.68 1.43 -1.26 -4.81 118.68 125.50 3lal s LEU 92 Ca 0.07 -1.18 0.00 0.00 -1.03 0.00 0.00 54.13 51.99 3lal s LEU 92 Cb -0.15 -2.30 0.00 0.00 0.03 0.00 0.00 46.19 43.77 3lal s LEU 92 CO -0.12 -0.78 0.00 0.61 0.23 0.00 0.00 176.35 176.29 3lal n GLY 93 N 5.20 2.34 3.32 -3.19 0.00 -1.26 -5.11 105.19 106.49 3lal n GLY 93 Ca -0.10 -1.63 -0.23 0.00 0.00 0.00 0.00 46.02 44.07 3lal n GLY 93 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3lal s ILE 94 N -1.35 1.81 0.59 -0.61 -4.36 -1.26 -5.11 121.20 110.90 3lal s ILE 94 Ca 0.00 -1.80 -0.20 0.00 -0.26 0.00 0.00 60.65 58.39 3lal s ILE 94 Cb 0.00 -1.76 -0.03 0.00 1.25 0.00 0.00 42.46 41.91 3lal s ILE 94 CO 0.00 -0.22 1.30 -2.84 0.24 0.00 0.00 174.94 173.41 3lal s PRO 95 N -2.50 2.91 -0.11 0.37 0.02 -1.26 -5.00 135.00 129.43 3lal s PRO 95 Ca 0.13 2.07 -0.03 0.00 0.02 0.00 0.00 61.00 63.19 3lal s PRO 95 Cb -0.07 -2.05 -0.03 0.00 0.02 0.00 0.00 34.50 32.37 3lal s PRO 95 CO 0.06 -1.32 0.02 -1.58 -0.33 0.00 0.00 177.00 173.85 3lal s HIS 96 N -1.40 3.20 0.36 6.54 2.46 -1.26 -5.01 115.29 120.18 3lal s HIS 96 Ca 0.77 0.14 0.12 0.00 0.47 0.00 0.00 55.06 56.56 3lal s HIS 96 Cb -0.37 -1.87 0.92 0.00 -0.13 0.00 0.00 32.58 31.14 3lal s HIS 96 CO 0.41 0.38 1.81 -1.35 -2.47 0.00 0.00 174.74 173.52 3lal h PRO 97 N 5.59 0.56 0.00 2.88 0.11 -1.98 0.13 132.00 139.28 3lal h PRO 97 Ca -0.46 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3lal h PRO 97 Cb 1.19 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.17 3lal h PRO 97 CO 0.58 0.37 0.00 0.00 -0.21 0.00 0.00 178.00 178.74 3lal h ALA 98 N 1.63 1.00 -0.00 -0.75 0.00 -1.85 -0.81 119.26 118.47 3lal h ALA 98 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.45 3lal h ALA 98 Cb 1.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3lal h ALA 98 CO -0.29 0.00 -0.64 0.41 0.00 0.00 0.00 179.25 178.73 3lal n GLY 99 N -0.96 -1.08 3.77 0.00 0.00 0.46 -4.05 105.19 103.33 3lal n GLY 99 Ca -0.02 -0.44 -0.39 0.00 0.00 0.00 0.00 46.02 45.17 3lal n GLY 99 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3lal s LEU 100 N -2.95 4.35 0.31 0.99 1.43 -0.31 -4.74 118.68 117.77 3lal s LEU 100 Ca 0.11 2.32 -0.24 0.00 -1.03 0.00 0.00 54.13 55.29 3lal s LEU 100 Cb 0.17 -3.85 -0.10 0.00 0.03 0.00 0.00 46.19 42.45 3lal s LEU 100 CO 0.74 -0.43 0.88 -0.54 0.23 0.00 0.00 176.35 177.23 3lal s LYS 101 N -1.93 4.45 0.34 1.70 1.02 -1.26 -0.44 119.74 123.62 3lal s LYS 101 Ca 0.51 1.18 -0.29 0.00 0.02 0.00 0.00 55.97 57.39 3lal s LYS 101 Cb -0.31 -2.75 -0.11 0.00 -0.52 0.00 0.00 37.83 34.14 3lal s LYS 101 CO 0.40 0.28 1.50 0.21 -0.92 0.00 0.00 175.35 176.82 3lal s LYS 102 N -2.16 4.14 0.02 1.68 2.20 -1.26 -4.86 119.74 119.50 3lal s LYS 102 Ca 0.50 2.53 0.07 0.00 -0.36 0.00 0.00 55.97 58.71 3lal s LYS 102 Cb -0.17 -3.00 -0.02 0.00 -1.51 0.00 0.00 37.83 33.13 3lal s LYS 102 CO 0.22 -0.53 -0.22 0.15 -0.36 0.00 0.00 175.35 174.61 3lal s LYS 103 N -1.51 1.60 0.08 4.03 -0.14 -1.26 -5.01 119.74 117.53 3lal s LYS 103 Ca 0.56 -0.90 -0.20 0.00 -1.36 0.00 0.00 55.97 54.07 3lal s LYS 103 Cb -0.46 -1.65 -0.10 0.00 -1.68 0.00 0.00 37.83 33.94 3lal s LYS 103 CO 0.57 0.44 1.58 -0.22 -0.76 0.00 0.00 175.35 176.96 3lal h LYS 104 N 5.16 0.30 -4.94 1.68 3.64 -1.81 -3.44 116.57 117.16 3lal h LYS 104 Ca -0.42 -0.07 -0.55 0.00 -1.27 0.00 0.00 60.65 58.34 3lal h LYS 104 Cb 1.15 -0.04 -0.33 0.00 -0.41 0.00 0.00 32.23 32.60 3lal h LYS 104 CO 0.45 0.42 -0.83 -1.12 -2.27 0.00 0.00 179.45 176.10 3lal s SER 105 N -5.68 2.09 -0.02 4.20 0.01 -0.63 -5.01 113.70 108.66 3lal s SER 105 Ca -0.14 -0.35 0.03 0.00 1.31 0.00 0.00 55.95 56.80 3lal s SER 105 Cb 0.07 -0.82 -0.00 0.00 0.21 0.00 0.00 66.02 65.48 3lal s SER 105 CO 0.71 0.10 -0.11 0.68 0.41 0.00 0.00 173.24 175.03 3lal s VAL 106 N 0.38 0.87 -0.02 3.43 -7.23 -1.26 -1.33 120.40 115.23 3lal s VAL 106 Ca -0.11 -0.45 0.04 0.00 -1.81 0.00 0.00 61.98 59.65 3lal s VAL 106 Cb -0.14 -0.74 -0.01 0.00 0.56 0.00 0.00 36.38 36.05 3lal s VAL 106 CO 0.04 0.25 -0.13 -0.89 -0.31 0.00 0.00 175.10 174.06 3lal s THR 107 N -0.09 1.09 -0.17 5.32 2.01 0.17 -4.98 115.64 118.99 3lal s THR 107 Ca 0.01 -0.57 -0.11 0.00 0.31 0.00 0.00 61.69 61.34 3lal s THR 107 Cb -0.06 -0.93 -0.05 0.00 0.01 0.00 0.00 72.50 71.47 3lal s THR 107 CO -0.00 0.32 0.18 0.54 -0.69 0.00 0.00 174.62 174.96 3lal s VAL 108 N -0.13 5.39 -0.27 3.82 0.11 -1.26 -0.56 120.40 127.50 3lal s VAL 108 Ca 0.02 0.30 0.01 0.00 -2.93 0.00 0.00 61.98 59.37 3lal s VAL 108 Cb -0.07 -3.50 0.07 0.00 -1.53 0.00 0.00 36.38 31.35 3lal s VAL 108 CO 0.00 0.46 -0.02 -0.76 -3.33 0.00 0.00 175.10 171.46 3lal s LEU 109 N 0.13 2.97 -0.17 2.54 1.43 0.49 -4.63 118.68 121.43 3lal s LEU 109 Ca 0.12 -1.43 -0.16 0.00 -1.03 0.00 0.00 54.13 51.63 3lal s LEU 109 Cb -0.12 -1.24 -0.04 0.00 0.03 0.00 0.00 46.19 44.82 3lal s LEU 109 CO 0.01 -0.28 0.39 1.51 0.23 0.00 0.00 176.35 178.20 3lal s ASP 110 N 1.32 6.51 0.10 2.29 1.47 -1.26 0.16 116.67 127.26 3lal s ASP 110 Ca -0.01 0.60 -0.31 0.00 1.18 0.00 0.00 52.55 54.01 3lal s ASP 110 Cb -0.19 -2.23 -0.07 0.00 -0.34 0.00 0.00 42.92 40.09 3lal s ASP 110 CO -0.09 -0.00 1.30 -0.69 0.68 0.00 0.00 175.17 176.37 3lal s VAL 111 N 0.87 3.58 0.06 2.11 1.01 0.07 -4.21 120.40 123.89 3lal s VAL 111 Ca 0.20 1.16 -0.24 0.00 0.00 0.00 0.00 61.98 63.10 3lal s VAL 111 Cb -0.14 -3.74 -0.06 0.00 0.00 0.00 0.00 36.38 32.44 3lal s VAL 111 CO 0.07 0.10 0.72 -0.83 0.00 0.00 0.00 175.10 175.16 3lal s GLY 112 N 0.98 2.77 -1.41 4.51 0.00 -1.17 -4.08 107.32 108.93 3lal s GLY 112 Ca 0.61 0.23 -0.02 0.00 0.00 0.00 0.00 44.72 45.54 3lal s GLY 112 CO 0.31 0.93 0.54 1.22 0.00 0.00 0.00 173.10 176.10 3lal n ASP 113 N 2.45 -0.92 -0.08 1.64 10.43 -1.26 -4.66 116.55 124.15 3lal n ASP 113 Ca -0.05 -0.95 -0.09 0.00 2.57 0.00 0.00 54.79 56.28 3lal n ASP 113 Cb 0.50 -3.32 -0.03 0.00 1.84 0.00 0.00 41.12 40.12 3lal n ASP 113 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3lal h ALA 114 N 0.86 -0.25 -0.27 2.24 0.00 -1.97 -0.28 119.26 119.59 3lal h ALA 114 Ca -0.62 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.34 3lal h ALA 114 Cb 1.37 0.67 -0.01 0.00 0.00 0.00 0.00 17.79 19.82 3lal h ALA 114 CO 0.62 -0.75 0.07 1.88 0.00 0.00 0.00 179.25 181.07 3lal h TYR 115 N -0.30 0.44 0.00 0.00 -1.99 -1.90 -2.70 116.97 110.52 3lal h TYR 115 Ca 0.14 -0.05 0.00 0.00 2.00 0.00 0.00 58.73 60.82 3lal h TYR 115 Cb 0.54 -0.12 0.00 0.00 2.00 0.00 0.00 36.73 39.14 3lal h TYR 115 CO -0.49 0.49 0.00 1.19 -0.00 0.00 0.00 178.16 179.35 3lal n PHE 116 N -4.71 0.35 1.20 4.88 0.99 -0.92 -2.11 117.46 117.13 3lal n PHE 116 Ca -0.03 0.14 0.10 0.00 -0.00 0.00 0.00 57.45 57.66 3lal n PHE 116 Cb 0.17 -0.72 0.36 0.00 -1.00 0.00 0.00 39.48 38.29 3lal n PHE 116 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.76 177.19 3lal n SER 117 N -1.82 1.70 -4.01 4.37 7.64 -0.16 -4.71 113.62 116.63 3lal n SER 117 Ca 0.03 -1.72 -0.25 0.00 1.01 0.00 0.00 58.87 57.93 3lal n SER 117 Cb 0.19 -0.11 -0.17 0.00 -1.01 0.00 0.00 64.21 63.11 3lal n SER 117 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3lal s VAL 118 N -1.78 1.15 0.69 0.44 1.01 -0.90 -0.64 120.40 120.37 3lal s VAL 118 Ca 0.32 -0.46 -0.16 0.00 0.00 0.00 0.00 61.98 61.67 3lal s VAL 118 Cb 0.17 -1.07 0.01 0.00 0.00 0.00 0.00 36.38 35.50 3lal s VAL 118 CO 0.26 0.36 1.21 -2.16 0.00 0.00 0.00 175.10 174.78 3lal s PRO 119 N 0.84 2.41 -0.07 2.72 0.04 -1.26 -1.93 135.00 137.74 3lal s PRO 119 Ca -0.11 1.79 -0.02 0.00 0.04 0.00 0.00 61.00 62.70 3lal s PRO 119 Cb -0.15 -1.86 -0.03 0.00 0.04 0.00 0.00 34.50 32.49 3lal s PRO 119 CO 0.02 -1.64 0.03 -1.17 0.04 0.00 0.00 177.00 174.28 3lal s LEU 120 N -4.81 3.72 -0.40 -3.56 0.20 0.56 -4.60 118.68 109.79 3lal s LEU 120 Ca 0.76 0.17 -0.43 0.00 0.69 0.00 0.00 54.13 55.32 3lal s LEU 120 Cb -0.30 -1.92 -0.17 0.00 -0.43 0.00 0.00 46.19 43.36 3lal s LEU 120 CO 0.42 0.36 1.79 -0.67 -0.29 0.00 0.00 176.35 177.96 3lal n ASP 121 N 1.94 1.69 -0.26 3.68 2.03 -1.26 -4.78 116.55 119.60 3lal n ASP 121 Ca -0.18 1.00 0.06 0.00 0.52 0.00 0.00 54.79 56.19 3lal n ASP 121 Cb 0.54 -1.02 0.19 0.00 -0.72 0.00 0.00 41.12 40.11 3lal n ASP 121 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 3lal h GLU 122 N 7.15 0.23 0.00 -0.67 4.81 -1.95 0.57 114.58 124.72 3lal h GLU 122 Ca -0.38 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.83 3lal h GLU 122 Cb 1.35 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.68 3lal h GLU 122 CO 0.99 0.15 0.00 -0.25 -0.73 0.00 0.00 179.01 179.18 3lal n ASP 123 N -5.19 0.00 -0.01 1.04 8.00 -1.26 -2.37 116.55 116.76 3lal n ASP 123 Ca 0.15 0.24 0.08 0.00 0.71 0.00 0.00 54.79 55.97 3lal n ASP 123 Cb 0.49 -0.37 -0.12 0.00 -0.02 0.00 0.00 41.12 41.10 3lal n ASP 123 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 3lal n PHE 124 N -1.37 0.00 -0.15 1.24 7.35 0.20 -4.60 117.46 120.13 3lal n PHE 124 Ca 0.05 0.00 0.13 0.00 -0.76 0.00 0.00 57.45 56.88 3lal n PHE 124 Cb 0.13 -0.29 0.48 0.00 0.35 0.00 0.00 39.48 40.15 3lal n PHE 124 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3lal h ARG 125 N 0.00 0.45 0.00 -4.13 3.08 -1.13 -1.74 114.38 110.91 3lal h ARG 125 Ca 0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.02 3lal h ARG 125 Cb 0.67 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.61 3lal h ARG 125 CO 0.00 0.30 0.00 1.57 -1.07 0.00 0.00 179.97 180.77 3lal h LYS 126 N 0.47 0.00 -0.00 0.04 2.10 -1.81 0.02 116.57 117.38 3lal h LYS 126 Ca 0.35 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.00 3lal h LYS 126 Cb 0.71 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.04 3lal h LYS 126 CO -0.11 0.00 -0.09 0.66 -2.00 0.00 0.00 179.45 177.90 3lal n TYR 127 N -2.85 0.00 0.87 0.07 4.01 -0.65 -3.36 117.16 115.25 3lal n TYR 127 Ca -0.00 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.86 3lal n TYR 127 Cb 0.19 -0.16 0.16 0.00 -0.31 0.00 0.00 39.34 39.22 3lal n TYR 127 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 3lal n THR 128 N -0.90 0.12 -1.61 -0.72 -2.24 -0.01 -4.71 114.28 104.22 3lal n THR 128 Ca 0.15 -0.54 -0.54 0.00 -2.27 0.00 0.00 64.05 60.85 3lal n THR 128 Cb 0.27 1.29 -0.06 0.00 -2.10 0.00 0.00 70.33 69.73 3lal n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3lal n ALA 129 N 1.30 -0.99 -2.34 6.98 0.00 -1.22 -4.41 120.51 119.82 3lal n ALA 129 Ca 0.16 0.50 -0.17 0.00 0.00 0.00 0.00 53.44 53.92 3lal n ALA 129 Cb 0.58 -2.08 -0.10 0.00 0.00 0.00 0.00 19.45 17.85 3lal n ALA 129 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 3lal s PHE 130 N 1.08 1.61 -0.05 0.00 -0.71 -0.53 -1.63 117.98 117.75 3lal s PHE 130 Ca 0.88 -1.13 0.01 0.00 -1.04 0.00 0.00 56.93 55.65 3lal s PHE 130 Cb -1.00 -0.96 0.02 0.00 -1.21 0.00 0.00 43.02 39.86 3lal s PHE 130 CO 0.51 -0.26 -0.06 0.95 -1.34 0.00 0.00 175.22 175.03 3lal s THR 131 N -3.66 0.64 -0.33 -4.49 -4.23 -1.26 -1.94 115.64 100.36 3lal s THR 131 Ca 0.37 -0.17 -0.21 0.00 -1.18 0.00 0.00 61.69 60.50 3lal s THR 131 Cb 0.08 -0.65 -0.00 0.00 1.34 0.00 0.00 72.50 73.27 3lal s THR 131 CO 0.14 0.25 0.68 -0.63 -0.54 0.00 0.00 174.62 174.51 3lal s ILE 132 N 0.94 4.87 0.41 2.99 1.01 0.12 -4.65 121.20 126.88 3lal s ILE 132 Ca -0.11 0.80 -0.25 0.00 0.00 0.00 0.00 60.65 61.10 3lal s ILE 132 Cb -0.14 -4.08 -0.08 0.00 0.01 0.00 0.00 42.46 38.16 3lal s ILE 132 CO 0.00 -0.26 1.16 -2.16 0.00 0.00 0.00 174.94 173.68 3lal s PRO 133 N 2.77 4.02 0.85 2.79 0.04 -1.26 -0.98 135.00 143.23 3lal s PRO 133 Ca 0.27 1.80 -0.11 0.00 0.04 0.00 0.00 61.00 63.00 3lal s PRO 133 Cb -0.14 -2.62 0.10 0.00 0.04 0.00 0.00 34.50 31.87 3lal s PRO 133 CO 0.14 -0.34 1.09 -1.54 0.04 0.00 0.00 177.00 176.39 3lal s SER 134 N -1.20 3.89 0.09 6.66 1.04 -1.26 -4.89 113.70 118.03 3lal s SER 134 Ca 0.58 1.56 -0.34 0.00 0.48 0.00 0.00 55.95 58.23 3lal s SER 134 Cb -0.30 -2.26 -0.14 0.00 0.10 0.00 0.00 66.02 63.43 3lal s SER 134 CO 0.37 -2.39 1.62 -0.38 0.98 0.00 0.00 173.24 173.45 3lal n ILE 135 N -3.73 0.13 -0.80 -1.02 5.41 -1.26 0.56 119.36 118.65 3lal n ILE 135 Ca 0.08 -0.02 -0.04 0.00 1.00 0.00 0.00 62.75 63.76 3lal n ILE 135 Cb 0.55 -1.54 -0.02 0.00 -0.71 0.00 0.00 39.64 37.92 3lal n ILE 135 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 3lal n ASN 136 N 4.06 -2.06 -1.36 4.38 3.02 -1.26 -2.55 115.26 119.49 3lal n ASN 136 Ca 0.18 0.09 -0.13 0.00 -0.03 0.00 0.00 54.58 54.70 3lal n ASN 136 Cb 0.28 -1.83 -0.02 0.00 -0.61 0.00 0.00 39.78 37.61 3lal n ASN 136 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3lal n ASN 137 N 0.84 -4.14 0.09 6.41 5.15 0.19 -4.90 115.26 118.91 3lal n ASN 137 Ca -0.04 0.06 -0.13 0.00 -0.60 0.00 0.00 54.58 53.87 3lal n ASN 137 Cb 0.21 -3.21 -0.10 0.00 -0.53 0.00 0.00 39.78 36.15 3lal n ASN 137 CO 0.00 0.00 0.00 -0.08 1.40 0.00 0.00 177.26 178.58 3lal h GLU 138 N 0.00 0.25 -6.07 1.20 4.57 -1.69 -3.46 114.58 109.39 3lal h GLU 138 Ca -0.30 -0.37 -0.55 0.00 -1.18 0.00 0.00 59.36 56.96 3lal h GLU 138 Cb 1.14 0.13 -0.08 0.00 -0.16 0.00 0.00 28.75 29.78 3lal h GLU 138 CO 0.37 1.13 -0.55 0.95 -1.18 0.00 0.00 179.01 179.73 3lal s THR 139 N -2.86 2.90 0.27 0.32 -4.23 -1.26 -5.10 115.64 105.67 3lal s THR 139 Ca -0.04 -1.75 -0.30 0.00 -1.18 0.00 0.00 61.69 58.42 3lal s THR 139 Cb 0.08 -2.94 -0.13 0.00 1.34 0.00 0.00 72.50 70.85 3lal s THR 139 CO 0.86 -0.18 1.28 -2.65 -0.54 0.00 0.00 174.62 173.40 3lal n PRO 140 N -1.11 1.84 -1.97 3.99 -0.02 -1.26 -4.18 135.00 132.28 3lal n PRO 140 Ca -0.03 0.65 -0.29 0.00 -2.02 0.00 0.00 63.50 61.80 3lal n PRO 140 Cb 0.62 -2.22 0.17 0.00 -0.02 0.00 0.00 33.50 32.05 3lal n PRO 140 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3lal s GLY 141 N -0.06 1.77 -0.22 -1.23 0.00 -1.26 -4.64 107.32 101.68 3lal s GLY 141 Ca 0.64 -1.19 -0.12 0.00 0.00 0.00 0.00 44.72 44.04 3lal s GLY 141 CO 0.55 -0.46 0.24 -0.42 0.00 0.00 0.00 173.10 173.01 3lal s ILE 142 N -3.82 5.31 -0.14 0.90 1.01 -0.15 -4.87 121.20 119.44 3lal s ILE 142 Ca 0.73 0.37 -0.01 0.00 0.00 0.00 0.00 60.65 61.73 3lal s ILE 142 Cb -0.04 -3.58 -0.01 0.00 0.01 0.00 0.00 42.46 38.84 3lal s ILE 142 CO 0.52 0.33 -0.12 -0.13 0.00 0.00 0.00 174.94 175.54 3lal s ARG 143 N 1.03 3.38 0.30 2.79 0.52 -1.26 0.11 118.95 125.82 3lal s ARG 143 Ca 0.12 -0.68 0.08 0.00 -0.52 0.00 0.00 55.73 54.73 3lal s ARG 143 Cb -0.14 -2.69 -0.06 0.00 0.52 0.00 0.00 34.95 32.59 3lal s ARG 143 CO 0.05 0.14 -0.08 0.71 0.02 0.00 0.00 175.30 176.14 3lal s TYR 144 N 0.54 2.11 0.04 -0.53 2.02 -0.82 0.08 117.35 120.80 3lal s TYR 144 Ca -0.08 -0.61 0.02 0.00 -0.37 0.00 0.00 57.07 56.03 3lal s TYR 144 Cb -0.16 -1.19 -0.02 0.00 -0.40 0.00 0.00 41.96 40.19 3lal s TYR 144 CO 0.04 0.40 -0.07 1.14 -1.57 0.00 0.00 175.55 175.49 3lal s GLN 145 N -3.68 0.52 0.35 -0.62 -2.07 -0.01 -1.45 119.66 112.71 3lal s GLN 145 Ca 0.30 -0.78 -0.27 0.00 -1.82 0.00 0.00 55.36 52.80 3lal s GLN 145 Cb 0.03 -0.25 -0.09 0.00 -1.09 0.00 0.00 33.01 31.61 3lal s GLN 145 CO 0.13 0.04 1.18 0.71 -1.32 0.00 0.00 175.29 176.03 3lal s TYR 146 N -1.51 3.22 -0.65 9.60 2.02 -1.26 -0.53 117.35 128.24 3lal s TYR 146 Ca -0.09 1.56 0.14 0.00 -0.37 0.00 0.00 57.07 58.31 3lal s TYR 146 Cb -0.09 -3.43 -0.15 0.00 -0.40 0.00 0.00 41.96 37.89 3lal s TYR 146 CO -0.00 -1.22 0.58 0.09 -1.57 0.00 0.00 175.55 173.43 3lal n ASN 147 N 0.58 0.66 -4.33 2.29 3.02 -0.18 -4.67 115.26 112.63 3lal n ASN 147 Ca 0.02 -0.82 -0.24 0.00 -0.03 0.00 0.00 54.58 53.50 3lal n ASN 147 Cb 0.45 1.00 -0.09 0.00 -0.61 0.00 0.00 39.78 40.53 3lal n ASN 147 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 3lal s VAL 148 N -2.30 0.92 -0.16 2.41 -7.23 -1.22 -0.33 120.40 112.49 3lal s VAL 148 Ca 0.05 -2.00 -0.29 0.00 -1.81 0.00 0.00 61.98 57.93 3lal s VAL 148 Cb 0.10 -2.55 -0.04 0.00 0.56 0.00 0.00 36.38 34.46 3lal s VAL 148 CO 0.57 0.00 1.68 -0.76 -0.31 0.00 0.00 175.10 176.28 3lal s LEU 149 N -3.57 4.02 0.40 1.32 1.43 -0.81 -4.60 118.68 116.87 3lal s LEU 149 Ca 0.29 1.87 -0.25 0.00 -1.03 0.00 0.00 54.13 55.00 3lal s LEU 149 Cb 0.05 -3.53 -0.08 0.00 0.03 0.00 0.00 46.19 42.66 3lal s LEU 149 CO 0.14 -1.19 1.19 -2.84 0.23 0.00 0.00 176.35 173.88 3lal