#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3lal s GLU 6 N 0.00 4.20 0.64 0.38 2.56 -1.26 -4.89 118.70 120.33 3lal s GLU 6 Ca 0.00 0.26 -0.11 0.00 0.00 0.00 0.00 54.97 55.12 3lal s GLU 6 Cb 0.00 -3.52 -0.02 0.00 2.00 0.00 0.00 34.13 32.58 3lal s GLU 6 CO 0.00 -0.01 1.04 0.95 -0.56 0.00 0.00 175.26 176.68 3lal s THR 7 N 1.22 4.42 -0.25 -1.70 -4.23 -1.26 -5.00 115.64 108.84 3lal s THR 7 Ca 0.20 0.79 -0.07 0.00 -1.18 0.00 0.00 61.69 61.43 3lal s THR 7 Cb -0.15 -3.74 -0.03 0.00 1.34 0.00 0.00 72.50 69.92 3lal s THR 7 CO 0.08 -1.03 0.06 -0.69 -0.54 0.00 0.00 174.62 172.51 3lal s VAL 8 N -3.19 4.27 0.29 2.29 1.01 -1.26 -4.99 120.40 118.82 3lal s VAL 8 Ca 0.56 -0.19 -0.30 0.00 0.00 0.00 0.00 61.98 62.05 3lal s VAL 8 Cb -0.11 -2.99 -0.12 0.00 0.00 0.00 0.00 36.38 33.15 3lal s VAL 8 CO 0.54 0.34 1.45 -2.65 0.00 0.00 0.00 175.10 174.78 3lal n PRO 9 N 4.91 2.31 -4.05 2.72 -0.02 -1.26 -4.37 135.00 135.24 3lal n PRO 9 Ca -0.16 0.82 -0.29 0.00 -2.02 0.00 0.00 63.50 61.85 3lal n PRO 9 Cb 0.51 -2.51 -0.17 0.00 -0.02 0.00 0.00 33.50 31.32 3lal n PRO 9 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3lal s VAL 10 N -0.31 1.39 -0.20 -1.45 1.01 -1.26 -5.09 120.40 114.49 3lal s VAL 10 Ca 0.63 -0.53 -0.08 0.00 0.00 0.00 0.00 61.98 62.01 3lal s VAL 10 Cb -0.57 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 3lal s VAL 10 CO 0.53 0.43 0.08 -0.75 0.00 0.00 0.00 175.10 175.39 3lal s LYS 11 N 1.47 3.97 1.05 2.72 2.20 -1.26 -4.81 119.74 125.07 3lal s LYS 11 Ca 0.03 -0.34 -0.11 0.00 -0.36 0.00 0.00 55.97 55.19 3lal s LYS 11 Cb -0.13 -3.29 0.22 0.00 -1.51 0.00 0.00 37.83 33.12 3lal s LYS 11 CO -0.08 0.19 1.09 -0.51 -0.36 0.00 0.00 175.35 175.67 3lal s LEU 12 N 0.62 1.81 0.22 5.43 1.43 -1.26 -4.63 118.68 122.30 3lal s LEU 12 Ca 0.04 1.87 -0.30 0.00 -1.03 0.00 0.00 54.13 54.72 3lal s LEU 12 Cb -0.13 -4.00 -0.09 0.00 0.03 0.00 0.00 46.19 42.00 3lal s LEU 12 CO 0.01 -3.71 1.26 -0.54 0.23 0.00 0.00 176.35 173.60 3lal s LYS 13 N -4.54 4.43 0.66 1.70 1.02 -1.13 -4.93 119.74 116.95 3lal s LYS 13 Ca 0.68 2.01 -0.17 0.00 0.02 0.00 0.00 55.97 58.50 3lal s LYS 13 Cb -0.24 -3.19 -0.02 0.00 -0.52 0.00 0.00 37.83 33.87 3lal s LYS 13 CO 0.62 -0.16 1.09 -0.35 -0.92 0.00 0.00 175.35 175.63 3lal n PRO 14 N 2.18 0.85 0.00 -1.68 -0.04 -1.26 -3.15 135.00 131.90 3lal n PRO 14 Ca 0.04 0.34 0.00 0.00 -0.04 0.00 0.00 63.50 63.84 3lal n PRO 14 Cb 0.43 -2.32 0.00 0.00 -0.04 0.00 0.00 33.50 31.57 3lal n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3lal n GLY 15 N 1.09 2.32 3.74 0.55 0.00 -1.26 -4.97 105.19 106.66 3lal n GLY 15 Ca 0.15 -0.04 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 3lal n GLY 15 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3lal s MET 16 N 0.00 2.78 0.47 1.61 0.23 -1.19 -5.00 119.30 118.20 3lal s MET 16 Ca 0.00 2.02 0.08 0.00 -1.03 0.00 0.00 55.69 56.76 3lal s MET 16 Cb 0.00 -1.94 0.03 0.00 -1.53 0.00 0.00 34.83 31.39 3lal s MET 16 CO 0.00 -1.41 0.60 0.34 -2.03 0.00 0.00 175.02 172.52 3lal s ASP 17 N -1.39 5.33 1.30 -1.18 -1.08 -1.26 -4.71 116.67 113.67 3lal s ASP 17 Ca 0.79 -0.66 -0.21 0.00 -0.52 0.00 0.00 52.55 51.96 3lal s ASP 17 Cb -0.36 -0.29 0.32 0.00 -1.46 0.00 0.00 42.92 41.14 3lal s ASP 17 CO 0.39 -0.94 1.04 -0.83 0.52 0.00 0.00 175.17 175.34 3lal s GLY 18 N -4.41 1.51 0.38 2.66 0.00 -1.26 -4.99 107.32 101.23 3lal s GLY 18 Ca 0.55 -0.89 -0.25 0.00 0.00 0.00 0.00 44.72 44.12 3lal s GLY 18 CO 0.33 0.05 1.12 2.56 0.00 0.00 0.00 173.10 177.16 3lal s PRO 19 N -5.26 4.17 -0.34 2.90 0.04 -1.26 -4.99 135.00 130.25 3lal s PRO 19 Ca 0.70 1.72 0.15 0.00 0.04 0.00 0.00 61.00 63.61 3lal s PRO 19 Cb -0.11 -2.70 0.42 0.00 0.04 0.00 0.00 34.50 32.15 3lal s PRO 19 CO 0.57 -0.19 0.89 1.63 0.04 0.00 0.00 177.00 179.94 3lal n LYS 20 N 0.17 1.08 -3.11 4.56 5.02 -1.20 -1.38 118.16 123.30 3lal n LYS 20 Ca 0.04 -3.21 -0.39 0.00 -2.02 0.00 0.00 58.31 52.73 3lal n LYS 20 Cb 0.47 -1.35 -0.05 0.00 -0.02 0.00 0.00 35.03 34.08 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 -2.68 4.92 0.54 -0.18 1.01 0.22 -4.82 120.40 119.41 3lal s VAL 21 Ca 0.31 1.38 -0.19 0.00 0.00 0.00 0.00 61.98 63.48 3lal s VAL 21 Cb 0.42 -4.00 -0.06 0.00 0.00 0.00 0.00 36.38 32.73 3lal s VAL 21 CO -0.01 0.35 1.07 -0.75 0.00 0.00 0.00 175.10 175.76 3lal s LYS 22 N 0.19 3.51 0.12 2.72 2.20 -1.26 -4.07 119.74 123.15 3lal s LYS 22 Ca 0.34 1.39 -0.30 0.00 -0.36 0.00 0.00 55.97 57.05 3lal s LYS 22 Cb -0.18 -2.05 -0.06 0.00 -1.51 0.00 0.00 37.83 34.03 3lal s LYS 22 CO 0.18 -0.68 0.95 -1.14 -0.36 0.00 0.00 175.35 174.30 3lal s GLN 23 N -3.50 4.70 0.44 4.03 2.00 -1.26 -4.59 119.66 121.48 3lal s GLN 23 Ca 0.68 1.43 -0.22 0.00 -2.00 0.00 0.00 55.36 55.26 3lal s GLN 23 Cb -0.18 -3.36 -0.10 0.00 0.80 0.00 0.00 33.01 30.16 3lal s GLN 23 CO 0.27 0.25 1.00 -1.58 -0.50 0.00 0.00 175.29 174.73 3lal s TRP 24 N -0.14 3.22 0.30 1.67 0.51 -1.26 -5.00 118.94 118.24 3lal s TRP 24 Ca 0.46 1.62 -0.29 0.00 -2.12 0.00 0.00 56.10 55.77 3lal s TRP 24 Cb -0.23 -2.99 -0.10 0.00 -0.81 0.00 0.00 33.47 29.34 3lal s TRP 24 CO 0.30 -0.44 1.38 -1.25 -0.51 0.00 0.00 176.95 176.43 3lal s PRO 25 N -2.97 4.29 0.20 4.98 0.04 -1.26 -4.93 135.00 135.35 3lal s PRO 25 Ca 0.62 2.29 0.10 0.00 0.04 0.00 0.00 61.00 64.06 3lal s PRO 25 Cb -0.15 -3.08 -0.04 0.00 0.04 0.00 0.00 34.50 31.27 3lal s PRO 25 CO 0.19 -0.33 -0.15 -0.51 0.04 0.00 0.00 177.00 176.24 3lal s LEU 26 N -1.22 2.76 0.74 -3.56 1.43 -1.26 -5.10 118.68 112.46 3lal s LEU 26 Ca 0.54 -0.74 -0.11 0.00 -1.03 0.00 0.00 54.13 52.79 3lal s LEU 26 Cb -0.41 -1.43 0.04 0.00 0.03 0.00 0.00 46.19 44.41 3lal s LEU 26 CO 0.50 0.09 1.08 0.42 0.23 0.00 0.00 176.35 178.67 3lal s THR 27 N -1.84 3.58 0.24 5.49 -4.23 -1.26 -4.84 115.64 112.78 3lal s THR 27 Ca 0.25 0.51 -0.06 0.00 -1.18 0.00 0.00 61.69 61.21 3lal s THR 27 Cb -0.08 -3.25 0.23 0.00 1.34 0.00 0.00 72.50 70.74 3lal s THR 27 CO 0.14 -0.67 1.88 -0.08 -0.54 0.00 0.00 174.62 175.35 3lal h GLU 28 N -0.90 1.09 -0.16 3.99 4.81 -2.00 -1.54 114.58 119.87 3lal h GLU 28 Ca -0.45 -0.07 -0.08 0.00 -0.13 0.00 0.00 59.36 58.64 3lal h GLU 28 Cb 1.24 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 30.36 3lal h GLU 28 CO 0.58 0.72 -0.24 1.05 -0.73 0.00 0.00 179.01 180.39 3lal h GLU 29 N 1.12 0.29 0.09 1.92 4.11 -1.99 -0.66 114.58 119.45 3lal h GLU 29 Ca 0.37 -0.10 -0.28 0.00 0.07 0.00 0.00 59.36 59.42 3lal h GLU 29 Cb 0.04 -0.02 0.02 0.00 0.50 0.00 0.00 28.75 29.28 3lal h GLU 29 CO -0.13 0.52 -1.18 0.87 0.07 0.00 0.00 179.01 179.16 3lal h LYS 30 N 0.26 0.58 0.02 1.06 1.57 -1.78 -1.90 116.57 116.38 3lal h LYS 30 Ca 0.04 -0.74 0.02 0.00 -1.87 0.00 0.00 60.65 58.10 3lal h LYS 30 Cb 0.57 0.24 -0.03 0.00 0.08 0.00 0.00 32.23 33.09 3lal h LYS 30 CO 0.04 1.32 -0.15 0.82 -0.57 0.00 0.00 179.45 180.91 3lal h ILE 31 N 0.28 0.63 -0.69 1.86 2.04 -1.01 -0.33 117.51 120.29 3lal h ILE 31 Ca -0.16 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.74 3lal h ILE 31 Cb 1.84 0.63 -0.05 0.00 -0.74 0.00 0.00 36.82 38.50 3lal h ILE 31 CO 0.22 0.00 0.41 0.11 0.00 0.00 0.00 178.15 178.89 3lal h LYS 32 N -0.26 0.76 -0.71 2.37 1.57 -1.12 0.12 116.57 119.30 3lal h LYS 32 Ca 0.05 -0.05 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 3lal h LYS 32 Cb 0.32 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.42 3lal h LYS 32 CO -0.14 0.50 0.47 0.00 -0.57 0.00 0.00 179.45 179.71 3lal h ALA 33 N 1.32 1.54 -0.04 3.86 0.00 -1.07 -2.17 119.26 122.70 3lal h ALA 33 Ca 0.29 -0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.93 3lal h ALA 33 Cb 0.10 -0.27 0.01 0.00 0.00 0.00 0.00 17.79 17.63 3lal h ALA 33 CO -0.14 0.41 -0.89 -0.07 0.00 0.00 0.00 179.25 178.56 3lal h LEU 34 N 0.91 0.65 0.27 0.00 3.38 0.81 -1.74 115.31 119.60 3lal h LEU 34 Ca 0.27 -0.49 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 3lal h LEU 34 Cb -0.04 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.52 3lal h LEU 34 CO -0.07 1.27 -0.13 0.58 0.09 0.00 0.00 178.44 180.19 3lal h VAL 35 N 0.32 0.74 -0.03 1.22 2.07 -0.61 0.76 116.25 120.72 3lal h VAL 35 Ca -0.07 -0.05 0.03 0.00 0.82 0.00 0.00 66.70 67.42 3lal h VAL 35 Cb 1.51 0.77 -0.06 0.00 -1.52 0.00 0.00 31.29 32.00 3lal h VAL 35 CO 0.16 0.01 -0.47 -0.33 0.02 0.00 0.00 177.57 176.97 3lal h GLU 36 N -0.39 -0.58 -0.66 1.57 5.08 -1.40 0.29 114.58 118.49 3lal h GLU 36 Ca -0.04 0.04 0.12 0.00 -1.00 0.00 0.00 59.36 58.48 3lal h GLU 36 Cb 0.30 0.13 -0.08 0.00 0.50 0.00 0.00 28.75 29.60 3lal h GLU 36 CO 0.06 -0.38 0.23 0.82 -1.00 0.00 0.00 179.01 178.73 3lal h ILE 37 N -0.60 0.69 0.02 3.13 2.04 -1.20 -2.27 117.51 119.32 3lal h ILE 37 Ca 0.04 -0.13 -0.20 0.00 1.00 0.00 0.00 64.86 65.57 3lal h ILE 37 Cb 0.68 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 37.03 3lal h ILE 37 CO -0.35 0.07 -0.93 0.00 0.00 0.00 0.00 178.15 176.94 3lal h THR 39 N 0.07 1.16 -0.08 0.00 2.02 -0.03 -1.94 112.91 114.11 3lal h THR 39 Ca -0.04 -0.40 -0.15 0.00 0.77 0.00 0.00 66.41 66.58 3lal h THR 39 Cb 1.59 0.46 0.01 0.00 -1.74 0.00 0.00 68.15 68.46 3lal h THR 39 CO 0.14 0.18 -0.54 -0.08 0.37 0.00 0.00 175.52 175.58 3lal h GLU 40 N 0.72 0.51 0.00 6.66 4.57 -1.22 -2.43 114.58 123.40 3lal h GLU 40 Ca 0.19 -0.44 -0.03 0.00 -1.18 0.00 0.00 59.36 57.89 3lal h GLU 40 Cb 0.02 0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 28.70 3lal h GLU 40 CO -0.03 1.07 -0.15 0.52 -1.18 0.00 0.00 179.01 179.25 3lal h MET 41 N 0.10 0.00 0.21 1.92 2.86 -1.19 -1.28 114.93 117.54 3lal h MET 41 Ca -0.04 0.00 -0.31 0.00 -2.06 0.00 0.00 59.70 57.29 3lal h MET 41 Cb 1.20 0.00 0.04 0.00 0.06 0.00 0.00 31.60 32.90 3lal h MET 41 CO 0.11 0.15 -1.33 1.49 1.06 0.00 0.00 176.91 178.39 3lal h GLU 42 N 0.00 0.53 -0.68 1.72 4.81 -1.33 0.26 114.58 119.89 3lal h GLU 42 Ca -0.00 -0.85 0.07 0.00 -0.13 0.00 0.00 59.36 58.45 3lal h GLU 42 Cb 0.45 0.31 -0.06 0.00 0.63 0.00 0.00 28.75 30.08 3lal h GLU 42 CO 0.02 1.40 0.36 0.87 -0.73 0.00 0.00 179.01 180.93 3lal h LYS 43 N 0.10 0.63 -0.01 1.92 1.57 -1.05 -1.51 116.57 118.23 3lal h LYS 43 Ca -0.23 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.52 3lal h LYS 43 Cb 2.04 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 34.21 3lal h LYS 43 CO 0.25 0.41 0.00 0.39 -0.57 0.00 0.00 179.45 179.94 3lal n GLU 44 N -4.82 1.05 -1.04 3.15 1.02 -0.52 -4.89 120.64 114.59 3lal n GLU 44 Ca 0.09 -0.07 -0.01 0.00 -0.02 0.00 0.00 57.16 57.15 3lal n GLU 44 Cb 0.21 -1.41 -0.01 0.00 -0.02 0.00 0.00 31.44 30.21 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 0.93 0.50 0.11 0.62 0.00 -0.57 -4.91 105.19 101.88 3lal n GLY 45 Ca 0.20 -0.34 -0.14 0.00 0.00 0.00 0.00 46.02 45.74 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 0.52 0.26 -5.57 1.61 1.57 -0.77 -3.43 116.57 110.76 3lal h LYS 46 Ca -0.03 -0.39 -0.45 0.00 -1.87 0.00 0.00 60.65 57.91 3lal h LYS 46 Cb 0.19 0.14 -0.15 0.00 0.08 0.00 0.00 32.23 32.49 3lal h LYS 46 CO 0.04 1.15 -0.74 0.96 -0.57 0.00 0.00 179.45 180.29 3lal s ILE 47 N -2.83 1.73 0.02 1.86 -4.36 -1.19 0.51 121.20 116.95 3lal s ILE 47 Ca -0.04 -2.19 0.02 0.00 -0.26 0.00 0.00 60.65 58.18 3lal s ILE 47 Cb 0.08 -2.03 -0.02 0.00 1.25 0.00 0.00 42.46 41.75 3lal s ILE 47 CO 0.87 -0.58 -0.08 -0.44 0.24 0.00 0.00 174.94 174.95 3lal s SER 48 N -3.28 0.89 0.46 4.36 0.01 -0.39 -4.34 113.70 111.41 3lal s SER 48 Ca 0.22 -0.36 -0.25 0.00 1.31 0.00 0.00 55.95 56.88 3lal s SER 48 Cb -0.01 -0.03 -0.08 0.00 0.21 0.00 0.00 66.02 66.12 3lal s SER 48 CO 0.07 -0.06 1.37 -0.54 0.41 0.00 0.00 173.24 174.49 3lal s LYS 49 N -0.94 3.63 0.27 12.44 1.02 -1.26 -1.50 119.74 133.39 3lal s LYS 49 Ca -0.04 2.29 0.07 0.00 0.02 0.00 0.00 55.97 58.32 3lal s LYS 49 Cb -0.07 -2.58 -0.06 0.00 -0.52 0.00 0.00 37.83 34.61 3lal s LYS 49 CO 0.00 -0.82 -0.09 0.96 -0.92 0.00 0.00 175.35 174.49 3lal s ILE 50 N -1.25 1.76 0.81 2.17 -4.36 -0.70 -4.84 121.20 114.79 3lal s ILE 50 Ca 0.63 -2.17 -0.05 0.00 -0.26 0.00 0.00 60.65 58.80 3lal s ILE 50 Cb -0.41 -2.38 0.17 0.00 1.25 0.00 0.00 42.46 41.09 3lal s ILE 50 CO 0.52 -0.36 1.11 -0.83 0.24 0.00 0.00 174.94 175.62 3lal s GLY 51 N -3.44 1.77 0.16 6.27 0.00 -1.26 -4.77 107.32 106.05 3lal s GLY 51 Ca 0.28 -1.70 0.23 0.00 0.00 0.00 0.00 44.72 43.54 3lal s GLY 51 CO 0.11 -1.03 1.71 -1.55 0.00 0.00 0.00 173.10 172.35 3lal n PRO 52 N -3.15 0.14 0.00 2.90 -0.04 -1.26 -2.88 135.00 130.71 3lal n PRO 52 Ca 0.16 0.27 0.08 0.00 -0.04 0.00 0.00 63.50 63.98 3lal n PRO 52 Cb 0.60 -1.72 0.47 0.00 -0.04 0.00 0.00 33.50 32.80 3lal n PRO 52 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 3lal n GLU 53 N -1.99 0.39 -3.55 0.54 0.00 -1.26 -4.32 120.64 110.45 3lal n GLU 53 Ca 0.04 0.07 -0.41 0.00 0.00 0.00 0.00 57.16 56.85 3lal n GLU 53 Cb 0.29 -1.50 -0.09 0.00 0.00 0.00 0.00 31.44 30.13 3lal n GLU 53 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 3lal s ASN 54 N -2.30 5.77 0.52 -1.84 3.84 -1.14 -4.96 114.94 114.84 3lal s ASN 54 Ca 0.21 -1.42 0.31 0.00 0.21 0.00 0.00 52.86 52.17 3lal s ASN 54 Cb 0.12 -2.04 1.15 0.00 -0.55 0.00 0.00 41.25 39.93 3lal s ASN 54 CO 0.23 -0.55 1.91 1.55 -2.79 0.00 0.00 177.10 177.44 3lal h PRO 55 N 8.50 0.00 -7.25 0.43 0.13 -1.90 -3.47 132.00 128.44 3lal h PRO 55 Ca -0.24 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.38 3lal h PRO 55 Cb 1.09 0.00 0.05 0.00 0.13 0.00 0.00 31.00 32.27 3lal h PRO 55 CO 0.78 0.02 0.35 0.71 -0.23 0.00 0.00 178.00 179.63 3lal s TYR 56 N -3.58 3.59 -0.25 1.56 2.02 -1.26 -4.87 117.35 114.55 3lal s TYR 56 Ca 0.02 1.24 -0.26 0.00 -0.37 0.00 0.00 57.07 57.70 3lal s TYR 56 Cb 0.08 -2.66 0.08 0.00 -0.40 0.00 0.00 41.96 39.06 3lal s TYR 56 CO 0.57 -0.55 0.76 1.21 -1.57 0.00 0.00 175.55 175.97 3lal s ASN 57 N -3.95 -0.69 0.09 2.29 2.47 -0.48 -4.74 114.94 109.92 3lal s ASN 57 Ca 0.54 1.29 0.07 0.00 0.42 0.00 0.00 52.86 55.18 3lal s ASN 57 Cb -0.11 1.29 -0.03 0.00 -1.45 0.00 0.00 41.25 40.95 3lal s ASN 57 CO 0.48 -0.27 -0.17 0.42 -3.72 0.00 0.00 177.10 173.84 3lal s THR 58 N 0.20 1.41 0.58 -5.21 -4.23 -0.18 -0.61 115.64 107.60 3lal s THR 58 Ca -0.01 -1.48 -0.19 0.00 -1.18 0.00 0.00 61.69 58.84 3lal s THR 58 Cb -0.04 -1.36 -0.04 0.00 1.34 0.00 0.00 72.50 72.40 3lal s THR 58 CO 0.01 -0.19 1.18 -2.84 -0.54 0.00 0.00 174.62 172.24 3lal s PRO 59 N -1.97 3.05 0.08 3.99 0.02 -1.26 -4.17 135.00 134.74 3lal s PRO 59 Ca 0.03 1.75 0.06 0.00 0.02 0.00 0.00 61.00 62.86 3lal s PRO 59 Cb -0.09 -1.95 -0.03 0.00 0.02 0.00 0.00 34.50 32.45 3lal s PRO 59 CO 0.03 -1.12 -0.15 0.14 -0.33 0.00 0.00 177.00 175.57 3lal s VAL 60 N -1.67 1.24 0.17 3.83 -7.23 -1.26 -0.75 120.40 114.73 3lal s VAL 60 Ca 0.76 -1.37 0.00 0.00 -1.81 0.00 0.00 61.98 59.56 3lal s VAL 60 Cb -0.28 -1.18 -0.04 0.00 0.56 0.00 0.00 36.38 35.43 3lal s VAL 60 CO 0.32 -0.20 0.06 -0.36 -0.31 0.00 0.00 175.10 174.61 3lal s PHE 61 N -1.29 1.12 -0.16 2.82 0.08 -0.08 -4.85 117.98 115.62 3lal s PHE 61 Ca 0.00 -1.19 -0.02 0.00 0.12 0.00 0.00 56.93 55.84 3lal s PHE 61 Cb -0.10 -0.62 -0.01 0.00 -0.57 0.00 0.00 43.02 41.72 3lal s PHE 61 CO 0.03 -0.43 -0.08 0.00 -0.10 0.00 0.00 175.22 174.64 3lal s ALA 62 N -3.91 2.76 0.37 5.36 0.00 -1.26 -0.63 121.76 124.44 3lal s ALA 62 Ca 0.29 -0.97 0.08 0.00 0.00 0.00 0.00 51.96 51.36 3lal s ALA 62 Cb 0.07 -1.44 -0.05 0.00 0.00 0.00 0.00 23.12 21.70 3lal s ALA 62 CO 0.06 0.02 0.11 0.96 0.00 0.00 0.00 175.76 176.91 3lal s ILE 63 N 0.72 2.52 -0.57 0.00 -4.36 -0.53 -4.92 121.20 114.06 3lal s ILE 63 Ca -0.04 -1.81 0.04 0.00 -0.26 0.00 0.00 60.65 58.58 3lal s ILE 63 Cb -0.15 -2.93 0.38 0.00 1.25 0.00 0.00 42.46 41.02 3lal s ILE 63 CO 0.02 -0.10 1.25 1.17 0.24 0.00 0.00 174.94 177.52 3lal n LYS 64 N -1.11 3.42 0.00 0.37 4.81 -1.26 0.32 118.16 124.71 3lal n LYS 64 Ca -0.03 -4.47 0.00 0.00 -0.87 0.00 0.00 58.31 52.94 3lal n LYS 64 Cb 0.63 -2.26 0.00 0.00 0.02 0.00 0.00 35.03 33.42 3lal n LYS 64 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 3lal n LYS 65 N -0.40 0.00 -0.63 1.64 4.76 -1.26 -4.76 118.16 117.51 3lal n LYS 65 Ca 0.40 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.84 3lal n LYS 65 Cb 0.51 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.70 3lal n LYS 65 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 3lal n SER 68 N 10.25 -3.49 -2.08 4.39 7.64 -1.26 -4.85 113.62 124.22 3lal n SER 68 Ca 0.00 0.70 -0.26 0.00 1.01 0.00 0.00 58.87 60.31 3lal n SER 68 Cb 0.00 -1.40 0.11 0.00 -1.01 0.00 0.00 64.21 61.92 3lal n SER 68 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 3lal n THR 69 N -1.74 3.20 -3.88 0.44 -2.24 -1.26 -4.92 114.28 103.88 3lal n THR 69 Ca 0.00 -2.89 -0.36 0.00 -2.27 0.00 0.00 64.05 58.53 3lal n THR 69 Cb 0.15 -0.87 -0.12 0.00 -2.10 0.00 0.00 70.33 67.39 3lal n THR 69 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3lal s LYS 70 N -3.59 3.67 0.43 -0.78 3.01 -1.26 -5.09 119.74 116.12 3lal s LYS 70 Ca 0.58 -0.48 -0.26 0.00 -1.01 0.00 0.00 55.97 54.80 3lal s LYS 70 Cb 0.47 -3.23 -0.09 0.00 -1.01 0.00 0.00 37.83 33.97 3lal s LYS 70 CO 0.03 -0.08 1.45 -1.58 0.51 0.00 0.00 175.35 175.68 3lal s TRP 71 N 1.31 2.49 0.12 3.18 0.52 -1.26 -4.11 118.94 121.18 3lal s TRP 71 Ca 0.05 1.22 0.06 0.00 0.02 0.00 0.00 56.10 57.45 3lal s TRP 71 Cb -0.15 -3.97 -0.04 0.00 -1.15 0.00 0.00 33.47 28.17 3lal s TRP 71 CO 0.03 -3.00 -0.15 0.50 0.02 0.00 0.00 176.95 174.35 3lal s ARG 72 N -2.33 1.02 -0.13 4.98 3.52 0.15 -4.98 118.95 121.16 3lal s ARG 72 Ca 0.58 -1.20 -0.16 0.00 -0.13 0.00 0.00 55.73 54.82 3lal s ARG 72 Cb -0.45 -0.96 -0.04 0.00 -1.56 0.00 0.00 34.95 31.94 3lal s ARG 72 CO 0.59 0.19 0.40 0.21 -0.81 0.00 0.00 175.30 175.88 3lal s LYS 73 N -2.47 4.30 -0.28 5.12 2.20 -1.26 -1.46 119.74 125.89 3lal s LYS 73 Ca 0.07 0.30 0.02 0.00 -0.36 0.00 0.00 55.97 56.01 3lal s LYS 73 Cb -0.06 -3.43 0.07 0.00 -1.51 0.00 0.00 37.83 32.90 3lal s LYS 73 CO 0.03 0.19 -0.03 -1.17 -0.36 0.00 0.00 175.35 174.02 3lal s LEU 74 N 0.55 3.42 -0.13 5.43 2.96 0.19 -4.94 118.68 126.16 3lal s LEU 74 Ca 0.22 -1.56 -0.20 0.00 -0.22 0.00 0.00 54.13 52.37 3lal s LEU 74 Cb -0.14 -1.39 -0.04 0.00 0.50 0.00 0.00 46.19 45.12 3lal s LEU 74 CO 0.08 -0.28 0.55 -0.69 -1.32 0.00 0.00 176.35 174.69 3lal s VAL 75 N 1.19 5.12 -0.89 1.68 1.01 -1.26 -0.90 120.40 126.35 3lal s VAL 75 Ca -0.01 1.10 -0.22 0.00 0.00 0.00 0.00 61.98 62.85 3lal s VAL 75 Cb -0.19 -3.89 0.07 0.00 0.00 0.00 0.00 36.38 32.37 3lal s VAL 75 CO -0.08 0.26 1.25 -0.62 0.00 0.00 0.00 175.10 175.91 3lal s ASP 76 N 0.82 6.43 -0.23 3.32 2.15 0.07 -4.80 116.67 124.42 3lal s ASP 76 Ca 0.29 -1.38 0.08 0.00 0.43 0.00 0.00 52.55 51.96 3lal s ASP 76 Cb -0.16 -2.49 0.57 0.00 -0.30 0.00 0.00 42.92 40.53 3lal s ASP 76 CO 0.12 -1.43 1.51 0.49 -0.17 0.00 0.00 175.17 175.69 3lal n PHE 77 N 8.11 1.79 -0.27 -5.34 3.72 -1.26 -4.06 117.46 120.15 3lal n PHE 77 Ca 0.19 -0.87 0.00 0.00 -0.05 0.00 0.00 57.45 56.73 3lal n PHE 77 Cb 0.49 -0.53 0.13 0.00 -0.94 0.00 0.00 39.48 38.63 3lal n PHE 77 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3lal h ARG 78 N 2.17 0.76 0.29 -1.08 3.08 -1.89 0.12 114.38 117.84 3lal h ARG 78 Ca 0.16 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.15 3lal h ARG 78 Cb 1.87 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 31.75 3lal h ARG 78 CO 0.52 0.51 -0.14 1.49 -1.07 0.00 0.00 179.97 181.28 3lal h GLU 79 N 0.79 -0.37 -0.63 0.04 4.57 -2.00 -2.28 114.58 114.70 3lal h GLU 79 Ca 0.35 0.03 0.13 0.00 -1.18 0.00 0.00 59.36 58.68 3lal h GLU 79 Cb 0.24 0.09 -0.11 0.00 -0.16 0.00 0.00 28.75 28.80 3lal h GLU 79 CO -0.20 -0.03 -0.10 1.25 -1.18 0.00 0.00 179.01 178.75 3lal h LEU 80 N -0.85 -0.48 -0.43 1.64 6.46 -1.86 0.90 115.31 120.69 3lal h LEU 80 Ca -0.04 0.18 0.04 0.00 -0.12 0.00 0.00 57.88 57.93 3lal h LEU 80 Cb 0.52 0.35 -0.04 0.00 -0.73 0.00 0.00 40.66 40.76 3lal h LEU 80 CO 0.07 -0.18 0.21 0.78 -0.62 0.00 0.00 178.44 178.70 3lal h ASN 81 N 0.04 0.30 -0.76 1.25 2.35 -0.97 0.24 115.58 118.02 3lal h ASN 81 Ca 0.31 0.03 0.02 0.00 -0.55 0.00 0.00 56.30 56.11 3lal h ASN 81 Cb 0.49 -0.03 -0.04 0.00 0.05 0.00 0.00 38.32 38.79 3lal h ASN 81 CO -0.61 0.22 0.50 0.50 -1.65 0.00 0.00 177.43 176.39 3lal h LYS 82 N 0.42 0.95 0.00 0.81 3.64 -0.56 -1.60 116.57 120.24 3lal h LYS 82 Ca 0.19 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 3lal h LYS 82 Cb 0.10 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.71 3lal h LYS 82 CO -0.14 0.63 -0.25 0.54 -2.27 0.00 0.00 179.45 177.96 3lal n ARG 83 N -4.44 0.09 -0.10 1.90 3.00 0.17 -3.66 116.66 113.62 3lal n ARG 83 Ca 0.09 0.05 0.05 0.00 -0.01 0.00 0.00 57.85 58.04 3lal n ARG 83 Cb 0.08 -1.58 0.11 0.00 0.00 0.00 0.00 32.46 31.07 3lal n ARG 83 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 3lal n THR 84 N -1.73 0.59 0.30 0.55 -2.24 0.74 -2.84 114.28 109.65 3lal n THR 84 Ca 0.06 -0.80 0.13 0.00 -2.27 0.00 0.00 64.05 61.17 3lal n THR 84 Cb 0.37 0.80 0.71 0.00 -2.10 0.00 0.00 70.33 70.10 3lal n THR 84 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 3lal h GLN 85 N 2.05 0.00 -0.07 -0.78 4.15 -1.38 0.37 115.11 119.45 3lal h GLN 85 Ca 0.00 0.00 -0.17 0.00 0.77 0.00 0.00 58.65 59.25 3lal h GLN 85 Cb 0.62 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.30 3lal h GLN 85 CO 0.00 0.00 -0.70 0.22 -1.93 0.00 0.00 178.83 176.42 3lal h ASP 86 N 0.00 0.38 0.02 -0.69 3.58 -1.88 -2.65 116.42 115.18 3lal h ASP 86 Ca 0.00 -0.25 -0.00 0.00 0.42 0.00 0.00 57.03 57.20 3lal h ASP 86 Cb 0.70 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 41.63 3lal h ASP 86 CO 0.00 0.97 -0.01 0.15 -2.88 0.00 0.00 179.24 177.47 3lal h PHE 87 N 0.22 -0.03 0.00 0.28 3.57 -0.52 -1.90 116.94 118.56 3lal h PHE 87 Ca -0.02 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.48 3lal h PHE 87 Cb 1.26 0.01 0.00 0.00 2.79 0.00 0.00 35.95 40.01 3lal h PHE 87 CO 0.03 0.61 -0.30 -2.67 -2.23 0.00 0.00 178.31 173.76 3lal n TRP 88 N -4.79 0.14 -0.04 0.41 4.27 -1.20 -2.16 117.44 114.06 3lal n TRP 88 Ca -0.09 0.04 -0.08 0.00 -3.89 0.00 0.00 57.50 53.48 3lal n TRP 88 Cb 0.32 -0.44 -0.04 0.00 -1.36 0.00 0.00 31.31 29.79 3lal n TRP 88 CO 0.00 0.00 0.00 -1.91 -2.29 0.00 0.00 177.69 173.49 3lal n GLU 89 N -1.63 0.21 -0.03 -2.67 2.13 -1.00 -3.68 120.64 113.97 3lal n GLU 89 Ca 0.06 0.07 0.03 0.00 0.66 0.00 0.00 57.16 57.98 3lal n GLU 89 Cb 0.36 -1.01 -0.13 0.00 0.27 0.00 0.00 31.44 30.93 3lal n GLU 89 CO 0.00 0.00 0.00 1.33 -0.41 0.00 0.00 177.13 178.05 3lal n VAL 90 N -3.06 0.36 -0.07 6.31 0.24 -1.12 -3.25 118.33 117.73 3lal n VAL 90 Ca -0.17 -0.48 -0.22 0.00 -2.04 0.00 0.00 64.34 61.43 3lal n VAL 90 Cb 0.65 -0.12 -0.12 0.00 -1.47 0.00 0.00 33.84 32.78 3lal n VAL 90 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 3lal n GLN 91 N -2.25 0.66 -1.96 7.34 0.00 -0.73 -4.64 117.38 115.80 3lal n GLN 91 Ca -0.11 0.32 -0.02 0.00 -0.00 0.00 0.00 57.00 57.20 3lal n GLN 91 Cb 0.63 -1.65 0.06 0.00 0.00 0.00 0.00 30.24 29.28 3lal n GLN 91 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 3lal n LEU 92 N -3.80 2.07 -4.55 1.69 4.77 -0.92 -5.06 117.00 111.22 3lal n LEU 92 Ca -0.38 -3.08 -0.40 0.00 -0.03 0.00 0.00 56.01 52.12 3lal n LEU 92 Cb 0.92 0.05 0.03 0.00 -2.33 0.00 0.00 43.42 42.09 3lal n LEU 92 CO 0.27 1.08 0.35 0.61 -1.33 0.00 0.00 177.39 178.37 3lal n GLY 93 N -0.33 -0.79 3.54 -0.72 0.00 -1.20 -4.77 105.19 100.91 3lal n GLY 93 Ca 0.14 -0.02 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 3lal n GLY 93 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3lal s ILE 94 N -1.48 4.79 0.28 -0.61 1.01 -1.26 -5.03 121.20 118.89 3lal s ILE 94 Ca 0.67 -0.01 -0.30 0.00 0.00 0.00 0.00 60.65 61.01 3lal s ILE 94 Cb -0.50 -3.24 -0.10 0.00 0.01 0.00 0.00 42.46 38.62 3lal s ILE 94 CO 0.54 0.33 1.43 -2.84 0.00 0.00 0.00 174.94 174.40 3lal s PRO 95 N 1.42 4.26 -0.27 2.79 0.02 -1.26 -5.01 135.00 136.95 3lal s PRO 95 Ca 0.06 2.33 -0.12 0.00 0.02 0.00 0.00 61.00 63.29 3lal s PRO 95 Cb -0.15 -3.08 -0.05 0.00 0.02 0.00 0.00 34.50 31.24 3lal s PRO 95 CO 0.06 -0.40 0.24 -1.58 -0.33 0.00 0.00 177.00 174.98 3lal s HIS 96 N -0.32 3.24 0.10 6.54 2.46 -1.26 -4.93 115.29 121.13 3lal s HIS 96 Ca 0.57 0.22 -0.30 0.00 0.47 0.00 0.00 55.06 56.01 3lal s HIS 96 Cb -0.42 -2.42 -0.07 0.00 -0.13 0.00 0.00 32.58 29.55 3lal s HIS 96 CO 0.47 -0.14 1.22 -1.25 -2.47 0.00 0.00 174.74 172.57 3lal s PRO 97 N 1.73 4.44 0.05 2.88 0.04 -1.26 -4.92 135.00 137.95 3lal s PRO 97 Ca 0.09 1.83 0.27 0.00 0.04 0.00 0.00 61.00 63.23 3lal s PRO 97 Cb -0.16 -3.31 0.82 0.00 0.04 0.00 0.00 34.50 31.90 3lal s PRO 97 CO 0.10 -0.23 1.66 0.00 0.04 0.00 0.00 177.00 178.57 3lal n ALA 98 N 3.57 2.76 0.20 8.56 0.00 -1.26 -3.35 120.51 130.99 3lal n ALA 98 Ca 0.08 -0.18 0.09 0.00 0.00 0.00 0.00 53.44 53.43 3lal n ALA 98 Cb 0.45 -1.32 0.17 0.00 0.00 0.00 0.00 19.45 18.75 3lal n ALA 98 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3lal h GLY 99 N 4.85 0.00 0.00 0.00 0.00 -1.96 -3.33 103.07 102.63 3lal h GLY 99 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 47.33 47.40 3lal h GLY 99 CO 0.00 0.00 -0.30 -2.00 0.00 0.00 0.00 176.54 174.24 3lal h LEU 100 N 0.00 -0.97 -0.72 3.11 5.85 -1.88 -1.37 115.31 119.33 3lal h LEU 100 Ca -0.00 0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.88 3lal h LEU 100 Cb 1.09 0.44 0.00 0.00 0.37 0.00 0.00 40.66 42.56 3lal h LEU 100 CO 0.02 -0.32 0.00 2.29 -0.34 0.00 0.00 178.44 180.09 3lal n LYS 101 N -5.40 0.13 0.00 1.25 2.85 -1.25 -1.95 118.16 113.77 3lal n LYS 101 Ca -0.01 0.47 0.13 0.00 -1.05 0.00 0.00 58.31 57.85 3lal n LYS 101 Cb 0.32 -1.79 0.47 0.00 -0.65 0.00 0.00 35.03 33.37 3lal n LYS 101 