s PRO 150 N 4.58 4.03 0.18 1.29 0.02 -1.26 -4.05 135.00 139.78 3lal s PRO 150 Ca 0.75 1.89 -0.32 0.00 0.02 0.00 0.00 61.00 63.34 3lal s PRO 150 Cb -0.29 -2.68 -0.10 0.00 0.02 0.00 0.00 34.50 31.45 3lal s PRO 150 CO 0.30 -0.35 1.59 -0.65 -0.33 0.00 0.00 177.00 177.56 3lal s GLN 151 N -2.29 4.20 0.00 5.54 -1.52 -1.26 -3.02 119.66 121.31 3lal s GLN 151 Ca 0.57 2.41 0.00 0.00 -1.95 0.00 0.00 55.36 56.39 3lal s GLN 151 Cb -0.32 -3.14 0.00 0.00 -0.22 0.00 0.00 33.01 29.34 3lal s GLN 151 CO 0.40 -0.63 0.00 0.41 -0.25 0.00 0.00 175.29 175.23 3lal n GLY 152 N 3.71 1.25 3.82 3.09 0.00 -1.26 -4.82 105.19 110.98 3lal n GLY 152 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 3lal n GLY 152 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3lal s TRP 153 N -2.60 3.27 0.17 1.61 -0.00 -1.17 -4.72 118.94 115.51 3lal s TRP 153 Ca 0.00 1.52 -0.10 0.00 -0.00 0.00 0.00 56.10 57.52 3lal s TRP 153 Cb 0.00 -2.88 0.05 0.00 -0.00 0.00 0.00 33.47 30.64 3lal s TRP 153 CO 0.00 -0.53 1.63 -0.22 -0.00 0.00 0.00 176.95 177.83 3lal h LYS 154 N 1.09 1.03 -0.01 5.86 3.64 -1.93 -3.15 116.57 123.10 3lal h LYS 154 Ca -0.48 -0.33 0.00 0.00 -1.27 0.00 0.00 60.65 58.57 3lal h LYS 154 Cb 1.20 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 3lal h LYS 154 CO 0.60 1.02 -0.02 0.41 -2.27 0.00 0.00 179.45 179.19 3lal n GLY 155 N -0.40 -0.42 0.09 5.01 0.00 -1.26 -4.49 105.19 103.71 3lal n GLY 155 Ca 0.02 -0.35 -0.13 0.00 0.00 0.00 0.00 46.02 45.57 3lal n GLY 155 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3lal h SER 156 N 1.41 -0.07 -0.52 1.61 0.02 -1.85 -1.38 113.55 112.76 3lal h SER 156 Ca 0.00 -0.44 0.01 0.00 -0.84 0.00 0.00 61.79 60.53 3lal h SER 156 Cb 0.33 0.02 -0.03 0.00 0.14 0.00 0.00 62.40 62.86 3lal h SER 156 CO 0.00 0.42 0.35 1.55 -1.14 0.00 0.00 176.83 178.01 3lal h PRO 157 N -0.59 0.65 -0.07 3.45 0.13 -1.82 -0.78 132.00 132.98 3lal h PRO 157 Ca -0.01 -0.04 -0.13 0.00 -0.87 0.00 0.00 66.00 64.95 3lal h PRO 157 Cb 0.51 -0.15 0.01 0.00 0.13 0.00 0.00 31.00 31.50 3lal h PRO 157 CO 0.01 0.43 -0.47 0.00 -0.23 0.00 0.00 178.00 177.75 3lal h ALA 158 N 1.68 0.15 -0.10 -0.56 0.00 -1.83 -2.67 119.26 115.93 3lal h ALA 158 Ca 0.20 -0.50 -0.15 0.00 0.00 0.00 0.00 54.91 54.45 3lal h ALA 158 Cb -0.02 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3lal h ALA 158 CO -0.05 0.32 -0.59 0.82 0.00 0.00 0.00 179.25 179.75 3lal h ILE 159 N -0.02 1.37 0.49 0.00 2.04 -1.10 -2.13 117.51 118.16 3lal h ILE 159 Ca -0.04 -1.93 -0.02 0.00 1.00 0.00 0.00 64.86 63.87 3lal h ILE 159 Cb 1.13 1.94 0.00 0.00 -0.74 0.00 0.00 36.82 39.16 3lal h ILE 159 CO 0.10 0.58 -0.24 0.15 0.00 0.00 0.00 178.15 178.74 3lal h PHE 160 N 0.25 -0.61 -0.98 1.37 3.57 -1.21 -1.36 116.94 117.96 3lal h PHE 160 Ca -0.00 -0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.60 3lal h PHE 160 Cb 1.11 0.20 -0.08 0.00 2.79 0.00 0.00 35.95 39.97 3lal h PHE 160 CO 0.03 -0.37 0.62 1.96 -2.23 0.00 0.00 178.31 178.32 3lal h GLN 161 N -0.67 0.92 -0.03 1.11 1.08 -1.36 0.36 115.11 116.52 3lal h GLN 161 Ca -0.07 -0.06 -0.15 0.00 -1.45 0.00 0.00 58.65 56.93 3lal h GLN 161 Cb 0.51 -0.21 -0.02 0.00 -0.05 0.00 0.00 27.48 27.72 3lal h GLN 161 CO 0.11 0.61 -0.66 0.66 -0.95 0.00 0.00 178.83 178.60 3lal h SER 162 N 0.95 0.15 -0.38 1.46 4.64 -1.30 -1.86 113.55 117.20 3lal h SER 162 Ca 0.49 -0.09 -0.05 0.00 -0.47 0.00 0.00 61.79 61.66 3lal h SER 162 Cb 0.52 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.55 3lal h SER 162 CO -0.25 0.76 0.03 0.28 -0.87 0.00 0.00 176.83 176.78 3lal h SER 163 N 0.09 0.64 -0.34 4.97 0.02 0.16 -1.23 113.55 117.86 3lal h SER 163 Ca -0.01 -0.29 -0.03 0.00 -0.84 0.00 0.00 61.79 60.62 3lal h SER 163 Cb 1.18 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 63.53 3lal h SER 163 CO 0.09 0.76 0.13 -0.03 -1.14 0.00 0.00 176.83 176.65 3lal h MET 164 N 0.49 0.59 -0.32 3.45 -1.53 -0.88 -1.05 114.93 115.67 3lal h MET 164 Ca 0.11 -0.09 -0.16 0.00 -3.44 0.00 0.00 59.70 56.12 3lal h MET 164 Cb 0.42 -0.10 -0.01 0.00 -0.55 0.00 0.00 31.60 31.36 3lal h MET 164 CO 0.01 0.52 -0.44 1.15 0.14 0.00 0.00 176.91 178.29 3lal h THR 165 N 0.58 1.28 -0.21 -0.77 2.02 -1.00 0.23 112.91 115.04 3lal h THR 165 Ca 0.14 -1.62 -0.15 0.00 0.77 0.00 0.00 66.41 65.55 3lal h THR 165 Cb 0.18 1.49 0.00 0.00 -1.74 0.00 0.00 68.15 68.08 3lal h THR 165 CO -0.01 0.53 -0.47 0.11 0.37 0.00 0.00 175.52 176.05 3lal h LYS 166 N 0.67 0.69 -0.53 6.66 1.57 -0.92 -1.99 116.57 122.72 3lal h LYS 166 Ca 0.04 -0.46 -0.10 0.00 -1.87 0.00 0.00 60.65 58.26 3lal h LYS 166 Cb 1.02 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.37 3lal h LYS 166 CO 0.10 1.08 -0.07 0.82 -0.57 0.00 0.00 179.45 180.81 3lal h ILE 167 N 0.40 1.26 0.00 1.86 2.04 -1.10 -3.01 117.51 118.97 3lal h ILE 167 Ca 0.00 -1.20 -0.12 0.00 1.00 0.00 0.00 64.86 64.54 3lal h ILE 167 Cb 1.08 0.92 -0.02 0.00 -0.74 0.00 0.00 36.82 38.06 3lal h ILE 167 CO 0.10 0.42 -0.58 -0.07 0.00 0.00 0.00 178.15 178.02 3lal h LEU 168 N 0.88 0.00 -0.84 1.44 3.38 -0.53 -3.37 115.31 116.26 3lal h LEU 168 Ca 0.15 0.00 0.18 0.00 0.09 0.00 0.00 57.88 58.29 3lal h LEU 168 Cb 0.61 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.20 3lal h LEU 168 CO 0.04 0.58 -0.17 -0.08 0.09 0.00 0.00 178.44 178.90 3lal h GLU 169 N 0.00 0.01 -0.26 1.13 4.81 -1.21 -1.49 114.58 117.57 3lal h GLU 169 Ca -0.01 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.16 3lal h GLU 169 Cb 1.08 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.45 3lal h GLU 169 CO 0.08 0.01 -0.07 -1.35 -0.73 0.00 0.00 179.01 176.95 3lal h PRO 170 N 0.01 0.51 -0.04 0.92 0.11 -1.76 -1.28 132.00 130.47 3lal h PRO 170 Ca 0.42 -0.20 0.01 0.00 0.11 0.00 0.00 66.00 66.35 3lal h PRO 170 Cb 0.67 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 31.75 3lal h PRO 170 CO -0.85 0.73 0.06 0.35 -0.21 0.00 0.00 178.00 178.07 3lal h PHE 171 N 0.26 0.00 0.17 0.65 3.04 -1.55 0.25 116.94 119.76 3lal h PHE 171 Ca 0.07 0.00 -0.31 0.00 3.98 0.00 0.00 57.97 61.71 3lal h PHE 171 Cb 0.54 0.00 0.03 0.00 2.56 0.00 0.00 35.95 39.08 3lal h PHE 171 CO 0.05 0.00 -1.32 0.00 -2.02 0.00 0.00 178.31 175.02 3lal h ARG 172 N 0.00 0.57 -0.74 1.11 3.08 -0.62 -1.70 114.38 116.08 3lal h ARG 172 Ca 0.02 -0.84 -0.01 0.00 0.07 0.00 0.00 59.98 59.22 3lal h ARG 172 Cb 0.14 0.29 -0.04 0.00 0.08 0.00 0.00 29.97 30.44 3lal h ARG 172 CO -0.00 1.39 0.43 -0.22 -1.07 0.00 0.00 179.97 180.50 3lal h LYS 173 N 0.22 1.02 0.00 0.04 3.64 0.13 -2.75 116.57 118.88 3lal h LYS 173 Ca -0.21 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.07 3lal h LYS 173 Cb 2.00 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 33.62 3lal h LYS 173 CO 0.25 0.74 -0.25 1.96 -2.27 0.00 0.00 179.45 179.88 3lal h GLN 174 N 1.02 0.00 -2.17 1.90 4.20 -1.31 -3.38 115.11 115.37 3lal h GLN 174 Ca 0.26 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.40 3lal h GLN 174 Cb -0.00 0.00 -0.41 0.00 0.30 0.00 0.00 27.48 27.36 3lal h GLN 174 CO -0.05 0.00 -0.77 0.09 -0.67 0.00 0.00 178.83 177.44 3lal n ASN 175 N -2.95 3.11 0.06 1.46 3.02 -0.64 -4.88 115.26 114.45 3lal n ASN 175 Ca 0.03 -3.37 0.04 0.00 -0.03 0.00 0.00 54.58 51.26 3lal n ASN 175 Cb 0.53 -0.62 0.44 0.00 -0.61 0.00 0.00 39.78 39.52 3lal n ASN 175 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 3lal h PRO 176 N 3.57 0.40 0.00 3.52 0.13 -1.74 -1.92 132.00 135.95 3lal h PRO 176 Ca 0.14 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 3lal h PRO 176 Cb 0.68 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.72 3lal h PRO 176 CO 0.73 0.32 0.00 -0.25 -0.23 0.00 0.00 178.00 178.57 3lal n ASP 177 N -4.44 0.43 -4.55 1.44 10.43 -1.26 -4.67 116.55 113.92 3lal n ASP 177 Ca 0.01 0.67 -0.34 0.00 2.57 0.00 0.00 54.79 57.70 3lal n ASP 177 Cb 0.11 -0.74 -0.12 0.00 1.84 0.00 0.00 41.12 42.22 3lal n ASP 177 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 3lal s ILE 178 N -3.35 3.74 -0.14 0.53 1.01 -0.73 -4.61 121.20 117.66 3lal s ILE 178 Ca 0.00 -0.45 -0.04 0.00 0.00 0.00 0.00 60.65 60.16 3lal s ILE 178 Cb 0.06 -2.56 -0.03 0.00 0.01 0.00 0.00 42.46 39.93 3lal s ILE 178 CO 0.20 0.57 0.02 -0.69 0.00 0.00 0.00 174.94 175.04 3lal s VAL 179 N -0.41 4.44 -0.13 2.92 1.01 0.06 -4.97 120.40 123.32 3lal s VAL 179 Ca 0.06 -0.18 -0.02 0.00 0.00 0.00 0.00 61.98 61.84 3lal s VAL 179 Cb -0.12 -2.94 0.04 0.00 0.00 0.00 0.00 36.38 33.36 3lal s VAL 179 CO 0.02 0.53 0.02 -0.63 0.00 0.00 0.00 175.10 175.04 3lal s ILE 180 N -0.17 0.40 -0.17 2.22 1.01 -1.25 -0.94 121.20 122.30 3lal s ILE 180 Ca 0.06 -0.16 -0.12 0.00 0.00 0.00 0.00 60.65 60.43 3lal s ILE 180 Cb -0.12 -0.73 -0.05 0.00 0.01 0.00 0.00 42.46 41.57 3lal s ILE 180 CO 0.02 0.04 0.22 -0.31 0.00 0.00 0.00 174.94 174.91 3lal s TYR 181 N 1.94 3.45 -0.33 3.97 1.51 0.04 -4.92 117.35 123.02 3lal s TYR 181 Ca 0.03 0.49 -0.17 0.00 -1.01 0.00 0.00 57.07 56.40 3lal s TYR 181 Cb -0.14 -2.25 -0.01 0.00 -0.11 0.00 0.00 41.96 39.44 3lal s TYR 181 CO -0.07 0.28 0.47 -0.65 -1.11 0.00 0.00 175.55 174.48 3lal s GLN 182 N 0.34 3.70 -0.16 -0.62 -0.21 -1.26 -1.54 119.66 119.91 3lal s GLN 182 Ca 0.13 -0.13 -0.02 0.00 0.02 0.00 0.00 55.36 55.36 3lal s GLN 182 Cb -0.12 -3.77 0.05 0.00 1.00 0.00 0.00 33.01 30.16 3lal s GLN 182 CO 0.02 -0.55 0.01 -0.47 -2.12 0.00 0.00 175.29 172.17 3lal s TYR 183 N 2.28 1.10 0.00 0.91 5.04 -1.09 -5.03 117.35 120.57 3lal s TYR 183 Ca 0.17 -0.77 0.00 0.00 -2.44 0.00 0.00 57.07 54.04 3lal s TYR 183 Cb -0.16 -1.04 0.00 0.00 0.35 0.00 0.00 41.96 41.11 3lal s TYR 183 CO 0.12 -0.55 0.00 -1.33 -1.34 0.00 0.00 175.55 172.45 3lal n MET 184 N 5.03 0.00 -1.17 4.97 2.81 -1.26 -0.65 117.12 126.85 3lal n MET 184 Ca -0.09 0.00 -0.21 0.00 -1.81 0.00 0.00 57.70 55.59 3lal n MET 184 Cb 0.48 0.00 0.18 0.00 -0.71 0.00 0.00 33.22 33.17 3lal n MET 184 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 3lal n ASP 185 N 5.64 3.61 -4.59 7.83 5.68 -1.26 -4.92 116.55 128.55 3lal n ASP 185 Ca 0.00 -3.64 -0.27 0.00 -0.50 0.00 0.00 54.79 50.37 3lal n ASP 185 Cb 0.00 -0.81 -0.09 0.00 -1.14 0.00 0.00 41.12 39.08 3lal n ASP 185 CO 0.00 0.00 0.00 -1.81 -1.33 0.00 0.00 177.20 174.06 3lal s ASP 186 N -1.51 4.36 -0.05 -1.12 1.01 0.18 -0.75 116.67 118.78 3lal s ASP 186 Ca 0.55 -0.51 0.04 0.00 0.71 0.00 0.00 52.55 53.34 3lal s ASP 186 Cb 0.47 -0.79 0.00 0.00 1.01 0.00 0.00 42.92 43.61 3lal s ASP 186 CO 0.09 0.11 -0.16 -0.76 0.21 0.00 0.00 175.17 174.66 3lal s LEU 187 N -2.73 1.86 -0.18 1.23 1.43 0.12 -2.66 118.68 117.75 3lal s LEU 187 Ca 0.25 -0.36 -0.01 0.00 -1.03 0.00 0.00 54.13 52.98 3lal s LEU 187 Cb -0.09 -0.97 -0.00 0.00 0.03 0.00 0.00 46.19 45.15 3lal s LEU 187 CO 0.15 0.12 -0.12 -0.31 0.23 0.00 0.00 176.35 176.43 3lal s TYR 188 N 0.23 2.85 -0.09 0.29 4.12 -0.59 -0.38 117.35 123.78 3lal s TYR 188 Ca -0.08 -1.07 0.03 0.00 0.02 0.00 0.00 57.07 55.98 3lal s TYR 188 Cb -0.13 -1.97 0.01 0.00 -1.52 0.00 0.00 41.96 38.35 3lal s TYR 188 CO 0.03 -0.53 -0.20 0.08 0.02 0.00 0.00 175.55 174.95 3lal s VAL 189 N 1.09 1.74 0.01 0.71 1.01 0.28 -0.78 120.40 124.47 3lal s VAL 189 Ca 0.00 -0.83 -0.06 0.00 0.00 0.00 0.00 61.98 61.09 3lal s VAL 189 Cb -0.14 -1.53 -0.00 0.00 0.00 0.00 0.00 36.38 34.70 3lal s VAL 189 CO -0.03 0.49 0.11 -0.83 0.00 0.00 0.00 175.10 174.84 3lal s GLY 190 N 0.51 0.09 0.37 4.51 0.00 -0.12 0.46 107.32 113.14 3lal s GLY 190 Ca -0.16 -0.25 -0.08 0.00 0.00 0.00 0.00 44.72 44.24 3lal s GLY 190 CO 0.06 -0.37 0.63 -1.14 0.00 0.00 0.00 173.10 172.27 3lal n SER 191 N 1.41 -1.79 -1.78 1.64 3.41 -0.45 -0.76 113.62 115.31 3lal n SER 191 Ca -0.23 -2.78 -0.19 0.00 -0.26 0.00 0.00 58.87 55.41 3lal n SER 191 Cb 0.56 3.13 0.07 0.00 -0.26 0.00 0.00 64.21 67.71 3lal n SER 191 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3lal n ASP 192 N -1.58 4.56 -4.94 4.04 10.43 -1.26 -1.60 116.55 126.20 3lal n ASP 192 Ca -0.04 -3.78 -0.24 0.00 2.57 0.00 0.00 54.79 53.30 3lal n ASP 192 Cb 0.60 -0.47 -0.02 0.00 1.84 0.00 0.00 41.12 43.06 3lal n ASP 192 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 3lal s LEU 193 N -3.54 4.14 0.34 0.64 1.43 -1.26 -4.92 118.68 115.51 3lal s LEU 193 Ca 0.50 0.36 -0.21 0.00 -1.03 0.00 0.00 54.13 53.76 3lal s LEU 193 Cb 0.42 -3.18 -0.10 0.00 0.03 0.00 0.00 46.19 43.36 3lal s LEU 193 CO 0.01 -0.18 0.86 -1.83 0.23 0.00 0.00 176.35 175.45 3lal s GLU 194 N -3.97 4.27 0.01 1.70 4.04 -1.26 -4.45 118.70 119.04 3lal s GLU 194 Ca 0.38 1.03 -0.02 0.00 0.04 0.00 0.00 54.97 56.41 3lal s GLU 194 Cb -0.10 -2.51 -0.00 0.00 0.02 0.00 0.00 34.13 31.53 3lal s GLU 194 CO 0.32 0.16 0.08 -0.89 -1.84 0.00 0.00 175.26 173.10 3lal n ILE 195 N -0.04 -0.03 0.15 1.83 2.08 -1.26 -1.09 119.36 121.00 3lal n ILE 195 Ca 0.03 0.12 -0.15 0.00 0.56 0.00 0.00 62.75 63.31 3lal n ILE 195 Cb 0.52 -0.15 -0.09 0.00 -0.75 0.00 0.00 39.64 39.17 3lal n ILE 195 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 3lal h GLY 196 N 0.00 -1.19 2.00 7.39 0.00 -1.99 0.29 103.07 109.57 3lal h GLY 196 Ca 0.01 0.61 0.00 0.00 0.00 0.00 0.00 47.33 47.95 3lal h GLY 196 CO -0.05 -0.31 0.00 -1.06 0.00 0.00 0.00 176.54 175.12 3lal n GLN 197 N -5.18 0.11 -0.07 4.80 6.02 -0.25 -1.25 117.38 121.56 3lal n GLN 197 Ca -0.09 0.48 -0.06 0.00 -0.01 0.00 0.00 57.00 57.32 3lal n GLN 197 Cb 0.39 -1.76 -0.03 0.00 1.02 0.00 0.00 30.24 29.85 3lal n GLN 197 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 3lal h HIS 198 N 0.00 0.00 -1.32 1.08 2.76 -1.13 -2.81 115.15 113.72 3lal h HIS 198 Ca 0.00 0.00 0.39 0.00 -2.20 0.00 0.00 60.37 58.56 3lal h HIS 198 Cb 0.15 0.00 -0.09 0.00 1.55 0.00 0.00 27.41 29.03 3lal h HIS 198 CO 0.00 0.27 0.91 0.00 -1.30 0.00 0.00 177.93 177.80 3lal h ARG 199 N -1.00 0.11 -0.09 5.26 3.08 -0.17 0.42 114.38 121.99 3lal h ARG 199 Ca -0.05 -0.01 -0.09 0.00 0.07 0.00 0.00 59.98 59.91 3lal h ARG 199 Cb 0.51 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.53 3lal h ARG 199 CO -0.03 0.07 -0.29 1.15 -1.07 0.00 0.00 179.97 179.80 3lal h THR 200 N 0.12 1.40 -0.04 2.04 2.02 -1.30 -2.96 112.91 114.19 3lal h THR 200 Ca 0.71 -1.64 -0.08 0.00 0.77 0.00 0.00 66.41 66.17 3lal h THR 200 Cb 2.43 2.21 -0.01 0.00 -1.74 0.00 0.00 68.15 71.04 3lal h THR 200 CO -0.19 0.47 -0.33 0.11 0.37 0.00 0.00 175.52 175.96 3lal h LYS 201 N -0.10 0.07 0.76 6.66 1.79 -0.06 -2.48 116.57 123.22 3lal h LYS 201 Ca -0.01 -0.03 -0.04 0.00 -2.18 0.00 0.00 60.65 58.40 3lal h LYS 201 Cb 0.91 -0.01 0.01 0.00 -1.58 0.00 0.00 32.23 31.57 3lal h LYS 201 CO 0.06 0.40 -0.37 0.82 -1.08 0.00 0.00 179.45 179.28 3lal h ILE 202 N 0.07 0.22 -0.98 1.86 1.08 -0.69 -2.14 117.51 116.93 3lal h ILE 202 Ca 0.01 -0.07 0.16 0.00 -0.39 0.00 0.00 64.86 64.57 3lal h ILE 202 Cb 0.61 0.24 -0.10 0.00 -3.07 0.00 0.00 36.82 34.50 3lal h ILE 202 CO 0.04 0.01 0.59 -0.33 -0.69 0.00 0.00 178.15 177.77 3lal h GLU 203 N -1.08 0.78 -0.01 2.37 4.39 -1.42 0.38 114.58 120.00 3lal h GLU 203 Ca -0.10 -0.05 0.03 0.00 0.34 0.00 0.00 59.36 59.58 3lal h GLU 203 Cb 0.80 -0.18 -0.04 0.00 -0.10 0.00 0.00 28.75 29.23 3lal h GLU 203 CO 0.17 0.52 -0.22 0.93 -1.16 0.00 0.00 179.01 179.25 3lal h GLU 204 N 0.81 -0.33 0.07 2.33 5.08 -1.38 0.16 114.58 121.31 3lal h GLU 204 Ca 0.53 0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.94 3lal h GLU 204 Cb 0.73 0.08 -0.05 0.00 0.50 0.00 0.00 28.75 30.01 3lal h GLU 204 CO -0.35 -0.22 -0.37 1.25 -1.00 0.00 0.00 179.01 178.33 3lal h LEU 205 N -0.35 -1.08 -0.55 1.33 6.46 -0.05 0.26 115.31 121.34 3lal h LEU 205 Ca 0.06 0.13 0.11 0.00 -0.12 0.00 0.00 57.88 58.06 3lal h LEU 205 Cb 0.43 0.42 -0.09 0.00 -0.73 0.00 0.00 40.66 40.69 3lal h LEU 205 CO -0.21 -0.44 0.02 0.03 -0.62 0.00 0.00 178.44 177.22 3lal h ARG 206 N -0.57 0.13 -0.16 1.25 3.08 -0.16 0.23 114.38 118.19 3lal h ARG 206 Ca 0.04 -0.01 -0.06 0.00 0.07 0.00 0.00 59.98 60.02 3lal h ARG 206 Cb 0.62 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.63 3lal h ARG 206 CO -0.24 0.09 -0.17 1.96 -1.07 0.00 0.00 179.97 180.54 3lal h GLN 207 N 0.14 0.26 -0.36 0.04 1.08 0.16 0.37 115.11 116.80 3lal h GLN 207 Ca 0.28 -0.07 -0.13 0.00 -1.45 0.00 0.00 58.65 57.29 3lal h GLN 207 Cb 0.44 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.83 3lal h GLN 207 CO -0.45 0.43 -0.27 1.25 -0.95 0.00 0.00 178.83 178.84 3lal h HIS 208 N 0.24 0.96 -0.66 2.96 2.76 0.11 -1.93 115.15 119.59 3lal h HIS 208 Ca 0.05 -0.26 -0.00 0.00 -2.20 0.00 0.00 60.37 57.95 3lal h HIS 208 Cb 0.44 -0.21 -0.03 0.00 1.55 0.00 0.00 27.41 29.16 3lal h HIS 208 CO 0.01 1.04 0.40 -0.07 -1.30 0.00 0.00 177.93 178.00 3lal h LEU 209 N 0.60 0.78 -0.33 0.26 4.07 0.83 -2.94 115.31 118.58 3lal h LEU 209 Ca 0.07 -0.04 -0.14 0.00 0.08 0.00 0.00 57.88 57.85 3lal h LEU 209 Cb 0.84 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 42.37 3lal h LEU 209 CO 0.07 0.60 -0.33 0.25 -1.08 0.00 0.00 178.44 177.95 3lal h LEU 210 N 0.90 0.87 -1.67 1.67 5.85 -0.08 0.10 115.31 122.94 3lal h LEU 210 Ca 0.24 -0.47 0.00 0.00 0.84 0.00 0.00 57.88 58.49 3lal h LEU 210 Cb -0.04 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 40.75 3lal h LEU 210 CO -0.04 1.16 0.12 0.03 -0.34 0.00 0.00 178.44 179.36 3lal h ARG 211 N 0.59 0.00 -0.21 1.25 3.08 -1.18 -2.48 114.38 115.44 3lal h ARG 211 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 3lal h ARG 211 Cb 0.91 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.96 3lal h ARG 211 CO 0.08 0.00 0.00 0.91 -1.07 0.00 0.00 179.97 179.89 3lal n TRP 212 N -2.45 0.34 0.00 3.04 7.02 -0.66 -4.82 117.44 119.91 3lal n TRP 212 Ca -0.02 -0.56 0.00 0.00 -1.02 0.00 0.00 57.50 55.90 3lal n TRP 212 Cb 0.16 -0.07 0.00 0.00 -2.42 0.00 0.00 31.31 28.98 3lal n TRP 212 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3lal n GLY 213 N -0.01 1.79 3.43 6.99 0.00 -0.93 -4.19 105.19 112.27 3lal n GLY 213 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 3lal n GLY 213 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3lal s LEU 214 N 0.00 5.17 0.59 0.99 1.43 -0.07 -4.23 118.68 122.55 3lal s LEU 214 Ca 0.00 -1.02 -0.13 0.00 -1.03 0.00 0.00 54.13 51.96 3lal s LEU 214 Cb 0.00 -2.14 -0.05 0.00 0.03 0.00 0.00 46.19 44.03 3lal s LEU 214 CO 0.00 -0.48 1.02 0.42 0.23 0.00 0.00 176.35 177.53 3lal s THR 215 N 1.65 4.61 0.12 5.49 -4.23 -1.26 -3.27 115.64 118.74 3lal s THR 215 Ca 0.04 0.98 -0.18 0.00 -1.18 0.00 0.00 61.69 61.35 3lal s THR 215 Cb -0.20 -3.79 0.04 0.00 1.34 0.00 0.00 72.50 69.89 3lal s THR 215 CO 0.09 -0.98 0.45 0.42 -0.54 0.00 0.00 174.62 174.07 3lal s THR 216 N -2.98 0.05 0.46 3.99 -4.23 -1.26 -3.01 115.64 108.65 3lal s THR 216 Ca 0.57 -0.41 -0.25 0.00 -1.18 0.00 0.00 61.69 60.42 3lal s THR 216 Cb -0.11 -1.10 -0.08 0.00 1.34 0.00 0.00 72.50 72.56 3lal s THR 216 CO 0.46 -0.23 1.34 -2.84 -0.54 0.00 0.00 174.62 172.82 3lal s PRO 217 N -3.54 3.68 0.55 3.99 0.02 -1.26 -5.03 135.00 133.41 3lal s PRO 217 Ca 0.01 2.23 -0.04 0.00 0.02 0.00 0.00 61.00 63.22 3lal s PRO 217 Cb 0.01 -2.59 0.01 0.00 0.02 0.00 0.00 34.50 31.95 3lal s PRO 217 CO -0.10 -0.75 0.83 0.16 -0.33 0.00 0.00 177.00 176.80 3lal s ASP 218 N -0.76 5.58 0.33 2.53 -4.77 -1.26 -4.81 116.67 113.51 3lal s ASP 218 Ca 0.62 0.51 0.21 0.00 -3.30 0.00 0.00 52.55 50.59 3lal s ASP 218 Cb -0.40 -1.54 1.17 0.00 -1.09 0.00 0.00 42.92 41.06 3lal s ASP 218 CO 0.50 -1.00 1.31 0.29 0.70 0.00 0.00 175.17 176.96 3lal n LYS 219 N -2.44 -0.04 0.18 2.11 4.76 -1.26 0.48 118.16 121.94 3lal n LYS 219 Ca 0.04 1.10 0.12 0.00 -2.87 0.00 0.00 58.31 56.70 3lal n LYS 219 Cb 0.58 -2.06 0.17 0.00 -1.84 0.00 0.00 35.03 31.88 3lal n LYS 219 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 3lal h LYS 220 N 0.00 0.00 -0.22 1.97 3.64 -2.03 -3.26 116.57 116.67 3lal h LYS 220 Ca 0.72 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 60.10 3lal h LYS 220 Cb 2.07 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.89 3lal h LYS 220 CO -0.54 0.00 0.00 0.72 -2.27 0.00 0.00 179.45 177.36 3lal n HIS 221 N -2.86 0.53 -3.05 1.91 8.25 0.18 -4.95 115.22 115.22 3lal n HIS 221 Ca 0.03 -0.71 -0.40 0.00 -0.26 0.00 0.00 57.72 56.38 3lal n HIS 221 Cb 0.52 -0.16 -0.05 0.00 1.12 0.00 0.00 29.99 31.41 3lal n HIS 221 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 3lal s GLN 222 N -1.97 4.28 0.74 -0.41 -0.21 -0.85 -4.72 119.66 116.52 3lal s GLN 222 Ca 0.29 0.76 -0.14 0.00 0.02 0.00 0.00 55.36 56.29 3lal s GLN 222 Cb 0.21 -3.55 0.05 0.00 1.00 0.00 0.00 33.01 30.72 3lal s GLN 222 CO 0.09 -0.20 1.18 0.15 -2.12 0.00 0.00 175.29 174.39 3lal s LYS 223 N 1.75 2.11 0.17 2.91 1.02 -1.26 -5.04 119.74 121.39 3lal s LYS 223 Ca 0.33 1.64 0.09 0.00 0.02 0.00 0.00 55.97 58.04 3lal s LYS 223 Cb -0.16 -1.84 -0.04 0.00 -0.52 0.00 0.00 37.83 35.26 3lal s LYS 223 CO 0.12 -1.83 -0.09 -1.21 -0.92 0.00 0.00 175.35 171.41 3lal s GLU 224 N -4.09 2.07 0.55 1.68 0.41 -1.26 -4.66 118.70 113.41 3lal s GLU 224 Ca 0.71 -1.22 -0.21 0.00 -0.41 0.00 0.00 54.97 53.84 3lal s GLU 224 Cb -0.26 -2.19 -0.04 0.00 -1.78 0.00 0.00 34.13 29.86 3lal s GLU 224 CO 0.47 0.45 1.29 -2.14 -0.49 0.00 0.00 175.26 174.84 3lal s PRO 225 N -2.72 3.13 0.17 0.39 0.02 -1.26 -4.25 135.00 130.47 3lal s PRO 225 Ca 0.24 2.07 -0.30 0.00 0.02 0.00 0.00 61.00 63.03 3lal s PRO 225 Cb -0.09 -2.17 -0.08 0.00 0.02 0.00 0.00 34.50 32.18 3lal s PRO 225 CO 0.15 -1.15 1.20 -1.25 -0.33 0.00 0.00 177.00 175.62 3lal s PRO 226 N -3.01 4.48 0.02 5.54 0.04 -1.26 -5.04 135.00 135.77 3lal s PRO 226 Ca 0.73 1.87 -0.26 0.00 0.04 0.00 0.00 61.00 63.38 3lal s PRO 226 Cb -0.36 -3.25 -0.05 0.00 0.04 0.00 0.00 34.50 30.88 3lal s PRO 226 CO 0.42 -0.11 0.80 -0.06 0.04 0.00 0.00 177.00 178.09 3lal s PHE 227 N 0.09 3.69 -0.19 0.56 0.08 -0.47 -4.86 117.98 116.89 3lal s PHE 227 Ca 0.54 1.49 -0.11 0.00 0.12 0.00 0.00 56.93 58.97 3lal s PHE 227 Cb -0.32 -2.89 -0.05 0.00 -0.57 0.00 0.00 43.02 39.19 3lal s PHE 227 CO 0.36 0.18 0.17 -0.51 -0.10 0.00 0.00 175.22 175.31 3lal s LEU 228 N 0.32 4.23 -0.24 -0.37 1.02 -1.26 0.50 118.68 122.88 3lal s LEU 228 Ca 0.41 0.31 -0.09 0.00 0.02 0.00 0.00 54.13 54.78 3lal s LEU 228 Cb -0.20 -2.15 0.11 0.00 0.02 0.00 0.00 46.19 43.96 3lal s LEU 228 CO 0.23 0.17 0.53 0.86 0.02 0.00 0.00 176.35 178.16 3lal s TRP 229 N 0.31 -1.03 -1.69 0.29 -0.00 -0.84 -4.96 118.94 111.01 3lal s TRP 229 Ca 0.10 1.88 -0.14 0.00 -0.00 0.00 0.00 56.10 57.94 3lal s TRP 229 Cb -0.12 0.53 0.13 0.00 -0.00 0.00 0.00 33.47 34.02 3lal s TRP 229 CO -0.00 -0.56 0.51 -1.33 -0.00 0.00 0.00 176.95 175.58 3lal n MET 230 N 5.31 -1.92 -0.36 5.86 2.81 -1.26 -0.92 117.12 126.64 3lal n MET 230 Ca -0.11 0.24 0.00 0.00 -1.81 0.00 0.00 57.70 56.02 3lal n MET 230 Cb 0.50 -4.59 0.00 0.00 -0.71 0.00 0.00 33.22 28.42 3lal n MET 230 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3lal n GLY 231 N -1.61 0.79 3.44 3.03 0.00 -1.26 -5.05 105.19 104.54 3lal n GLY 231 Ca -0.05 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.75 3lal n GLY 231 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3lal s TYR 232 N -2.15 2.09 -0.23 1.61 2.02 -0.10 -1.50 117.35 119.10 3lal s TYR 232 Ca 0.00 -0.51 0.02 0.00 -0.37 0.00 0.00 57.07 56.21 3lal s TYR 232 Cb 0.00 -1.05 0.04 0.00 -0.40 0.00 0.00 41.96 40.55 3lal s TYR 232 CO 0.00 0.50 -0.14 -2.00 -1.57 0.00 0.00 175.55 172.34 3lal s GLU 233 N -3.61 2.58 -0.40 -0.62 2.12 0.19 -1.98 118.70 116.96 3lal s GLU 233 Ca 0.29 -1.12 -0.08 0.00 0.36 0.00 0.00 54.97 54.41 3lal s GLU 233 Cb -0.00 -2.78 0.07 0.00 0.26 0.00 0.00 34.13 31.68 3lal s GLU 233 CO 0.13 -0.42 0.23 -0.51 -0.54 0.00 0.00 175.26 174.14 3lal s LEU 234 N 1.19 5.02 0.44 2.70 1.43 0.18 -1.86 118.68 127.79 3lal s LEU 234 Ca -0.03 -1.48 0.05 0.00 -1.03 0.00 0.00 54.13 51.64 3lal s LEU 234 Cb -0.17 -1.95 0.01 0.00 0.03 0.00 0.00 46.19 44.11 3lal s LEU 234 CO -0.08 -0.50 0.62 -1.00 0.23 0.00 0.00 176.35 175.62 3lal s HIS 235 N 1.40 2.94 0.21 0.29 3.76 -0.05 -1.37 115.29 122.47 3lal s HIS 235 Ca 0.03 -0.17 -0.10 0.00 -0.15 0.00 0.00 55.06 54.67 3lal s HIS 235 Cb -0.22 -2.39 0.27 0.00 1.11 0.00 0.00 32.58 31.35 3lal s HIS 235 CO 0.02 -0.45 1.74 -1.35 -0.85 0.00 0.00 174.74 173.85 3lal h PRO 236 N 0.51 0.37 -0.36 8.40 0.11 -1.96 -3.20 132.00 135.87 3lal h PRO 236 Ca -0.43 -0.02 -0.28 0.00 0.11 0.00 0.00 66.00 65.38 3lal h PRO 236 Cb 1.28 -0.08 -0.32 0.00 0.11 0.00 0.00 31.00 31.99 3lal h PRO 236 CO 0.50 0.25 -0.86 -0.40 -0.21 0.00 0.00 178.00 177.28 3lal n ASP 237 N -5.01 2.65 -3.66 -2.05 5.68 -1.26 -4.48 116.55 108.42 3lal n ASP 237 Ca 0.08 -3.04 -0.01 0.00 -0.50 0.00 0.00 54.79 51.32 3lal n ASP 237 Cb 0.27 -0.41 -0.00 0.00 -1.14 0.00 0.00 41.12 39.83 3lal n ASP 237 CO 0.00 0.00 0.00 -1.59 -1.33 0.00 0.00 177.20 174.28 3lal s LYS 238 N -2.94 0.79 0.06 0.11 -2.85 -1.21 -4.67 119.74 109.02 3lal s LYS 238 Ca 0.39 -0.45 -0.17 0.00 -1.00 0.00 0.00 55.97 54.74 3lal s LYS 238 Cb 0.37 0.26 0.03 0.00 -2.06 0.00 0.00 37.83 36.44 3lal s LYS 238 CO -0.04 -0.36 0.40 1.67 0.10 0.00 0.00 175.35 177.11 3lal s TRP 239 N -2.70 -0.24 0.29 1.78 1.48 0.30 -0.87 118.94 118.99 3lal s TRP 239 Ca 0.15 0.13 -0.14 0.00 -1.06 0.00 0.00 56.10 55.19 3lal s TRP 239 Cb 0.01 0.21 0.01 0.00 -1.16 0.00 0.00 33.47 32.55 3lal s TRP 239 CO -0.00 -0.59 0.59 -0.08 -4.06 0.00 0.00 176.95 172.81 3lal s THR 240 N -2.75 0.00 0.78 0.66 -1.32 -0.78 0.16 115.64 112.38 3lal s THR 240 Ca -0.04 -1.26 -0.11 0.00 -1.21 0.00 0.00 61.69 59.07 3lal s THR 240 Cb -0.00 -2.34 0.06 0.00 -1.51 0.00 0.00 72.50 68.71 3lal s THR 240 CO -0.04 0.00 1.08 0.68 -2.21 0.00 0.00 174.62 174.13 3lal s VAL 241 N -3.55 3.37 0.62 5.08 -7.23 -1.26 0.54 120.40 117.97 3lal s VAL 241 Ca 0.19 0.45 -0.15 0.00 -1.81 0.00 0.00 61.98 60.67 3lal s VAL 241 Cb -0.03 -3.05 -0.03 0.00 0.56 0.00 0.00 36.38 33.84 3lal s VAL 241 CO 0.11 -0.58 1.06 -1.10 -0.31 0.00 0.00 175.10 174.27 3lal s GLN 242 N -4.99 3.22 0.22 4.82 -0.21 -0.56 -4.44 119.66 117.72 3lal s GLN 242 Ca 0.61 1.15 -0.32 0.00 0.02 0.00 0.00 55.36 56.81 3lal s GLN 242 Cb -0.16 -2.02 -0.13 0.00 1.00 0.00 0.00 33.01 31.70 3lal s GLN 242 CO 0.56 -0.88 1.53 -0.35 -2.12 0.00 0.00 175.29 174.03 3lal n PRO 243 N -2.29 2.28 -4.26 2.91 -0.04 -1.26 -4.96 135.00 127.37 3lal n PRO 243 Ca 0.08 0.82 -0.34 0.00 -0.04 0.00 0.00 63.50 64.02 3lal n PRO 243 Cb 0.53 -2.55 -0.15 0.00 -0.04 0.00 0.00 33.50 31.29 3lal n PRO 243 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3lal s ILE 244 N 0.39 3.00 -0.33 0.52 1.01 -1.26 -5.09 121.20 119.44 3lal s ILE 244 Ca 0.71 -0.64 -0.00 0.00 0.00 0.00 0.00 60.65 60.72 3lal s ILE 244 Cb -0.61 -2.31 0.08 0.00 0.01 0.00 0.00 42.46 39.62 3lal s ILE 244 CO 0.44 0.48 0.05 0.54 0.00 0.00 0.00 174.94 176.45 3lal s VAL 245 N 1.04 2.80 -0.22 2.92 0.11 -1.26 -5.07 120.40 120.71 3lal s VAL 245 Ca -0.00 -1.81 -0.29 0.00 -2.93 0.00 0.00 61.98 56.94 3lal s VAL 245 Cb -0.15 -2.79 -0.02 0.00 -1.53 0.00 0.00 36.38 31.89 3lal s VAL 245 CO -0.02 -0.36 1.51 -0.76 -3.33 0.00 0.00 175.10 172.15 3lal s LEU 246 N 1.12 3.94 0.33 2.54 1.43 -1.26 -4.97 118.68 121.81 3lal s LEU 246 Ca 0.01 1.57 -0.29 0.00 -1.03 0.00 0.00 54.13 54.39 3lal s LEU 246 Cb -0.20 -3.53 -0.11 0.00 0.03 0.00 0.00 46.19 42.37 3lal s LEU 246 CO -0.04 -1.15 1.47 -2.16 0.23 0.00 0.00 176.35 174.69 3lal s PRO 247 N 4.42 4.19 -0.12 1.29 0.04 -1.26 -5.00 135.00 138.55 3lal s PRO 247 Ca 0.67 2.45 -0.25 0.00 0.04 0.00 0.00 61.00 63.91 3lal s PRO 247 Cb -0.23 -3.03 -0.02 0.00 0.04 0.00 0.00 34.50 31.26 3lal s PRO 247 CO 0.27 -0.47 0.79 -1.21 0.04 0.00 0.00 177.00 176.42 3lal s GLU 248 N -1.36 4.36 -0.15 4.56 0.41 -1.26 -5.05 118.70 120.22 3lal s GLU 248 Ca 0.56 0.99 -0.14 0.00 -0.41 0.00 0.00 54.97 55.96 3lal s GLU 248 Cb -0.45 -3.52 0.04 0.00 -1.78 0.00 0.00 34.13 28.42 3lal s GLU 248 CO 0.54 -0.17 0.40 0.15 -0.49 0.00 0.00 175.26 175.69 3lal s LYS 249 N 1.59 0.47 0.10 1.61 1.02 -1.26 -5.02 119.74 118.26 3lal s LYS 249 Ca 0.39 0.54 -0.12 0.00 0.02 0.00 0.00 55.97 56.80 3lal s LYS 249 Cb -0.17 0.23 -0.15 0.00 -0.52 0.00 0.00 37.83 37.21 3lal s LYS 249 CO 0.16 -0.06 1.30 -0.44 -0.92 0.00 0.00 175.35 175.39 3lal h ASP 250 N 5.48 0.92 -3.31 2.83 3.45 -2.05 -3.44 116.42 120.31 3lal h ASP 250 Ca -0.27 -0.62 -0.57 0.00 0.43 0.00 0.00 57.03 56.00 3lal h ASP 250 Cb 1.18 -0.27 -0.34 0.00 -0.56 0.00 0.00 39.33 39.34 3lal h ASP 250 CO 0.26 1.42 -0.83 -0.44 -1.57 0.00 0.00 179.24 178.08 3lal s SER 251 N -7.13 2.32 -0.18 6.45 0.01 -1.26 -5.01 113.70 108.90 3lal s SER 251 Ca -0.10 -0.40 -0.08 0.00 1.31 0.00 0.00 55.95 56.68 3lal s SER 251 Cb 0.08 -1.04 -0.04 0.00 0.21 0.00 0.00 66.02 65.23 3lal s SER 251 CO 0.91 0.03 0.08 0.26 0.41 0.00 0.00 173.24 174.92 3lal s TRP 252 N 0.89 3.31 0.31 2.43 0.52 -1.26 -5.02 118.94 120.12 3lal s TRP 252 Ca -0.09 0.18 0.01 0.00 0.02 0.00 0.00 56.10 56.22 3lal s TRP 252 Cb -0.15 -2.08 -0.03 0.00 -1.15 0.00 0.00 33.47 30.05 3lal s TRP 252 CO 0.00 0.24 0.49 0.95 0.02 0.00 0.00 176.95 178.65 3lal s THR 253 N 0.23 5.15 0.20 2.01 -4.23 -1.26 0.32 115.64 118.06 3lal s THR 253 Ca 0.05 -0.58 -0.19 0.00 -1.18 0.00 0.00 61.69 59.80 3lal s THR 253 Cb -0.12 -3.85 0.17 0.00 1.34 0.00 0.00 72.50 70.04 3lal s THR 253 CO -0.00 -0.47 1.58 0.58 -0.54 0.00 0.00 174.62 175.76 3lal h VAL 254 N 0.92 0.12 -0.93 2.29 2.07 -0.57 0.13 116.25 120.28 3lal h VAL 254 Ca -0.50 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.17 3lal h VAL 254 Cb 1.22 0.12 -0.10 0.00 -1.52 0.00 0.00 31.29 31.01 3lal h VAL 254 CO 0.62 0.00 0.53 -1.13 0.02 0.00 0.00 177.57 177.61 3lal h ASN 255 N -0.10 0.69 -0.20 0.57 -0.00 -1.58 0.99 115.58 115.95 3lal h ASN 255 Ca 0.27 0.08 -0.13 0.00 -0.00 0.00 0.00 56.30 56.53 3lal h ASN 255 Cb 0.57 -0.04 -0.01 0.00 -0.00 0.00 0.00 38.32 38.84 3lal h ASN 255 CO -0.79 0.30 -0.34 0.44 -0.00 0.00 0.00 177.43 177.05 3lal h ASP 256 N 0.75 0.74 0.48 1.15 3.45 -1.11 -1.84 116.42 120.04 3lal h ASP 256 Ca 0.51 -0.31 -0.20 0.00 0.43 0.00 0.00 57.03 57.46 3lal h ASP 256 Cb 0.69 -0.21 -0.01 0.00 -0.56 0.00 0.00 39.33 39.25 3lal h ASP 256 CO -0.35 1.02 -0.86 0.40 -1.57 0.00 0.00 179.24 177.88 3lal h ILE 257 N 0.60 1.45 -0.37 0.35 2.04 -0.25 -1.30 117.51 120.03 3lal h ILE 257 Ca 0.06 -2.49 -0.04 0.00 1.00 0.00 0.00 64.86 63.39 3lal h ILE 257 Cb 0.86 2.39 -0.01 0.00 -0.74 0.00 0.00 36.82 39.31 3lal h ILE 257 CO 0.07 0.73 0.06 1.56 0.00 0.00 0.00 178.15 180.57 3lal h GLN 258 N 0.16 0.62 -0.35 2.37 4.20 -0.73 -0.50 115.11 120.88 3lal h GLN 258 Ca -0.05 -0.17 -0.13 0.00 0.06 0.00 0.00 58.65 58.36 3lal h GLN 258 Cb 1.48 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 29.18 3lal h GLN 258 CO 0.14 0.68 -0.31 0.87 -0.67 0.00 0.00 178.83 179.54 3lal h LYS 259 N 0.46 0.76 -0.45 1.46 1.57 -1.32 -1.17 116.57 117.87 3lal h LYS 259 Ca 0.11 -0.35 -0.00 0.00 -1.87 0.00 0.00 60.65 58.54 3lal h LYS 259 Cb 0.36 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.64 3lal h LYS 259 CO 0.01 0.97 0.28 1.25 -0.57 0.00 0.00 179.45 181.38 3lal h LEU 260 N 0.64 0.53 -1.03 2.94 5.85 -1.13 -0.83 115.31 122.28 3lal h LEU 260 Ca 0.07 -0.04 -0.06 0.00 0.84 0.00 0.00 57.88 58.69 3lal h LEU 260 Cb 0.84 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.72 3lal h LEU 260 CO 0.07 0.42 0.05 0.58 -0.34 0.00 0.00 178.44 179.22 3lal h VAL 261 N 0.60 1.23 -0.45 1.05 2.07 -0.84 -0.85 116.25 119.05 3lal h VAL 261 Ca 0.16 -0.88 -0.11 0.00 0.82 0.00 0.00 66.70 66.68 3lal h VAL 261 Cb -0.02 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 3lal h VAL 261 CO -0.03 0.32 -0.18 1.23 0.02 0.00 0.00 177.57 178.93 3lal h GLY 262 N 0.94 0.95 1.28 2.17 0.00 -0.78 0.50 103.07 108.12 3lal h GLY 262 Ca 0.15 -0.79 -0.17 0.00 0.00 0.00 0.00 47.33 46.52 3lal h GLY 262 CO 0.01 0.72 -0.53 0.50 0.00 0.00 0.00 176.54 177.24 3lal h LYS 263 N 0.77 0.77 0.04 4.80 1.57 -0.84 -1.44 116.57 122.23 3lal h LYS 263 Ca 0.11 -0.47 -0.00 0.00 -1.87 0.00 0.00 60.65 58.42 3lal h LYS 263 Cb 0.71 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.07 3lal h LYS 263 CO 0.05 1.10 -0.02 -0.07 -0.57 0.00 0.00 179.45 179.94 3lal h LEU 264 N 0.59 -0.05 -0.67 2.94 4.07 -0.92 -0.14 115.31 121.13 3lal h LEU 264 Ca 0.02 -0.16 0.09 0.00 0.08 0.00 0.00 57.88 57.91 3lal h LEU 264 Cb 1.11 0.01 -0.07 0.00 1.08 0.00 0.00 40.66 42.79 3lal h LEU 264 CO 0.11 0.13 0.31 0.78 -1.08 0.00 