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 3lal n LYS 102 N -2.04 0.26 -2.20 -1.58 4.76 -0.52 -4.30 118.16 112.54 3lal n LYS 102 Ca 0.01 -0.10 -0.33 0.00 -2.87 0.00 0.00 58.31 55.02 3lal n LYS 102 Cb 0.14 -1.50 -0.01 0.00 -1.84 0.00 0.00 35.03 31.82 3lal n LYS 102 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 3lal s LYS 103 N -2.81 3.56 0.19 1.97 -0.14 -0.83 -4.75 119.74 116.94 3lal s LYS 103 Ca 0.18 1.14 -0.05 0.00 -1.36 0.00 0.00 55.97 55.88 3lal s LYS 103 Cb 0.19 -2.07 0.11 0.00 -1.68 0.00 0.00 37.83 34.37 3lal s LYS 103 CO 0.57 -0.61 1.52 0.87 -0.76 0.00 0.00 175.35 176.95 3lal h LYS 104 N 0.70 0.66 -3.69 1.68 1.57 -1.72 -3.26 116.57 112.50 3lal h LYS 104 Ca -0.47 -0.37 -0.24 0.00 -1.87 0.00 0.00 60.65 57.70 3lal h LYS 104 Cb 1.21 0.02 -0.29 0.00 0.08 0.00 0.00 32.23 33.25 3lal h LYS 104 CO 0.59 0.98 -0.72 -1.12 -0.57 0.00 0.00 179.45 178.61 3lal s SER 105 N -6.88 0.01 -0.09 0.86 0.01 -0.98 -4.22 113.70 102.40 3lal s SER 105 Ca -0.08 0.01 0.01 0.00 1.31 0.00 0.00 55.95 57.19 3lal s SER 105 Cb 0.12 -0.01 0.02 0.00 0.21 0.00 0.00 66.02 66.36 3lal s SER 105 CO 0.85 -0.02 -0.09 -0.69 0.41 0.00 0.00 173.24 173.70 3lal s VAL 106 N 0.17 0.99 -0.11 3.43 1.01 0.11 -1.69 120.40 124.31 3lal s VAL 106 Ca -0.01 -0.32 -0.05 0.00 0.00 0.00 0.00 61.98 61.59 3lal s VAL 106 Cb -0.02 -0.97 -0.04 0.00 0.00 0.00 0.00 36.38 35.35 3lal s VAL 106 CO -0.00 0.34 0.09 -0.89 0.00 0.00 0.00 175.10 174.64 3lal s THR 107 N 1.27 5.06 -0.25 3.92 2.01 0.75 -0.06 115.64 128.34 3lal s THR 107 Ca -0.04 0.04 -0.08 0.00 0.31 0.00 0.00 61.69 61.93 3lal s THR 107 Cb -0.14 -3.19 -0.03 0.00 0.01 0.00 0.00 72.50 69.15 3lal s THR 107 CO -0.03 0.60 0.09 -0.69 -0.69 0.00 0.00 174.62 173.90 3lal s VAL 108 N -0.87 4.49 -0.06 3.82 1.01 -1.08 -0.54 120.40 127.18 3lal s VAL 108 Ca 0.14 -0.11 0.03 0.00 0.00 0.00 0.00 61.98 62.03 3lal s VAL 108 Cb -0.12 -3.10 -0.02 0.00 0.00 0.00 0.00 36.38 33.14 3lal s VAL 108 CO 0.03 0.34 -0.14 -0.76 0.00 0.00 0.00 175.10 174.57 3lal s LEU 109 N 1.53 2.74 -0.30 3.92 1.43 0.89 -3.85 118.68 125.04 3lal s LEU 109 Ca 0.06 -0.21 -0.28 0.00 -1.03 0.00 0.00 54.13 52.67 3lal s LEU 109 Cb -0.15 -1.56 0.01 0.00 0.03 0.00 0.00 46.19 44.52 3lal s LEU 109 CO 0.05 0.32 1.04 -0.62 0.23 0.00 0.00 176.35 177.36 3lal s ASP 110 N -0.58 6.93 -0.19 2.29 -1.08 -1.26 0.99 116.67 123.76 3lal s ASP 110 Ca 0.08 1.06 0.16 0.00 -0.52 0.00 0.00 52.55 53.33 3lal s ASP 110 Cb -0.11 -2.53 0.45 0.00 -1.46 0.00 0.00 42.92 39.27 3lal s ASP 110 CO 0.01 -0.82 1.34 1.33 0.52 0.00 0.00 175.17 177.56 3lal n VAL 111 N 5.75 2.22 0.29 1.11 0.24 0.28 -4.77 118.33 123.45 3lal n VAL 111 Ca 0.11 -2.22 0.16 0.00 -2.04 0.00 0.00 64.34 60.35 3lal n VAL 111 Cb 0.47 -0.26 0.94 0.00 -1.47 0.00 0.00 33.84 33.52 3lal n VAL 111 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 3lal h GLY 112 N 1.10 0.00 2.00 7.63 0.00 -1.84 -1.34 103.07 110.61 3lal h GLY 112 Ca 0.04 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.34 3lal h GLY 112 CO 0.18 0.00 -0.17 -0.55 0.00 0.00 0.00 176.54 176.00 3lal h ASP 113 N 0.00 0.00 -1.02 0.19 3.32 -1.87 -2.65 116.42 114.39 3lal h ASP 113 Ca 0.01 0.00 0.29 0.00 0.02 0.00 0.00 57.03 57.35 3lal h ASP 113 Cb 0.09 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 39.51 3lal h ASP 113 CO -0.00 0.17 0.61 0.00 -1.72 0.00 0.00 179.24 178.29 3lal h ALA 114 N 1.83 1.96 0.00 3.45 0.00 -1.43 -2.51 119.26 122.56 3lal h ALA 114 Ca -0.00 0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 3lal h ALA 114 Cb 0.34 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3lal h ALA 114 CO 0.02 -0.49 -0.18 1.88 0.00 0.00 0.00 179.25 180.48 3lal h TYR 115 N 0.43 0.00 0.00 0.00 0.99 -1.67 -3.16 116.97 113.56 3lal h TYR 115 Ca 0.68 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.41 3lal h TYR 115 Cb 1.50 0.00 0.00 0.00 1.00 0.00 0.00 36.73 39.23 3lal h TYR 115 CO -0.01 0.18 0.00 1.97 -0.00 0.00 0.00 178.16 180.30 3lal n PHE 116 N -3.32 0.00 0.59 4.88 1.16 -0.94 -2.55 117.46 117.28 3lal n PHE 116 Ca 0.00 0.00 0.10 0.00 -1.87 0.00 0.00 57.45 55.69 3lal n PHE 116 Cb 0.42 -0.34 -0.12 0.00 -1.61 0.00 0.00 39.48 37.82 3lal n PHE 116 CO 0.00 0.00 0.00 0.43 -1.87 0.00 0.00 176.76 175.32 3lal n SER 117 N -1.34 0.60 -4.73 5.98 7.64 -1.19 -4.86 113.62 115.70 3lal n SER 117 Ca 0.09 -0.56 -0.35 0.00 1.01 0.00 0.00 58.87 59.05 3lal n SER 117 Cb 0.18 1.35 -0.08 0.00 -1.01 0.00 0.00 64.21 64.65 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 -3.21 5.32 0.44 0.44 1.01 -1.06 -5.01 120.40 118.32 3lal s VAL 118 Ca 0.02 0.15 -0.22 0.00 0.00 0.00 0.00 61.98 61.93 3lal s VAL 118 Cb 0.15 -3.41 -0.09 0.00 0.00 0.00 0.00 36.38 33.04 3lal s VAL 118 CO 0.88 0.47 1.04 -2.84 0.00 0.00 0.00 175.10 174.65 3lal s PRO 119 N 0.18 4.02 -0.05 2.72 0.02 -1.26 -1.23 135.00 139.39 3lal s PRO 119 Ca 0.08 1.43 -0.12 0.00 0.02 0.00 0.00 61.00 62.42 3lal s PRO 119 Cb -0.11 -2.34 -0.05 0.00 0.02 0.00 0.00 34.50 32.01 3lal s PRO 119 CO -0.01 -0.26 0.31 -1.17 -0.33 0.00 0.00 177.00 175.54 3lal s LEU 120 N -3.01 4.44 -0.09 -5.54 2.96 0.47 -4.60 118.68 113.31 3lal s LEU 120 Ca 0.62 0.78 -0.39 0.00 -0.22 0.00 0.00 54.13 54.91 3lal s LEU 120 Cb -0.19 -2.39 -0.17 0.00 0.50 0.00 0.00 46.19 43.94 3lal s LEU 120 CO 0.24 0.35 1.44 -0.67 -1.32 0.00 0.00 176.35 176.39 3lal n ASP 121 N 1.90 1.56 -0.35 3.68 2.03 -1.26 -4.82 116.55 119.30 3lal n ASP 121 Ca -0.16 1.12 0.11 0.00 0.52 0.00 0.00 54.79 56.38 3lal n ASP 121 Cb 0.53 -1.11 0.30 0.00 -0.72 0.00 0.00 41.12 40.12 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 5.13 0.77 -0.00 -0.67 4.57 -1.95 0.88 114.58 123.30 3lal h GLU 122 Ca -0.48 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 57.66 3lal h GLU 122 Cb 1.35 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 29.77 3lal h GLU 122 CO 0.83 0.51 -0.01 -0.25 -1.18 0.00 0.00 179.01 178.90 3lal n ASP 123 N -4.76 0.42 -0.01 1.04 10.43 -1.26 -3.45 116.55 118.97 3lal n ASP 123 Ca 0.22 -1.02 0.07 0.00 2.57 0.00 0.00 54.79 56.63 3lal n ASP 123 Cb 0.52 -0.02 -0.12 0.00 1.84 0.00 0.00 41.12 43.33 3lal n ASP 123 CO 0.00 0.00 0.00 0.33 -1.07 0.00 0.00 177.20 176.46 3lal n PHE 124 N -0.72 0.00 -0.16 1.24 7.35 0.28 -4.62 117.46 120.83 3lal n PHE 124 Ca 0.21 0.00 0.28 0.00 -0.76 0.00 0.00 57.45 57.18 3lal n PHE 124 Cb 0.20 -0.38 0.72 0.00 0.35 0.00 0.00 39.48 40.37 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 0.00 0.00 -4.13 3.08 -1.53 -1.14 114.38 110.66 3lal h ARG 125 Ca -0.02 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 3lal h ARG 125 Cb 0.77 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.82 3lal h ARG 125 CO 0.00 0.00 -0.00 1.57 -1.07 0.00 0.00 179.97 180.47 3lal h LYS 126 N 0.00 0.00 0.00 0.04 2.10 -1.82 -2.08 116.57 114.80 3lal h LYS 126 Ca 0.41 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.06 3lal h LYS 126 Cb 1.66 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.99 3lal h LYS 126 CO -0.00 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 178.11 3lal n TYR 127 N -3.10 0.48 0.21 0.07 4.01 -0.43 -3.25 117.16 115.16 3lal n TYR 127 Ca 0.01 0.14 0.07 0.00 -0.16 0.00 0.00 57.90 57.96 3lal n TYR 127 Cb 0.34 -0.73 0.24 0.00 -0.31 0.00 0.00 39.34 38.87 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 -1.90 1.01 -1.72 -0.72 -2.24 -0.78 -4.73 114.28 103.20 3lal n THR 128 Ca 0.06 -0.75 -0.43 0.00 -2.27 0.00 0.00 64.05 60.67 3lal n THR 128 Cb 0.37 0.14 -0.01 0.00 -2.10 0.00 0.00 70.33 68.73 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 0.81 1.94 -2.24 6.98 0.00 -1.20 -4.39 120.51 122.41 3lal n ALA 129 Ca 0.17 0.37 -0.14 0.00 0.00 0.00 0.00 53.44 53.85 3lal n ALA 129 Cb 0.56 -2.37 -0.10 0.00 0.00 0.00 0.00 19.45 17.54 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 -0.40 1.32 -0.04 0.00 -0.71 -0.44 -1.01 117.98 116.69 3lal s PHE 130 Ca 0.62 -1.37 0.01 0.00 -1.04 0.00 0.00 56.93 55.15 3lal s PHE 130 Cb -0.54 -0.66 0.02 0.00 -1.21 0.00 0.00 43.02 40.63 3lal s PHE 130 CO 0.54 -0.60 -0.04 0.99 -1.34 0.00 0.00 175.22 174.77 3lal s THR 131 N -3.98 0.52 -0.30 -4.49 2.01 -1.26 -2.13 115.64 106.00 3lal s THR 131 Ca 0.39 -0.12 -0.19 0.00 0.31 0.00 0.00 61.69 62.07 3lal s THR 131 Cb 0.07 -0.54 -0.01 0.00 0.01 0.00 0.00 72.50 72.02 3lal s THR 131 CO 0.14 0.22 0.59 -0.63 -0.69 0.00 0.00 174.62 174.25 3lal s ILE 132 N 0.88 4.98 0.93 1.82 1.01 -0.00 -4.67 121.20 126.14 3lal s ILE 132 Ca -0.12 0.79 -0.13 0.00 0.00 0.00 0.00 60.65 61.19 3lal s ILE 132 Cb -0.14 -3.96 0.15 0.00 0.01 0.00 0.00 42.46 38.52 3lal s ILE 132 CO 0.00 -0.10 1.15 -2.16 0.00 0.00 0.00 174.94 173.83 3lal s PRO 133 N 2.52 1.00 0.06 2.79 0.04 -1.26 -1.09 135.00 139.06 3lal s PRO 133 Ca 0.23 0.19 0.07 0.00 0.04 0.00 0.00 61.00 61.53 3lal s PRO 133 Cb -0.15 -1.83 -0.03 0.00 0.04 0.00 0.00 34.50 32.53 3lal s PRO 133 CO 0.11 -2.27 -0.18 -1.54 0.04 0.00 0.00 177.00 173.16 3lal s SER 134 N -4.13 2.14 0.30 6.66 1.04 -1.26 -4.84 113.70 113.61 3lal s SER 134 Ca 0.65 -0.56 -0.29 0.00 0.48 0.00 0.00 55.95 56.23 3lal s SER 134 Cb -0.13 -0.14 -0.11 0.00 0.10 0.00 0.00 66.02 65.74 3lal s SER 134 CO 0.53 0.07 1.49 -0.63 0.98 0.00 0.00 173.24 175.68 3lal s ILE 135 N -0.97 2.34 -1.32 -1.02 1.01 -1.26 -2.33 121.20 117.65 3lal s ILE 135 Ca 0.04 0.30 0.00 0.00 0.00 0.00 0.00 60.65 60.99 3lal s ILE 135 Cb -0.09 -3.19 0.00 0.00 0.01 0.00 0.00 42.46 39.19 3lal s ILE 135 CO 0.02 0.05 0.00 -3.20 0.00 0.00 0.00 174.94 171.82 3lal n ASN 136 N 1.76 -4.12 -3.34 3.58 5.15 -1.26 -2.17 115.26 114.86 3lal n ASN 136 Ca 0.05 0.31 -0.24 0.00 -0.60 0.00 0.00 54.58 54.10 3lal n ASN 136 Cb 0.39 -3.52 0.04 0.00 -0.53 0.00 0.00 39.78 36.17 3lal n ASN 136 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 3lal n ASN 137 N -0.60 -5.85 -0.12 1.20 5.03 -0.98 -4.88 115.26 109.06 3lal n ASN 137 Ca -0.12 -0.43 -0.05 0.00 0.87 0.00 0.00 54.58 54.85 3lal n ASN 137 Cb 0.48 -4.68 0.03 0.00 -1.02 0.00 0.00 39.78 34.59 3lal n ASN 137 CO 0.00 0.00 0.00 -0.08 -1.83 0.00 0.00 177.26 175.35 3lal h GLU 138 N -1.85 0.20 -5.60 3.52 4.81 -1.66 -3.44 114.58 110.57 3lal h GLU 138 Ca -0.54 -0.01 -0.57 0.00 -0.13 0.00 0.00 59.36 58.10 3lal h GLU 138 Cb 1.36 -0.05 -0.13 0.00 0.63 0.00 0.00 28.75 30.56 3lal h GLU 138 CO 0.58 0.14 -0.63 0.95 -0.73 0.00 0.00 179.01 179.31 3lal s THR 139 N -6.16 1.82 0.72 0.32 -4.23 -1.26 -5.13 115.64 101.71 3lal s THR 139 Ca -0.13 -2.06 -0.12 0.00 -1.18 0.00 0.00 61.69 58.20 3lal s THR 139 Cb 0.13 -2.81 0.03 0.00 1.34 0.00 0.00 72.50 71.20 3lal s THR 139 CO 0.71 -0.08 1.09 -2.84 -0.54 0.00 0.00 174.62 172.96 3lal s PRO 140 N -3.73 2.57 0.98 3.99 0.02 -1.26 -4.65 135.00 132.92 3lal s PRO 140 Ca 0.34 1.23 -0.13 0.00 0.02 0.00 0.00 61.00 62.45 3lal s PRO 140 Cb 0.07 -1.93 0.08 0.00 0.02 0.00 0.00 34.50 32.74 3lal s PRO 140 CO 0.16 -1.41 0.48 0.41 -0.33 0.00 0.00 177.00 176.32 3lal n GLY 141 N -1.03 -1.85 3.59 0.52 0.00 -1.26 -4.83 105.19 100.32 3lal n GLY 141 Ca 0.09 -0.77 -0.41 0.00 0.00 0.00 0.00 46.02 44.94 3lal n GLY 141 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3lal s ILE 142 N -2.41 5.04 -0.14 -0.61 1.01 -0.25 -4.89 121.20 118.96 3lal s ILE 142 Ca 0.59 0.60 -0.05 0.00 0.00 0.00 0.00 60.65 61.79 3lal s ILE 142 Cb -0.20 -3.89 -0.04 0.00 0.01 0.00 0.00 42.46 38.34 3lal s ILE 142 CO 0.66 -0.07 0.03 -0.13 0.00 0.00 0.00 174.94 175.43 3lal s ARG 143 N 2.36 3.51 0.12 2.79 0.52 -1.26 -0.82 118.95 126.17 3lal s ARG 143 Ca 0.20 -0.37 0.02 0.00 -0.52 0.00 0.00 55.73 55.06 3lal s ARG 143 Cb -0.15 -3.01 -0.04 0.00 0.52 0.00 0.00 34.95 32.26 3lal s ARG 143 CO 0.11 0.48 -0.05 0.71 0.02 0.00 0.00 175.30 176.57 3lal s TYR 144 N -0.24 1.01 0.31 -0.53 2.02 -0.91 -1.73 117.35 117.28 3lal s TYR 144 Ca 0.07 -0.93 0.03 0.00 -0.37 0.00 0.00 57.07 55.86 3lal s TYR 144 Cb -0.12 -0.57 -0.05 0.00 -0.40 0.00 0.00 41.96 40.82 3lal s TYR 144 CO 0.02 -0.15 0.10 1.14 -1.57 0.00 0.00 175.55 175.09 3lal s GLN 145 N -3.85 1.59 0.12 -0.62 -2.07 -0.56 -1.33 119.66 112.94 3lal s GLN 145 Ca 0.16 -1.90 -0.13 0.00 -1.82 0.00 0.00 55.36 51.67 3lal s GLN 145 Cb 0.05 -0.47 -0.07 0.00 -1.09 0.00 0.00 33.01 31.43 3lal s GLN 145 CO -0.02 -0.31 0.50 0.71 -1.32 0.00 0.00 175.29 174.85 3lal s TYR 146 N -3.51 3.61 -0.45 9.60 1.51 -1.26 -1.27 117.35 125.58 3lal s TYR 146 Ca 0.35 0.99 0.11 0.00 -1.01 0.00 0.00 57.07 57.51 3lal s TYR 146 Cb 0.07 -2.31 -0.13 0.00 -0.11 0.00 0.00 41.96 39.48 3lal s TYR 146 CO 0.15 0.46 0.44 0.09 -1.11 0.00 0.00 175.55 175.59 3lal n ASN 147 N 0.89 0.82 -4.50 2.29 3.02 0.18 -4.69 115.26 113.26 3lal n ASN 147 Ca -0.06 -0.65 -0.24 0.00 -0.03 0.00 0.00 54.58 53.60 3lal n ASN 147 Cb 0.52 1.08 -0.11 0.00 -0.61 0.00 0.00 39.78 40.67 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 -2.18 1.54 -0.14 2.41 -7.23 -1.22 -0.39 120.40 113.18 3lal s VAL 148 Ca 0.03 -2.03 -0.35 0.00 -1.81 0.00 0.00 61.98 57.82 3lal s VAL 148 Cb 0.08 -2.80 -0.12 0.00 0.56 0.00 0.00 36.38 34.10 3lal s VAL 148 CO 0.47 -0.05 1.87 0.18 -0.31 0.00 0.00 175.10 177.25 3lal n LEU 149 N -0.76 3.19 -4.81 1.32 4.77 -0.37 -4.55 117.00 115.79 3lal n LEU 149 Ca -0.04 0.97 -0.34 0.00 -0.03 0.00 0.00 56.01 56.57 3lal n LEU 149 Cb 0.66 -1.32 -0.07 0.00 -2.33 0.00 0.00 43.42 40.36 3lal n LEU 149 CO 0.44 -0.16 0.61 -2.16 -1.33 0.00 0.00 177.39 174.80 3lal s PRO 150 N 4.10 4.29 0.38 3.23 0.04 -1.26 -3.99 135.00 141.78 3lal s PRO 150 Ca 0.95 1.10 -0.25 0.00 0.04 0.00 0.00 61.00 62.84 3lal s PRO 150 Cb -0.77 -2.39 -0.09 0.00 0.04 0.00 0.00 34.50 31.28 3lal s PRO 150 CO 0.55 0.09 1.03 -0.65 0.04 0.00 0.00 177.00 178.05 3lal s GLN 151 N -2.83 4.27 0.00 4.56 -0.21 -1.26 -3.80 119.66 120.39 3lal s GLN 151 Ca 0.57 1.47 0.00 0.00 0.02 0.00 0.00 55.36 57.43 3lal s GLN 151 Cb -0.12 -2.61 0.00 0.00 1.00 0.00 0.00 33.01 31.29 3lal s GLN 151 CO 0.16 -0.04 0.00 0.41 -2.12 0.00 0.00 175.29 173.71 3lal n GLY 152 N 0.38 3.23 3.69 3.09 0.00 -1.26 -4.69 105.19 109.63 3lal n GLY 152 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.84 3.52 -1.62 1.61 -0.00 -1.25 -4.59 118.94 113.77 3lal s TRP 153 Ca 0.00 1.34 0.16 0.00 -0.00 0.00 0.00 56.10 57.60 3lal s TRP 153 Cb 0.00 -2.96 0.84 0.00 -0.00 0.00 0.00 33.47 31.35 3lal s TRP 153 CO 0.00 -0.08 1.41 1.63 -0.00 0.00 0.00 176.95 179.91 3lal n LYS 154 N 4.47 0.31 0.08 5.86 5.02 -1.26 -2.11 118.16 130.53 3lal n LYS 154 Ca 0.03 0.09 -0.06 0.00 -2.02 0.00 0.00 58.31 56.35 3lal n LYS 154 Cb 0.50 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.95 3lal n LYS 154 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 3lal h GLY 155 N 2.54 0.01 0.93 0.72 0.00 -1.93 -3.26 103.07 102.08 3lal h GLY 155 Ca 0.00 -0.03 -0.00 0.00 0.00 0.00 0.00 47.33 47.30 3lal h GLY 155 CO 0.00 0.03 -0.04 1.76 0.00 0.00 0.00 176.54 178.29 3lal h SER 156 N 0.00 -0.09 -0.04 0.19 0.02 -1.69 0.30 113.55 112.23 3lal h SER 156 Ca -0.01 -0.06 -0.06 0.00 -0.84 0.00 0.00 61.79 60.81 3lal h SER 156 Cb 1.63 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 64.19 3lal h SER 156 CO 0.12 0.00 -0.14 1.55 -1.14 0.00 0.00 176.83 177.23 3lal h PRO 157 N -0.18 0.35 -0.56 3.45 0.13 -1.74 0.90 132.00 134.36 3lal h PRO 157 Ca -0.01 -0.09 -0.01 0.00 -0.87 0.00 0.00 66.00 65.02 3lal h PRO 157 Cb 0.15 -0.04 -0.03 0.00 0.13 0.00 0.00 31.00 31.21 3lal h PRO 157 CO 0.02 0.49 0.31 0.00 -0.23 0.00 0.00 178.00 178.59 3lal h ALA 158 N 1.53 0.71 -0.02 -0.56 0.00 -1.36 -1.34 119.26 118.23 3lal h ALA 158 Ca 0.06 -0.09 -0.23 0.00 0.00 0.00 0.00 54.91 54.65 3lal h ALA 158 Cb 0.44 -0.22 0.02 0.00 0.00 0.00 0.00 17.79 18.03 3lal h ALA 158 CO 0.03 0.23 -0.88 0.82 0.00 0.00 0.00 179.25 179.44 3lal h ILE 159 N 0.75 1.32 -0.00 0.00 2.04 -0.24 -3.30 117.51 118.08 3lal h ILE 159 Ca 0.20 -2.16 0.00 0.00 1.00 0.00 0.00 64.86 63.90 3lal h ILE 159 Cb 0.04 2.40 0.00 0.00 -0.74 0.00 0.00 36.82 38.52 3lal h ILE 159 CO -0.03 0.66 -0.02 0.33 0.00 0.00 0.00 178.15 179.09 3lal n PHE 160 N -3.98 0.00 -0.36 1.37 7.35 0.29 -4.26 117.46 117.87 3lal n PHE 160 Ca -0.10 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.59 3lal n PHE 160 Cb 0.80 -0.34 0.14 0.00 0.35 0.00 0.00 39.48 40.43 3lal n PHE 160 CO 0.00 0.00 0.00 -0.56 -0.76 0.00 0.00 176.76 175.44 3lal h GLN 161 N 0.04 1.18 0.00 -4.13 3.07 -1.32 -0.99 115.11 112.96 3lal h GLN 161 Ca 0.00 -0.07 -0.06 0.00 0.09 0.00 0.00 58.65 58.61 3lal h GLN 161 Cb 0.36 -0.27 -0.01 0.00 0.08 0.00 0.00 27.48 27.64 3lal h GLN 161 CO 0.00 0.78 -0.29 0.66 0.09 0.00 0.00 178.83 180.08 3lal h SER 162 N 1.22 0.00 0.44 0.06 4.64 -1.85 0.28 113.55 118.34 3lal h SER 162 Ca 0.39 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.58 3lal h SER 162 Cb 0.02 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.10 3lal h SER 162 CO -0.13 0.29 -0.57 0.28 -0.87 0.00 0.00 176.83 175.83 3lal h SER 163 N 0.00 0.15 -0.52 4.97 0.02 -1.57 -3.05 113.55 113.55 3lal h SER 163 Ca -0.00 -0.08 -0.11 0.00 -0.84 0.00 0.00 61.79 60.76 3lal h SER 163 Cb 0.71 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.19 3lal h SER 163 CO 0.04 0.69 -0.09 -0.03 -1.14 0.00 0.00 176.83 176.30 3lal h MET 164 N 0.10 1.00 -0.50 3.45 -1.53 0.47 -2.33 114.93 115.60 3lal h MET 164 Ca -0.00 -0.35 -0.01 0.00 -3.44 0.00 0.00 59.70 55.89 3lal h MET 164 Cb 1.03 -0.07 -0.02 0.00 -0.55 0.00 0.00 31.60 31.99 3lal h MET 164 CO 0.08 1.03 0.26 1.15 0.14 0.00 0.00 176.91 179.57 3lal h THR 165 N 0.90 1.18 -0.05 -0.77 2.02 -0.59 -1.59 112.91 114.01 3lal h THR 165 Ca 0.14 -0.49 0.01 0.00 0.77 0.00 0.00 66.41 66.84 3lal h THR 165 Cb 0.64 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 67.63 3lal h THR 165 CO 0.04 0.20 -0.00 0.11 0.37 0.00 0.00 175.52 176.24 3lal h LYS 166 N 0.67 0.01 -0.86 6.66 1.57 -1.50 -1.10 116.57 122.02 3lal h LYS 166 Ca 0.17 -0.00 0.08 0.00 -1.87 0.00 0.00 60.65 59.04 3lal h LYS 166 Cb 0.08 -0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.33 3lal h LYS 166 CO -0.03 0.01 0.56 0.82 -0.57 0.00 0.00 179.45 180.24 3lal h ILE 167 N 0.01 1.00 -0.00 1.86 2.04 -1.10 -2.62 117.51 118.70 3lal h ILE 167 Ca 0.02 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.58 3lal h ILE 167 Cb 0.03 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.14 3lal h ILE 167 CO -0.04 0.16 -0.58 0.18 0.00 0.00 0.00 178.15 177.88 3lal n LEU 168 N -4.51 0.96 -0.04 1.44 4.77 -0.63 -4.52 117.00 114.48 3lal n LEU 168 Ca 0.14 -0.29 -0.10 0.00 -0.03 0.00 0.00 56.01 55.72 3lal n LEU 168 Cb 0.27 -0.12 -0.04 0.00 -2.33 0.00 0.00 43.42 41.20 3lal n LEU 168 CO 0.32 0.21 0.94 -0.08 -1.33 0.00 0.00 177.39 177.44 3lal h GLU 169 N 0.60 0.21 -0.04 3.23 4.22 -0.80 0.22 114.58 122.21 3lal h GLU 169 Ca 0.00 -0.01 0.01 0.00 0.08 0.00 0.00 59.36 59.43 3lal h GLU 169 Cb 0.54 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 3lal h GLU 169 CO 0.00 0.14 -0.01 -1.35 -2.18 0.00 0.00 179.01 175.61 3lal h PRO 170 N 0.22 0.01 -0.92 0.92 0.11 -1.79 0.15 132.00 130.69 3lal h PRO 170 Ca 0.07 -0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.20 3lal h PRO 170 Cb -0.00 -0.00 -0.05 0.00 0.11 0.00 0.00 31.00 31.06 3lal h PRO 170 CO -0.03 0.00 0.61 0.35 -0.21 0.00 0.00 178.00 178.72 3lal h PHE 171 N 0.01 1.14 -0.30 0.65 3.57 -1.73 -0.73 116.94 119.54 3lal h PHE 171 Ca 0.02 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.51 3lal h PHE 171 Cb 0.03 -0.38 -0.01 0.00 2.79 0.00 0.00 35.95 38.37 3lal h PHE 171 CO -0.11 0.69 0.04 0.00 -2.23 0.00 0.00 178.31 176.70 3lal h ARG 172 N 1.20 0.51 -0.99 1.11 3.08 -0.23 -1.64 114.38 117.43 3lal h ARG 172 Ca 0.35 -0.14 0.08 0.00 0.07 0.00 0.00 59.98 60.33 3lal h ARG 172 Cb -0.07 -0.06 -0.07 0.00 0.08 0.00 0.00 29.97 29.85 3lal h ARG 172 CO -0.09 0.62 0.64 -0.22 -1.07 0.00 0.00 179.97 179.85 3lal h LYS 173 N 0.33 1.08 0.00 0.04 3.64 0.05 -2.48 116.57 119.23 3lal h LYS 173 Ca 0.09 -0.07 -0.14 0.00 -1.27 0.00 0.00 60.65 59.27 3lal h LYS 173 Cb 0.37 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 31.92 3lal h LYS 173 CO 0.01 0.72 -0.76 1.96 -2.27 0.00 0.00 179.45 179.11 3lal h GLN 174 N 1.11 0.00 -2.93 1.90 4.20 -1.03 -3.37 115.11 114.99 3lal h GLN 174 Ca 0.44 0.00 -0.61 0.00 0.06 0.00 0.00 58.65 58.53 3lal h GLN 174 Cb 0.24 0.00 -0.40 0.00 0.30 0.00 0.00 27.48 27.61 3lal h GLN 174 CO -0.18 0.55 -0.71 -0.80 -0.67 0.00 0.00 178.83 177.02 3lal s ASN 175 N -6.39 3.70 0.46 1.46 -0.87 -0.63 -4.97 114.94 107.71 3lal s ASN 175 Ca 0.02 -3.27 0.31 0.00 -1.57 0.00 0.00 52.86 48.35 3lal s ASN 175 Cb 0.08 -1.21 1.33 0.00 -0.02 0.00 0.00 41.25 41.44 3lal s ASN 175 CO 0.77 -0.17 1.92 1.55 -2.57 0.00 0.00 177.10 178.60 3lal h PRO 176 N 5.92 0.00 -0.15 -0.60 0.13 -1.68 -2.78 132.00 132.84 3lal h PRO 176 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 3lal h PRO 176 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 3lal h PRO 176 CO 0.57 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.09 3lal n ASP 177 N -2.78 2.38 -4.78 1.44 8.00 -1.26 -4.88 116.55 114.68 3lal n ASP 177 Ca 0.01 -1.80 -0.37 0.00 0.71 0.00 0.00 54.79 53.34 3lal n ASP 177 Cb 0.25 -0.09 -0.07 0.00 -0.02 0.00 0.00 41.12 41.19 3lal n ASP 177 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3lal s ILE 178 N -1.83 5.31 -0.22 0.53 1.01 -1.05 -4.73 121.20 120.22 3lal s ILE 178 Ca 0.34 0.50 -0.07 0.00 0.00 0.00 0.00 60.65 61.42 3lal s ILE 178 Cb 0.20 -3.58 -0.03 0.00 0.01 0.00 0.00 42.46 39.05 3lal s ILE 178 CO 0.30 0.47 0.07 -0.69 0.00 0.00 0.00 174.94 175.09 3lal s VAL 179 N -0.12 4.52 -0.11 2.92 1.01 -0.21 -4.96 120.40 123.44 3lal s VAL 179 Ca 0.17 -0.12 0.03 0.00 0.00 0.00 0.00 61.98 62.06 3lal s VAL 179 Cb -0.13 -3.07 0.00 0.00 0.00 0.00 0.00 36.38 33.18 3lal s VAL 179 CO 0.05 0.39 -0.23 -0.63 0.00 0.00 0.00 175.10 174.68 3lal s ILE 180 N 1.05 2.01 -0.04 2.22 1.01 -1.26 -0.05 121.20 126.14 3lal s ILE 180 Ca 0.04 -0.98 0.02 0.00 0.00 0.00 0.00 60.65 59.73 3lal s ILE 180 Cb -0.14 -1.76 0.01 0.00 0.01 0.00 0.00 42.46 40.58 3lal s ILE 180 CO 0.03 0.55 -0.08 -0.47 0.00 0.00 0.00 174.94 174.97 3lal s TYR 181 N 0.54 0.97 -0.19 3.97 5.04 0.78 -4.95 117.35 123.52 3lal s TYR 181 Ca -0.14 -0.29 -0.10 0.00 -2.44 0.00 0.00 57.07 54.11 3lal s TYR 181 Cb -0.17 -0.75 -0.05 0.00 0.35 0.00 0.00 41.96 41.34 3lal s TYR 181 CO 0.05 -0.17 0.13 -1.14 -1.34 0.00 0.00 175.55 173.08 3lal s GLN 182 N 0.55 4.06 -0.10 4.97 0.74 -1.26 0.10 119.66 128.72 3lal s GLN 182 Ca -0.09 -0.20 -0.03 0.00 0.05 0.00 0.00 55.36 55.09 3lal s GLN 182 Cb -0.12 -3.38 0.04 0.00 1.10 0.00 0.00 33.01 30.65 3lal s GLN 182 CO 0.01 0.38 0.05 -0.47 -0.55 0.00 0.00 175.29 174.72 3lal s TYR 183 N 0.12 0.35 0.00 1.67 5.04 -0.18 -4.99 117.35 119.36 3lal s TYR 183 Ca 0.09 -0.11 0.00 0.00 -2.44 0.00 0.00 57.07 54.61 3lal s TYR 183 Cb -0.11 -0.67 0.00 0.00 0.35 0.00 0.00 41.96 41.52 3lal s TYR 183 CO -0.01 -0.35 0.00 -1.33 -1.34 0.00 0.00 175.55 172.52 3lal n MET 184 N 5.23 0.00 -0.09 4.97 2.81 -1.26 -1.38 117.12 127.39 3lal n MET 184 Ca -0.06 0.00 0.06 0.00 -1.81 0.00 0.00 57.70 55.89 3lal n MET 184 Cb 0.49 0.00 0.20 0.00 -0.71 0.00 0.00 33.22 33.21 3lal n MET 184 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3lal n ASP 185 N 5.46 1.13 -4.37 7.83 8.00 -1.26 -4.63 116.55 128.71 3lal n ASP 185 Ca 0.00 -1.88 -0.27 0.00 0.71 0.00 0.00 54.79 53.35 3lal n ASP 185 Cb 0.00 -0.12 -0.13 0.00 -0.02 0.00 0.00 41.12 40.85 3lal n ASP 185 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 3lal s ASP 186 N -1.17 3.14 -0.12 -2.24 1.01 -0.48 -0.56 116.67 116.24 3lal s ASP 186 Ca 0.20 -0.75 -0.01 0.00 0.71 0.00 0.00 52.55 52.70 3lal s ASP 186 Cb 0.10 -0.20 -0.02 0.00 1.01 0.00 0.00 42.92 43.81 3lal s ASP 186 CO 0.14 0.14 -0.11 -0.22 0.21 0.00 0.00 175.17 175.34 3lal s LEU 187 N -2.09 2.87 -0.23 1.23 2.96 0.28 -1.01 118.68 122.68 3lal s LEU 187 Ca 0.13 -0.25 -0.04 0.00 -0.22 0.00 0.00 54.13 53.75 3lal s LEU 187 Cb -0.10 -1.65 -0.00 0.00 0.50 0.00 0.00 46.19 44.94 3lal s LEU 187 CO 0.06 0.20 -0.04 -0.31 -1.32 0.00 0.00 176.35 174.94 3lal s TYR 188 N 0.18 2.97 -0.21 5.38 1.51 0.28 -0.07 117.35 127.38 3lal s TYR 188 Ca -0.06 -1.00 0.01 0.00 -1.01 0.00 0.00 57.07 55.01 3lal s TYR 188 Cb -0.15 -2.11 0.05 0.00 -0.11 0.00 0.00 41.96 39.64 3lal s TYR 188 CO 0.04 -0.57 -0.11 0.08 -1.11 0.00 0.00 175.55 173.88 3lal s VAL 189 N 1.46 1.81 -0.02 0.71 1.01 0.30 -0.16 120.40 125.52 3lal s VAL 189 Ca 0.05 -1.17 0.07 0.00 0.00 0.00 0.00 61.98 60.93 3lal s VAL 189 Cb -0.15 -1.88 -0.02 0.00 0.00 0.00 0.00 36.38 34.34 3lal s VAL 189 CO -0.03 0.14 -0.24 -0.83 0.00 0.00 0.00 175.10 174.13 3lal s GLY 190 N 1.31 1.18 0.31 4.51 0.00 0.92 -0.18 107.32 115.38 3lal s GLY 190 Ca -0.03 -1.04 -0.01 0.00 0.00 0.00 0.00 44.72 43.64 3lal s GLY 190 CO -0.08 -0.86 0.38 -1.35 0.00 0.00 0.00 173.10 171.19 3lal s SER 191 N -0.56 0.91 0.00 1.64 1.04 -0.68 -1.05 113.70 115.00 3lal s SER 191 Ca 0.09 -1.49 0.11 0.00 0.48 0.00 0.00 55.95 55.14 3lal s SER 191 Cb -0.09 0.59 0.20 0.00 0.10 0.00 0.00 66.02 66.82 3lal s SER 191 CO -0.01 -1.16 1.06 0.47 0.98 0.00 0.00 173.24 174.58 3lal n ASP 192 N -1.19 2.46 -4.48 7.02 8.00 -1.26 -1.96 116.55 125.13 3lal n ASP 192 Ca 0.02 -1.74 -0.31 0.00 0.71 0.00 0.00 54.79 53.47 3lal n ASP 192 Cb 0.62 -0.12 0.19 0.00 -0.02 0.00 0.00 41.12 41.79 3lal n ASP 192 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3lal n LEU 193 N 0.59 0.05 -4.78 0.64 4.77 -1.26 -4.85 117.00 112.16 3lal n LEU 193 Ca 0.09 0.12 -0.32 0.00 -0.03 0.00 0.00 56.01 55.87 3lal n LEU 193 Cb 0.36 -1.26 0.06 0.00 -2.33 0.00 0.00 43.42 40.25 3lal n LEU 193 CO 0.08 -3.00 0.72 -1.83 -1.33 0.00 0.00 177.39 172.03 