0.00 178.44 178.69 3lal h ASN 265 N -0.23 0.39 -0.80 -0.43 2.35 -0.87 -0.01 115.58 115.98 3lal h ASN 265 Ca -0.01 0.06 -0.04 0.00 -0.55 0.00 0.00 56.30 55.77 3lal h ASN 265 Cb 0.20 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.54 3lal h ASN 265 CO 0.01 0.23 0.36 -0.25 -1.65 0.00 0.00 177.43 176.12 3lal h TRP 266 N 0.54 1.19 0.00 1.19 2.91 -1.04 -2.54 115.95 118.20 3lal h TRP 266 Ca 0.33 -0.07 -0.07 0.00 1.13 0.00 0.00 58.89 60.21 3lal h TRP 266 Cb 0.35 -0.36 -0.01 0.00 -0.51 0.00 0.00 29.16 28.63 3lal h TRP 266 CO -0.12 0.88 -0.33 0.00 -1.03 0.00 0.00 178.44 177.83 3lal h ALA 267 N 1.23 1.12 0.00 2.65 0.00 0.25 -2.98 119.26 121.53 3lal h ALA 267 Ca 0.27 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3lal h ALA 267 Cb 0.16 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3lal h ALA 267 CO -0.03 0.41 0.00 -1.13 0.00 0.00 0.00 179.25 178.50 3lal n SER 268 N -3.66 0.00 0.26 0.00 3.41 -0.14 -1.64 113.62 111.85 3lal n SER 268 Ca -0.01 -0.60 0.14 0.00 -0.26 0.00 0.00 58.87 58.14 3lal n SER 268 Cb 0.44 -0.00 0.72 0.00 -0.26 0.00 0.00 64.21 65.11 3lal n SER 268 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 3lal h GLN 269 N 0.00 0.00 0.00 4.33 4.20 -1.65 -3.22 115.11 118.76 3lal h GLN 269 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3lal h GLN 269 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 3lal h GLN 269 CO 0.00 0.11 0.00 1.51 -0.67 0.00 0.00 178.83 179.78 3lal n ILE 270 N -3.50 0.00 -3.11 2.54 0.13 -1.02 -0.25 119.36 114.15 3lal n ILE 270 Ca -0.01 0.00 -0.43 0.00 -1.10 0.00 0.00 62.75 61.21 3lal n ILE 270 Cb 0.26 0.15 -0.07 0.00 -0.84 0.00 0.00 39.64 39.14 3lal n ILE 270 CO 0.00 0.00 0.00 -0.31 2.80 0.00 0.00 176.55 179.04 3lal s TYR 271 N 0.00 3.06 0.22 9.51 2.02 -0.65 -4.75 117.35 126.77 3lal s TYR 271 Ca 0.00 -0.06 -0.30 0.00 -0.37 0.00 0.00 57.07 56.33 3lal s TYR 271 Cb 0.00 -3.36 -0.10 0.00 -0.40 0.00 0.00 41.96 38.11 3lal s TYR 271 CO 0.00 -0.88 1.43 -2.14 -1.57 0.00 0.00 175.55 172.39 3lal s PRO 272 N 2.83 4.28 0.00 -1.71 0.02 -1.26 -3.65 135.00 135.51 3lal s PRO 272 Ca 0.23 2.26 0.00 0.00 0.02 0.00 0.00 61.00 63.50 3lal s PRO 272 Cb -0.14 -3.14 0.00 0.00 0.02 0.00 0.00 34.50 31.24 3lal s PRO 272 CO 0.19 -0.41 0.00 0.41 -0.33 0.00 0.00 177.00 176.86 3lal n GLY 273 N 2.46 0.43 3.77 0.52 0.00 -1.26 -5.02 105.19 106.09 3lal n GLY 273 Ca 0.08 -0.90 -0.40 0.00 0.00 0.00 0.00 46.02 44.79 3lal n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3lal s ILE 274 N -2.00 2.15 0.06 -0.61 -1.09 -1.24 -4.94 121.20 113.53 3lal s ILE 274 Ca 0.00 0.13 0.03 0.00 -2.23 0.00 0.00 60.65 58.59 3lal s ILE 274 Cb 0.00 -3.08 -0.03 0.00 -1.58 0.00 0.00 42.46 37.77 3lal s ILE 274 CO 0.00 0.02 -0.10 -0.54 -1.23 0.00 0.00 174.94 173.09 3lal s LYS 275 N -2.42 0.69 0.00 2.79 1.02 -1.26 -5.01 119.74 115.55 3lal s LYS 275 Ca 0.60 -0.92 0.00 0.00 0.02 0.00 0.00 55.97 55.67 3lal s LYS 275 Cb -0.43 -0.49 0.00 0.00 -0.52 0.00 0.00 37.83 36.39 3lal s LYS 275 CO 0.55 0.09 0.63 1.33 -0.92 0.00 0.00 175.35 177.03 3lal n VAL 276 N 1.17 0.00 -0.00 3.17 0.24 -1.26 -4.91 118.33 116.74 3lal n VAL 276 Ca -0.21 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 61.99 3lal n VAL 276 Cb 0.55 0.57 -0.05 0.00 -1.47 0.00 0.00 33.84 33.44 3lal n VAL 276 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 3lal h ARG 277 N 0.00 0.08 0.00 7.34 2.43 -1.99 -0.75 114.38 121.50 3lal h ARG 277 Ca 0.00 -0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.08 3lal h ARG 277 Cb 1.15 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.67 3lal h ARG 277 CO 0.00 0.05 -0.42 1.96 -1.51 0.00 0.00 179.97 180.06 3lal h GLN 278 N 0.08 0.00 0.06 0.20 1.08 -1.91 -1.89 115.11 112.74 3lal h GLN 278 Ca 0.04 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.24 3lal h GLN 278 Cb 0.02 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.46 3lal h GLN 278 CO -0.05 0.42 -0.03 -0.07 -0.95 0.00 0.00 178.83 178.15 3lal h LEU 279 N 0.00 -0.07 -1.38 1.46 3.38 -1.85 -3.31 115.31 113.54 3lal h LEU 279 Ca -0.00 -0.57 0.20 0.00 0.09 0.00 0.00 57.88 57.60 3lal h LEU 279 Cb 1.02 0.02 -0.08 0.00 0.09 0.00 0.00 40.66 41.71 3lal h LEU 279 CO 0.05 0.61 0.61 0.00 0.09 0.00 0.00 178.44 179.80 3lal h LYS 281 N 0.50 0.68 -0.92 0.00 1.57 -1.43 -0.70 116.57 116.27 3lal h LYS 281 Ca 0.51 -0.04 0.08 0.00 -1.87 0.00 0.00 60.65 59.33 3lal h LYS 281 Cb 1.13 -0.15 -0.06 0.00 0.08 0.00 0.00 32.23 33.22 3lal h LYS 281 CO -0.23 0.45 0.59 -0.07 -0.57 0.00 0.00 179.45 179.62 3lal h LEU 282 N 0.70 0.89 -1.47 2.94 4.07 -1.00 -2.37 115.31 119.07 3lal h LEU 282 Ca 0.50 0.02 -0.01 0.00 0.08 0.00 0.00 57.88 58.47 3lal h LEU 282 Cb 0.71 -0.17 -0.00 0.00 1.08 0.00 0.00 40.66 42.28 3lal h LEU 282 CO -0.36 0.54 -0.06 -0.07 -1.08 0.00 0.00 178.44 177.42 3lal h LEU 283 N 0.99 0.00 -9.96 1.67 4.07 -1.13 -3.44 115.31 107.51 3lal h LEU 283 Ca 0.41 0.00 -0.53 0.00 0.08 0.00 0.00 57.88 57.84 3lal h LEU 283 Cb 0.29 0.00 0.21 0.00 1.08 0.00 0.00 40.66 42.24 3lal h LEU 283 CO -0.17 0.06 -0.27 0.54 -1.08 0.00 0.00 178.44 177.52 3lal n ARG 284 N -3.19 -0.30 0.00 1.13 1.74 -0.89 -4.76 116.66 110.39 3lal n ARG 284 Ca 0.00 -0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 3lal n ARG 284 Cb 0.32 -2.05 0.00 0.00 -1.02 0.00 0.00 32.46 29.71 3lal n ARG 284 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3lal n GLY 285 N 1.06 -0.81 2.97 -0.13 0.00 -1.26 -4.90 105.19 102.11 3lal n GLY 285 Ca 0.09 -1.70 -0.31 0.00 0.00 0.00 0.00 46.02 44.10 3lal n GLY 285 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3lal s THR 286 N -1.10 1.92 0.20 2.61 -1.32 -1.26 -5.08 115.64 111.60 3lal s THR 286 Ca 0.00 -1.91 -0.01 0.00 -1.21 0.00 0.00 61.69 58.56 3lal s THR 286 Cb 0.00 -2.32 -0.04 0.00 -1.51 0.00 0.00 72.50 68.63 3lal s THR 286 CO 0.00 -0.45 0.12 -0.54 -2.21 0.00 0.00 174.62 171.54 3lal s LYS 287 N 1.12 1.19 0.63 7.08 1.02 -1.26 -5.16 119.74 124.35 3lal s LYS 287 Ca 0.05 -1.62 -0.09 0.00 0.02 0.00 0.00 55.97 54.33 3lal s LYS 287 Cb -0.19 0.26 -0.01 0.00 -0.52 0.00 0.00 37.83 37.37 3lal s LYS 287 CO -0.10 -0.38 0.99 0.00 -0.92 0.00 0.00 175.35 174.94 3lal s ALA 288 N -4.14 3.11 0.44 5.17 0.00 -1.26 -4.97 121.76 120.11 3lal s ALA 288 Ca 0.38 -0.37 0.20 0.00 0.00 0.00 0.00 51.96 52.16 3lal s ALA 288 Cb 0.07 -2.89 1.17 0.00 0.00 0.00 0.00 23.12 21.47 3lal s ALA 288 CO 0.11 -0.83 2.02 1.37 0.00 0.00 0.00 175.76 178.43 3lal h LEU 289 N -0.34 0.00 -0.19 0.00 -0.00 -1.99 -2.63 115.31 110.16 3lal h LEU 289 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.43 3lal h LEU 289 Cb 1.23 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.89 3lal h LEU 289 CO 0.62 0.17 0.00 0.41 -0.00 0.00 0.00 178.44 179.64 3lal n THR 290 N -4.04 0.59 -2.51 0.15 -1.04 -1.26 -1.56 114.28 104.61 3lal n THR 290 Ca -0.02 0.01 -0.41 0.00 -2.04 0.00 0.00 64.05 61.58 3lal n THR 290 Cb 0.25 -0.79 -0.04 0.00 -1.82 0.00 0.00 70.33 67.93 3lal n THR 290 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 3lal s GLU 291 N -3.12 4.55 -0.02 -2.82 0.41 -0.99 -4.80 118.70 111.91 3lal s GLU 291 Ca 0.09 1.71 -0.27 0.00 -0.41 0.00 0.00 54.97 56.08 3lal s GLU 291 Cb 0.13 -3.31 -0.03 0.00 -1.78 0.00 0.00 34.13 29.13 3lal s GLU 291 CO 0.47 -0.01 0.86 0.08 -0.49 0.00 0.00 175.26 176.17 3lal s VAL 292 N 0.15 4.93 -0.21 2.63 1.01 -1.26 -0.58 120.40 127.07 3lal s VAL 292 Ca 0.52 1.80 -0.04 0.00 0.00 0.00 0.00 61.98 64.27 3lal s VAL 292 Cb -0.29 -4.20 -0.01 0.00 0.00 0.00 0.00 36.38 31.88 3lal s VAL 292 CO 0.33 0.21 -0.05 -0.63 0.00 0.00 0.00 175.10 174.96 3lal s ILE 293 N 0.87 3.35 0.23 2.22 -1.09 0.15 -4.95 121.20 121.97 3lal s ILE 293 Ca 0.46 -0.51 -0.31 0.00 -2.23 0.00 0.00 60.65 58.06 3lal s ILE 293 Cb -0.20 -2.51 -0.11 0.00 -1.58 0.00 0.00 42.46 38.06 3lal s ILE 293 CO 0.24 0.43 1.66 -2.84 -1.23 0.00 0.00 174.94 173.20 3lal s PRO 294 N 1.38 4.14 0.09 2.79 0.02 -1.26 -4.30 135.00 137.87 3lal s PRO 294 Ca 0.05 2.55 -0.31 0.00 0.02 0.00 0.00 61.00 63.31 3lal s PRO 294 Cb -0.14 -3.07 -0.07 0.00 0.02 0.00 0.00 34.50 31.23 3lal s PRO 294 CO -0.03 -0.69 1.38 -0.51 -0.33 0.00 0.00 177.00 176.82 3lal s LEU 295 N 0.68 4.36 1.27 -5.54 1.43 -1.26 -5.02 118.68 114.61 3lal s LEU 295 Ca 0.71 2.27 -0.20 0.00 -1.03 0.00 0.00 54.13 55.88 3lal s LEU 295 Cb -0.48 -3.58 0.31 0.00 0.03 0.00 0.00 46.19 42.47 3lal s LEU 295 CO 0.36 -0.65 1.04 0.42 0.23 0.00 0.00 176.35 177.75 3lal s THR 296 N 1.35 1.51 0.13 5.49 -4.23 -1.26 -4.80 115.64 113.81 3lal s THR 296 Ca 0.64 0.00 -0.07 0.00 -1.18 0.00 0.00 61.69 61.08 3lal s THR 296 Cb -0.35 -2.31 -0.16 0.00 1.34 0.00 0.00 72.50 71.01 3lal s THR 296 CO 0.30 0.00 1.32 -0.08 -0.54 0.00 0.00 174.62 175.62 3lal h GLU 297 N -2.86 0.57 0.00 3.99 4.57 -1.98 -1.82 114.58 117.05 3lal h GLU 297 Ca -0.46 -0.53 -0.12 0.00 -1.18 0.00 0.00 59.36 57.07 3lal h GLU 297 Cb 1.32 0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 30.02 3lal h GLU 297 CO 0.34 1.15 -0.56 1.05 -1.18 0.00 0.00 179.01 179.81 3lal h GLU 298 N 0.36 0.00 -0.07 1.92 9.09 -1.96 -0.99 114.58 122.93 3lal h GLU 298 Ca -0.07 0.00 -0.21 0.00 0.05 0.00 0.00 59.36 59.13 3lal h GLU 298 Cb 1.48 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.58 3lal h GLU 298 CO 0.16 0.56 -0.81 0.00 0.05 0.00 0.00 179.01 178.97 3lal h ALA 299 N 1.44 0.44 -0.52 1.06 0.00 -1.78 -1.82 119.26 118.09 3lal h ALA 299 Ca -0.01 -0.64 -0.08 0.00 0.00 0.00 0.00 54.91 54.18 3lal h ALA 299 Cb 1.15 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 3lal h ALA 299 CO 0.07 0.75 -0.01 1.49 0.00 0.00 0.00 179.25 181.56 3lal h GLU 300 N 0.33 0.89 -0.56 0.00 4.57 -1.13 -0.33 114.58 118.35 3lal h GLU 300 Ca -0.05 -0.26 -0.11 0.00 -1.18 0.00 0.00 59.36 57.75 3lal h GLU 300 Cb 1.42 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.90 3lal h GLU 300 CO 0.15 0.89 -0.09 -0.07 -1.18 0.00 0.00 179.01 178.71 3lal h LEU 301 N 0.82 1.05 -0.07 1.64 3.38 -1.13 -2.80 115.31 118.19 3lal h LEU 301 Ca 0.15 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 3lal h LEU 301 Cb 0.50 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 3lal h LEU 301 CO 0.03 1.14 -0.02 -0.08 0.09 0.00 0.00 178.44 179.60 3lal h GLU 302 N 0.94 0.14 -0.61 1.13 4.81 -0.72 -1.02 114.58 119.23 3lal h GLU 302 Ca 0.15 -0.05 0.09 0.00 -0.13 0.00 0.00 59.36 59.41 3lal h GLU 302 Cb 0.66 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.99 3lal h GLU 302 CO 0.05 0.46 0.41 1.25 -0.73 0.00 0.00 179.01 180.45 3lal h LEU 303 N -0.20 0.42 -0.02 1.64 6.46 -1.12 -0.84 115.31 121.65 3lal h LEU 303 Ca 0.02 0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 57.78 3lal h LEU 303 Cb 0.41 -0.08 -0.00 0.00 -0.73 0.00 0.00 40.66 40.26 3lal h LEU 303 CO 0.01 0.26 -0.02 0.00 -0.62 0.00 0.00 178.44 178.07 3lal h ALA 304 N 1.68 0.03 -0.38 1.25 0.00 -1.18 0.35 119.26 121.02 3lal h ALA 304 Ca 0.28 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 3lal h ALA 304 Cb 0.48 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3lal h ALA 304 CO -0.08 -0.22 0.22 1.49 0.00 0.00 0.00 179.25 180.66 3lal h GLU 305 N -0.40 0.50 -0.02 0.00 4.81 -0.63 -0.36 114.58 118.48 3lal h GLU 305 Ca 0.00 -0.04 -0.18 0.00 -0.13 0.00 0.00 59.36 59.01 3lal h GLU 305 Cb 0.49 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 3lal h GLU 305 CO 0.00 0.36 -0.79 -0.91 -0.73 0.00 0.00 179.01 176.94 3lal h ASN 306 N 0.52 0.31 -0.37 1.04 2.35 -1.09 -3.03 115.58 115.30 3lal h ASN 306 Ca 0.14 -0.22 -0.06 0.00 -0.55 0.00 0.00 56.30 55.60 3lal h ASN 306 Cb -0.01 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.25 3lal h ASN 306 CO -0.03 0.98 0.02 -0.09 -1.65 0.00 0.00 177.43 176.67 3lal h ARG 307 N 0.15 0.73 0.05 0.81 9.65 0.78 -2.15 114.38 124.40 3lal h ARG 307 Ca -0.04 -0.18 -0.25 0.00 -1.10 0.00 0.00 59.98 58.42 3lal h ARG 307 Cb 1.39 -0.09 0.01 0.00 -1.39 0.00 0.00 29.97 29.88 3lal h ARG 307 CO 0.12 0.73 -1.05 1.49 2.80 0.00 0.00 179.97 184.06 3lal h GLU 308 N 0.69 0.42 -0.33 0.20 4.57 -1.39 -2.84 114.58 115.90 3lal h GLU 308 Ca 0.14 -0.51 -0.08 0.00 -1.18 0.00 0.00 59.36 57.73 3lal h GLU 308 Cb 0.39 0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 29.13 3lal h GLU 308 CO 0.01 1.17 -0.12 0.82 -1.18 0.00 0.00 179.01 179.72 3lal h ILE 309 N 0.21 1.24 0.00 2.32 2.04 -1.38 -2.51 117.51 119.43 3lal h ILE 309 Ca -0.11 -1.07 0.00 0.00 1.00 0.00 0.00 64.86 64.68 3lal h ILE 309 Cb 1.71 1.12 0.00 0.00 -0.74 0.00 0.00 36.82 38.91 3lal h ILE 309 CO 0.18 0.35 0.00 -0.07 0.00 0.00 0.00 178.15 178.62 3lal h LEU 310 N 0.53 0.00 -0.01 1.44 4.07 -1.38 -3.38 115.31 116.58 3lal h LEU 310 Ca 0.09 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.06 3lal h LEU 310 Cb 0.52 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.26 3lal h LEU 310 CO 0.03 0.00 -0.04 0.50 -1.08 0.00 0.00 178.44 177.85 3lal h LYS 311 N 0.00 -0.04 -6.50 1.13 1.63 -1.19 -3.40 116.57 108.20 3lal h LYS 311 Ca 0.00 0.00 -0.53 0.00 -0.85 0.00 0.00 60.65 59.27 3lal h LYS 311 Cb 0.71 0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 32.32 3lal h LYS 311 CO 0.00 -0.03 0.13 -1.83 -3.45 0.00 0.00 179.45 174.27 3lal s GLU 312 N -3.20 4.43 0.33 1.90 1.03 -1.26 -5.05 118.70 116.89 3lal s GLU 312 Ca -0.01 1.02 -0.28 0.00 0.03 0.00 0.00 54.97 55.73 3lal s GLU 312 Cb 0.01 -3.15 -0.09 0.00 -0.80 0.00 0.00 34.13 30.09 3lal s GLU 312 CO 0.05 0.53 1.16 -1.25 -1.33 0.00 0.00 175.26 174.41 3lal s PRO 313 N -1.38 4.38 0.21 -4.83 0.04 -1.26 -5.01 135.00 127.14 3lal s PRO 313 Ca 0.37 1.88 0.11 0.00 0.04 0.00 0.00 61.00 63.40 3lal s PRO 313 Cb -0.21 -2.97 -0.05 0.00 0.04 0.00 0.00 34.50 31.32 3lal s PRO 313 CO 0.24 -0.05 -0.23 0.08 0.04 0.00 0.00 177.00 177.07 3lal s VAL 314 N -1.27 2.36 0.13 -0.36 1.01 -1.26 -5.16 120.40 115.85 3lal s VAL 314 Ca 0.50 -2.09 0.01 0.00 0.00 0.00 0.00 61.98 60.39 3lal s VAL 314 Cb -0.32 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 33.86 3lal s VAL 314 CO 0.42 -0.16 -0.00 -1.38 0.00 0.00 0.00 175.10 173.97 3lal s HIS 315 N -1.81 0.94 0.26 5.22 -3.43 -1.26 -4.78 115.29 110.43 3lal s HIS 315 Ca 0.22 -1.06 0.08 0.00 -0.80 0.00 0.00 55.06 53.50 3lal s HIS 315 Cb -0.07 -0.55 -0.04 0.00 -1.43 0.00 0.00 32.58 30.49 3lal s HIS 315 CO 0.11 -0.31 0.08 0.20 -2.00 0.00 0.00 174.74 172.82 3lal s GLY 316 N -3.07 1.55 0.55 -1.38 0.00 0.41 -4.77 107.32 100.61 3lal s GLY 316 Ca 0.19 -1.55 0.09 0.00 0.00 0.00 0.00 44.72 43.44 3lal s GLY 316 CO -0.01 -1.61 0.72 -1.34 0.00 0.00 0.00 173.10 170.86 3lal s VAL 317 N -2.24 2.19 0.56 1.40 -7.23 -0.78 -0.54 120.40 113.76 3lal s VAL 317 Ca 0.32 -1.06 0.08 0.00 -1.81 0.00 0.00 61.98 59.51 3lal s VAL 317 Cb -0.07 -2.25 0.07 0.00 0.56 0.00 0.00 36.38 34.69 3lal s VAL 317 CO 0.22 0.00 0.77 -0.31 -0.31 0.00 0.00 175.10 175.47 3lal s TYR 318 N -2.64 1.74 -0.21 2.82 2.02 -1.26 -4.56 117.35 115.25 3lal s TYR 318 Ca 0.58 -0.60 -0.15 0.00 -0.37 0.00 0.00 57.07 56.52 3lal s TYR 318 Cb -0.06 -2.33 -0.04 0.00 -0.40 0.00 0.00 41.96 39.14 3lal s TYR 318 CO 0.36 -1.05 0.36 -0.47 -1.57 0.00 0.00 175.55 173.18 3lal s TYR 319 N -2.65 3.36 -0.37 2.71 5.04 0.42 -4.85 117.35 121.01 3lal s TYR 319 Ca 0.61 0.54 -0.11 0.00 -2.44 0.00 0.00 57.07 55.67 3lal s TYR 319 Cb -0.07 -2.49 0.02 0.00 0.35 0.00 0.00 41.96 39.77 3lal s TYR 319 CO 0.38 -0.01 0.21 0.34 -1.34 0.00 0.00 175.55 175.13 3lal s ASP 320 N 1.08 5.77 0.34 4.32 3.68 -1.26 -4.18 116.67 126.41 3lal s ASP 320 Ca 0.17 -0.87 0.26 0.00 2.13 0.00 0.00 52.55 54.24 3lal s ASP 320 Cb -0.15 -2.04 1.16 0.00 -1.45 0.00 0.00 42.92 40.44 3lal s ASP 320 CO 0.08 -0.35 1.78 -0.65 0.13 0.00 0.00 175.17 176.15 3lal h PRO 321 N 8.45 0.00 -0.01 4.34 0.11 -1.99 -2.81 132.00 140.09 3lal h PRO 321 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 3lal h PRO 321 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3lal h PRO 321 CO 0.67 0.00 -0.24 -1.13 -0.21 0.00 0.00 178.00 177.08 3lal n SER 322 N -2.42 1.01 -4.62 -2.05 3.41 -1.26 -4.85 113.62 102.84 3lal n SER 322 Ca 0.01 -0.89 -0.25 0.00 -0.26 0.00 0.00 58.87 57.49 3lal n SER 322 Cb 0.19 0.12 -0.08 0.00 -0.26 0.00 0.00 64.21 64.19 3lal n SER 322 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3lal s LYS 323 N -2.49 2.24 0.66 4.33 1.02 -1.06 -5.14 119.74 119.30 3lal s LYS 323 Ca 0.25 -1.33 -0.12 0.00 0.02 0.00 0.00 55.97 54.79 3lal s LYS 323 Cb 0.19 -2.19 -0.01 0.00 -0.52 0.00 0.00 37.83 35.30 3lal s LYS 323 CO 0.51 0.40 1.05 -0.51 -0.92 0.00 0.00 175.35 175.88 3lal s ASP 324 N -3.33 5.68 -0.13 2.83 -0.00 -1.26 -4.93 116.67 115.53 3lal s ASP 324 Ca 0.29 1.60 -0.13 0.00 -0.00 0.00 0.00 52.55 54.31 3lal s ASP 324 Cb -0.07 -2.50 -0.05 0.00 -0.00 0.00 0.00 42.92 40.30 3lal s ASP 324 CO 0.18 -1.24 0.29 -0.76 -0.00 0.00 0.00 175.17 173.65 3lal s LEU 325 N -5.25 4.31 -0.10 1.23 1.43 -1.26 -4.51 118.68 114.52 3lal s LEU 325 Ca 0.58 0.59 0.00 0.00 -1.03 0.00 0.00 54.13 54.27 3lal s LEU 325 Cb -0.13 -2.37 -0.02 0.00 0.03 0.00 0.00 46.19 43.69 3lal s LEU 325 CO 0.51 0.18 -0.10 -0.63 0.23 0.00 0.00 176.35 176.55 3lal s ILE 326 N -0.02 3.40 -0.12 -0.59 1.09 0.12 -0.18 121.20 124.91 3lal s ILE 326 Ca 0.18 -0.57 0.03 0.00 -1.10 0.00 0.00 60.65 59.19 3lal s ILE 326 Cb -0.13 -2.40 0.00 0.00 -1.06 0.00 0.00 42.46 38.86 3lal s ILE 326 CO 0.06 0.56 -0.22 0.00 -0.10 0.00 0.00 174.94 175.24 3lal s ALA 327 N -0.27 2.26 -0.06 9.38 0.00 0.02 -1.40 121.76 131.69 3lal s ALA 327 Ca 0.03 -0.99 0.03 0.00 0.00 0.00 0.00 51.96 51.02 3lal s ALA 327 Cb -0.13 -0.92 -0.03 0.00 0.00 0.00 0.00 23.12 22.04 3lal s ALA 327 CO 0.03 0.20 -0.12 -1.21 0.00 0.00 0.00 175.76 174.66 3lal s GLU 328 N 0.47 2.58 -0.01 0.00 2.02 -0.52 -0.57 118.70 122.67 3lal s GLU 328 Ca -0.15 -0.65 0.06 0.00 0.02 0.00 0.00 54.97 54.26 3lal s GLU 328 Cb -0.17 -2.45 -0.02 0.00 0.10 0.00 0.00 34.13 31.60 3lal s GLU 328 CO 0.06 0.64 -0.20 0.42 0.02 0.00 0.00 175.26 176.20 3lal s ILE 329 N -0.75 1.56 0.04 -1.63 1.01 -1.15 -1.73 121.20 118.55 3lal s ILE 329 Ca 0.12 -0.85 0.05 0.00 0.00 0.00 0.00 60.65 59.97 3lal s ILE 329 Cb -0.11 -1.30 -0.02 0.00 0.01 0.00 0.00 42.46 41.04 3lal s ILE 329 CO 0.01 0.44 -0.15 -1.10 0.00 0.00 0.00 174.94 174.13 3lal s GLN 330 N -0.48 1.03 -0.01 2.79 1.11 0.08 -4.30 119.66 119.89 3lal s GLN 330 Ca 0.08 -0.78 -0.30 0.00 0.01 0.00 0.00 55.36 54.36 3lal s GLN 330 Cb -0.08 -1.06 -0.04 0.00 -1.01 0.00 0.00 33.01 30.82 3lal s GLN 330 CO -0.01 0.27 1.24 0.21 0.01 0.00 0.00 175.29 177.01 3lal s LYS 331 N -1.11 4.36 0.00 2.91 2.20 -1.26 -1.44 119.74 125.40 3lal s LYS 331 Ca 0.03 1.76 0.15 0.00 -0.36 0.00 0.00 55.97 57.55 3lal s LYS 331 Cb -0.08 -3.50 -0.08 0.00 -1.51 0.00 0.00 37.83 32.67 3lal s LYS 331 CO 0.01 -0.41 0.73 1.04 -0.36 0.00 0.00 175.35 176.36 3lal n GLN 332 N 4.84 1.92 0.00 4.03 6.02 -0.14 -4.60 117.38 129.45 3lal n GLN 332 Ca 0.11 -0.41 0.00 0.00 -0.01 0.00 0.00 57.00 56.69 3lal n GLN 332 Cb 0.46 -1.23 0.00 0.00 1.02 0.00 0.00 30.24 30.49 3lal n GLN 332 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3lal n GLY 333 N 1.23 0.57 3.57 1.08 0.00 -1.20 -4.90 105.19 105.55 3lal n GLY 333 Ca 0.05 -1.51 -0.17 0.00 0.00 0.00 0.00 46.02 44.38 3lal n GLY 333 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3lal s GLN 334 N -1.79 1.53 0.00 1.61 0.00 -1.26 -1.78 119.66 117.97 3lal s GLN 334 Ca 0.00 -0.33 0.00 0.00 -0.00 0.00 0.00 55.36 55.03 3lal s GLN 334 Cb 0.00 -4.98 0.00 0.00 0.00 0.00 0.00 33.01 28.03 3lal s GLN 334 CO 0.00 -4.95 0.00 0.41 0.00 0.00 0.00 175.29 170.75 3lal n GLY 335 N 6.28 0.76 3.80 2.60 0.00 -1.26 -5.02 105.19 112.34 3lal n GLY 335 Ca 0.43 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.09 3lal n GLY 335 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3lal s GLN 336 N -0.05 3.43 0.03 1.61 -0.21 -0.73 -4.29 119.66 119.45 3lal s GLN 336 Ca 0.00 -0.23 0.02 0.00 0.02 0.00 0.00 55.36 55.18 3lal s GLN 336 Cb 0.00 -3.11 -0.02 0.00 1.00 0.00 0.00 33.01 30.88 3lal s GLN 336 CO 0.00 0.68 -0.08 -1.58 -2.12 0.00 0.00 175.29 172.19 3lal s TRP 337 N -0.76 0.68 0.12 0.91 0.52 0.15 -0.97 118.94 119.59 3lal s TRP 337 Ca 0.13 -0.37 0.05 0.00 0.02 0.00 0.00 56.10 55.93 3lal s TRP 337 Cb -0.12 -0.41 -0.04 0.00 -1.15 0.00 0.00 33.47 31.75 3lal s TRP 337 CO 0.03 -0.05 -0.12 -0.08 0.02 0.00 0.00 176.95 176.75 3lal s THR 338 N -0.99 1.21 0.11 2.01 -1.32 -0.52 0.24 115.64 116.38 3lal s THR 338 Ca -0.05 -1.77 -0.08 0.00 -1.21 0.00 0.00 61.69 58.57 3lal s THR 338 Cb -0.08 -1.56 -0.01 0.00 -1.51 0.00 0.00 72.50 69.35 3lal s THR 338 CO 0.00 -0.52 0.19 -0.72 -2.21 0.00 0.00 174.62 171.37 3lal s TYR 339 N -2.45 0.27 0.00 9.09 1.13 0.05 -0.74 117.35 124.69 3lal s TYR 339 Ca 0.10 -0.69 0.01 0.00 -1.41 0.00 0.00 57.07 55.08 3lal s TYR 339 Cb -0.03 -0.10 -0.00 0.00 -1.10 0.00 0.00 41.96 40.73 3lal s TYR 339 CO 0.02 -0.57 -0.03 -0.65 -2.51 0.00 0.00 175.55 171.81 3lal s GLN 340 N -3.90 0.24 -0.18 -3.49 1.11 -0.70 -0.77 119.66 111.97 3lal s GLN 340 Ca 0.09 -0.16 0.01 0.00 0.01 0.00 0.00 55.36 55.31 3lal s GLN 340 Cb 0.05 -0.20 0.02 0.00 -1.01 0.00 0.00 33.01 31.87 3lal s GLN 340 CO -0.08 0.05 -0.18 0.42 0.01 0.00 0.00 175.29 175.51 3lal s ILE 341 N -0.21 1.96 0.33 1.08 1.01 0.13 -1.43 121.20 124.06 3lal s ILE 341 Ca -0.00 -0.90 0.03 0.00 0.00 0.00 0.00 60.65 59.78 3lal s ILE 341 Cb -0.02 -1.79 -0.04 0.00 0.01 0.00 0.00 42.46 40.62 3lal s ILE 341 CO -0.00 0.50 0.14 -0.72 0.00 0.00 0.00 174.94 174.86 3lal s TYR 342 N 1.33 1.68 0.00 3.97 -0.85 -0.49 0.11 117.35 123.09 3lal s TYR 342 Ca 0.04 -1.31 0.00 0.00 -0.52 0.00 0.00 57.07 55.29 3lal s TYR 342 Cb -0.13 -0.96 0.00 0.00 0.38 0.00 0.00 41.96 41.24 3lal s TYR 342 CO -0.12 -0.42 0.00 1.04 -1.52 0.00 0.00 175.55 174.53 3lal n GLN 343 N -0.66 2.49 -4.37 -3.49 6.02 -1.26 -0.70 117.38 115.41 3lal n GLN 343 Ca -0.01 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.68 3lal n GLN 343 Cb 0.65 -0.87 -0.17 0.00 1.02 0.00 0.00 30.24 30.87 3lal n GLN 343 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 3lal s GLU 344 N -1.75 2.46 0.26 -1.09 2.56 -1.26 -4.86 118.70 115.02 3lal s GLU 344 Ca 0.00 -0.64 -0.29 0.00 0.00 0.00 0.00 54.97 54.03 3lal s GLU 344 Cb 0.00 -2.11 -0.09 0.00 2.00 0.00 0.00 34.13 33.93 3lal s GLU 344 CO 0.00 -0.11 1.18 -1.25 -0.56 0.00 0.00 175.26 174.53 3lal s PRO 345 N 1.10 4.53 -0.58 4.30 0.04 -1.26 -0.29 135.00 142.83 3lal s PRO 345 Ca -0.03 1.92 0.04 0.00 0.04 0.00 0.00 61.00 62.98 3lal s PRO 345 Cb -0.14 -3.18 0.36 0.00 0.04 0.00 0.00 34.50 31.58 3lal s PRO 345 CO -0.05 0.02 1.10 1.19 0.04 0.00 0.00 177.00 179.30 3lal n PHE 346 N 1.56 3.74 -3.03 0.56 3.01 -1.26 -5.09 117.46 116.96 3lal n PHE 346 Ca 0.01 -3.57 -0.44 0.00 1.01 0.00 0.00 57.45 54.46 3lal n PHE 346 Cb 0.44 -0.44 -0.04 0.00 -0.01 0.00 0.00 39.48 39.43 3lal n PHE 346 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 3lal s LYS 347 N -3.58 3.16 0.21 -1.08 1.02 0.60 -5.02 119.74 115.05 3lal s LYS 347 Ca 0.48 -1.31 -0.30 0.00 0.02 0.00 0.00 55.97 54.87 3lal s LYS 347 Cb 0.32 -4.35 -0.09 0.00 -0.52 0.00 0.00 37.83 33.19 3lal s LYS 347 CO -0.16 -1.63 1.21 -0.80 -0.92 0.00 0.00 175.35 173.04 3lal s ASN 348 N 3.57 7.06 -0.01 2.83 0.02 -1.26 -4.19 114.94 122.97 3lal s ASN 348 Ca 0.17 2.30 -0.24 0.00 -1.02 0.00 0.00 52.86 54.07 3lal s ASN 348 Cb -0.19 -2.61 -0.17 0.00 0.02 0.00 0.00 41.25 38.30 3lal s ASN 348 CO 0.04 -0.37 1.13 -0.07 0.02 0.00 0.00 177.10 177.86 3lal h LEU 349 N 4.91 -0.24 -8.24 0.60 -0.00 0.54 -2.06 115.31 110.81 3lal h LEU 349 Ca -0.45 -0.28 -0.09 0.00 -0.00 0.00 0.00 57.88 57.06 3lal h LEU 349 Cb 1.21 0.06 -0.07 0.00 -0.00 0.00 0.00 40.66 41.87 3lal h LEU 349 CO 0.73 0.20 -0.04 -1.59 -0.00 0.00 0.00 178.44 177.75 3lal s LYS 350 N -4.23 1.77 0.41 1.13 -2.85 -1.04 -4.35 119.74 110.58 3lal s LYS 350 Ca -0.14 -1.38 0.04 0.00 -1.00 0.00 0.00 55.97 53.49 3lal s LYS 350 Cb 0.02 0.50 -0.03 0.00 -2.06 0.00 0.00 37.83 36.26 3lal s LYS 350 CO 0.55 -0.76 0.12 0.95 0.10 0.00 0.00 175.35 176.30 3lal s THR 351 N -3.50 0.68 0.05 3.79 -4.23 0.65 0.17 115.64 113.25 3lal s THR 351 Ca 0.22 -2.00 -0.18 0.00 -1.18 0.00 0.00 61.69 58.55 3lal s THR 351 Cb -0.02 -2.38 0.06 0.00 1.34 0.00 0.00 72.50 71.51 3lal s THR 351 CO 0.12 0.00 0.84 0.61 -0.54 0.00 0.00 174.62 175.65 3lal n GLY 352 N -0.91 0.54 3.02 3.99 0.00 0.05 -4.37 105.19 107.52 3lal n GLY 352 Ca -0.06 -1.03 -0.14 0.00 0.00 0.00 0.00 46.02 44.79 3lal n GLY 352 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3lal s LYS 353 N -2.02 0.48 -0.07 1.61 2.20 -1.26 -0.77 119.74 119.91 3lal s LYS 353 Ca 0.19 -0.55 -0.04 0.00 -0.36 0.00 0.00 55.97 55.21 3lal s LYS 353 Cb -0.01 -0.31 0.03 0.00 -1.51 0.00 0.00 37.83 36.03 3lal s LYS 353 CO 0.02 0.07 0.15 -0.47 -0.36 0.00 0.00 175.35 174.75 3lal s TYR 354 N -0.95 -0.18 0.00 4.03 5.04 0.14 -4.95 117.35 120.48 3lal s TYR 354 Ca -0.06 0.48 0.00 0.00 -2.44 0.00 0.00 57.07 55.05 3lal s TYR 354 Cb -0.07 -0.03 0.00 0.00 0.35 0.00 0.00 41.96 42.21 3lal s TYR 354 CO 0.00 -0.14 0.00 0.00 -1.34 0.00 0.00 175.55 174.07 3lal n ALA 355 N 3.80 2.59 -0.80 3.97 0.00 -1.26 0.29 120.51 129.10 3lal n ALA 355 Ca -0.22 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 52.94 3lal n ALA 355 Cb 0.54 0.17 -0.02 0.00 0.00 0.00 0.00 19.45 20.14 3lal n ALA 355 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3lal n ARG 356 N -2.32 0.00 -3.52 0.00 0.63 -1.26 -4.74 116.66 105.45 3lal n ARG 356 Ca 0.00 0.00 -0.38 0.00 -0.92 0.00 0.00 57.85 56.55 3lal n ARG 356 Cb 0.17 -0.62 -0.06 0.00 0.45 0.00 0.00 32.46 32.40 3lal n ARG 356 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3lal s MET 357 N -0.46 3.89 -0.55 -0.14 0.23 -1.26 -5.06 119.30 115.95 3lal s MET 357 Ca 0.39 0.38 -0.04 0.00 -1.03 0.00 0.00 55.69 55.39 3lal s MET 357 Cb -0.56 -3.21 0.14 0.00 -1.53 0.00 0.00 34.83 29.68 3lal s MET 357 CO 0.32 0.69 0.37 1.03 -2.03 0.00 0.00 175.02 175.40 3lal s ARG 358 N -1.12 2.44 0.00 3.16 1.81 -1.26 -4.98 118.95 119.00 3lal s ARG 358 Ca 0.24 -2.22 0.00 0.00 -1.72 0.00 0.00 55.73 52.03 3lal s ARG 358 Cb -0.16 -3.75 0.00 0.00 -0.45 0.00 0.00 34.95 30.59 3lal s ARG 358 CO 0.13 -1.15 0.00 0.41 -0.68 0.00 0.00 175.30 174.01 3lal n GLY 359 N 4.02 0.46 0.09 -3.53 0.00 -1.26 -4.74 105.19 100.22 3lal n GLY 359 Ca 0.03 -2.13 -0.04 0.00 0.00 0.00 0.00 46.02 43.88 3lal n GLY 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3lal n ALA 360 N 0.86 1.75 -3.47 4.61 0.00 -1.26 -4.88 120.51 118.13 3lal n ALA 360 Ca 0.00 -0.63 -0.26 0.00 0.00 0.00 0.00 53.44 52.55 3lal n ALA 360 Cb 0.00 -0.92 -0.17 0.00 0.00 0.00 0.00 19.45 18.36 3lal n ALA 360 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 3lal s HIS 361 N -2.79 1.66 0.22 0.00 3.76 -1.26 -1.88 115.29 115.00 3lal s HIS 361 Ca -0.04 -0.65 -0.01 0.00 -0.15 0.00 0.00 55.06 54.21 3lal s HIS 361 Cb 0.08 -1.20 0.01 0.00 1.11 0.00 0.00 32.58 32.58 3lal s HIS 361 CO 0.82 -0.33 0.31 0.25 -0.85 0.00 0.00 174.74 174.94 3lal n THR 362 N 3.86 0.00 -4.36 1.30 -2.24 -1.10 -4.98 114.28 106.77 3lal n THR 362 Ca -0.22 -1.14 -0.18 0.00 -2.27 0.00 0.00 64.05 60.25 3lal n THR 362 Cb 0.52 0.70 -0.10 0.00 -2.10 0.00 0.00 70.33 69.34 3lal n THR 362 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3lal s ASN 363 N -2.38 1.60 0.41 3.42 2.20 -1.26 -1.48 114.94 117.44 3lal s ASN 363 Ca 0.19 -1.38 0.07 0.00 -0.94 0.00 0.00 52.86 50.80 3lal s ASN 363 Cb -0.01 0.08 0.87 0.00 -2.00 0.00 0.00 41.25 40.19 3lal s ASN 363 CO 0.13 -0.68 2.05 0.44 -2.94 0.00 0.00 177.10 176.10 3lal h ASP 364 N 2.30 0.45 -0.52 3.54 5.19 -1.94 -1.38 116.42 124.07 3lal h ASP 364 Ca -0.39 -0.02 -0.05 0.00 -0.62 0.00 0.00 57.03 55.95 3lal h ASP 364 Cb 1.25 -0.11 -0.02 0.00 0.18 0.00 0.00 39.33 40.62 3lal h ASP 364 CO 0.64 0.34 0.12 0.58 -3.12 0.00 0.00 179.24 177.79 3lal h VAL 365 N 0.52 1.24 -0.33 -1.35 2.07 -1.94 0.11 116.25 116.58 3lal h VAL 365 Ca 0.14 -0.87 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 3lal h VAL 365 Cb -0.04 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 3lal h VAL 365 CO -0.03 0.32 0.18 0.11 0.02 0.00 0.00 177.57 178.17 3lal h LYS 366 N 0.72 0.46 -0.49 1.57 1.57 -1.86 -2.35 116.57 116.19 3lal h LYS 366 Ca 0.16 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.81 3lal h LYS 366 Cb 0.35 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 3lal h LYS 366 CO 0.00 0.39 0.00 1.96 -0.57 0.00 0.00 179.45 181.24 3lal h GLN 367 N 0.41 0.81 -0.45 3.15 4.20 -0.98 -1.63 115.11 120.62 3lal h GLN 367 Ca 0.11 -0.22 -0.14 0.00 0.06 0.00 0.00 58.65 58.46 3lal h GLN 367 Cb 0.07 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.74 3lal h GLN 367 CO -0.02 0.81 -0.27 1.25 -0.67 0.00 0.00 178.83 179.94 3lal h LEU 368 N 0.76 1.01 -1.11 1.46 5.85 -0.70 -2.14 115.31 120.44 3lal h LEU 368 Ca 0.15 -0.41 -0.07 0.00 0.84 0.00 0.00 57.88 58.39 3lal h LEU 368 Cb 0.45 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 3lal h LEU 368 CO 0.02 1.20 -0.11 0.74 -0.34 0.00 0.00 178.44 179.96 3lal h THR 369 N 0.82 1.23 -0.29 1.05 2.02 -1.22 0.77 112.91 117.28 3lal h THR 369 Ca 0.09 -0.99 -0.08 0.00 0.77 0.00 0.00 66.41 66.21 3lal h THR 369 Cb 0.85 1.12 -0.02 0.00 -1.74 0.00 0.00 68.15 68.36 3lal h THR 369 CO 0.08 0.32 -0.17 -0.33 0.37 0.00 0.00 175.52 175.79 3lal h GLU 370 N 0.47 0.52 0.06 6.66 5.08 -0.96 -1.60 114.58 124.80 3lal h GLU 370 Ca 0.09 -0.17 -0.26 0.00 -1.00 0.00 0.00 59.36 58.02 3lal h GLU 370 Cb 0.47 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.69 3lal h GLU 370 CO 0.03 0.67 -1.09 0.00 -1.00 0.00 0.00 179.01 177.62 3lal h ALA 371 N 1.35 0.20 -0.95 3.43 0.00 -0.85 -1.16 119.26 121.29 3lal h ALA 371 Ca 0.08 -0.76 0.07 0.00 0.00 0.00 0.00 54.91 54.31 3lal h ALA 371 Cb 0.56 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.32 3lal h ALA 371 CO 0.04 0.80 0.61 0.28 0.00 0.00 0.00 179.25 180.98 3lal h VAL 372 N 0.23 1.05 -0.16 0.00 2.07 -0.76 -0.99 116.25 117.69 3lal h VAL 372 Ca -0.12 -0.36 -0.22 0.00 0.82 0.00 0.00 66.70 66.82 3lal h VAL 372 Cb 1.75 -0.10 0.01 0.00 -1.52 0.00 0.00 31.29 31.42 3lal h VAL 372 CO 0.19 0.19 -0.75 -0.61 0.02 0.00 0.00 177.57 176.62 3lal h GLN 373 N 1.06 0.78 -0.54 1.57 5.75 -1.09 -0.98 115.11 121.65 3lal h GLN 373 Ca 0.42 -0.62 -0.10 0.00 -0.15 0.00 0.00 58.65 58.20 3lal h GLN 373 Cb 0.25 0.12 -0.02 0.00 1.07 0.00 0.00 27.48 28.90 3lal h GLN 373 CO -0.17 1.23 -0.06 -0.22 -2.65 0.00 0.00 178.83 176.95 3lal h LYS 374 N 0.54 1.00 -0.15 1.69 3.11 -0.97 -2.38 116.57 119.41 3lal h LYS 374 Ca -0.04 -0.35 -0.10 0.00 -2.81 0.00 0.00 60.65 57.34 3lal h LYS 374 Cb 1.37 -0.07 -0.01 0.00 -1.00 0.00 0.00 32.23 32.52 3lal h LYS 374 CO 0.15 1.03 -0.36 0.82 -2.81 0.00 0.00 179.45 178.29 3lal h ILE 375 N 0.88 1.29 -0.12 2.00 2.04 -1.09 -2.63 117.51 119.88 3lal h ILE 375 Ca 0.15 -1.42 -0.02 0.00 1.00 0.00 0.00 64.86 64.57 3lal h ILE 375 Cb 0.62 1.57 -0.00 0.00 -0.74 0.00 0.00 36.82 38.27 3lal h ILE 375 CO 0.04 0.43 0.01 0.74 0.00 0.00 0.00 178.15 179.37 3lal h THR 376 N 0.28 1.24 -0.11 -0.27 2.02 -0.91 -1.55 112.91 113.61 3lal h THR 376 Ca 0.03 -0.77 0.03 0.00 0.77 0.00 0.00 66.41 66.48 3lal h THR 376 Cb 0.76 1.52 -0.04 0.00 -1.74 0.00 0.00 68.15 68.65 3lal h THR 376 CO 0.06 0.22 -0.11 0.74 0.37 0.00 0.00 175.52 176.81 3lal h THR 377 N -0.05 0.70 -0.92 3.16 2.02 -1.36 -1.58 112.91 114.88 3lal h THR 377 Ca 0.04 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.23 3lal h THR 377 Cb 0.33 0.70 -0.05 0.00 -1.74 0.00 0.00 68.15 67.40 3lal h THR 377 CO 0.00 0.00 0.61 -0.08 0.37 0.00 0.00 175.52 176.43 3lal h GLU 378 N -0.13 1.20 -0.41 6.66 4.81 -1.43 -1.51 114.58 123.77 3lal h GLU 378 Ca 0.08 -0.07 -0.13 0.00 -0.13 0.00 0.00 59.36 59.10 3lal h GLU 378 Cb 0.24 -0.27 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 3lal h GLU 378 CO -0.18 0.80 -0.26 1.03 -0.73 0.00 0.00 179.01 179.66 3lal h SER 379 N 1.24 0.88 -0.76 1.04 0.87 -0.91 -0.25 113.55 115.65 3lal h SER 379 Ca 0.34 -0.34 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 3lal h SER 379 Cb -0.12 -0.24 -0.04 0.00 -0.44 0.00 0.00 62.40 61.56 3lal h SER 379 CO -0.08 1.09 0.44 0.40 -0.53 0.00 0.00 176.83 178.15 3lal h ILE 380 N 0.73 1.22 -0.03 2.23 2.04 -0.73 0.32 117.51 123.28 3lal h ILE 380 Ca 0.09 -0.52 -0.00 0.00 1.00 0.00 0.00 64.86 65.43 3lal h ILE 380 Cb 0.81 0.18 -0.00 0.00 -0.74 0.00 0.00 36.82 37.07 3lal h ILE 380 CO 0.07 0.24 0.02 0.58 0.00 0.00 0.00 178.15 179.06 3lal h VAL 381 N 1.05 1.05 0.19 1.67 2.07 -1.02 -0.47 116.25 120.78 3lal h VAL 381 Ca 0.27 -0.15 -0.32 0.00 0.82 0.00 0.00 66.70 67.32 3lal h VAL 381 Cb -0.01 1.09 0.03 0.00 -1.52 0.00 0.00 31.29 30.89 3lal h VAL 381 CO -0.05 0.04 -1.37 0.40 0.02 0.00 0.00 177.57 176.62 3lal h ILE 382 N -0.01 1.31 0.00 4.57 2.04 -0.85 -3.40 117.51 121.17 3lal h ILE 382 Ca 0.01 -2.66 0.00 0.00 1.00 0.00 0.00 64.86 63.21 3lal h ILE 382 Cb 0.05 2.91 0.00 0.00 -0.74 0.00 0.00 36.82 39.04 3lal h ILE 382 CO -0.00 0.80 -0.58 0.79 0.00 0.00 0.00 178.15 179.16 3lal n TRP 383 N -3.72 0.00 -0.88 1.37 8.01 0.11 -4.65 117.44 117.67 3lal n TRP 383 Ca -0.15 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.04 3lal n TRP 383 Cb 1.05 -0.03 0.00 0.00 -2.01 0.00 0.00 31.31 30.32 3lal n TRP 383 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3lal n GLY 384 N 1.58 0.70 3.26 6.99 0.00 -0.19 -4.99 105.19 112.54 3lal n GLY 384 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 3lal n GLY 384 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3lal s LYS 385 N -0.12 0.79 0.38 1.61 -2.85 -1.25 -4.92 119.74 113.38 3lal s LYS 385 Ca 0.00 -0.39 -0.25 0.00 -1.00 0.00 0.00 55.97 54.33 3lal s LYS 385 Cb 0.00 0.35 -0.09 0.00 -2.06 0.00 0.00 37.83 36.03 3lal s LYS 385 CO 0.00 -0.25 1.08 0.95 0.10 0.00 0.00 175.35 177.24 3lal s THR 386 N -2.19 3.56 0.82 3.79 -4.23 -1.26 -3.88 115.64 112.25 3lal s THR 386 Ca -0.07 1.29 -0.11 0.00 -1.18 0.00 0.00 61.69 61.61 3lal s THR 386 Cb -0.02 -3.71 0.09 0.00 1.34 0.00 0.00 72.50 70.20 3lal s THR 386 CO -0.01 0.10 1.09 -2.16 -0.54 0.00 0.00 174.62 173.10 3lal s PRO 387 N -2.25 1.87 -0.19 3.99 0.04 -1.26 -4.81 135.00 132.38 3lal s PRO 387 Ca 0.55 0.79 -0.14 0.00 0.04 0.00 0.00 61.00 62.25 3lal s PRO 387 Cb -0.26 -1.88 -0.05 0.00 0.04 0.00 0.00 34.50 32.36 3lal s PRO 387 CO 0.32 -1.81 0.29 0.15 0.04 0.00 0.00 177.00 175.99 3lal s LYS 388 N -5.04 4.21 0.18 4.56 1.02 0.75 -4.73 119.74 120.69 3lal s LYS 388 Ca 0.62 0.05 -0.07 0.00 0.02 0.00 0.00 55.97 56.58 3lal s LYS 388 Cb -0.16 -3.47 -0.06 0.00 -0.52 0.00 0.00 37.83 33.62 3lal s LYS 388 CO 0.55 0.14 0.46 -0.06 -0.92 0.00 0.00 175.35 175.53 3lal s PHE 389 N 0.77 3.45 -0.19 3.18 0.40 -0.49 -0.80 117.98 124.30 3lal s PHE 389 Ca 0.15 0.72 0.00 0.00 -0.60 0.00 0.00 56.93 57.20 3lal s PHE 389 Cb -0.13 -2.13 0.04 0.00 0.51 0.00 0.00 43.02 41.31 3lal s PHE 389 CO 0.05 0.36 -0.07 0.15 0.70 0.00 0.00 175.22 176.40 3lal s LYS 390 N -2.70 1.71 0.05 0.44 1.02 0.26 -1.53 119.74 118.99 3lal s LYS 390 Ca 0.44 -0.73 0.08 0.00 0.02 0.00 0.00 55.97 55.78 3lal s LYS 390 Cb -0.12 -2.28 -0.03 0.00 -0.52 0.00 0.00 37.83 34.89 3lal s LYS 390 CO 0.23 -0.46 -0.23 -0.51 -0.92 0.00 0.00 175.35 173.46 3lal s LEU 391 N 1.50 2.38 -0.58 3.17 1.43 -0.15 -2.94 118.68 123.49 3lal s LEU 391 Ca -0.01 -0.52 -0.07 0.00 -1.03 0.00 0.00 54.13 52.49 3lal s LEU 391 Cb -0.16 -1.39 -0.20 0.00 0.03 0.00 0.00 46.19 44.46 3lal s LEU 391 CO -0.08 0.25 3.39 -0.81 0.23 0.00 0.00 176.35 179.34 3lal n PRO 392 N 1.64 2.61 -3.71 1.29 -0.04 -1.26 -0.66 135.00 134.88 3lal n PRO 392 Ca -0.17 -1.43 -0.13 0.00 -0.04 0.00 0.00 63.50 61.73 3lal n PRO 392 Cb 0.52 -2.28 -0.09 0.00 -0.04 0.00 0.00 33.50 31.60 3lal n PRO 392 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 3lal s ILE 393 N 1.40 -0.00 0.62 0.52 2.07 -1.26 -0.63 121.20 123.91 3lal s ILE 393 Ca 0.68 0.00 -0.18 0.00 -1.41 0.00 0.00 60.65 59.75 3lal s ILE 393 Cb 0.27 -0.68 -0.02 0.00 0.13 0.00 0.00 42.46 42.16 3lal s ILE 393 CO -0.02 0.00 1.17 -1.10 -1.91 0.00 0.00 174.94 173.08 3lal s GLN 394 N 0.34 2.87 0.39 3.50 -1.52 -1.26 -4.53 119.66 119.45 3lal s GLN 394 Ca -0.01 1.69 0.09 0.00 -1.95 0.00 0.00 55.36 55.19 3lal s GLN 394 Cb -0.04 -1.93 0.81 0.00 -0.22 0.00 0.00 33.01 31.63 3lal s GLN 394 CO -0.00 -1.26 1.95 0.87 -0.25 0.00 0.00 175.29 176.60 3lal h LYS 395 N 0.58 0.31 0.05 2.91 1.79 -1.98 -2.44 116.57 117.79 3lal h LYS 395 Ca -0.49 -0.06 -0.23 0.00 -2.18 0.00 0.00 60.65 57.69 3lal h LYS 395 Cb 1.28 -0.05 -0.00 0.00 -1.58 0.00 0.00 32.23 31.88 3lal h LYS 395 CO 0.54 0.37 -1.04 1.49 -1.08 0.00 0.00 179.45 179.73 3lal h GLU 396 N 0.30 0.24 -0.33 3.15 4.81 -1.99 -1.51 114.58 119.25 3lal h GLU 396 Ca 0.07 -0.33 0.00 0.00 -0.13 0.00 0.00 59.36 58.97 3lal h GLU 396 Cb 0.27 0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.74 3lal h GLU 396 CO 0.01 1.09 0.22 1.15 -0.73 0.00 0.00 179.01 180.74 3lal h THR 397 N 0.11 1.09 -0.30 0.32 2.02 -1.90 -1.69 112.91 112.56 3lal h THR 397 Ca -0.08 -0.18 -0.10 0.00 0.77 0.00 0.00 66.41 66.82 3lal h THR 397 Cb 1.72 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 68.73 3lal h THR 397 CO 0.16 0.09 -0.23 -0.25 0.37 0.00 0.00 175.52 175.66 3lal h TRP 398 N 0.45 0.64 0.04 3.16 2.91 -1.28 -2.22 115.95 119.65 3lal h TRP 398 Ca 0.12 -0.13 -0.22 0.00 1.13 0.00 0.00 58.89 59.78 3lal h TRP 398 Cb -0.04 -0.16 -0.02 0.00 -0.51 0.00 0.00 29.16 28.44 3lal h TRP 398 CO -0.05 0.75 -1.03 1.05 -1.03 0.00 0.00 178.44 178.13 3lal h GLU 399 N 0.50 0.12 -0.37 2.65 4.11 -1.23 -1.57 114.58 118.79 3lal h GLU 399 Ca 0.07 -0.18 0.05 0.00 0.07 0.00 0.00 59.36 59.36 3lal h GLU 399 Cb 0.67 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.95 3lal h GLU 399 CO 0.05 1.04 0.13 1.15 0.07 0.00 0.00 179.01 181.45 3lal h THR 400 N 0.04 0.88 0.58 -1.06 2.02 -1.19 -2.37 112.91 111.82 3lal h THR 400 Ca -0.05 -0.10 -0.02 0.00 0.77 0.00 0.00 66.41 67.01 3lal h THR 400 Cb 1.75 0.58 -0.00 0.00 -1.74 0.00 0.00 68.15 68.74 3lal h THR 400 CO 0.15 0.05 -0.33 -0.25 0.37 0.00 0.00 175.52 175.51 3lal h TRP 401 N 0.28 -0.87 -0.66 3.16 2.91 -1.25 -3.08 115.95 116.44 3lal h TRP 401 Ca 0.17 -0.01 0.02 0.00 1.13 0.00 0.00 58.89 60.20 3lal h TRP 401 Cb 0.15 0.30 -0.04 0.00 -0.51 0.00 0.00 29.16 29.07 3lal h TRP 401 CO -0.15 -0.51 0.42 2.35 -1.03 0.00 0.00 178.44 179.52 3lal h TRP 402 N -0.85 0.80 -0.61 2.65 7.01 -1.26 -1.26 115.95 122.43 3lal h TRP 402 Ca -0.07 0.02 -0.09 0.00 2.11 0.00 0.00 58.89 60.86 3lal h TRP 402 Cb 0.68 -0.27 -0.02 0.00 -2.10 0.00 0.00 29.16 27.45 3lal h TRP 402 CO -0.08 0.49 0.03 1.79 -2.79 0.00 0.00 178.44 177.88 3lal h THR 403 N 0.85 1.26 -0.00 2.65 1.35 -1.47 -3.14 112.91 114.41 3lal h THR 403 Ca 0.25 -1.11 0.00 0.00 -0.55 0.00 0.00 66.41 65.00 3lal h THR 403 Cb -0.05 0.78 0.00 0.00 -1.73 0.00 0.00 68.15 67.15 3lal h THR 403 CO -0.07 0.41 -0.63 -1.84 -0.25 0.00 0.00 175.52 173.13 3lal n GLU 404 N -4.22 0.07 -2.87 4.72 0.28 -1.12 -4.90 120.64 112.60 3lal n GLU 404 Ca 0.03 -0.05 -0.32 0.00 -0.16 0.00 0.00 57.16 56.66 3lal n GLU 404 Cb 0.33 -1.50 -0.06 0.00 1.43 0.00 0.00 31.44 31.64 3lal n GLU 404 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 177.13 176.50 3lal s TYR 405 N -2.96 3.37 0.03 -1.84 5.04 -0.49 -5.00 117.35 115.50 3lal s TYR 405 Ca 0.11 1.39 0.09 0.00 -2.44 0.00 0.00 57.07 56.22 3lal s TYR 405 Cb 0.17 -2.68 -0.23 0.00 0.35 0.00 0.00 41.96 39.57 3lal s TYR 405 CO 0.74 -0.08 0.93 0.11 -1.34 0.00 0.00 175.55 175.91 3lal h TRP 406 N 1.81 0.03 -3.84 4.97 5.08 -1.90 -3.45 115.95 118.65 3lal h TRP 406 Ca -0.48 -0.02 -0.49 0.00 1.08 0.00 0.00 58.89 58.97 3lal h TRP 406 Cb 1.18 -0.00 0.01 0.00 -3.00 0.00 0.00 29.16 27.34 3lal h TRP 406 CO 0.62 1.03 0.42 -0.65 -1.28 0.00 0.00 178.44 178.58 3lal s GLN 407 N -2.65 4.56 0.51 0.12 -1.52 -1.26 -5.02 119.66 114.41 3lal s GLN 407 Ca -0.03 1.63 -0.20 0.00 -1.95 0.00 0.00 55.36 54.81 3lal s GLN 407 Cb 0.09 -3.01 -0.07 0.00 -0.22 0.00 0.00 33.01 29.79 3lal s GLN 407 CO 0.82 0.20 1.08 0.00 -0.25 0.00 0.00 175.29 177.14 3lal s ALA 408 N -1.33 2.81 0.33 6.09 0.00 -1.26 -5.05 121.76 123.34 3lal s ALA 408 Ca 0.48 0.71 -0.09 0.00 0.00 0.00 0.00 51.96 53.06 3lal s ALA 408 Cb -0.27 -3.30 0.02 0.00 0.00 0.00 0.00 23.12 19.56 3lal s ALA 408 CO 0.34 -0.51 0.57 -0.08 0.00 0.00 0.00 175.76 176.08 3lal s THR 409 N -1.87 0.00 0.00 0.00 -1.32 -1.26 -5.15 115.64 106.04 3lal s THR 409 Ca 0.69 -1.37 0.00 0.00 -1.21 0.00 0.00 61.69 59.80 3lal s THR 409 Cb -0.20 -2.58 0.00 0.00 -1.51 0.00 0.00 72.50 68.21 3lal s THR 409 CO 0.24 0.00 0.00 1.87 -2.21 0.00 0.00 174.62 174.52 3lal n TRP 410 N -0.51 0.00 -3.47 9.09 -0.00 -1.26 -5.14 117.44 116.15 3lal n TRP 410 Ca -0.02 0.00 -0.36 0.00 -0.00 0.00 0.00 57.50 57.11 3lal n TRP 410 Cb 0.61 0.00 -0.06 0.00 -0.00 0.00 0.00 31.31 31.86 3lal n TRP 410 CO 0.00 0.00 0.00 0.96 -0.00 0.00 0.00 177.69 178.65 3lal s ILE 411 N 0.00 4.98 0.00 5.87 -4.36 -1.26 -5.10 121.20 121.33 3lal s ILE 411 Ca 0.00 0.75 0.00 0.00 -0.26 0.00 0.00 60.65 61.14 3lal s ILE 411 Cb 0.00 -3.71 0.00 0.00 1.25 0.00 0.00 42.46 40.00 3lal s ILE 411 CO 0.00 0.41 0.00 -0.81 0.24 0.00 0.00 174.94 174.78 3lal n PRO 412 N 1.28 -0.69 -1.68 0.37 -0.04 -1.26 -4.82 135.00 128.16 3lal n PRO 412 Ca -0.10 0.00 -0.45 0.00 -0.04 0.00 0.00 63.50 62.91 3lal n PRO 412 Cb 0.52 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.94 3lal n PRO 412 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 3lal n GLU 413 N -1.14 2.51 -3.98 0.54 2.13 -1.26 -4.89 120.64 114.55 3lal n GLU 413 Ca 0.00 0.92 -0.08 0.00 0.66 0.00 0.00 57.16 58.66 3lal n GLU 413 Cb 0.00 -2.80 -0.09 0.00 0.27 0.00 0.00 31.44 28.82 3lal n GLU 413 CO 0.00 0.00 0.00 1.67 -0.41 0.00 0.00 177.13 178.39 3lal s TRP 414 N 3.66 0.34 0.10 4.31 1.48 -1.26 -1.39 118.94 126.18 3lal s TRP 414 Ca 0.88 -0.81 0.06 0.00 -1.06 0.00 0.00 56.10 55.17 3lal s TRP 414 Cb -0.57 -0.23 -0.03 0.00 -1.16 0.00 0.00 33.47 31.47 3lal s TRP 414 CO 0.45 -0.44 -0.16 -1.21 -4.06 0.00 0.00 176.95 171.53 3lal s GLU 415 N -3.72 1.00 0.36 3.25 2.02 -0.58 -4.97 118.70 116.06 3lal s GLU 415 Ca 0.05 -1.14 -0.27 0.00 0.02 0.00 0.00 54.97 53.62 3lal s GLU 415 Cb 0.06 -1.02 -0.09 0.00 0.10 0.00 0.00 34.13 33.17 3lal s GLU 415 CO -0.10 0.22 1.24 0.12 0.02 0.00 0.00 175.26 176.76 3lal s PHE 416 N -1.63 3.08 -0.02 1.61 5.36 -1.26 -0.97 117.98 124.15 3lal s PHE 416 Ca 0.05 1.50 0.01 0.00 -0.96 0.00 0.00 56.93 57.53 3lal s PHE 416 Cb -0.08 -3.54 0.01 0.00 -0.34 0.00 0.00 43.02 39.08 3lal s PHE 416 CO 0.03 -1.56 -0.02 0.54 -1.46 0.00 0.00 175.22 172.76 3lal s VAL 417 N -1.25 0.23 -1.28 3.12 0.11 0.17 -4.77 120.40 116.73 3lal s VAL 417 Ca 0.52 -0.02 -0.13 0.00 -2.93 0.00 0.00 61.98 59.42 3lal s VAL 417 Cb -0.36 -0.27 0.14 0.00 -1.53 0.00 0.00 36.38 34.37 3lal s VAL 417 CO 0.46 0.12 1.75 -3.20 -3.33 0.00 0.00 175.10 170.90 3lal n ASN 418 N 3.64 4.96 -3.81 3.54 2.85 -1.26 -4.05 115.26 121.13 3lal n ASN 418 Ca -0.21 -3.00 -0.28 0.00 -0.11 0.00 0.00 54.58 50.98 3lal n ASN 418 Cb 0.54 -1.57 -0.12 0.00 1.24 0.00 0.00 39.78 39.87 3lal n ASN 418 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 3lal s THR 419 N 1.66 2.43 0.91 -0.44 2.01 -1.26 -5.11 115.64 115.85 3lal s THR 419 Ca 0.44 -4.00 -0.10 0.00 0.31 0.00 0.00 61.69 58.34 3lal s THR 419 Cb 0.05 -2.60 0.15 0.00 0.01 0.00 0.00 72.50 70.10 3lal s THR 419 CO 0.00 -1.05 1.14 -2.16 -0.69 0.00 0.00 174.62 171.86 3lal s PRO 420 N -1.20 1.02 0.29 4.92 0.04 -1.26 -4.51 135.00 134.31 3lal s PRO 420 Ca 0.26 1.51 -0.29 0.00 0.04 0.00 0.00 61.00 62.52 3lal s PRO 420 Cb -0.03 -1.73 -0.10 0.00 0.04 0.00 0.00 34.50 32.68 3lal s PRO 420 CO -0.17 -2.62 1.30 -1.25 0.04 0.00 0.00 177.00 174.30 3lal s PRO 421 N -4.66 4.39 0.30 0.56 0.04 -1.26 -4.93 135.00 129.43 3lal s PRO 421 Ca 0.67 2.15 -0.19 0.00 0.04 0.00 0.00 61.00 63.66 3lal s PRO 421 Cb -0.23 -3.11 -0.09 0.00 0.04 0.00 0.00 34.50 31.11 3lal s PRO 421 CO 0.58 -0.17 0.79 -0.51 0.04 0.00 0.00 177.00 177.73 3lal s LEU 422 N -1.31 4.20 -0.12 -3.56 1.43 -1.26 -4.57 118.68 113.49 3lal s LEU 422 Ca 0.51 1.48 -0.26 0.00 -1.03 0.00 0.00 54.13 54.83 3lal s LEU 422 Cb -0.38 -3.93 -0.02 0.00 0.03 0.00 0.00 46.19 41.88 3lal s LEU 422 CO 0.48 -0.11 0.84 0.54 0.23 0.00 0.00 176.35 178.33 3lal s VAL 423 N -1.76 4.90 0.22 -1.59 0.11 0.19 -5.02 120.40 117.45 3lal s VAL 423 Ca 0.50 1.69 0.01 0.00 -2.93 0.00 0.00 61.98 61.25 3lal s VAL 423 Cb -0.14 -4.16 -0.05 0.00 -1.53 0.00 0.00 36.38 30.50 3lal s VAL 423 CO 0.19 0.09 0.08 -1.59 -3.33 0.00 0.00 175.10 170.54 3lal s LYS 424 N 1.72 1.29 -0.13 1.54 -2.85 -1.26 -4.55 119.74 115.50 3lal s LYS 424 Ca 0.41 -1.68 -0.16 0.00 -1.00 0.00 0.00 55.97 53.54 3lal s LYS 424 Cb -0.18 -0.13 -0.05 0.00 -2.06 0.00 0.00 37.83 35.42 3lal s LYS 424 CO 0.16 -0.28 0.38 -0.51 0.10 0.00 0.00 175.35 175.19 3lal s LEU 425 N -3.24 4.28 0.04 2.77 1.43 -1.26 -4.77 118.68 117.92 3lal s LEU 425 Ca 0.35 0.67 0.24 0.00 -1.03 0.00 0.00 54.13 54.35 3lal s LEU 425 Cb 0.07 -2.52 0.21 0.00 0.03 0.00 0.00 46.19 43.99 3lal s LEU 425 CO 0.11 0.08 1.19 0.79 0.23 0.00 0.00 176.35 178.75 3lal n TRP 426 N 3.46 0.21 -3.60 0.29 7.02 -1.26 -4.92 117.44 118.63 3lal n TRP 426 Ca -0.10 0.06 -0.08 0.00 -1.02 0.00 0.00 57.50 56.36 3lal n TRP 426 Cb 0.52 -0.38 -0.02 0.00 -2.42 0.00 0.00 31.31 29.01 3lal n TRP 426 CO 0.00 0.00 0.00 1.52 -2.02 0.00 0.00 177.69 177.19 3lal s TYR 427 N -3.11 -0.32 -0.04 -5.99 1.13 -1.26 -4.71 117.35 103.04 3lal s TYR 427 Ca 0.07 0.07 -0.01 0.00 -1.41 0.00 0.00 57.07 55.78 3lal s TYR 427 Cb 0.15 0.60 0.03 0.00 -1.10 0.00 0.00 41.96 41.64 3lal s TYR 427 CO 0.76 -0.83 0.04 -0.65 -2.51 0.00 0.00 175.55 172.36 3lal s GLN 428 N -3.49 0.12 0.60 -3.49 -0.21 -1.26 -5.02 119.66 106.90 3lal s GLN 428 Ca 0.07 0.26 -0.19 0.00 0.02 0.00 0.00 55.36 55.52 3lal s GLN 428 Cb -0.02 -0.57 -0.03 0.00 1.00 0.00 0.00 33.01 33.39 3lal s GLN 428 CO -0.05 -0.28 1.26 -0.51 -2.12 0.00 0.00 175.29 173.59 3lal s LEU 429 N 1.85 3.67 0.71 2.90 1.43 -1.26 -4.71 118.68 123.27 3lal s LEU 429 Ca 0.01 2.52 -0.15 0.00 -1.03 0.00 0.00 54.13 55.48 3lal s LEU 429 Cb -0.12 -4.55 0.03 0.00 0.03 0.00 0.00 46.19 41.57 3lal s LEU 429 CO -0.03 -1.71 1.17 -1.61 0.23 0.00 0.00 176.35 174.41 3lal s GLU 430 N -3.26 2.35 0.09 1.70 0.41 0.10 -4.96 118.70 115.13 3lal s GLU 430 Ca 0.78 1.64 0.22 0.00 -0.41 0.00 0.00 54.97 57.20 3lal s GLU 430 Cb -0.34 -1.87 -0.16 0.00 -1.78 0.00 0.00 34.13 29.97 3lal s GLU 430 CO 0.37 -1.65 0.77 1.63 -0.49 0.00 0.00 175.26 175.89 3lal n LYS 431 N -2.62 0.62 -4.20 1.61 5.02 -1.26 -4.73 118.16 112.60 3lal n LYS 431 Ca 0.12 -0.04 -0.15 0.00 -2.02 0.00 0.00 58.31 56.23 3lal n LYS 431 Cb 0.51 -1.67 -0.11 0.00 -0.02 0.00 0.00 35.03 33.74 3lal n LYS 431 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3lal s GLU 432 N -3.44 0.92 0.46 1.97 0.41 -1.26 -5.12 118.70 112.64 3lal s GLU 432 Ca -0.04 -1.25 -0.24 0.00 -0.41 0.00 0.00 54.97 53.03 3lal s GLU 432 Cb 0.12 -0.58 -0.09 0.00 -1.78 0.00 0.00 34.13 31.80 3lal s GLU 432 CO 0.85 0.09 1.21 -2.30 -0.49 0.00 0.00 175.26 174.61 3lal n PRO 433 N 0.33 1.70 -3.28 0.39 -0.02 -1.26 -4.83 135.00 128.02 3lal n PRO 433 Ca -0.14 0.61 -0.42 0.00 -2.02 0.00 0.00 63.50 61.53 3lal n PRO 433 Cb 0.59 -2.33 -0.08 0.00 -0.02 0.00 0.00 33.50 31.65 3lal n PRO 433 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3lal s ILE 434 N -1.25 5.05 0.29 4.25 1.01 -1.26 -5.04 121.20 124.24 3lal s ILE 434 Ca 0.64 0.07 -0.30 0.00 0.00 0.00 0.00 60.65 61.07 3lal s ILE 434 Cb -0.49 -3.98 -0.11 0.00 0.01 0.00 0.00 42.46 37.89 3lal s ILE 434 CO 0.56 -0.28 1.51 -0.69 0.00 0.00 0.00 174.94 176.03 3lal s VAL 435 N 2.29 2.32 -0.73 2.92 1.01 -1.26 -2.11 120.40 124.84 3lal s VAL 435 Ca 0.16 0.28 0.00 0.00 0.00 0.00 0.00 61.98 62.41 3lal s VAL 435 Cb -0.16 -3.18 0.00 0.00 0.00 0.00 0.00 36.38 33.04 3lal s VAL 435 CO 0.14 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.89 3lal n GLY 436 N 1.90 0.84 3.29 4.51 0.00 -1.26 -5.01 105.19 109.46 3lal n GLY 436 Ca 0.06 -0.72 -0.32 0.00 0.00 0.00 0.00 46.02 45.04 3lal n GLY 436 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3lal s ALA 437 N -2.27 2.37 0.17 4.61 0.00 -0.89 -5.05 121.76 120.69 3lal s ALA 437 Ca 0.00 -0.94 -0.32 0.00 0.00 0.00 0.00 51.96 50.70 3lal s ALA 437 Cb 0.00 -0.98 -0.12 0.00 0.00 0.00 0.00 23.12 22.03 3lal s ALA 437 CO 