3lal s GLU 194 N -4.14 2.67 0.32 3.23 4.04 -1.26 -4.71 118.70 118.85 3lal s GLU 194 Ca 0.63 1.27 0.02 0.00 0.04 0.00 0.00 54.97 56.93 3lal s GLU 194 Cb -0.21 -1.94 0.53 0.00 0.02 0.00 0.00 34.13 32.52 3lal s GLU 194 CO 0.64 -1.33 1.88 0.97 -1.84 0.00 0.00 175.26 175.57 3lal h ILE 195 N -0.37 1.20 -0.71 1.83 6.09 -1.99 0.19 117.51 123.76 3lal h ILE 195 Ca -0.45 -0.70 -0.05 0.00 -1.37 0.00 0.00 64.86 62.28 3lal h ILE 195 Cb 1.24 0.70 -0.03 0.00 0.47 0.00 0.00 36.82 39.20 3lal h ILE 195 CO 0.54 0.26 0.24 1.23 -3.07 0.00 0.00 178.15 177.35 3lal h GLY 196 N 0.88 1.16 1.53 8.18 0.00 -1.99 -0.40 103.07 112.45 3lal h GLY 196 Ca 0.16 -0.67 -0.13 0.00 0.00 0.00 0.00 47.33 46.69 3lal h GLY 196 CO -0.01 0.63 -0.40 1.46 0.00 0.00 0.00 176.54 178.23 3lal h GLN 197 N 1.03 0.52 -0.18 4.80 4.20 -1.55 -0.61 115.11 123.31 3lal h GLN 197 Ca 0.23 -0.26 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 3lal h GLN 197 Cb 0.28 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.05 3lal h GLN 197 CO -0.01 0.83 0.03 1.25 -0.67 0.00 0.00 178.83 180.27 3lal h HIS 198 N 0.43 0.31 -0.51 2.96 2.76 -0.78 -0.10 115.15 120.22 3lal h HIS 198 Ca 0.04 -0.04 -0.02 0.00 -2.20 0.00 0.00 60.37 58.15 3lal h HIS 198 Cb 0.89 -0.09 -0.03 0.00 1.55 0.00 0.00 27.41 29.74 3lal h HIS 198 CO 0.03 0.44 0.24 0.00 -1.30 0.00 0.00 177.93 177.35 3lal h ARG 199 N 0.09 0.72 -0.45 5.26 3.08 -0.96 -1.10 114.38 121.03 3lal h ARG 199 Ca 0.06 -0.09 -0.05 0.00 0.07 0.00 0.00 59.98 59.97 3lal h ARG 199 Cb 0.29 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 3lal h ARG 199 CO 0.00 0.56 0.10 1.15 -1.07 0.00 0.00 179.97 180.72 3lal h THR 200 N 0.72 1.24 0.00 2.04 2.02 -0.73 -2.36 112.91 115.83 3lal h THR 200 Ca 0.18 -0.83 -0.03 0.00 0.77 0.00 0.00 66.41 66.50 3lal h THR 200 Cb 0.08 0.92 -0.00 0.00 -1.74 0.00 0.00 68.15 67.41 3lal h THR 200 CO -0.02 0.29 -0.16 0.11 0.37 0.00 0.00 175.52 176.11 3lal h LYS 201 N 0.59 0.00 -0.14 6.66 1.79 -0.15 -1.69 116.57 123.63 3lal h LYS 201 Ca 0.14 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.45 3lal h LYS 201 Cb 0.33 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.99 3lal h LYS 201 CO 0.00 0.16 -0.52 0.82 -1.08 0.00 0.00 179.45 178.83 3lal h ILE 202 N 0.00 1.34 -0.81 1.86 1.08 -0.75 -1.89 117.51 118.33 3lal h ILE 202 Ca -0.00 -1.79 0.02 0.00 -0.39 0.00 0.00 64.86 62.70 3lal h ILE 202 Cb 0.31 2.05 -0.04 0.00 -3.07 0.00 0.00 36.82 36.06 3lal h ILE 202 CO 0.02 0.55 0.53 -0.08 -0.69 0.00 0.00 178.15 178.48 3lal h GLU 203 N 0.26 1.02 -0.94 2.37 4.22 -1.09 0.13 114.58 120.56 3lal h GLU 203 Ca -0.02 -0.06 0.06 0.00 0.08 0.00 0.00 59.36 59.41 3lal h GLU 203 Cb 1.15 -0.23 -0.06 0.00 0.50 0.00 0.00 28.75 30.11 3lal h GLU 203 CO 0.11 0.68 0.60 1.49 -2.18 0.00 0.00 179.01 179.71 3lal h GLU 204 N 1.06 1.07 -0.32 1.92 4.81 -1.22 -1.84 114.58 120.06 3lal h GLU 204 Ca 0.31 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 59.38 3lal h GLU 204 Cb -0.06 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.08 3lal h GLU 204 CO -0.09 0.71 -0.20 1.25 -0.73 0.00 0.00 179.01 179.95 3lal h LEU 205 N 1.10 0.72 -1.21 1.64 6.46 -0.39 -2.89 115.31 120.75 3lal h LEU 205 Ca 0.40 -0.43 0.06 0.00 -0.12 0.00 0.00 57.88 57.80 3lal h LEU 205 Cb 0.14 -0.20 -0.05 0.00 -0.73 0.00 0.00 40.66 39.81 3lal h LEU 205 CO -0.16 0.99 0.56 0.03 -0.62 0.00 0.00 178.44 179.24 3lal h ARG 206 N 0.45 0.94 -0.53 1.25 3.08 -0.18 -0.59 114.38 118.79 3lal h ARG 206 Ca 0.07 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 60.00 3lal h ARG 206 Cb 0.74 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.56 3lal h ARG 206 CO 0.05 0.62 0.11 1.96 -1.07 0.00 0.00 179.97 181.65 3lal h GLN 207 N 0.96 0.87 0.07 0.04 1.08 -1.20 0.44 115.11 117.37 3lal h GLN 207 Ca 0.37 -0.22 0.01 0.00 -1.45 0.00 0.00 58.65 57.36 3lal h GLN 207 Cb 0.20 -0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 27.50 3lal h GLN 207 CO -0.13 0.83 -0.14 0.45 -0.95 0.00 0.00 178.83 178.89 3lal h HIS 208 N 0.76 -0.35 -0.94 2.96 3.86 -1.07 -2.36 115.15 118.01 3lal h HIS 208 Ca 0.17 0.01 0.08 0.00 -1.16 0.00 0.00 60.37 59.46 3lal h HIS 208 Cb 0.36 0.15 -0.07 0.00 1.06 0.00 0.00 27.41 28.91 3lal h HIS 208 CO 0.03 -0.21 0.59 -0.07 0.86 0.00 0.00 177.93 179.12 3lal h LEU 209 N -0.27 0.90 -1.89 2.43 -0.00 -0.77 -2.41 115.31 113.30 3lal h LEU 209 Ca 0.03 0.03 0.06 0.00 -0.00 0.00 0.00 57.88 57.99 3lal h LEU 209 Cb 0.29 -0.16 -0.01 0.00 -0.00 0.00 0.00 40.66 40.77 3lal h LEU 209 CO -0.09 0.55 0.21 0.25 -0.00 0.00 0.00 178.44 179.36 3lal h LEU 210 N 1.02 0.12 0.00 1.67 5.85 0.40 0.12 115.31 124.49 3lal h LEU 210 Ca 0.42 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.15 3lal h LEU 210 Cb 0.27 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.27 3lal h LEU 210 CO -0.20 0.08 0.00 0.54 -0.34 0.00 0.00 178.44 178.51 3lal n ARG 211 N -4.47 0.69 -0.04 1.25 3.00 -0.91 -2.95 116.66 113.23 3lal n ARG 211 Ca 0.04 0.01 0.02 0.00 -0.01 0.00 0.00 57.85 57.91 3lal n ARG 211 Cb 0.29 -1.50 0.03 0.00 0.00 0.00 0.00 32.46 31.28 3lal n ARG 211 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.63 178.54 3lal n TRP 212 N -1.11 0.00 -1.48 -1.55 7.02 0.38 -5.00 117.44 115.72 3lal n TRP 212 Ca 0.18 -0.54 0.00 0.00 -1.02 0.00 0.00 57.50 56.12 3lal n TRP 212 Cb 0.14 -0.07 0.00 0.00 -2.42 0.00 0.00 31.31 28.96 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 -0.65 0.86 2.57 6.99 0.00 -1.11 -4.93 105.19 108.92 3lal n GLY 213 Ca 0.04 -0.61 -0.27 0.00 0.00 0.00 0.00 46.02 45.17 3lal n GLY 213 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3lal n LEU 214 N -0.05 3.48 -4.57 0.99 4.32 -1.02 -4.34 117.00 115.81 3lal n LEU 214 Ca 0.00 -5.36 -0.41 0.00 -0.02 0.00 0.00 56.01 50.22 3lal n LEU 214 Cb 0.36 -0.67 -0.03 0.00 -1.62 0.00 0.00 43.42 41.45 3lal n LEU 214 CO 0.00 1.96 1.36 0.42 -1.22 0.00 0.00 177.39 179.92 3lal s THR 215 N -2.14 3.63 0.33 -5.08 -4.23 -1.26 -4.06 115.64 102.83 3lal s THR 215 Ca 0.35 0.48 0.09 0.00 -1.18 0.00 0.00 61.69 61.44 3lal s THR 215 Cb 0.09 -4.31 -0.05 0.00 1.34 0.00 0.00 72.50 69.57 3lal s THR 215 CO -0.06 -1.15 0.01 -0.72 -0.54 0.00 0.00 174.62 172.16 3lal s TYR 232 N 6.92 2.56 -0.24 3.99 -0.85 -1.25 -5.00 117.35 123.48 3lal s TYR 232 Ca 0.56 -0.40 -0.08 0.00 -0.52 0.00 0.00 57.07 56.63 3lal s TYR 232 Cb -0.12 -1.43 -0.04 0.00 0.38 0.00 0.00 41.96 40.75 3lal s TYR 232 CO 0.23 0.50 0.10 -1.21 -1.52 0.00 0.00 175.55 173.65 3lal s GLU 233 N -3.71 3.80 0.22 -3.49 2.02 -1.26 -2.63 118.70 113.65 3lal s GLU 233 Ca 0.34 -0.41 -0.04 0.00 0.02 0.00 0.00 54.97 54.89 3lal s GLU 233 Cb -0.01 -3.38 -0.05 0.00 0.10 0.00 0.00 34.13 30.78 3lal s GLU 233 CO 0.19 -0.09 0.45 -0.51 0.02 0.00 0.00 175.26 175.32 3lal s LEU 234 N 1.38 4.18 -0.50 1.80 1.02 0.91 -4.93 118.68 122.55 3lal s LEU 234 Ca 0.06 0.57 0.05 0.00 0.02 0.00 0.00 54.13 54.83 3lal s LEU 234 Cb -0.15 -3.35 0.18 0.00 0.02 0.00 0.00 46.19 42.90 3lal s LEU 234 CO 0.05 -0.07 0.42 1.41 0.02 0.00 0.00 176.35 178.18 3lal n HIS 235 N -0.54 0.51 0.24 0.29 8.25 -1.26 -0.71 115.22 122.01 3lal n HIS 235 Ca -0.03 -3.65 0.14 0.00 -0.26 0.00 0.00 57.72 53.92 3lal n HIS 235 Cb 0.53 -0.08 0.81 0.00 1.12 0.00 0.00 29.99 32.37 3lal n HIS 235 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 3lal h PRO 236 N 5.35 0.00 -0.14 -0.41 0.11 -1.73 0.07 132.00 135.25 3lal h PRO 236 Ca 0.22 0.00 0.04 0.00 0.11 0.00 0.00 66.00 66.36 3lal h PRO 236 Cb 0.85 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.92 3lal h PRO 236 CO 0.50 0.00 -0.11 -0.44 -0.21 0.00 0.00 178.00 177.74 3lal h ASP 237 N 0.00 -0.35 0.02 -2.05 3.45 -1.74 -1.63 116.42 114.11 3lal h ASP 237 Ca 0.04 0.07 0.00 0.00 0.43 0.00 0.00 57.03 57.57 3lal h ASP 237 Cb 0.20 0.18 0.00 0.00 -0.56 0.00 0.00 39.33 39.15 3lal h ASP 237 CO -0.00 -0.15 0.00 0.29 -1.57 0.00 0.00 179.24 177.81 3lal n LYS 238 N -5.26 0.00 -2.50 3.56 4.76 0.01 -4.53 118.16 114.20 3lal n LYS 238 Ca -0.03 0.48 -0.43 0.00 -2.87 0.00 0.00 58.31 55.46 3lal n LYS 238 Cb 0.18 -1.50 -0.02 0.00 -1.84 0.00 0.00 35.03 31.85 3lal n LYS 238 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 3lal s TRP 239 N -2.97 2.95 0.06 2.13 0.52 -0.62 -4.99 118.94 116.02 3lal s TRP 239 Ca 0.00 1.10 -0.08 0.00 0.02 0.00 0.00 56.10 57.15 3lal s TRP 239 Cb 0.00 -3.56 -0.00 0.00 -1.15 0.00 0.00 33.47 28.76 3lal s TRP 239 CO 0.01 -1.33 0.16 0.95 0.02 0.00 0.00 176.95 176.76 3lal s THR 240 N 3.65 0.14 0.49 2.01 -4.23 -1.26 -5.06 115.64 111.37 3lal s THR 240 Ca 0.52 -1.14 -0.21 0.00 -1.18 0.00 0.00 61.69 59.68 3lal s THR 240 Cb -0.18 -1.17 -0.10 0.00 1.34 0.00 0.00 72.50 72.39 3lal s THR 240 CO 0.15 -0.63 0.65 1.33 -0.54 0.00 0.00 174.62 175.58 3lal n VAL 241 N 0.29 2.21 -3.14 2.29 0.24 -1.26 -4.93 118.33 114.02 3lal n VAL 241 Ca -0.17 -0.50 -0.45 0.00 -2.04 0.00 0.00 64.34 61.18 3lal n VAL 241 Cb 0.61 -0.75 -0.01 0.00 -1.47 0.00 0.00 33.84 32.21 3lal n VAL 241 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 3lal s GLN 242 N -1.93 3.90 0.45 7.34 2.00 -1.00 -4.98 119.66 125.43 3lal s GLN 242 Ca 0.66 -2.54 -0.25 0.00 -2.00 0.00 0.00 55.36 51.23 3lal s GLN 242 Cb -0.52 -4.75 -0.08 0.00 0.80 0.00 0.00 33.01 28.46 3lal s GLN 242 CO 0.56 -1.51 1.37 -1.25 -0.50 0.00 0.00 175.29 173.95 3lal s PRO 243 N 0.73 3.72 0.02 1.67 0.04 -1.26 -4.64 135.00 135.29 3lal s PRO 243 Ca 0.31 2.29 -0.33 0.00 0.04 0.00 0.00 61.00 63.31 3lal s PRO 243 Cb -0.07 -2.64 -0.11 0.00 0.04 0.00 0.00 34.50 31.72 3lal s PRO 243 CO -0.06 -0.74 1.84 -0.89 0.04 0.00 0.00 177.00 177.19 3lal n ILE 244 N -0.19 0.48 -3.76 0.56 5.41 -1.26 -4.93 119.36 115.67 3lal n ILE 244 Ca 0.05 -0.09 -0.37 0.00 1.00 0.00 0.00 62.75 63.35 3lal n ILE 244 Cb 0.43 -1.97 -0.13 0.00 -0.71 0.00 0.00 39.64 37.27 3lal n ILE 244 CO 0.00 0.00 0.00 0.68 0.00 0.00 0.00 176.55 177.23 3lal s VAL 245 N 3.36 4.20 -0.18 1.39 -7.23 -1.26 -4.89 120.40 115.80 3lal s VAL 245 Ca 0.87 -0.29 -0.21 0.00 -1.81 0.00 0.00 61.98 60.54 3lal s VAL 245 Cb -0.59 -3.01 -0.03 0.00 0.56 0.00 0.00 36.38 33.32 3lal s VAL 245 CO 0.44 0.29 0.64 -0.76 -0.31 0.00 0.00 175.10 175.40 3lal s LEU 246 N 1.59 4.17 1.05 1.32 1.43 -1.26 -4.99 118.68 121.99 3lal s LEU 246 Ca 0.06 0.89 -0.14 0.00 -1.03 0.00 0.00 54.13 53.91 3lal s LEU 246 Cb -0.15 -2.92 0.15 0.00 0.03 0.00 0.00 46.19 43.29 3lal s LEU 246 CO 0.03 -0.25 0.62 -0.81 0.23 0.00 0.00 176.35 176.18 3lal n PRO 247 N 4.83 -1.26 -3.81 1.29 -0.04 -1.26 -4.98 135.00 129.77 3lal n PRO 247 Ca -0.01 -0.33 -0.29 0.00 -0.04 0.00 0.00 63.50 62.83 3lal n PRO 247 Cb 0.50 -2.01 -0.13 0.00 -0.04 0.00 0.00 33.50 31.82 3lal n PRO 247 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 3lal s GLU 248 N -4.00 1.82 0.37 0.54 -1.05 -1.26 -5.11 118.70 110.00 3lal s GLU 248 Ca 0.62 -2.62 0.08 0.00 -0.15 0.00 0.00 54.97 52.90 3lal s GLU 248 Cb -0.20 -2.88 -0.03 0.00 -0.44 0.00 0.00 34.13 30.58 3lal s GLU 248 CO 0.65 -1.21 0.27 0.21 0.95 0.00 0.00 175.26 176.13 3lal s LYS 249 N -0.43 2.55 -0.02 -4.83 2.20 -1.26 -5.08 119.74 112.87 3lal s LYS 249 Ca 0.21 -1.47 -0.01 0.00 -0.36 0.00 0.00 55.97 54.34 3lal s LYS 249 Cb -0.16 -2.34 -0.00 0.00 -1.51 0.00 0.00 37.83 33.82 3lal s LYS 249 CO -0.07 0.00 -0.02 -0.44 -0.36 0.00 0.00 175.35 174.46 3lal h ASP 250 N 1.27 0.00 -3.87 1.43 5.19 -2.05 -3.45 116.42 114.94 3lal h ASP 250 Ca -0.43 0.00 -0.69 0.00 -0.62 0.00 0.00 57.03 55.29 3lal h ASP 250 Cb 1.26 0.00 -0.21 0.00 0.18 0.00 0.00 39.33 40.56 3lal h ASP 250 CO 0.60 0.10 -0.75 -0.94 -3.12 0.00 0.00 179.24 175.13 3lal s SER 251 N -3.73 4.25 -0.15 6.45 1.04 -1.26 -5.09 113.70 115.20 3lal s SER 251 Ca -0.02 -0.17 -0.09 0.00 0.48 0.00 0.00 55.95 56.15 3lal s SER 251 Cb 0.00 -0.93 -0.04 0.00 0.10 0.00 0.00 66.02 65.15 3lal s SER 251 CO 0.02 0.33 0.16 0.26 0.98 0.00 0.00 173.24 174.99 3lal s TRP 252 N -0.82 3.53 0.50 5.02 0.52 -1.26 -5.04 118.94 121.39 3lal s TRP 252 Ca 0.13 0.49 0.01 0.00 0.02 0.00 0.00 56.10 56.74 3lal s TRP 252 Cb -0.11 -2.06 0.02 0.00 -1.15 0.00 0.00 33.47 30.17 3lal s TRP 252 CO 0.03 0.54 0.73 0.95 0.02 0.00 0.00 176.95 179.22 3lal s THR 253 N -0.44 3.33 0.11 2.01 -4.23 -1.26 -1.75 115.64 113.42 3lal s THR 253 Ca 0.13 -0.56 -0.28 0.00 -1.18 0.00 0.00 61.69 59.80 3lal s THR 253 Cb -0.12 -3.24 -0.08 0.00 1.34 0.00 0.00 72.50 70.39 3lal s THR 253 CO 0.02 -0.17 1.63 0.58 -0.54 0.00 0.00 174.62 176.14 3lal h VAL 254 N 0.22 0.38 -0.87 2.29 2.07 -1.17 -0.42 116.25 118.74 3lal h VAL 254 Ca -0.44 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.29 3lal h VAL 254 Cb 1.27 0.38 -0.12 0.00 -1.52 0.00 0.00 31.29 31.30 3lal h VAL 254 CO 0.55 0.00 0.36 -1.13 0.02 0.00 0.00 177.57 177.37 3lal h ASN 255 N -0.50 0.28 -0.53 0.57 -1.24 -1.62 0.21 115.58 112.75 3lal h ASN 255 Ca 0.03 0.15 -0.08 0.00 0.71 