0.00 0.28 1.76 -1.91 0.00 0.00 0.00 175.76 175.89 3lal n GLU 438 N 3.48 2.73 -3.02 0.00 2.13 -1.26 -4.50 120.64 120.20 3lal n GLU 438 Ca -0.19 0.99 -0.43 0.00 0.66 0.00 0.00 57.16 58.20 3lal n GLU 438 Cb 0.53 -2.85 -0.06 0.00 0.27 0.00 0.00 31.44 29.33 3lal n GLU 438 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 3lal s THR 439 N 1.81 4.75 -0.36 6.31 2.01 -1.26 -2.42 115.64 126.47 3lal s THR 439 Ca 0.78 0.49 -0.20 0.00 0.31 0.00 0.00 61.69 63.08 3lal s THR 439 Cb -0.51 -4.23 0.00 0.00 0.01 0.00 0.00 72.50 67.77 3lal s THR 439 CO 0.35 -0.56 0.62 -0.36 -0.69 0.00 0.00 174.62 173.99 3lal s PHE 440 N 3.04 3.15 -0.53 4.92 0.40 0.02 -2.63 117.98 126.35 3lal s PHE 440 Ca 0.28 0.31 -0.22 0.00 -0.60 0.00 0.00 56.93 56.69 3lal s PHE 440 Cb -0.13 -3.12 0.05 0.00 0.51 0.00 0.00 43.02 40.32 3lal s PHE 440 CO 0.19 -0.63 0.83 0.71 0.70 0.00 0.00 175.22 177.02 3lal s TYR 441 N 2.68 2.88 0.29 0.36 1.51 0.21 -0.57 117.35 124.71 3lal s TYR 441 Ca 0.24 -0.19 0.07 0.00 -1.01 0.00 0.00 57.07 56.18 3lal s TYR 441 Cb -0.15 -3.88 -0.03 0.00 -0.11 0.00 0.00 41.96 37.79 3lal s TYR 441 CO 0.15 -1.23 0.24 0.14 -1.11 0.00 0.00 175.55 173.73 3lal s VAL 442 N 3.48 4.02 -0.20 0.71 -7.23 -0.27 -0.88 120.40 120.04 3lal s VAL 442 Ca 0.25 -1.40 -0.29 0.00 -1.81 0.00 0.00 61.98 58.74 3lal s VAL 442 Cb -0.15 -3.30 0.13 0.00 0.56 0.00 0.00 36.38 33.63 3lal s VAL 442 CO 0.17 -0.27 1.04 -0.62 -0.31 0.00 0.00 175.10 175.10 3lal s ASP 443 N -3.91 -0.36 0.42 4.85 3.68 -1.13 -4.55 116.67 115.67 3lal s ASP 443 Ca 0.36 0.47 0.04 0.00 2.13 0.00 0.00 52.55 55.56 3lal s ASP 443 Cb -0.07 0.40 -0.05 0.00 -1.45 0.00 0.00 42.92 41.76 3lal s ASP 443 CO 0.26 -0.28 0.04 -0.83 0.13 0.00 0.00 175.17 174.49 3lal s GLY 444 N -0.79 2.60 -0.30 2.66 0.00 -1.25 -1.60 107.32 108.64 3lal s GLY 444 Ca 0.00 -1.45 -0.17 0.00 0.00 0.00 0.00 44.72 43.10 3lal s GLY 444 CO -0.01 -2.02 1.29 0.00 0.00 0.00 0.00 173.10 172.36 3lal s ALA 445 N -2.98 -2.85 0.06 3.20 0.00 -1.18 -4.80 121.76 113.22 3lal s ALA 445 Ca 0.24 1.92 0.08 0.00 0.00 0.00 0.00 51.96 54.19 3lal s ALA 445 Cb 0.06 -2.08 -0.03 0.00 0.00 0.00 0.00 23.12 21.07 3lal s ALA 445 CO 0.12 -0.46 -0.21 0.00 0.00 0.00 0.00 175.76 175.22 3lal s ALA 446 N 1.23 1.77 0.01 0.00 0.00 -1.26 -1.62 121.76 121.89 3lal s ALA 446 Ca -0.06 -1.11 -0.28 0.00 0.00 0.00 0.00 51.96 50.51 3lal s ALA 446 Cb -0.02 -0.31 -0.04 0.00 0.00 0.00 0.00 23.12 22.75 3lal s ALA 446 CO -0.11 0.38 0.88 1.21 0.00 0.00 0.00 175.76 178.13 3lal s ASN 447 N -1.39 7.28 0.19 0.00 3.84 -0.42 -4.80 114.94 119.64 3lal s ASN 447 Ca 0.07 1.54 -0.10 0.00 0.21 0.00 0.00 52.86 54.59 3lal s ASN 447 Cb -0.09 -2.52 0.11 0.00 -0.55 0.00 0.00 41.25 38.19 3lal s ASN 447 CO 0.02 -0.15 1.73 -0.09 -2.79 0.00 0.00 177.10 175.82 3lal h ARG 448 N 6.41 1.05 0.15 0.43 9.65 -1.96 -0.05 114.38 130.06 3lal h ARG 448 Ca -0.42 -0.22 -0.32 0.00 -1.10 0.00 0.00 59.98 57.93 3lal h ARG 448 Cb 1.21 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 29.64 3lal h ARG 448 CO 0.74 0.90 -1.62 0.93 2.80 0.00 0.00 179.97 183.72 3lal h GLU 449 N 0.99 0.33 -0.47 0.20 3.07 -1.98 -3.37 114.58 113.33 3lal h GLU 449 Ca 0.22 -0.56 -0.12 0.00 -0.50 0.00 0.00 59.36 58.40 3lal h GLU 449 Cb 0.27 0.21 -0.01 0.00 -0.84 0.00 0.00 28.75 28.38 3lal h GLU 449 CO -0.01 1.27 -0.17 1.15 -1.40 0.00 0.00 179.01 179.85 3lal h THR 450 N -0.07 1.27 -0.07 1.13 2.02 -1.97 -3.47 112.91 111.76 3lal h THR 450 Ca -0.33 -1.32 -0.03 0.00 0.77 0.00 0.00 66.41 65.50 3lal h THR 450 Cb 1.95 1.13 -0.01 0.00 -1.74 0.00 0.00 68.15 69.48 3lal h THR 450 CO 0.12 0.46 -0.03 0.29 0.37 0.00 0.00 175.52 176.73 3lal n LYS 451 N -4.17 -0.47 -3.01 6.66 4.76 -0.04 -4.79 118.16 117.10 3lal n LYS 451 Ca -0.00 0.29 -0.40 0.00 -2.87 0.00 0.00 58.31 55.33 3lal n LYS 451 Cb 0.43 -3.77 -0.05 0.00 -1.84 0.00 0.00 35.03 29.80 3lal n LYS 451 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3lal s LEU 452 N -0.35 4.46 0.21 -0.35 2.96 -1.26 -0.35 118.68 124.01 3lal s LEU 452 Ca 0.00 1.43 0.09 0.00 -0.22 0.00 0.00 54.13 55.43 3lal s LEU 452 Cb 0.00 -3.20 -0.05 0.00 0.50 0.00 0.00 46.19 43.45 3lal s LEU 452 CO 0.00 0.05 -0.17 -0.83 -1.32 0.00 0.00 176.35 174.08 3lal s GLY 453 N -0.21 1.53 -0.14 7.98 0.00 0.17 -1.30 107.32 115.34 3lal s GLY 453 Ca 0.37 -1.67 -0.04 0.00 0.00 0.00 0.00 44.72 43.39 3lal s GLY 453 CO 0.23 -1.75 0.18 0.54 0.00 0.00 0.00 173.10 172.29 3lal s LYS 454 N -3.38 0.10 -0.14 2.90 1.02 -0.64 0.77 119.74 120.36 3lal s LYS 454 Ca 0.22 0.35 -0.04 0.00 0.02 0.00 0.00 55.97 56.52 3lal s LYS 454 Cb -0.03 -0.83 -0.03 0.00 -0.52 0.00 0.00 37.83 36.42 3lal s LYS 454 CO 0.09 -0.48 -0.00 0.00 -0.92 0.00 0.00 175.35 174.03 3lal s ALA 455 N 2.29 3.17 0.00 5.17 0.00 -0.36 -3.09 121.76 128.94 3lal s ALA 455 Ca 0.04 -0.80 0.00 0.00 0.00 0.00 0.00 51.96 51.21 3lal s ALA 455 Cb -0.14 -1.62 0.00 0.00 0.00 0.00 0.00 23.12 21.36 3lal s ALA 455 CO -0.09 0.31 0.00 0.41 0.00 0.00 0.00 175.76 176.40 3lal n GLY 456 N 3.14 4.08 3.61 0.00 0.00 -0.63 -0.95 105.19 114.45 3lal n GLY 456 Ca -0.17 -1.41 -0.08 0.00 0.00 0.00 0.00 46.02 44.36 3lal n GLY 456 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3lal s TYR 457 N -2.62 -0.31 0.05 1.61 -0.85 -0.95 -2.84 117.35 111.44 3lal s TYR 457 Ca 0.00 0.05 0.04 0.00 -0.52 0.00 0.00 57.07 56.64 3lal s TYR 457 Cb 0.00 0.60 -0.02 0.00 0.38 0.00 0.00 41.96 42.92 3lal s TYR 457 CO 0.00 -0.82 -0.12 0.08 -1.52 0.00 0.00 175.55 173.17 3lal s VAL 458 N -3.46 0.97 0.40 -3.49 1.01 -0.06 -2.52 120.40 113.24 3lal s VAL 458 Ca 0.07 -1.07 0.05 0.00 0.00 0.00 0.00 61.98 61.03 3lal s VAL 458 Cb -0.02 -0.92 -0.06 0.00 0.00 0.00 0.00 36.38 35.38 3lal s VAL 458 CO -0.04 -0.13 0.04 0.42 0.00 0.00 0.00 175.10 175.38 3lal s THR 459 N -1.04 1.49 -0.93 3.92 -4.23 -0.07 0.64 115.64 115.43 3lal s THR 459 Ca -0.02 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 58.77 3lal s THR 459 Cb -0.09 -2.76 0.21 0.00 1.34 0.00 0.00 72.50 71.20 3lal s THR 459 CO 0.01 0.00 1.80 -0.46 -0.54 0.00 0.00 174.62 175.43 3lal n ASN 460 N -0.94 0.25 -1.08 3.99 6.94 -1.08 -2.06 115.26 121.28 3lal n ASN 460 Ca -0.06 0.39 0.10 0.00 -0.02 0.00 0.00 54.58 54.99 3lal n ASN 460 Cb 0.67 -0.41 0.27 0.00 -2.36 0.00 0.00 39.78 37.94 3lal n ASN 460 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 3lal n ARG 461 N -1.67 2.37 -0.48 -3.83 1.74 -1.26 -4.94 116.66 108.59 3lal n ARG 461 Ca 0.06 -2.11 0.00 0.00 -0.77 0.00 0.00 57.85 55.03 3lal n ARG 461 Cb 0.36 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.33 3lal n ARG 461 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3lal n GLY 462 N 1.45 0.74 3.78 -0.13 0.00 -0.87 -5.03 105.19 105.13 3lal n GLY 462 Ca 0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.88 3lal n GLY 462 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3lal s ARG 463 N -0.52 3.32 -0.07 1.61 0.52 -1.26 -4.81 118.95 117.74 3lal s ARG 463 Ca 0.00 1.47 -0.19 0.00 -0.52 0.00 0.00 55.73 56.49 3lal s ARG 463 Cb 0.00 -2.01 0.04 0.00 0.52 0.00 0.00 34.95 33.50 3lal s ARG 463 CO 0.00 -0.85 0.44 -0.65 0.02 0.00 0.00 175.30 174.26 3lal s GLN 464 N -3.53 0.72 -0.30 3.54 -0.21 -1.26 -0.89 119.66 117.73 3lal s GLN 464 Ca 0.69 0.16 -0.15 0.00 0.02 0.00 0.00 55.36 56.08 3lal s GLN 464 Cb -0.21 0.33 0.16 0.00 1.00 0.00 0.00 33.01 34.30 3lal s GLN 464 CO 0.30 -0.18 0.99 0.21 -2.12 0.00 0.00 175.29 174.48 3lal s LYS 465 N -0.83 0.30 0.06 2.91 2.20 -1.05 -4.99 119.74 118.35 3lal s LYS 465 Ca -0.09 0.73 0.08 0.00 -0.36 0.00 0.00 55.97 56.32 3lal s LYS 465 Cb -0.03 0.40 -0.03 0.00 -1.51 0.00 0.00 37.83 36.65 3lal s LYS 465 CO 0.04 -0.10 -0.18 0.54 -0.36 0.00 0.00 175.35 175.29 3lal s VAL 466 N 2.31 2.79 0.09 4.02 0.11 -1.26 -2.24 120.40 126.21 3lal s VAL 466 Ca -0.03 -1.26 0.03 0.00 -2.93 0.00 0.00 61.98 57.79 3lal s VAL 466 Cb -0.06 -2.20 -0.03 0.00 -1.53 0.00 0.00 36.38 32.56 3lal s VAL 466 CO -0.17 0.28 -0.09 0.68 -3.33 0.00 0.00 175.10 172.47 3lal s VAL 467 N -0.97 0.84 -0.07 2.04 -7.23 -0.12 -4.98 120.40 109.90 3lal s VAL 467 Ca 0.15 -1.58 -0.04 0.00 -1.81 0.00 0.00 61.98 58.70 3lal s VAL 467 Cb -0.10 -1.27 -0.04 0.00 0.56 0.00 0.00 36.38 35.52 3lal s VAL 467 CO 0.06 -0.56 0.11 -0.89 -0.31 0.00 0.00 175.10 173.51 3lal s THR 468 N -2.40 5.16 0.03 5.32 2.01 -1.26 -1.23 115.64 123.27 3lal s THR 468 Ca 0.04 -0.04 0.07 0.00 0.31 0.00 0.00 61.69 62.07 3lal s THR 468 Cb -0.03 -3.28 -0.02 0.00 0.01 0.00 0.00 72.50 69.17 3lal s THR 468 CO -0.01 0.52 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.47 3lal s LEU 469 N -1.29 2.14 -0.08 4.42 1.43 0.23 -4.95 118.68 120.59 3lal s LEU 469 Ca 0.18 -0.51 0.00 0.00 -1.03 0.00 0.00 54.13 52.78 3lal s LEU 469 Cb -0.12 -1.04 -0.03 0.00 0.03 0.00 0.00 46.19 45.03 3lal s LEU 469 CO 0.08 0.19 -0.07 0.42 0.23 0.00 0.00 176.35 177.21 3lal s THR 470 N -0.74 3.68 -0.84 5.49 -4.23 -1.26 0.42 115.64 118.17 3lal s THR 470 Ca 0.08 -0.48 -0.03 0.00 -1.18 0.00 0.00 61.69 60.08 3lal s THR 470 Cb -0.09 -2.52 -0.01 0.00 1.34 0.00 0.00 72.50 71.23 3lal s THR 470 CO 0.01 0.59 0.70 -0.67 -0.54 0.00 0.00 174.62 174.71 3lal n ASP 471 N 2.40 -6.62 -4.05 3.99 2.03 0.52 -4.93 116.55 109.90 3lal n ASP 471 Ca -0.18 -0.48 -0.14 0.00 0.52 0.00 0.00 54.79 54.52 3lal n ASP 471 Cb 0.53 -4.09 -0.12 0.00 -0.72 0.00 0.00 41.12 36.72 3lal n ASP 471 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 3lal s THR 472 N -3.08 0.54 0.34 5.18 -1.32 -0.29 -5.04 115.64 111.97 3lal s THR 472 Ca 0.09 -0.95 -0.05 0.00 -1.21 0.00 0.00 61.69 59.58 3lal s THR 472 Cb -0.03 -0.58 -0.05 0.00 -1.51 0.00 0.00 72.50 70.34 3lal s THR 472 CO 0.80 -0.29 0.62 0.42 -2.21 0.00 0.00 174.62 173.96 3lal s THR 473 N -1.17 4.99 -0.94 5.08 -4.23 -1.26 -4.62 115.64 113.49 3lal s THR 473 Ca -0.08 0.06 0.00 0.00 -1.18 0.00 0.00 61.69 60.50 3lal s THR 473 Cb -0.09 -3.78 0.00 0.00 1.34 0.00 0.00 72.50 69.98 3lal s THR 473 CO 0.00 -0.47 0.83 -3.20 -0.54 0.00 0.00 174.62 171.24 3lal n ASN 474 N -1.33 0.00 -0.00 3.99 5.15 -1.26 -1.25 115.26 120.56 3lal n ASN 474 Ca -0.01 0.34 0.02 0.00 -0.60 0.00 0.00 54.58 54.32 3lal n ASN 474 Cb 0.54 -0.34 -0.03 0.00 -0.53 0.00 0.00 39.78 39.42 3lal n ASN 474 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3lal n GLN 475 N -1.33 0.65 0.03 1.20 10.64 -1.26 -4.33 117.38 122.99 3lal n GLN 475 Ca 0.00 -0.03 -0.01 0.00 -1.83 0.00 0.00 57.00 55.13 3lal n GLN 475 Cb 0.08 -1.10 0.28 0.00 -0.86 0.00 0.00 30.24 28.64 3lal n GLN 475 CO 0.00 0.00 0.00 0.87 -1.83 0.00 0.00 177.06 176.10 3lal h LYS 476 N 0.00 0.45 0.00 2.61 1.57 -1.56 -2.94 116.57 116.70 3lal h LYS 476 Ca -0.02 -0.12 -0.04 0.00 -1.87 0.00 0.00 60.65 58.60 3lal h LYS 476 Cb 0.37 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 3lal h LYS 476 CO 0.00 0.57 -0.19 1.79 -0.57 0.00 0.00 179.45 181.05 3lal h THR 477 N 0.42 0.55 0.00 -0.16 1.35 -1.69 -1.65 112.91 111.73 3lal h THR 477 Ca 0.08 -0.93 -0.19 0.00 -0.55 0.00 0.00 66.41 64.82 3lal h THR 477 Cb 0.46 1.63 -0.03 0.00 -1.73 0.00 0.00 68.15 68.48 3lal h THR 477 CO 0.03 0.19 -0.92 -0.33 -0.25 0.00 0.00 175.52 174.23 3lal h GLU 478 N 0.00 0.00 0.13 4.72 5.08 -1.71 -1.97 114.58 120.83 3lal h GLU 478 Ca -0.00 0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 58.07 3lal h GLU 478 Cb 0.61 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.88 3lal h GLU 478 CO 0.02 0.92 -1.24 -0.07 -1.00 0.00 0.00 179.01 177.64 3lal h LEU 479 N 0.00 0.73 -0.76 1.33 4.07 -1.44 -3.15 115.31 116.09 3lal h LEU 479 Ca -0.01 -0.70 0.01 0.00 0.08 0.00 0.00 57.88 57.26 3lal h LEU 479 Cb 1.68 -0.23 -0.04 0.00 1.08 0.00 0.00 40.66 43.15 3lal h LEU 479 CO 0.12 1.52 0.50 1.56 -1.08 0.00 0.00 178.44 181.06 3lal h GLN 480 N 0.21 1.00 -0.28 1.13 1.08 -1.28 0.11 115.11 117.08 3lal h GLN 480 Ca -0.17 -0.06 -0.02 0.00 -1.45 0.00 0.00 58.65 56.94 3lal h GLN 480 Cb 1.92 -0.22 -0.01 0.00 -0.05 0.00 0.00 27.48 29.11 3lal h GLN 480 CO 0.23 0.66 0.07 0.00 -0.95 0.00 0.00 178.83 178.84 3lal h ALA 481 N 1.28 1.61 0.02 3.87 0.00 -1.41 0.39 119.26 125.01 3lal h ALA 481 Ca 0.28 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.95 3lal h ALA 481 Cb -0.12 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 17.56 3lal h ALA 481 CO -0.06 0.30 -0.49 0.82 0.00 0.00 0.00 179.25 179.82 3lal h ILE 482 N 0.39 1.49 -0.74 0.00 2.04 -1.32 -2.34 117.51 117.03 3lal h ILE 482 Ca 0.10 -2.10 0.13 0.00 1.00 0.00 0.00 64.86 63.98 3lal h ILE 482 Cb 0.15 2.76 -0.05 0.00 -0.74 0.00 0.00 36.82 38.94 3lal h ILE 482 CO -0.00 0.60 0.49 0.22 0.00 0.00 0.00 178.15 179.45 3lal h TYR 483 N -0.31 0.56 -0.46 1.37 3.20 -0.32 -0.51 116.97 120.50 3lal h TYR 483 Ca -0.07 0.02 -0.14 0.00 3.14 0.00 0.00 58.73 61.68 3lal h TYR 483 Cb 1.24 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 39.32 3lal h TYR 483 CO 0.17 0.23 -0.26 1.25 -1.64 0.00 0.00 178.16 177.92 3lal h LEU 484 N 0.49 1.02 -0.63 2.82 5.85 -0.11 -1.84 115.31 122.92 3lal h LEU 484 Ca 0.35 -0.41 -0.07 0.00 0.84 0.00 0.00 57.88 58.60 3lal h LEU 484 Cb 0.69 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 3lal h LEU 484 CO -0.12 1.21 -0.32 0.00 -0.34 0.00 0.00 178.44 178.88 3lal h ALA 485 N 0.84 0.90 -0.08 1.25 0.00 -0.80 -2.81 119.26 118.56 3lal h ALA 485 Ca 0.10 -0.29 -0.24 0.00 0.00 0.00 0.00 54.91 54.49 3lal h ALA 485 Cb 0.84 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 18.60 3lal h ALA 485 CO 0.07 0.39 -0.87 -0.07 0.00 0.00 0.00 179.25 178.78 3lal h LEU 486 N 0.00 0.90 0.00 0.00 3.38 -0.80 -3.02 115.31 115.77 3lal h LEU 486 Ca -0.00 -0.68 0.00 0.00 0.09 0.00 0.00 57.88 57.28 3lal h LEU 486 Cb 1.00 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.48 3lal h LEU 486 CO 0.04 1.45 -0.33 0.00 0.09 0.00 0.00 178.44 179.69 3lal n GLN 487 N -3.93 0.07 0.00 1.13 10.64 -0.72 -3.46 117.38 121.11 3lal n GLN 487 Ca -0.09 0.03 0.09 0.00 -1.83 0.00 0.00 57.00 55.20 3lal n GLN 487 Cb 0.80 -1.55 0.06 0.00 -0.86 0.00 0.00 30.24 28.68 3lal n GLN 487 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 3lal n ASP 488 N -1.65 2.39 -5.00 2.61 8.00 -1.07 -5.00 116.55 116.82 3lal n ASP 488 Ca 0.06 -1.69 -0.18 0.00 0.71 0.00 0.00 54.79 53.68 3lal n ASP 488 Cb 0.36 0.11 0.02 0.00 -0.02 0.00 0.00 41.12 41.59 3lal n ASP 488 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3lal s SER 489 N -1.68 5.53 0.62 -2.24 1.04 -1.14 -5.07 113.70 110.76 3lal s SER 489 Ca 0.20 -0.42 0.00 0.00 0.48 0.00 0.00 55.95 56.22 3lal s SER 489 Cb 0.15 -0.57 0.00 0.00 0.10 0.00 0.00 66.02 65.71 3lal s SER 489 CO 0.28 -0.89 0.00 0.61 0.98 0.00 0.00 173.24 174.22 3lal n GLY 490 N -1.97 -1.16 0.24 7.32 0.00 -1.26 -4.95 105.19 103.41 3lal n GLY 490 Ca 0.09 -1.63 0.15 0.00 0.00 0.00 0.00 46.02 44.64 3lal n GLY 490 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3lal h LEU 491 N 0.00 0.00 -8.61 0.99 3.38 -1.95 -3.41 115.31 105.70 3lal h LEU 491 Ca 0.00 0.00 -0.68 0.00 0.09 0.00 0.00 57.88 57.29 3lal h LEU 491 Cb 0.00 0.00 -0.29 0.00 0.09 0.00 0.00 40.66 40.46 3lal h LEU 491 CO 0.00 0.00 -0.88 -1.61 0.09 0.00 0.00 178.44 176.04 3lal s GLU 492 N -3.48 1.99 -0.28 1.13 2.02 -1.26 -0.53 118.70 118.28 3lal s GLU 492 Ca 0.04 -0.94 -0.18 0.00 0.02 0.00 0.00 54.97 53.90 3lal s GLU 492 Cb 0.08 -1.97 0.12 0.00 0.10 0.00 0.00 34.13 32.46 3lal s GLU 492 CO 0.56 0.53 0.89 0.54 0.02 0.00 0.00 175.26 177.81 3lal s VAL 493 N -0.63 0.00 -0.10 2.63 0.11 -0.86 -4.32 120.40 117.22 3lal s VAL 493 Ca 0.10 0.00 -0.11 0.00 -2.93 0.00 0.00 61.98 59.04 3lal s VAL 493 Cb -0.10 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.71 3lal s VAL 493 CO -0.00 0.00 0.24 0.20 -3.33 0.00 0.00 175.10 172.20 3lal s ASN 494 N 1.16 6.49 -0.11 3.54 0.01 -1.02 -2.14 114.94 122.88 3lal s ASN 494 Ca -0.06 0.59 0.02 0.00 -0.71 0.00 0.00 52.86 52.69 3lal s ASN 494 Cb -0.04 -2.14 0.01 0.00 0.41 0.00 0.00 41.25 39.49 3lal s ASN 494 CO -0.14 0.31 -0.16 -0.63 -1.51 0.00 0.00 177.10 174.98 3lal s ILE 495 N -0.66 1.55 -0.20 0.60 1.01 0.15 -0.80 121.20 122.86 3lal s ILE 495 Ca 0.17 -0.68 -0.05 0.00 0.00 0.00 0.00 60.65 60.09 3lal s ILE 495 Cb -0.13 -1.41 -0.02 