0.00 0.00 56.30 57.11 3lal h ASN 255 Cb 0.53 0.15 -0.02 0.00 0.73 0.00 0.00 38.32 39.71 3lal h ASN 255 CO -0.16 -0.01 0.01 0.44 -1.29 0.00 0.00 177.43 176.42 3lal h ASP 256 N 0.38 0.92 0.15 1.15 3.32 -1.63 -0.83 116.42 119.87 3lal h ASP 256 Ca 0.54 -0.30 -0.19 0.00 0.02 0.00 0.00 57.03 57.09 3lal h ASP 256 Cb 1.00 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 40.31 3lal h ASP 256 CO -0.53 1.00 -0.73 0.40 -1.72 0.00 0.00 179.24 177.66 3lal h ILE 257 N 0.81 1.35 -0.71 0.35 2.04 -0.06 -1.46 117.51 119.82 3lal h ILE 257 Ca 0.15 -2.08 0.03 0.00 1.00 0.00 0.00 64.86 63.96 3lal h ILE 257 Cb 0.52 2.06 -0.05 0.00 -0.74 0.00 0.00 36.82 38.62 3lal h ILE 257 CO 0.03 0.63 0.44 1.56 0.00 0.00 0.00 178.15 180.82 3lal h GLN 258 N 0.35 0.84 -0.04 2.37 4.20 -0.46 0.23 115.11 122.60 3lal h GLN 258 Ca -0.03 -0.05 -0.08 0.00 0.06 0.00 0.00 58.65 58.54 3lal h GLN 258 Cb 1.32 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 28.89 3lal h GLN 258 CO 0.13 0.55 -0.37 0.87 -0.67 0.00 0.00 178.83 179.35 3lal h LYS 259 N 0.86 0.07 -0.22 1.46 1.57 -0.99 -1.88 116.57 117.45 3lal h LYS 259 Ca 0.29 -0.03 -0.17 0.00 -1.87 0.00 0.00 60.65 58.87 3lal h LYS 259 Cb 0.04 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.35 3lal h LYS 259 CO -0.12 0.44 -0.53 1.25 -0.57 0.00 0.00 179.45 179.92 3lal h LEU 260 N 0.06 0.85 -0.31 2.94 6.46 -0.27 -2.03 115.31 123.02 3lal h LEU 260 Ca 0.01 -0.56 -0.06 0.00 -0.12 0.00 0.00 57.88 57.15 3lal h LEU 260 Cb 0.69 -0.25 -0.01 0.00 -0.73 0.00 0.00 40.66 40.36 3lal h LEU 260 CO 0.05 1.26 -0.03 0.58 -0.62 0.00 0.00 178.44 179.68 3lal h VAL 261 N 0.48 1.27 -0.53 1.05 2.07 -0.49 -1.15 116.25 118.95 3lal h VAL 261 Ca -0.00 -1.01 0.05 0.00 0.82 0.00 0.00 66.70 66.56 3lal h VAL 261 Cb 1.14 1.31 -0.05 0.00 -1.52 0.00 0.00 31.29 32.18 3lal h VAL 261 CO 0.12 0.33 0.26 1.23 0.02 0.00 0.00 177.57 179.52 3lal h GLY 262 N 0.34 0.74 1.01 2.17 0.00 -1.34 0.55 103.07 106.55 3lal h GLY 262 Ca 0.08 -0.17 -0.05 0.00 0.00 0.00 0.00 47.33 47.19 3lal h GLY 262 CO 0.02 0.10 0.20 1.70 0.00 0.00 0.00 176.54 178.56 3lal h LYS 263 N 0.50 0.97 -0.01 4.80 3.64 -1.27 -1.24 116.57 123.96 3lal h LYS 263 Ca 0.24 -0.21 -0.13 0.00 -1.27 0.00 0.00 60.65 59.28 3lal h LYS 263 Cb 0.17 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 3lal h LYS 263 CO -0.18 0.85 -0.63 -0.07 -2.27 0.00 0.00 179.45 177.16 3lal h LEU 264 N 0.90 0.04 -1.01 5.20 3.38 -0.68 -1.53 115.31 121.60 3lal h LEU 264 Ca 0.20 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 58.06 3lal h LEU 264 Cb 0.28 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 3lal h LEU 264 CO -0.01 0.66 -0.27 -1.13 0.09 0.00 0.00 178.44 177.78 3lal h ASN 265 N 0.02 0.38 0.05 -0.43 -1.24 0.44 -1.93 115.58 112.87 3lal h ASN 265 Ca -0.01 -0.13 -0.00 0.00 0.71 0.00 0.00 56.30 56.87 3lal h ASN 265 Cb 1.12 -0.10 0.00 0.00 0.73 0.00 0.00 38.32 40.06 3lal h ASN 265 CO 0.08 0.65 -0.02 -0.25 -1.29 0.00 0.00 177.43 176.60 3lal h TRP 266 N 0.34 -0.06 -0.98 0.67 2.91 -0.85 -3.21 115.95 114.77 3lal h TRP 266 Ca 0.05 -0.00 0.20 0.00 1.13 0.00 0.00 58.89 60.27 3lal h TRP 266 Cb 0.66 0.02 -0.09 0.00 -0.51 0.00 0.00 29.16 29.24 3lal h TRP 266 CO 0.02 0.26 0.62 0.00 -1.03 0.00 0.00 178.44 178.30 3lal h ALA 267 N 0.56 1.90 0.00 2.65 0.00 -0.98 -2.01 119.26 121.36 3lal h ALA 267 Ca -0.01 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3lal h ALA 267 Cb 0.34 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3lal h ALA 267 CO 0.01 -0.24 0.00 0.66 0.00 0.00 0.00 179.25 179.68 3lal h SER 268 N 0.62 0.00 0.72 0.00 4.64 -1.35 0.77 113.55 118.95 3lal h SER 268 Ca 0.54 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.82 3lal h SER 268 Cb 1.03 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.11 3lal h SER 268 CO -0.30 0.00 -0.20 1.56 -0.87 0.00 0.00 176.83 177.02 3lal h GLN 269 N 0.00 0.00 0.00 4.77 1.08 -1.48 -3.39 115.11 116.09 3lal h GLN 269 Ca 0.00 0.00 -0.18 0.00 -1.45 0.00 0.00 58.65 57.02 3lal h GLN 269 Cb 0.36 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.77 3lal h GLN 269 CO 0.00 0.20 -1.45 -0.89 -0.95 0.00 0.00 178.83 175.73 3lal n ILE 270 N -3.48 1.14 -3.48 2.54 5.41 0.23 -4.92 119.36 116.80 3lal n ILE 270 Ca -0.01 -0.05 -0.43 0.00 1.00 0.00 0.00 62.75 63.26 3lal n ILE 270 Cb 0.36 -1.87 -0.10 0.00 -0.71 0.00 0.00 39.64 37.32 3lal n ILE 270 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 3lal s TYR 271 N -2.42 3.24 0.21 1.39 2.02 0.12 -4.80 117.35 117.10 3lal s TYR 271 Ca -0.22 -0.64 -0.32 0.00 -0.37 0.00 0.00 57.07 55.52 3lal s TYR 271 Cb 0.07 -2.57 -0.13 0.00 -0.40 0.00 0.00 41.96 38.93 3lal s TYR 271 CO 0.30 -0.60 1.57 -0.35 -1.57 0.00 0.00 175.55 174.90 3lal n PRO 272 N 5.14 2.34 0.00 -1.71 -0.04 -1.26 -3.30 135.00 136.17 3lal n PRO 272 Ca -0.11 0.84 0.00 0.00 -0.04 0.00 0.00 63.50 64.19 3lal n PRO 272 Cb 0.47 -2.60 0.00 0.00 -0.04 0.00 0.00 33.50 31.32 3lal n PRO 272 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3lal n GLY 273 N 3.07 0.80 3.69 0.55 0.00 -1.26 -5.00 105.19 107.04 3lal n GLY 273 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 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 4.17 0.08 -0.61 -1.09 -1.21 -4.97 121.20 115.58 3lal s ILE 274 Ca 0.00 1.51 0.10 0.00 -2.23 0.00 0.00 60.65 60.03 3lal s ILE 274 Cb 0.00 -3.97 -0.03 0.00 -1.58 0.00 0.00 42.46 36.87 3lal s ILE 274 CO 0.00 0.02 -0.25 -0.54 -1.23 0.00 0.00 174.94 172.93 3lal s LYS 275 N 2.07 1.50 0.00 2.79 1.02 -1.26 -4.90 119.74 120.96 3lal s LYS 275 Ca 0.57 -1.18 0.00 0.00 0.02 0.00 0.00 55.97 55.38 3lal s LYS 275 Cb -0.26 -1.80 0.00 0.00 -0.52 0.00 0.00 37.83 35.25 3lal s LYS 275 CO 0.23 0.45 0.00 0.28 -0.92 0.00 0.00 175.35 175.39 3lal n VAL 276 N 1.37 0.00 0.01 3.17 0.31 -1.26 -4.89 118.33 117.04 3lal n VAL 276 Ca -0.18 -0.06 -0.15 0.00 -0.01 0.00 0.00 64.34 63.94 3lal n VAL 276 Cb 0.53 0.46 -0.10 0.00 -0.91 0.00 0.00 33.84 33.82 3lal n VAL 276 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 3lal h ARG 277 N 0.00 -0.59 -0.63 5.55 2.47 -1.99 -1.42 114.38 117.77 3lal h ARG 277 Ca 0.00 0.04 0.18 0.00 -1.26 0.00 0.00 59.98 58.94 3lal h ARG 277 Cb 0.00 0.13 -0.03 0.00 -1.65 0.00 0.00 29.97 28.43 3lal h ARG 277 CO 0.00 -0.39 0.46 1.96 0.56 0.00 0.00 179.97 182.55 3lal h GLN 278 N -0.61 0.00 0.11 0.04 1.08 -1.91 -1.01 115.11 112.81 3lal h GLN 278 Ca 0.03 0.00 -0.18 0.00 -1.45 0.00 0.00 58.65 57.05 3lal h GLN 278 Cb 0.70 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.14 3lal h GLN 278 CO -0.41 0.00 -0.83 1.25 -0.95 0.00 0.00 178.83 177.88 3lal h LEU 279 N 0.00 0.36 -0.09 1.46 5.85 -1.62 -3.32 115.31 117.95 3lal h LEU 279 Ca 0.30 -0.92 0.00 0.00 0.84 0.00 0.00 57.88 58.10 3lal h LEU 279 Cb 1.21 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.12 3lal h LEU 279 CO -0.00 1.38 0.00 0.00 -0.34 0.00 0.00 178.44 179.48 3lal h LYS 281 N 0.00 0.10 -0.40 0.00 1.57 -1.30 -0.71 116.57 115.82 3lal h LYS 281 Ca 0.00 -0.01 -0.09 0.00 -1.87 0.00 0.00 60.65 58.68 3lal h LYS 281 Cb 0.70 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.97 3lal h LYS 281 CO 0.00 0.06 -0.12 -0.07 -0.57 0.00 0.00 179.45 178.75 3lal h LEU 282 N 0.10 0.71 -7.01 2.94 3.38 -1.40 -3.33 115.31 110.70 3lal h LEU 282 Ca 0.34 -0.21 -0.72 0.00 0.09 0.00 0.00 57.88 57.37 3lal h LEU 282 Cb 1.19 -0.19 -0.12 0.00 0.09 0.00 0.00 40.66 41.63 3lal h LEU 282 CO -0.04 0.85 2.15 0.18 0.09 0.00 0.00 178.44 181.68 3lal n LEU 283 N -4.16 5.92 -4.26 1.67 4.77 -0.27 -4.94 117.00 115.73 3lal n LEU 283 Ca 0.01 -4.31 -0.32 0.00 -0.03 0.00 0.00 56.01 51.36 3lal n LEU 283 Cb 0.36 -1.62 -0.16 0.00 -2.33 0.00 0.00 43.42 39.67 3lal n LEU 283 CO 0.43 0.86 -0.52 -0.60 -1.33 0.00 0.00 177.39 176.22 3lal s ARG 284 N 2.25 3.14 0.33 3.23 6.06 -1.25 -5.01 118.95 127.71 3lal s ARG 284 Ca 0.46 -0.82 0.00 0.00 -2.50 0.00 0.00 55.73 52.87 3lal s ARG 284 Cb 0.06 -2.42 0.00 0.00 0.06 0.00 0.00 34.95 32.65 3lal s ARG 284 CO 0.00 0.16 0.00 0.41 -2.50 0.00 0.00 175.30 173.37 3lal n GLY 285 N 3.61 -1.75 2.93 8.12 0.00 -1.26 -4.74 105.19 112.10 3lal n GLY 285 Ca -0.19 -1.89 -0.30 0.00 0.00 0.00 0.00 46.02 43.65 3lal n GLY 285 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3lal s THR 286 N 0.00 2.52 0.24 2.61 -4.23 -1.26 -5.10 115.64 110.41 3lal s THR 286 Ca 0.00 -3.31 0.02 0.00 -1.18 0.00 0.00 61.69 57.22 3lal s THR 286 Cb 0.00 -2.75 -0.04 0.00 1.34 0.00 0.00 72.50 71.06 3lal s THR 286 CO 0.00 -0.81 0.40 -0.54 -0.54 0.00 0.00 174.62 173.13 3lal s LYS 287 N -0.29 3.48 0.41 3.99 -0.14 -1.26 -5.07 119.74 120.86 3lal s LYS 287 Ca 0.17 -0.49 -0.25 0.00 -1.36 0.00 0.00 55.97 54.04 3lal s LYS 287 Cb -0.25 -2.83 -0.08 0.00 -1.68 0.00 0.00 37.83 32.98 3lal s LYS 287 CO -0.01 0.37 1.17 0.00 -0.76 0.00 0.00 175.35 176.13 3lal s ALA 288 N -1.98 3.12 0.32 5.17 0.00 -1.26 -4.94 121.76 122.19 3lal s ALA 288 Ca 0.37 0.96 0.04 0.00 0.00 0.00 0.00 51.96 53.33 3lal s ALA 288 Cb -0.10 -3.38 0.55 0.00 0.00 0.00 0.00 23.12 20.19 3lal s ALA 288 CO 0.30 -0.55 1.82 -0.07 0.00 0.00 0.00 175.76 177.26 3lal h LEU 289 N 2.51 0.45 -0.31 0.00 3.38 -1.97 -2.79 115.31 116.57 3lal h LEU 289 Ca -0.49 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.37 3lal h LEU 289 Cb 1.24 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.87 3lal h LEU 289 CO 0.62 0.61 0.00 0.35 0.09 0.00 0.00 178.44 180.11 3lal n THR 290 N -4.21 0.03 -2.60 0.22 -2.24 -1.26 -1.70 114.28 102.52 3lal n THR 290 Ca 0.00 -0.09 -0.40 0.00 -2.27 0.00 0.00 64.05 61.29 3lal n THR 290 Cb 0.32 -0.14 -0.05 0.00 -2.10 0.00 0.00 70.33 68.35 3lal n THR 290 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3lal s GLU 291 N -1.97 4.71 -0.32 -0.78 2.12 -1.06 -4.83 118.70 116.58 3lal s GLU 291 Ca 0.36 1.64 -0.21 0.00 0.36 0.00 0.00 54.97 57.13 3lal s GLU 291 Cb 0.18 -3.26 -0.01 0.00 0.26 0.00 0.00 34.13 31.30 3lal s GLU 291 CO 0.29 0.28 0.65 0.08 -0.54 0.00 0.00 175.26 176.01 3lal s VAL 292 N -0.81 4.91 -0.16 3.70 1.01 -1.26 -1.42 120.40 126.37 3lal s VAL 292 Ca 0.45 0.83 -0.00 0.00 0.00 0.00 0.00 61.98 63.26 3lal s VAL 292 Cb -0.28 -4.03 -0.00 0.00 0.00 0.00 0.00 36.38 32.06 3lal s VAL 292 CO 0.35 -0.19 -0.14 -0.51 0.00 0.00 0.00 175.10 174.62 3lal s ILE 293 N 2.66 2.73 0.65 2.22 2.07 -0.72 -5.01 121.20 125.81 3lal s ILE 293 Ca 0.26 -0.74 -0.17 0.00 -1.41 0.00 0.00 60.65 58.59 3lal s ILE 293 Cb -0.15 -2.17 -0.01 0.00 0.13 0.00 0.00 42.46 40.27 3lal s ILE 293 CO 0.12 0.51 1.22 -2.16 -1.91 0.00 0.00 174.94 172.72 3lal s PRO 294 N 0.92 2.61 -0.08 3.50 0.04 -1.26 -4.44 135.00 136.29 3lal s PRO 294 Ca -0.03 1.83 -0.19 0.00 0.04 0.00 0.00 61.00 62.65 3lal s PRO 294 Cb -0.15 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.46 3lal s PRO 294 CO -0.01 -1.49 0.53 -0.51 0.04 0.00 0.00 177.00 175.56 3lal s LEU 295 N -4.51 4.32 0.64 -3.56 1.43 -1.26 -5.06 118.68 110.68 3lal s LEU 295 Ca 0.77 0.95 -0.17 0.00 -1.03 0.00 0.00 54.13 54.65 3lal s LEU 295 Cb -0.31 -2.79 -0.01 0.00 0.03 0.00 0.00 46.19 43.11 3lal s LEU 295 CO 0.39 0.02 1.17 -0.89 0.23 0.00 0.00 176.35 177.27 3lal s THR 296 N 0.38 2.79 0.29 5.49 2.01 -1.26 -4.89 115.64 120.44 3lal s THR 296 Ca 0.29 0.43 0.03 0.00 0.31 0.00 0.00 61.69 62.75 3lal s THR 296 Cb -0.16 -3.05 0.28 0.00 0.01 0.00 0.00 72.50 69.58 3lal s THR 296 CO 0.13 -0.17 1.79 -0.33 -0.69 0.00 0.00 174.62 175.35 3lal h GLU 297 N 0.40 0.77 0.18 4.92 3.07 -1.99 -2.02 114.58 119.91 3lal h GLU 297 Ca -0.49 -0.05 -0.31 0.00 -0.50 0.00 0.00 59.36 58.02 3lal h GLU 297 Cb 1.28 -0.17 0.03 0.00 -0.84 0.00 0.00 28.75 29.04 3lal h GLU 297 CO 0.54 0.51 -1.35 0.93 -1.40 0.00 0.00 179.01 178.24 3lal h GLU 298 N 0.79 0.48 -0.87 2.33 4.39 -1.94 -2.96 114.58 116.81 3lal h GLU 298 Ca 0.54 -0.77 -0.01 0.00 0.34 0.00 0.00 59.36 59.45 3lal h GLU 298 Cb 0.75 0.28 -0.04 0.00 -0.10 0.00 0.00 28.75 29.64 3lal h GLU 298 CO -0.35 1.36 0.49 0.00 -1.16 0.00 0.00 179.01 179.34 3lal h ALA 299 N 0.32 1.11 0.00 3.43 0.00 -1.71 0.25 119.26 122.67 3lal h ALA 299 Ca -0.20 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.51 3lal h ALA 299 Cb 2.04 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 19.47 3lal h ALA 299 CO 0.25 0.60 -0.39 0.93 0.00 0.00 0.00 179.25 180.64 3lal h GLU 300 N 1.20 0.00 0.01 0.00 5.08 -1.41 0.32 114.58 119.79 3lal h GLU 300 Ca 0.31 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.57 3lal h GLU 300 Cb 0.01 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.27 3lal h GLU 300 CO -0.05 0.39 -0.37 1.25 -1.00 0.00 0.00 179.01 179.22 3lal h LEU 301 N 0.00 0.31 -0.16 1.33 5.85 -1.27 -2.47 115.31 118.90 3lal h LEU 301 Ca -0.00 -0.80 0.05 0.00 0.84 0.00 0.00 57.88 57.96 3lal h LEU 301 Cb 0.84 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.73 3lal h LEU 301 CO 0.05 1.07 -0.15 -0.08 -0.34 0.00 0.00 178.44 178.99 3lal h GLU 302 N -0.42 -0.17 -0.83 1.25 4.81 -0.70 0.19 114.58 118.72 3lal h GLU 302 Ca -0.05 0.01 0.10 0.00 -0.13 0.00 0.00 59.36 59.29 3lal h GLU 302 Cb 1.13 0.04 -0.07 0.00 0.63 0.00 0.00 28.75 30.48 3lal h GLU 302 CO 0.07 -0.11 0.47 1.25 -0.73 0.00 0.00 179.01 179.96 3lal h LEU 303 N -0.17 0.67 -0.25 1.64 5.85 -0.45 0.51 115.31 123.11 3lal h LEU 303 Ca 0.10 0.05 -0.09 0.00 0.84 0.00 0.00 57.88 58.78 3lal h LEU 303 Cb 0.33 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.28 3lal h LEU 303 CO -0.26 0.37 -0.20 0.00 -0.34 0.00 0.00 178.44 178.01 3lal h ALA 304 N 1.47 0.37 0.00 1.25 0.00 -0.87 -2.03 119.26 119.44 3lal h ALA 304 Ca 0.40 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 3lal h ALA 304 Cb 0.39 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3lal h ALA 304 CO -0.26 0.30 -0.25 0.93 0.00 0.00 0.00 179.25 179.98 3lal h GLU 305 N 0.30 0.00 -0.04 0.00 5.08 0.07 -2.17 114.58 117.83 3lal h GLU 305 Ca 0.05 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.22 3lal h GLU 305 Cb 0.74 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.00 3lal h GLU 305 CO 0.05 0.25 -0.71 -0.91 -1.00 0.00 0.00 179.01 176.69 3lal h ASN 306 N 0.00 0.69 -0.41 1.42 -0.26 -0.78 -3.16 115.58 113.09 3lal h ASN 306 Ca -0.00 -0.72 0.03 0.00 -0.56 0.00 0.00 56.30 55.05 3lal h ASN 306 Cb 0.53 -0.21 -0.02 0.00 -1.06 0.00 0.00 38.32 37.56 3lal h ASN 306 CO 0.03 1.31 0.27 0.03 -1.06 0.00 0.00 177.43 178.01 3lal h ARG 307 N 0.13 0.42 -0.31 0.81 3.08 -1.02 0.91 114.38 118.40 3lal h ARG 307 Ca -0.08 -0.02 0.05 0.00 0.07 0.00 0.00 59.98 59.99 3lal h ARG 307 Cb 1.38 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 31.30 3lal h ARG 307 CO 0.14 0.27 0.06 1.49 -1.07 0.00 0.00 179.97 180.86 3lal h GLU 308 N 0.43 0.16 -0.35 0.04 4.81 -1.42 -3.04 114.58 115.21 3lal h GLU 308 Ca 0.17 -0.01 -0.14 0.00 -0.13 0.00 0.00 59.36 59.25 3lal h GLU 308 Cb 0.13 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 3lal h GLU 308 CO -0.04 0.11 -0.34 0.82 -0.73 0.00 0.00 179.01 178.83 3lal h ILE 309 N 0.17 1.28 0.00 2.32 2.04 -0.81 -2.78 117.51 119.72 3lal h ILE 309 Ca 0.15 -1.50 -0.03 0.00 1.00 0.00 0.00 64.86 64.47 3lal h ILE 309 Cb 0.16 1.38 -0.00 0.00 -0.74 0.00 0.00 36.82 37.61 3lal h ILE 309 CO -0.20 0.49 -0.17 -0.07 0.00 0.00 0.00 178.15 178.21 3lal h LEU 310 N 0.65 0.00 -0.91 1.44 -0.00 -1.34 -2.91 115.31 112.24 3lal h LEU 310 Ca 0.07 0.00 -0.10 0.00 -0.00 0.00 0.00 57.88 57.85 3lal h LEU 310 Cb 0.88 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.53 3lal h LEU 310 CO 0.08 0.17 -0.23 0.50 -0.00 0.00 0.00 178.44 178.96 3lal h LYS 311 N 0.00 0.54 -7.18 1.13 3.64 -1.37 -3.42 116.57 109.91 3lal h LYS 311 Ca -0.00 -0.20 -0.45 0.00 -1.27 0.00 0.00 60.65 58.73 3lal h LYS 311 Cb 0.65 -0.03 0.08 0.00 -0.41 0.00 0.00 32.23 32.51 3lal h LYS 311 CO 0.02 0.73 0.15 -1.21 -2.27 0.00 0.00 179.45 176.88 3lal s GLU 312 N -4.55 2.12 0.77 1.90 0.41 -1.10 -4.91 118.70 113.34 3lal s GLU 312 Ca -0.07 -0.53 -0.11 0.00 -0.41 0.00 0.00 54.97 53.85 3lal s GLU 312 Cb 0.14 -2.26 0.05 0.00 -1.78 0.00 0.00 34.13 30.28 3lal s GLU 312 CO 0.80 -1.20 1.09 -1.25 -0.49 0.00 0.00 175.26 174.21 3lal s PRO 313 N -5.14 2.31 0.01 0.39 0.04 -1.26 -4.98 135.00 126.37 3lal s PRO 313 Ca 0.61 1.14 -0.30 0.00 0.04 0.00 0.00 61.00 62.48 3lal s PRO 313 Cb -0.09 -1.91 -0.05 0.00 0.04 0.00 0.00 34.50 32.49 3lal s PRO 313 CO 0.43 -1.59 1.24 0.08 0.04 0.00 0.00 177.00 177.20 3lal s VAL 314 N -2.92 4.04 -0.11 -0.36 1.01 -1.26 -4.98 120.40 115.82 3lal s VAL 314 Ca 0.61 1.43 -0.30 0.00 0.00 0.00 0.00 61.98 63.72 3lal s VAL 314 Cb -0.17 -3.92 -0.02 0.00 0.00 0.00 0.00 36.38 32.28 3lal s VAL 314 CO 0.56 0.05 1.12 -2.28 0.00 0.00 0.00 175.10 174.56 3lal s HIS 315 N 1.68 3.27 0.00 5.22 2.46 -1.26 -3.49 115.29 123.16 3lal s HIS 315 Ca 0.59 1.35 0.00 0.00 0.47 0.00 0.00 55.06 57.46 3lal s HIS 315 Cb -0.28 -3.34 0.00 0.00 -0.13 0.00 0.00 32.58 28.83 3lal s HIS 315 CO 0.26 -0.89 0.00 0.41 -2.47 0.00 0.00 174.74 172.05 3lal n GLY 316 N 3.30 0.35 3.70 1.59 0.00 -1.26 -4.72 105.19 108.15 3lal n GLY 316 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 3lal n GLY 316 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3lal s VAL 317 N -2.00 5.38 0.04 1.61 1.01 -1.23 -5.08 120.40 120.13 3lal s VAL 317 Ca 0.00 0.20 -0.00 0.00 0.00 0.00 0.00 61.98 62.18 3lal s VAL 317 Cb 0.00 -3.49 -0.03 0.00 0.00 0.00 0.00 36.38 32.86 3lal s VAL 317 CO 0.00 0.39 -0.03 -0.31 0.00 0.00 0.00 175.10 175.15 3lal s TYR 318 N 0.69 0.41 -0.18 5.22 1.51 -1.26 -4.94 117.35 118.80 3lal s TYR 318 Ca 0.08 -0.74 -0.29 0.00 -1.01 0.00 0.00 57.07 55.11 3lal s TYR 318 Cb -0.12 -0.29 -0.00 0.00 -0.11 0.00 0.00 41.96 41.43 3lal s TYR 318 CO 0.01 -0.25 1.11 -0.47 -1.11 0.00 0.00 175.55 174.84 3lal s TYR 319 N -2.45 3.22 -0.40 2.71 5.04 -1.26 -5.00 117.35 119.20 3lal s TYR 319 Ca -0.06 1.34 -0.15 0.00 -2.44 0.00 0.00 57.07 55.76 3lal s TYR 319 Cb -0.03 -3.34 0.02 0.00 0.35 0.00 0.00 41.96 38.96 3lal s TYR 319 CO -0.04 -0.86 0.29 0.34 -1.34 0.00 0.00 175.55 173.94 3lal s ASP 320 N 1.42 6.09 0.40 4.32 -1.08 -1.26 -4.96 116.67 121.60 3lal s ASP 320 Ca 0.49 -0.88 0.28 0.00 -0.52 0.00 0.00 52.55 51.92 3lal s ASP 320 Cb -0.18 -2.15 1.36 0.00 -1.46 0.00 0.00 42.92 40.49 3lal s ASP 320 CO 0.12 -0.44 1.85 1.55 0.52 0.00 0.00 175.17 178.77 3lal h PRO 321 N 8.61 0.00 0.00 4.34 0.13 -2.00 -1.95 132.00 141.13 3lal h PRO 321 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 3lal h PRO 321 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 3lal h PRO 321 CO 0.72 0.00 -0.40 -1.13 -0.23 0.00 0.00 178.00 176.97 3lal n SER 322 N -2.52 0.44 -4.94 1.44 3.41 -1.26 -4.90 113.62 105.30 3lal n SER 322 Ca -0.00 0.02 -0.26 0.00 -0.26 0.00 0.00 58.87 58.38 3lal n SER 322 Cb 0.14 0.03 -0.03 0.00 -0.26 0.00 0.00 64.21 64.09 3lal n SER 322 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 3lal s LYS 323 N -3.04 3.40 0.47 4.33 2.47 -0.74 -5.09 119.74 121.54 3lal s LYS 323 Ca 0.11 -0.64 -0.21 0.00 -1.56 0.00 0.00 55.97 53.67 3lal s LYS 323 Cb 0.17 -2.93 -0.09 0.00 -1.46 0.00 0.00 37.83 33.52 3lal s LYS 323 CO 0.66 0.51 1.04 -0.51 0.16 0.00 0.00 175.35 177.21 3lal s ASP 324 N -3.30 6.43 0.10 1.43 1.01 -1.26 -4.94 116.67 116.13 3lal s ASP 324 Ca 0.34 1.95 -0.16 0.00 0.71 0.00 0.00 52.55 55.40 3lal s ASP 324 Cb -0.11 -2.57 -0.07 0.00 1.01 0.00 0.00 42.92 41.19 3lal s ASP 324 CO 0.28 -0.72 0.53 -0.76 0.21 0.00 0.00 175.17 174.72 3lal s LEU 325 N -3.30 4.42 0.10 1.23 1.43 -1.26 -4.50 118.68 116.80 3lal s LEU 325 Ca 0.65 1.11 0.10 0.00 -1.03 0.00 0.00 54.13 54.96 3lal s LEU 325 Cb -0.18 -3.04 -0.04 0.00 0.03 0.00 0.00 46.19 42.96 3lal s LEU 325 CO 0.21 0.19 -0.25 -0.63 0.23 0.00 0.00 176.35 176.10 3lal s ILE 326 N -1.30 2.10 -0.04 -0.59 -1.09 0.49 -0.85 121.20 119.92 3lal s ILE 326 Ca 0.33 -1.62 0.00 0.00 -2.23 0.00 0.00 60.65 57.13 3lal s ILE 326 Cb -0.17 -1.85 0.02 0.00 -1.58 0.00 0.00 42.46 38.89 3lal s ILE 326 CO 0.18 0.12 -0.02 0.00 -1.23 0.00 0.00 174.94 173.99 3lal s ALA 327 N -1.02 0.52 -0.08 9.38 0.00 -0.39 -1.74 121.76 128.42 3lal s ALA 327 Ca 0.12 0.03 -0.01 0.00 0.00 0.00 0.00 51.96 52.09 3lal s ALA 327 Cb -0.10 -0.43 -0.03 0.00 0.00 0.00 0.00 23.12 22.56 3lal s ALA 327 CO 0.05 -0.11 -0.01 -1.21 0.00 0.00 0.00 175.76 174.48 3lal s GLU 328 N 1.13 2.97 -0.09 0.00 2.02 -0.46 -0.25 118.70 124.02 3lal s GLU 328 Ca -0.08 -0.43 0.03 0.00 0.02 0.00 0.00 54.97 54.51 3lal s GLU 328 Cb -0.14 -2.77 0.00 0.00 0.10 0.00 0.00 34.13 31.33 3lal s GLU 328 CO -0.01 0.69 -0.20 0.42 0.02 0.00 0.00 175.26 176.18 3lal s ILE 329 N -0.84 1.71 -0.08 -1.63 1.01 -1.22 -1.54 121.20 118.60 3lal s ILE 329 Ca 0.13 -0.82 -0.00 0.00 0.00 0.00 0.00 60.65 59.96 3lal s ILE 329 Cb -0.11 -1.50 -0.03 0.00 0.01 0.00 0.00 42.46 40.83 3lal s ILE 329 CO 0.02 0.48 -0.06 -1.10 0.00 0.00 0.00 174.94 174.29 3lal s GLN 330 N 0.46 2.88 -0.27 2.79 1.11 0.56 -4.45 119.66 122.74 3lal s GLN 330 Ca -0.17 -0.53 -0.27 0.00 0.01 0.00 0.00 55.36 54.40 3lal s GLN 330 Cb -0.17 -2.65 0.01 0.00 -1.01 0.00 0.00 33.01 29.18 3lal s GLN 330 CO 0.07 0.62 0.97 0.21 0.01 0.00 0.00 175.29 177.17 3lal s LYS 331 N -0.69 4.15 0.00 2.91 2.20 -1.26 -1.43 119.74 125.62 3lal s LYS 331 Ca 0.11 1.09 0.23 0.00 -0.36 0.00 0.00 55.97 57.04 3lal s LYS 331 Cb -0.11 -3.68 0.19 0.00 -1.51 0.00 0.00 37.83 32.72 3lal s LYS 331 CO 0.02 -0.68 1.20 1.04 -0.36 0.00 0.00 175.35 176.56 3lal n GLN 332 N 6.38 0.35 0.00 4.03 1.13 -0.20 -4.98 117.38 124.10 3lal n GLN 332 Ca 0.09 -0.26 0.00 0.00 -1.94 0.00 0.00 57.00 54.90 3lal n GLN 332 Cb 0.47 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.32 3lal n GLN 332 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3lal n GLY 333 N 1.46 -1.35 3.30 1.08 0.00 -1.22 -4.85 105.19 103.60 3lal n GLY 333 Ca 0.07 -1.59 -0.23 0.00 0.00 0.00 0.00 46.02 44.27 3lal n GLY 333 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3lal n GLN 334 N -1.45 -3.66 -1.12 1.61 6.02 -1.26 -1.41 117.38 116.10 3lal n GLN 334 Ca 0.00 0.55 -0.04 0.00 -0.01 0.00 0.00 57.00 57.50 3lal n GLN 334 Cb 0.00 -5.29 -0.02 0.00 1.02 0.00 0.00 30.24 25.96 3lal n GLN 334 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3lal n GLY 335 N -1.23 0.64 3.71 1.08 0.00 -1.26 -4.81 105.19 103.32 3lal n GLY 335 Ca -0.03 -0.28 -0.33 0.00 0.00 0.00 0.00 46.02 45.37 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 -1.72 2.93 -0.03 1.61 -0.21 -0.50 -0.44 119.66 121.29 3lal s GLN 336 Ca 0.00 -0.51 -0.00 0.00 0.02 0.00 0.00 55.36 54.86 3lal s GLN 336 Cb 0.00 -2.77 0.03 0.00 1.00 0.00 0.00 33.01 31.28 3lal s GLN 336 CO 0.00 0.66 0.05 -1.58 -2.12 0.00 0.00 175.29 172.29 3lal s TRP 337 N -1.06 0.01 0.11 0.91 0.52 0.53 -1.03 118.94 118.92 3lal s TRP 337 Ca 0.19 0.18 0.02 0.00 0.02 0.00 0.00 56.10 56.51 3lal s TRP 337 Cb -0.12 -0.22 -0.04 0.00 -1.15 0.00 0.00 33.47 31.94 3lal s TRP 337 CO 0.09 -0.10 0.18 0.95 0.02 0.00 0.00 176.95 178.08 3lal s THR 338 N 1.11 4.96 0.02 2.01 -4.23 -0.51 -0.66 115.64 118.33 3lal s THR 338 Ca -0.09 -0.70 -0.10 0.00 -1.18 0.00 0.00 61.69 59.63 3lal s THR 338 Cb -0.13 -3.46 0.01 0.00 1.34 0.00 0.00 72.50 70.25 3lal s THR 338 CO -0.03 0.03 0.19 -0.72 -0.54 0.00 0.00 174.62 173.55 3lal s TYR 339 N -1.58 0.02 0.03 3.99 -0.85 -0.65 -0.32 117.35 118.00 3lal s TYR 339 Ca 0.32 -0.15 0.04 0.00 -0.52 0.00 0.00 57.07 56.76 3lal s TYR 339 Cb -0.12 -0.02 -0.02 0.00 0.38 0.00 0.00 41.96 42.19 3lal s TYR 339 CO 0.26 -0.38 -0.11 -0.65 -1.52 0.00 0.00 175.55 173.15 3lal s GLN 340 N -2.02 0.72 -0.09 -3.49 1.11 -0.59 -0.43 119.66 114.87 3lal s GLN 340 Ca -0.09 -0.66 0.04 0.00 0.01 0.00 0.00 55.36 54.66 3lal s GLN 340 Cb -0.04 -0.66 -0.01 0.00 -1.01 0.00 0.00 33.01 31.30 3lal s GLN 340 CO -0.01 0.16 -0.22 0.42 0.01 0.00 0.00 175.29 175.65 3lal s ILE 341 N -0.88 2.27 0.20 1.08 1.01 0.12 -1.35 121.20 123.66 3lal s ILE 341 Ca -0.02 -0.96 -0.15 0.00 0.00 0.00 0.00 60.65 59.53 3lal s ILE 341 Cb -0.07 -1.88 0.02 0.00 0.01 0.00 0.00 42.46 40.54 3lal s ILE 341 CO 0.01 0.56 0.47 -0.72 0.00 0.00 0.00 174.94 175.26 3lal s TYR 342 N 0.19 0.06 -0.18 3.97 1.13 -0.71 0.20 117.35 122.00 3lal s TYR 342 Ca -0.13 -0.41 0.01 0.00 -1.41 0.00 0.00 57.07 55.13 3lal s TYR 342 Cb -0.16 0.28 -0.11 0.00 -1.10 0.00 0.00 41.96 40.86 3lal s TYR 342 CO 0.07 -0.90 -0.16 1.04 -2.51 0.00 0.00 175.55 173.09 3lal n GLN 343 N -0.32 0.44 -4.67 -3.49 6.02 -1.26 -0.38 117.38 113.72 3lal n GLN 343 Ca -0.08 0.11 -0.33 0.00 -0.01 0.00 0.00 57.00 56.68 3lal n GLN 343 Cb 0.62 -1.35 -0.13 0.00 1.02 0.00 0.00 30.24 30.41 3lal n GLN 343 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 3lal s GLU 344 N -2.36 3.05 -0.17 -1.09 2.02 -1.26 -4.84 118.70 114.05 3lal s GLU 344 Ca -0.24 -0.60 -0.39 0.00 0.02 0.00 0.00 54.97 53.75 3lal s GLU 344 Cb 0.06 -2.63 -0.16 0.00 0.10 0.00 0.00 34.13 31.51 3lal s GLU 344 CO 0.41 0.46 1.61 -2.30 0.02 0.00 0.00 175.26 175.45 3lal n PRO 345 N 2.83 1.11 0.00 0.39 -0.02 -1.26 -1.37 135.00 136.68 3lal n PRO 345 Ca -0.18 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 3lal n PRO 345 Cb 0.53 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 3lal n PRO 345 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3lal n PHE 346 N 4.43 0.00 -2.84 6.00 3.01 -1.26 -4.95 117.46 121.86 3lal n PHE 346 Ca 0.24 0.00 -0.44 0.00 1.01 0.00 0.00 57.45 58.26 3lal n PHE 346 Cb 0.14 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.61 3lal n PHE 346 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 3lal n LYS 347 N -2.00 3.36 -2.18 -1.08 5.02 -0.47 -4.63 118.16 116.17 3lal n LYS 347 Ca 0.00 -3.73 -0.42 0.00 -2.02 0.00 0.00 58.31 52.14 3lal n LYS 347 Cb 0.00 -3.10 -0.03 0.00 -0.02 