0.00 0.01 0.00 0.00 42.46 40.91 3lal s ILE 495 CO 0.06 0.45 -0.01 -0.69 0.00 0.00 0.00 174.94 174.75 3lal s VAL 496 N 0.91 3.86 0.16 2.92 1.01 0.27 -0.77 120.40 128.76 3lal s VAL 496 Ca -0.08 -0.34 0.05 0.00 0.00 0.00 0.00 61.98 61.61 3lal s VAL 496 Cb -0.15 -2.75 -0.04 0.00 0.00 0.00 0.00 36.38 33.44 3lal s VAL 496 CO -0.01 0.43 -0.11 0.28 0.00 0.00 0.00 175.10 175.69 3lal s THR 497 N 1.03 1.30 -0.55 3.92 -1.32 0.04 -1.12 115.64 118.95 3lal s THR 497 Ca 0.02 -2.07 0.12 0.00 -1.21 0.00 0.00 61.69 58.54 3lal s THR 497 Cb -0.14 -1.87 0.34 0.00 -1.51 0.00 0.00 72.50 69.32 3lal s THR 497 CO 0.01 -0.70 1.28 -0.90 -2.21 0.00 0.00 174.62 172.10 3lal n ASP 498 N -0.19 3.10 -4.38 8.08 5.68 -1.26 -0.65 116.55 126.93 3lal n ASP 498 Ca -0.10 -2.38 -0.45 0.00 -0.50 0.00 0.00 54.79 51.36 3lal n ASP 498 Cb 0.60 -0.32 -0.06 0.00 -1.14 0.00 0.00 41.12 40.21 3lal n ASP 498 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 3lal s SER 499 N -1.40 6.19 0.28 -1.12 0.15 -1.26 -4.68 113.70 111.86 3lal s SER 499 Ca 0.27 -1.37 -0.02 0.00 0.70 0.00 0.00 55.95 55.53 3lal s SER 499 Cb 0.19 -2.25 0.44 0.00 -1.71 0.00 0.00 66.02 62.68 3lal s SER 499 CO 0.11 -0.91 1.91 -0.61 1.20 0.00 0.00 173.24 174.94 3lal h GLN 500 N 8.98 1.11 -0.08 5.44 5.75 -1.94 -0.47 115.11 133.91 3lal h GLN 500 Ca -0.29 -0.07 0.03 0.00 -0.15 0.00 0.00 58.65 58.17 3lal h GLN 500 Cb 1.10 -0.25 -0.03 0.00 1.07 0.00 0.00 27.48 29.37 3lal h GLN 500 CO 1.01 0.74 -0.09 -0.92 -2.65 0.00 0.00 178.83 176.92 3lal h TYR 501 N 1.15 -0.22 -0.37 3.99 3.20 -1.99 0.78 116.97 123.51 3lal h TYR 501 Ca 0.39 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.23 3lal h TYR 501 Cb 0.10 0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.46 3lal h TYR 501 CO -0.00 -0.14 0.07 0.00 -1.64 0.00 0.00 178.16 176.45 3lal h ALA 502 N 0.94 0.49 -0.13 1.82 0.00 -1.85 -2.40 119.26 118.12 3lal h ALA 502 Ca 0.06 -0.20 0.04 0.00 0.00 0.00 0.00 54.91 54.80 3lal h ALA 502 Cb 0.20 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 3lal h ALA 502 CO -0.15 0.19 -0.10 1.25 0.00 0.00 0.00 179.25 180.44 3lal h LEU 503 N 0.45 -0.32 -0.62 0.00 5.85 -0.72 -1.86 115.31 118.09 3lal h LEU 503 Ca 0.11 0.07 0.08 0.00 0.84 0.00 0.00 57.88 58.99 3lal h LEU 503 Cb 0.35 0.16 -0.07 0.00 0.37 0.00 0.00 40.66 41.48 3lal h LEU 503 CO 0.01 -0.13 0.27 1.23 -0.34 0.00 0.00 178.44 179.47 3lal h GLY 504 N -0.11 0.89 0.80 3.75 0.00 0.71 0.14 103.07 109.25 3lal h GLY 504 Ca 0.08 -0.16 -0.00 0.00 0.00 0.00 0.00 47.33 47.25 3lal h GLY 504 CO -0.20 0.03 -0.02 -2.22 0.00 0.00 0.00 176.54 174.13 3lal h ILE 505 N 0.48 1.10 -0.06 2.60 2.04 -1.14 -3.13 117.51 119.40 3lal h ILE 505 Ca 0.30 -0.45 -0.18 0.00 1.00 0.00 0.00 64.86 65.54 3lal h ILE 505 Cb 0.33 1.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.80 3lal h ILE 505 CO -0.27 0.11 -0.73 0.40 0.00 0.00 0.00 178.15 177.66 3lal h ILE 506 N -0.25 1.40 0.00 -0.67 1.08 -0.96 -3.03 117.51 115.09 3lal h ILE 506 Ca -0.01 -2.20 0.00 0.00 -0.39 0.00 0.00 64.86 62.26 3lal h ILE 506 Cb 0.23 2.16 0.00 0.00 -3.07 0.00 0.00 36.82 36.14 3lal h ILE 506 CO 0.01 0.65 0.00 1.67 -0.69 0.00 0.00 178.15 179.79 3lal n GLN 507 N -3.81 0.15 -0.13 2.37 7.27 0.45 -1.39 117.38 122.30 3lal n GLN 507 Ca -0.04 0.44 0.10 0.00 0.07 0.00 0.00 57.00 57.57 3lal n GLN 507 Cb 0.71 -1.82 0.30 0.00 2.41 0.00 0.00 30.24 31.83 3lal n GLN 507 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3lal n ALA 508 N -1.73 2.48 -3.63 1.69 0.00 -1.14 -4.97 120.51 113.21 3lal n ALA 508 Ca 0.02 -0.67 -0.22 0.00 0.00 0.00 0.00 53.44 52.56 3lal n ALA 508 Cb 0.18 -1.01 0.06 0.00 0.00 0.00 0.00 19.45 18.68 3lal n ALA 508 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3lal n GLN 509 N 0.67 -6.34 -1.66 0.00 6.02 -0.48 -4.85 117.38 110.74 3lal n GLN 509 Ca 0.16 0.74 -0.40 0.00 -0.01 0.00 0.00 57.00 57.49 3lal n GLN 509 Cb 0.39 -5.63 0.03 0.00 1.02 0.00 0.00 30.24 26.05 3lal n GLN 509 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 3lal n PRO 510 N -4.49 1.46 0.00 -1.09 -0.02 -1.26 -4.65 135.00 124.94 3lal n PRO 510 Ca -0.16 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 3lal n PRO 510 Cb 0.62 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 3lal n PRO 510 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3lal n ASP 511 N -0.08 1.41 -3.52 2.55 5.68 -0.55 -4.92 116.55 117.12 3lal n ASP 511 Ca 0.10 -1.62 -0.16 0.00 -0.50 0.00 0.00 54.79 52.61 3lal n ASP 511 Cb 0.42 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 40.35 3lal n ASP 511 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3lal s GLN 512 N -0.62 1.08 0.03 0.11 -2.07 -0.89 -4.99 119.66 112.31 3lal s GLN 512 Ca 0.00 0.01 -0.26 0.00 -1.82 0.00 0.00 55.36 53.29 3lal s GLN 512 Cb 0.00 0.50 0.06 0.00 -1.09 0.00 0.00 33.01 32.49 3lal s GLN 512 CO 0.00 -0.38 0.60 0.45 -1.32 0.00 0.00 175.29 174.65 3lal s SER 513 N -1.63 -0.56 0.50 12.60 0.15 -1.26 -2.69 113.70 120.81 3lal s SER 513 Ca -0.08 0.36 0.29 0.00 0.70 0.00 0.00 55.95 57.23 3lal s SER 513 Cb -0.01 0.53 1.06 0.00 -1.71 0.00 0.00 66.02 65.90 3lal s SER 513 CO 0.03 -0.73 1.87 -0.33 1.20 0.00 0.00 173.24 175.29 3lal h GLU 514 N 2.71 0.00 -6.04 5.44 5.08 -1.76 -3.45 114.58 116.57 3lal h GLU 514 Ca -0.30 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.50 3lal h GLU 514 Cb 1.20 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.40 3lal h GLU 514 CO 0.39 0.06 0.06 0.45 -1.00 0.00 0.00 179.01 178.97 3lal s SER 515 N -5.91 6.98 0.04 1.42 0.15 -1.26 -4.98 113.70 110.13 3lal s SER 515 Ca 0.02 1.17 -0.24 0.00 0.70 0.00 0.00 55.95 57.61 3lal s SER 515 Cb 0.08 -2.40 -0.17 0.00 -1.71 0.00 0.00 66.02 61.82 3lal s SER 515 CO 0.59 -0.07 1.50 -0.08 1.20 0.00 0.00 173.24 176.38 3lal h GLU 516 N 6.54 0.03 -0.24 5.44 4.57 -1.99 -1.03 114.58 127.90 3lal h GLU 516 Ca -0.42 -0.01 0.04 0.00 -1.18 0.00 0.00 59.36 57.80 3lal h GLU 516 Cb 1.20 -0.00 -0.07 0.00 -0.16 0.00 0.00 28.75 29.71 3lal h GLU 516 CO 0.74 0.28 -0.51 1.25 -1.18 0.00 0.00 179.01 179.59 3lal h LEU 517 N -0.21 -1.64 -1.78 1.64 6.46 -1.99 0.12 115.31 117.91 3lal h LEU 517 Ca 0.01 0.21 0.03 0.00 -0.12 0.00 0.00 57.88 58.01 3lal h LEU 517 Cb 0.26 0.66 -0.02 0.00 -0.73 0.00 0.00 40.66 40.83 3lal h LEU 517 CO 0.00 -0.44 0.21 0.58 -0.62 0.00 0.00 178.44 178.17 3lal h VAL 518 N -0.49 0.99 -0.04 1.05 2.07 -1.95 0.73 116.25 118.60 3lal h VAL 518 Ca 0.07 -0.10 -0.10 0.00 0.82 0.00 0.00 66.70 67.39 3lal h VAL 518 Cb 0.64 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 3lal h VAL 518 CO -0.49 0.05 -0.43 0.78 0.02 0.00 0.00 177.57 177.50 3lal h ASN 519 N 0.28 0.10 -0.01 0.57 -0.26 -0.05 -1.36 115.58 114.85 3lal h ASN 519 Ca 0.13 -0.04 -0.06 0.00 -0.56 0.00 0.00 56.30 55.77 3lal h ASN 519 Cb 0.18 -0.03 0.00 0.00 -1.06 0.00 0.00 38.32 37.41 3lal h ASN 519 CO -0.03 0.52 -0.22 1.56 -1.06 0.00 0.00 177.43 178.20 3lal h GLN 520 N 0.08 0.17 -0.97 0.81 4.20 0.29 -2.59 115.11 117.10 3lal h GLN 520 Ca 0.00 -0.17 0.16 0.00 0.06 0.00 0.00 58.65 58.71 3lal h GLN 520 Cb 0.80 0.04 -0.09 0.00 0.30 0.00 0.00 27.48 28.54 3lal h GLN 520 CO 0.06 0.88 0.61 0.82 -0.67 0.00 0.00 178.83 180.53 3lal h ILE 521 N -0.47 0.79 -0.35 2.54 2.04 -0.67 -1.75 117.51 119.64 3lal h ILE 521 Ca -0.02 -0.26 -0.06 0.00 1.00 0.00 0.00 64.86 65.51 3lal h ILE 521 Cb 0.95 -0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 3lal h ILE 521 CO 0.04 0.14 -0.03 0.40 0.00 0.00 0.00 178.15 178.71 3lal h ILE 522 N 0.76 1.27 -0.00 -0.67 2.04 -1.20 0.05 117.51 119.75 3lal h ILE 522 Ca 0.51 -1.03 -0.01 0.00 1.00 0.00 0.00 64.86 65.33 3lal h ILE 522 Cb 0.79 1.24 -0.00 0.00 -0.74 0.00 0.00 36.82 38.10 3lal h ILE 522 CO -0.28 0.34 -0.05 1.05 0.00 0.00 0.00 178.15 179.21 3lal h GLU 523 N 0.44 0.00 -0.03 2.37 4.11 -0.93 -1.99 114.58 118.55 3lal h GLU 523 Ca 0.10 -0.00 -0.12 0.00 0.07 0.00 0.00 59.36 59.41 3lal h GLU 523 Cb 0.50 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.76 3lal h GLU 523 CO 0.02 0.05 -0.44 1.96 0.07 0.00 0.00 179.01 180.68 3lal h GLN 524 N 0.00 0.35 0.00 1.06 1.08 -0.79 -2.92 115.11 113.90 3lal h GLN 524 Ca -0.00 -0.34 -0.02 0.00 -1.45 0.00 0.00 58.65 56.84 3lal h GLN 524 Cb 0.09 0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 27.60 3lal h GLN 524 CO 0.01 1.00 -0.11 -0.07 -0.95 0.00 0.00 178.83 178.71 3lal h LEU 525 N -0.18 0.00 -0.12 1.46 3.38 -0.30 -0.20 115.31 119.35 3lal h LEU 525 Ca -0.05 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.69 3lal h LEU 525 Cb 1.13 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.88 3lal h LEU 525 CO 0.09 0.11 -1.01 0.40 0.09 0.00 0.00 178.44 178.12 3lal h ILE 526 N 0.00 1.45 0.00 1.22 2.04 -1.44 -3.21 117.51 117.57 3lal h ILE 526 Ca -0.00 -2.67 0.00 0.00 1.00 0.00 0.00 64.86 63.19 3lal h ILE 526 Cb 0.26 2.58 0.00 0.00 -0.74 0.00 0.00 36.82 38.92 3lal h ILE 526 CO 0.01 0.79 0.00 0.11 0.00 0.00 0.00 178.15 179.06 3lal h LYS 527 N 0.16 0.00 -7.54 2.37 1.79 -0.83 -3.46 116.57 109.06 3lal h LYS 527 Ca -0.08 0.00 -0.46 0.00 -2.18 0.00 0.00 60.65 57.93 3lal h LYS 527 Cb 1.67 0.00 0.11 0.00 -1.58 0.00 0.00 32.23 32.42 3lal h LYS 527 CO 0.17 0.00 0.34 0.15 -1.08 0.00 0.00 179.45 179.03 3lal s LYS 528 N -3.81 1.72 -0.24 3.15 -0.14 -1.05 -5.03 119.74 114.34 3lal s LYS 528 Ca -0.01 -0.19 -0.07 0.00 -1.36 0.00 0.00 55.97 54.34 3lal s LYS 528 Cb 0.10 -2.02 -0.12 0.00 -1.68 0.00 0.00 37.83 34.11 3lal s LYS 528 CO 0.50 -1.67 -0.28 -1.91 -0.76 0.00 0.00 175.35 171.24 3lal n GLU 529 N -3.27 0.54 -3.72 1.68 4.07 0.31 -5.00 120.64 115.25 3lal n GLU 529 Ca 0.10 0.20 -0.12 0.00 -0.06 0.00 0.00 57.16 57.28 3lal n GLU 529 Cb 0.60 -1.41 -0.12 0.00 -0.06 0.00 0.00 31.44 30.45 3lal n GLU 529 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 3lal s LYS 530 N -2.46 0.28 -0.07 5.31 1.02 -0.74 -5.01 119.74 118.08 3lal s LYS 530 Ca -0.33 0.59 0.02 0.00 0.02 0.00 0.00 55.97 56.27 3lal s LYS 530 Cb 0.11 -0.06 0.02 0.00 -0.52 0.00 0.00 37.83 37.38 3lal s LYS 530 CO 0.47 -0.15 -0.11 0.08 -0.92 0.00 0.00 175.35 174.72 3lal s VAL 531 N 1.17 1.08 -0.14 3.17 1.01 -1.26 -2.04 120.40 123.39 3lal s VAL 531 Ca -0.08 -0.43 0.00 0.00 0.00 0.00 0.00 61.98 61.47 3lal s VAL 531 Cb -0.09 -1.00 -0.01 0.00 0.00 0.00 0.00 36.38 35.28 3lal s VAL 531 CO -0.09 0.35 -0.14 -0.47 0.00 0.00 0.00 175.10 174.75 3lal s TYR 532 N 0.81 2.79 -0.16 5.22 5.04 -0.91 0.03 117.35 130.18 3lal s TYR 532 Ca -0.12 -0.76 -0.01 0.00 -2.44 0.00 0.00 57.07 53.74 3lal s TYR 532 Cb -0.15 -1.85 -0.01 0.00 0.35 0.00 0.00 41.96 40.29 3lal s TYR 532 CO 0.02 -0.29 -0.11 -1.17 -1.34 0.00 0.00 175.55 172.66 3lal s LEU 533 N 0.48 2.72 0.16 6.97 0.20 -1.26 -0.67 118.68 127.28 3lal s LEU 533 Ca -0.10 -0.37 0.09 0.00 0.69 0.00 0.00 54.13 54.44 3lal s LEU 533 Cb -0.16 -1.64 -0.04 0.00 -0.43 0.00 0.00 46.19 43.92 3lal s LEU 533 CO 0.05 0.10 -0.20 0.00 -0.29 0.00 0.00 176.35 176.01 3lal s ALA 534 N 0.76 2.06 0.02 5.97 0.00 0.05 -4.98 121.76 125.63 3lal s ALA 534 Ca -0.05 -1.47 0.08 0.00 0.00 0.00 0.00 51.96 50.53 3lal s ALA 534 Cb -0.15 -0.22 -0.02 0.00 0.00 0.00 0.00 23.12 22.72 3lal s ALA 534 CO 0.01 0.29 -0.25 -0.46 0.00 0.00 0.00 175.76 175.36 3lal s TRP 535 N -1.81 2.20 0.09 0.00 -0.00 -1.25 -0.78 118.94 117.40 3lal s TRP 535 Ca 0.15 -0.41 0.04 0.00 -0.00 0.00 0.00 56.10 55.88 3lal s TRP 535 Cb -0.07 -1.36 -0.03 0.00 -0.00 0.00 0.00 33.47 32.00 3lal s TRP 535 CO 0.07 0.05 -0.11 0.08 -0.00 0.00 0.00 176.95 177.03 3lal s VAL 536 N -0.70 0.97 0.07 5.86 1.01 0.17 -4.92 120.40 122.86 3lal s VAL 536 Ca 0.10 -1.58 -0.31 0.00 0.00 0.00 0.00 61.98 60.19 3lal s VAL 536 Cb -0.10 -1.30 -0.08 0.00 0.00 0.00 0.00 36.38 34.90 3lal s VAL 536 CO 0.01 -0.50 1.54 -2.84 0.00 0.00 0.00 175.10 173.30 3lal s PRO 537 N -2.61 4.24 0.53 2.72 0.02 -1.26 -4.24 135.00 134.40 3lal s PRO 537 Ca 0.04 2.20 -0.21 0.00 0.02 0.00 0.00 61.00 63.05 3lal s PRO 537 Cb -0.04 -3.48 -0.05 0.00 0.02 0.00 0.00 34.50 30.94 3lal s PRO 537 CO 0.01 -0.63 1.23 0.00 -0.33 0.00 0.00 177.00 177.28 3lal s ALA 538 N 2.16 2.79 -1.64 -1.55 0.00 -1.26 -3.66 121.76 118.60 3lal s ALA 538 Ca 0.69 1.07 -0.03 0.00 0.00 0.00 0.00 51.96 53.70 3lal s ALA 538 Cb -0.38 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.29 3lal s ALA 538 CO 0.30 -1.02 0.31 0.72 0.00 0.00 0.00 175.76 176.07 3lal n HIS 539 N -1.00 -1.51 0.49 0.00 8.25 -1.26 -4.82 115.22 115.36 3lal n HIS 539 Ca 0.10 0.27 0.06 0.00 -0.26 0.00 0.00 57.72 57.89 3lal n HIS 539 Cb 0.48 -4.18 0.06 0.00 1.12 0.00 0.00 29.99 27.47 3lal n HIS 539 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3lal n LYS 540 N -3.53 0.89 -1.08 -0.41 4.76 -1.24 -4.96 118.16 112.59 3lal n LYS 540 Ca -0.17 -1.31 -0.03 0.00 -2.87 0.00 0.00 58.31 53.93 3lal n LYS 540 Cb 0.65 -1.25 -0.01 0.00 -1.84 0.00 0.00 35.03 32.58 3lal n LYS 540 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3lal n GLY 541 N 0.71 0.60 3.72 0.72 0.00 -1.26 -4.97 105.19 104.71 3lal n GLY 541 Ca 0.08 -0.77 -0.42 0.00 0.00 0.00 0.00 46.02 44.91 3lal n GLY 541 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3lal s ILE 542 N -2.08 3.21 0.00 -0.61 -1.09 -1.26 -4.75 121.20 114.62 3lal s ILE 542 Ca 0.00 0.87 0.00 0.00 -2.23 0.00 0.00 60.65 59.29 3lal s ILE 542 Cb 0.00 -3.56 0.00 0.00 -1.58 0.00 0.00 42.46 37.32 3lal s ILE 542 CO 0.00 0.07 0.00 0.61 -1.23 0.00 0.00 174.94 174.39 3lal n GLY 543 N 3.53 0.37 0.00 6.18 0.00 -1.26 -1.50 105.19 112.51 3lal n GLY 543 Ca 0.12 -0.13 0.03 0.00 0.00 0.00 0.00 46.02 46.04 3lal n GLY 543 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3lal n GLY 544 N 0.00 -0.38 0.17 -0.02 0.00 -1.26 -2.04 105.19 101.66 3lal n GLY 544 Ca 0.00 -0.04 -0.12 0.00 0.00 0.00 0.00 46.02 45.86 3lal n GLY 544 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 3lal h ASN 545 N 0.00 0.52 -0.89 1.61 -1.24 -1.64 -2.87 115.58 111.07 3lal h ASN 545 Ca 0.00 -0.41 0.17 0.00 0.71 0.00 0.00 56.30 56.77 3lal h ASN 545 Cb 0.04 -0.14 -0.10 0.00 0.73 0.00 0.00 38.32 38.84 3lal h ASN 545 CO 0.00 0.81 0.47 -0.08 -1.29 0.00 0.00 177.43 177.34 3lal h GLU 546 N 0.22 0.58 0.02 6.67 4.57 -1.02 -1.31 114.58 124.32 3lal h GLU 546 Ca 0.05 -0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.20 3lal h GLU 546 Cb 0.62 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 29.08 3lal h GLU 546 CO 0.04 0.39 -0.01 1.96 -1.18 0.00 0.00 179.01 180.20 3lal h GLN 547 N 0.60 -0.03 0.00 1.92 7.50 -1.68 -2.57 115.11 120.85 3lal h GLN 547 Ca 0.51 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.66 3lal h GLN 547 Cb 0.81 0.01 0.00 0.00 0.05 0.00 0.00 27.48 28.34 3lal h GLN 547 CO -0.41 0.46 0.00 -0.24 -1.50 0.00 0.00 178.83 177.14 3lal h VAL 548 N -0.54 0.00 -0.18 -0.54 3.04 -1.41 -2.52 116.25 114.10 3lal h VAL 548 Ca -0.00 -0.72 -0.16 0.00 -1.01 0.00 0.00 66.70 64.80 3lal h VAL 548 Cb 0.50 1.71 -0.01 0.00 -2.01 0.00 0.00 31.29 31.49 3lal h VAL 548 CO 0.01 0.00 -0.54 -0.78 -1.01 0.00 0.00 177.57 175.24 3lal h ASP 549 N 0.00 0.60 0.17 3.17 1.82 -1.18 -3.04 116.42 117.95 3lal h ASP 549 Ca 0.00 -0.32 -0.15 0.00 -0.39 0.00 0.00 57.03 56.17 3lal h ASP 549 Cb 0.75 -0.17 -0.01 0.00 0.68 0.00 0.00 39.33 40.58 3lal h ASP 549 CO 0.00 1.03 -0.56 0.11 -1.61 0.00 0.00 179.24 178.21 3lal h LYS 550 N 0.42 0.41 0.00 0.28 1.57 -1.04 -3.19 116.57 115.02 3lal h LYS 550 Ca 0.01 -0.26 -0.03 0.00 -1.87 0.00 0.00 60.65 58.50 3lal h LYS 550 Cb 1.08 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 33.42 3lal h LYS 550 CO 0.10 0.86 -0.12 -0.07 -0.57 0.00 0.00 179.45 179.65 3lal h LEU 551 N 0.32 0.00 -8.22 2.94 -0.00 -1.37 -3.40 115.31 105.58 3lal h LEU 551 Ca 0.00 0.00 -0.71 0.00 -0.00 0.00 0.00 57.88 57.18 3lal h LEU 551 Cb 1.08 0.00 -0.27 0.00 -0.00 0.00 0.00 40.66 41.46 3lal h LEU 551 CO 0.10 0.12 -0.53 0.68 -0.00 0.00 0.00 178.44 178.80 3lal s VAL 552 N -3.83 4.17 0.00 1.22 -7.23 -1.20 -5.01 120.40 108.53 3lal s VAL 552 Ca -0.01 -1.14 0.00 0.00 -1.81 0.00 0.00 61.98 59.03 3lal s VAL 552 Cb 0.11 -3.42 0.00 0.00 0.56 0.00 0.00 36.38 33.63 3lal s VAL 552 CO 0.58 -0.31 0.00 -1.54 -0.31 0.00 0.00 175.10 173.53