0.00 0.00 35.03 31.88 3lal n LYS 347 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 3lal s ASN 348 N 2.86 6.83 -0.01 4.39 0.02 -1.26 -4.33 114.94 123.43 3lal s ASN 348 Ca 0.44 2.22 0.10 0.00 -1.02 0.00 0.00 52.86 54.60 3lal s ASN 348 Cb -0.01 -2.57 -0.23 0.00 0.02 0.00 0.00 41.25 38.46 3lal s ASN 348 CO 0.01 -0.70 0.77 -0.07 0.02 0.00 0.00 177.10 177.13 3lal h LEU 349 N 7.75 0.03 -7.14 0.60 3.38 -0.63 -3.43 115.31 115.87 3lal h LEU 349 Ca -0.40 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 57.44 3lal h LEU 349 Cb 1.19 -0.01 -0.20 0.00 0.09 0.00 0.00 40.66 41.73 3lal h LEU 349 CO 0.89 1.05 0.03 -0.75 0.09 0.00 0.00 178.44 179.75 3lal s LYS 350 N -2.62 0.86 0.07 1.13 2.20 -1.10 -5.00 119.74 115.29 3lal s LYS 350 Ca -0.04 0.40 0.03 0.00 -0.36 0.00 0.00 55.97 55.99 3lal s LYS 350 Cb 0.08 0.40 -0.03 0.00 -1.51 0.00 0.00 37.83 36.77 3lal s LYS 350 CO 0.82 -0.21 -0.09 0.95 -0.36 0.00 0.00 175.35 176.47 3lal s THR 351 N -0.64 0.74 0.21 3.43 -4.23 -1.26 0.16 115.64 114.04 3lal s THR 351 Ca -0.07 -1.47 -0.12 0.00 -1.18 0.00 0.00 61.69 58.85 3lal s THR 351 Cb -0.03 -1.13 0.04 0.00 1.34 0.00 0.00 72.50 72.73 3lal s THR 351 CO 0.05 -0.54 0.60 0.61 -0.54 0.00 0.00 174.62 174.80 3lal n GLY 352 N 0.81 1.11 2.93 3.99 0.00 0.43 -2.38 105.19 112.08 3lal n GLY 352 Ca -0.18 -1.14 -0.13 0.00 0.00 0.00 0.00 46.02 44.58 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 -2.05 0.23 -0.01 1.61 2.20 -1.26 -1.63 119.74 118.83 3lal s LYS 353 Ca 0.13 -0.23 0.03 0.00 -0.36 0.00 0.00 55.97 55.54 3lal s LYS 353 Cb -0.03 -0.14 -0.01 0.00 -1.51 0.00 0.00 37.83 36.15 3lal s LYS 353 CO 0.06 0.03 -0.09 -0.47 -0.36 0.00 0.00 175.35 174.52 3lal s TYR 354 N -0.40 0.84 0.02 4.03 6.14 0.16 -5.00 117.35 123.14 3lal s TYR 354 Ca -0.03 -0.16 -0.04 0.00 0.64 0.00 0.00 57.07 57.49 3lal s TYR 354 Cb -0.03 -0.54 -0.01 0.00 0.42 0.00 0.00 41.96 41.80 3lal s TYR 354 CO -0.00 -0.01 0.05 0.00 0.64 0.00 0.00 175.55 176.23 3lal s ALA 355 N -0.22 -0.07 0.52 3.97 0.00 -1.26 -0.35 121.76 124.35 3lal s ALA 355 Ca 0.04 -0.42 0.00 0.00 0.00 0.00 0.00 51.96 51.58 3lal s ALA 355 Cb -0.04 0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.24 3lal s ALA 355 CO -0.00 -0.21 0.00 -2.13 0.00 0.00 0.00 175.76 173.42 3lal n ARG 356 N 1.38 -4.75 -0.15 0.00 3.00 0.41 -5.01 116.66 111.55 3lal n ARG 356 Ca -0.23 3.52 0.00 0.00 -0.00 0.00 0.00 57.85 61.15 3lal n ARG 356 Cb 0.56 -3.99 0.00 0.00 0.00 0.00 0.00 32.46 29.03 3lal n ARG 356 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.63 175.24 3lal n HIS 361 N -0.69 0.00 -1.44 -0.14 -0.00 -1.26 -4.99 115.22 106.69 3lal n HIS 361 Ca 0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 57.72 57.44 3lal n HIS 361 Cb 0.00 -0.92 0.10 0.00 -0.00 0.00 0.00 29.99 29.17 3lal n HIS 361 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 3lal n THR 362 N 1.36 3.27 -3.82 0.61 -2.24 -1.26 -5.02 114.28 107.17 3lal n THR 362 Ca 0.00 -2.96 -0.36 0.00 -2.27 0.00 0.00 64.05 58.46 3lal n THR 362 Cb 0.00 -0.96 -0.13 0.00 -2.10 0.00 0.00 70.33 67.14 3lal n THR 362 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3lal s ASN 363 N -2.11 5.12 0.22 3.42 3.84 -1.26 -4.99 114.94 119.18 3lal s ASN 363 Ca 0.59 -1.27 -0.09 0.00 0.21 0.00 0.00 52.86 52.30 3lal s ASN 363 Cb 0.48 -1.79 0.19 0.00 -0.55 0.00 0.00 41.25 39.57 3lal s ASN 363 CO 0.02 -0.31 1.89 0.44 -2.79 0.00 0.00 177.10 176.35 3lal h ASP 364 N 8.11 0.98 0.63 -4.21 3.45 -2.00 -2.58 116.42 120.80 3lal h ASP 364 Ca -0.21 -0.03 -0.17 0.00 0.43 0.00 0.00 57.03 57.04 3lal h ASP 364 Cb 1.07 -0.24 -0.02 0.00 -0.56 0.00 0.00 39.33 39.58 3lal h ASP 364 CO 0.58 0.72 -0.77 0.58 -1.57 0.00 0.00 179.24 178.78 3lal h VAL 365 N 1.14 1.50 -0.12 -1.35 2.07 -1.99 -1.40 116.25 116.11 3lal h VAL 365 Ca 0.31 -2.49 -0.01 0.00 0.82 0.00 0.00 66.70 65.32 3lal h VAL 365 Cb -0.11 2.35 -0.00 0.00 -1.52 0.00 0.00 31.29 32.00 3lal h VAL 365 CO -0.06 0.72 0.02 0.50 0.02 0.00 0.00 177.57 178.76 3lal h LYS 366 N 0.06 0.20 -0.34 1.57 3.64 -1.91 -1.59 116.57 118.20 3lal h LYS 366 Ca -0.02 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 3lal h LYS 366 Cb 1.35 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.13 3lal h LYS 366 CO 0.11 0.40 0.17 1.96 -2.27 0.00 0.00 179.45 179.82 3lal h GLN 367 N -0.03 0.49 -0.43 1.90 4.20 -1.42 -1.61 115.11 118.20 3lal h GLN 367 Ca 0.04 -0.07 0.03 0.00 0.06 0.00 0.00 58.65 58.70 3lal h GLN 367 Cb 0.30 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.96 3lal h GLN 367 CO 0.00 0.44 0.23 1.25 -0.67 0.00 0.00 178.83 180.08 3lal h LEU 368 N 0.42 0.36 -0.82 1.46 6.46 -1.21 0.07 115.31 122.04 3lal h LEU 368 Ca 0.12 0.01 0.10 0.00 -0.12 0.00 0.00 57.88 57.99 3lal h LEU 368 Cb 0.10 -0.06 -0.07 0.00 -0.73 0.00 0.00 40.66 39.90 3lal h LEU 368 CO -0.02 0.26 0.47 0.74 -0.62 0.00 0.00 178.44 179.27 3lal h THR 369 N 0.47 0.90 -0.60 1.05 2.02 -1.06 -0.97 112.91 114.72 3lal h THR 369 Ca 0.18 -0.27 -0.04 0.00 0.77 0.00 0.00 66.41 67.05 3lal h THR 369 Cb 0.05 0.05 -0.03 0.00 -1.74 0.00 0.00 68.15 66.49 3lal h THR 369 CO -0.10 0.14 0.20 -0.33 0.37 0.00 0.00 175.52 175.80 3lal h GLU 370 N 0.78 0.92 -0.43 6.66 5.08 -0.22 -2.60 114.58 124.77 3lal h GLU 370 Ca 0.40 -0.19 -0.11 0.00 -1.00 0.00 0.00 59.36 58.45 3lal h GLU 370 Cb 0.38 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 3lal h GLU 370 CO -0.25 0.81 -0.19 0.00 -1.00 0.00 0.00 179.01 178.38 3lal h ALA 371 N 1.06 0.86 -0.33 3.43 0.00 -0.29 -0.60 119.26 123.39 3lal h ALA 371 Ca 0.19 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 3lal h ALA 371 Cb 0.27 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3lal h ALA 371 CO -0.01 0.64 0.06 0.28 0.00 0.00 0.00 179.25 180.22 3lal h VAL 372 N 0.73 1.23 -0.44 0.00 2.07 -1.14 0.16 116.25 118.86 3lal h VAL 372 Ca 0.11 -0.80 -0.05 0.00 0.82 0.00 0.00 66.70 66.77 3lal h VAL 372 Cb 0.71 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 31.58 3lal h VAL 372 CO 0.05 0.27 0.07 1.56 0.02 0.00 0.00 177.57 179.54 3lal h GLN 373 N 0.38 0.73 0.05 1.57 4.20 -1.29 0.17 115.11 120.92 3lal h GLN 373 Ca 0.10 -0.20 0.01 0.00 0.06 0.00 0.00 58.65 58.62 3lal h GLN 373 Cb 0.34 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 3lal h GLN 373 CO 0.01 0.76 -0.07 -0.22 -0.67 0.00 0.00 178.83 178.64 3lal h LYS 374 N 0.59 -0.14 -0.41 1.46 3.64 -1.05 -0.49 116.57 120.17 3lal h LYS 374 Ca 0.13 0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.54 3lal h LYS 374 Cb 0.39 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.21 3lal h LYS 374 CO 0.01 -0.09 0.23 0.82 -2.27 0.00 0.00 179.45 178.15 3lal h ILE 375 N -0.14 1.03 -0.55 2.00 2.04 -0.76 -1.40 117.51 119.72 3lal h ILE 375 Ca 0.01 -0.16 0.06 0.00 1.00 0.00 0.00 64.86 65.77 3lal h ILE 375 Cb 0.15 0.51 -0.05 0.00 -0.74 0.00 0.00 36.82 36.69 3lal h ILE 375 CO -0.03 0.09 0.25 0.74 0.00 0.00 0.00 178.15 179.19 3lal h THR 376 N 0.48 0.89 -0.25 -0.27 2.02 -0.49 0.13 112.91 115.42 3lal h THR 376 Ca 0.17 -0.16 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 3lal h THR 376 Cb 0.02 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 66.80 3lal h THR 376 CO -0.08 0.09 0.15 0.74 0.37 0.00 0.00 175.52 176.79 3lal h THR 377 N 0.47 1.08 -0.81 3.16 2.02 -0.53 0.14 112.91 118.45 3lal h THR 377 Ca 0.26 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 67.23 3lal h THR 377 Cb 0.22 0.77 -0.04 0.00 -1.74 0.00 0.00 68.15 67.36 3lal h THR 377 CO -0.21 0.08 0.45 -0.33 0.37 0.00 0.00 175.52 175.89 3lal h GLU 378 N 0.32 1.12 -0.35 6.66 5.08 -0.97 -1.74 114.58 124.70 3lal h GLU 378 Ca 0.09 -0.12 0.01 0.00 -1.00 0.00 0.00 59.36 58.34 3lal h GLU 378 Cb -0.00 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.00 3lal h GLU 378 CO -0.02 0.82 0.21 1.03 -1.00 0.00 0.00 179.01 180.05 3lal h SER 379 N 1.12 0.34 -0.95 1.42 0.87 -0.22 -0.70 113.55 115.44 3lal h SER 379 Ca 0.29 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.86 3lal h SER 379 Cb 0.01 -0.07 -0.05 0.00 -0.44 0.00 0.00 62.40 61.86 3lal h SER 379 CO -0.05 0.25 0.63 0.40 -0.53 0.00 0.00 176.83 177.53 3lal h ILE 380 N 0.43 1.24 -0.23 2.23 2.04 -0.29 0.96 117.51 123.88 3lal h ILE 380 Ca 0.14 -0.44 -0.06 0.00 1.00 0.00 0.00 64.86 65.50 3lal h ILE 380 Cb -0.00 -0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 35.92 3lal h ILE 380 CO -0.06 0.23 -0.08 0.58 0.00 0.00 0.00 178.15 178.82 3lal h VAL 381 N 1.28 1.29 0.04 1.67 2.07 -0.81 -0.46 116.25 121.33 3lal h VAL 381 Ca 0.35 -1.11 -0.00 0.00 0.82 0.00 0.00 66.70 66.76 3lal h VAL 381 Cb -0.13 1.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 3lal h VAL 381 CO -0.08 0.34 -0.02 0.40 0.02 0.00 0.00 177.57 178.23 3lal h ILE 382 N 0.19 1.36 0.00 4.57 2.04 -0.91 -3.39 117.51 121.38 3lal h ILE 382 Ca 0.06 -1.55 0.00 0.00 1.00 0.00 0.00 64.86 64.36 3lal h ILE 382 Cb 0.56 2.36 0.00 0.00 -0.74 0.00 0.00 36.82 38.99 3lal h ILE 382 CO 0.03 0.38 -0.59 0.79 0.00 0.00 0.00 178.15 178.75 3lal n TRP 383 N -4.79 0.00 -1.47 1.37 8.01 0.31 -4.94 117.44 115.94 3lal n TRP 383 Ca -0.09 0.00 -0.10 0.00 -1.31 0.00 0.00 57.50 56.00 3lal n TRP 383 Cb 0.33 -0.03 -0.04 0.00 -2.01 0.00 0.00 31.31 29.56 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 1.32 0.92 2.99 6.99 0.00 -0.18 -4.98 105.19 112.25 3lal n GLY 384 Ca 0.01 -0.55 -0.11 0.00 0.00 0.00 0.00 46.02 45.37 3lal n GLY 384 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3lal s LYS 385 N -3.18 0.34 -0.08 1.61 2.20 -1.25 -4.96 119.74 114.43 3lal s LYS 385 Ca 0.00 -0.54 -0.13 0.00 -0.36 0.00 0.00 55.97 54.94 3lal s LYS 385 Cb 0.00 -0.07 -0.05 0.00 -1.51 0.00 0.00 37.83 36.20 3lal s LYS 385 CO 0.00 -0.00 0.32 0.99 -0.36 0.00 0.00 175.35 176.30 3lal s THR 386 N -1.14 5.22 0.61 3.43 2.01 -1.26 -3.25 115.64 121.27 3lal s THR 386 Ca -0.11 0.63 -0.13 0.00 0.31 0.00 0.00 61.69 62.40 3lal s THR 386 Cb -0.08 -3.63 -0.03 0.00 0.01 0.00 0.00 72.50 68.76 3lal s THR 386 CO -0.00 0.52 1.03 -2.16 -0.69 0.00 0.00 174.62 173.32 3lal s PRO 387 N -0.53 3.45 -0.15 4.92 0.04 -1.26 -4.60 135.00 136.88 3lal s PRO 387 Ca 0.20 0.91 -0.18 0.00 0.04 0.00 0.00 61.00 61.97 3lal s PRO 387 Cb -0.15 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 32.30 3lal s PRO 387 CO 0.08 -0.68 0.49 0.21 0.04 0.00 0.00 177.00 177.14 3lal s LYS 388 N -4.75 4.28 -0.02 4.56 2.20 -0.03 -4.01 119.74 121.97 3lal s LYS 388 Ca 0.58 0.43 -0.16 0.00 -0.36 0.00 0.00 55.97 56.46 3lal s LYS 388 Cb -0.12 -3.48 -0.05 0.00 -1.51 0.00 0.00 37.83 32.66 3lal s LYS 388 CO 0.47 0.04 0.44 -0.06 -0.36 0.00 0.00 175.35 175.88 3lal s PHE 389 N 1.01 3.69 -0.51 4.03 0.40 0.76 -1.27 117.98 126.09 3lal s PHE 389 Ca 0.25 1.00 -0.19 0.00 -0.60 0.00 0.00 56.93 57.40 3lal s PHE 389 Cb -0.15 -2.38 0.06 0.00 0.51 0.00 0.00 43.02 41.06 3lal s PHE 389 CO 0.10 0.52 0.60 0.15 0.70 0.00 0.00 175.22 177.28 3lal s LYS 390 N -0.66 3.10 -0.25 0.44 1.02 0.65 -0.55 119.74 123.50 3lal s LYS 390 Ca 0.25 -0.98 -0.10 0.00 0.02 0.00 0.00 55.97 55.16 3lal s LYS 390 Cb -0.17 -4.11 -0.05 0.00 -0.52 0.00 0.00 37.83 32.99 3lal s LYS 390 CO 0.13 -1.21 0.14 -0.51 -0.92 0.00 0.00 175.35 172.98 3lal s LEU 391 N 2.49 3.94 -1.31 3.17 1.43 -0.42 -3.44 118.68 124.55 3lal s LEU 391 Ca 0.13 0.02 -0.09 0.00 -1.03 0.00 0.00 54.13 53.16 3lal s LEU 391 Cb -0.20 -2.06 -0.07 0.00 0.03 0.00 0.00 46.19 43.89 3lal s LEU 391 CO 0.11 0.03 2.54 -0.81 0.23 0.00 0.00 176.35 178.45 3lal n PRO 392 N 4.53 2.94 -3.51 1.29 -0.04 -1.25 -0.50 135.00 138.45 3lal n PRO 392 Ca -0.15 -1.94 -0.17 0.00 -0.04 0.00 0.00 63.50 61.20 3lal n PRO 392 Cb 0.52 -2.71 -0.06 0.00 -0.04 0.00 0.00 33.50 31.21 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 2.84 0.00 0.19 0.52 2.07 -1.25 -4.99 121.20 120.58 3lal s ILE 393 Ca 0.56 0.00 -0.31 0.00 -1.41 0.00 0.00 60.65 59.49 3lal s ILE 393 Cb 0.15 -1.00 -0.10 0.00 0.13 0.00 0.00 42.46 41.64 3lal s ILE 393 CO -0.04 0.00 1.49 -1.58 -1.91 0.00 0.00 174.94 172.90 3lal s GLN 394 N -1.37 4.25 0.24 3.50 0.74 -1.26 -4.44 119.66 121.31 3lal s GLN 394 Ca -0.10 2.29 -0.10 0.00 0.05 0.00 0.00 55.36 57.51 3lal s GLN 394 Cb -0.00 -3.15 0.36 0.00 1.10 0.00 0.00 33.01 31.32 3lal s GLN 394 CO 0.08 -0.51 1.62 -0.22 -0.55 0.00 0.00 175.29 175.71 3lal h LYS 395 N 6.16 0.04 -0.31 1.67 3.64 -1.96 -2.36 116.57 123.46 3lal h LYS 395 Ca -0.44 -0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 58.85 3lal h LYS 395 Cb 1.21 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.01 3lal h LYS 395 CO 0.86 0.02 -0.18 0.93 -2.27 0.00 0.00 179.45 178.81 3lal h GLU 396 N 0.04 0.66 0.27 1.90 3.07 -1.98 0.29 114.58 118.83 3lal h GLU 396 Ca 0.38 -0.31 0.00 0.00 -0.50 0.00 0.00 59.36 58.94 3lal h GLU 396 Cb 0.62 -0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 28.49 3lal h GLU 396 CO -0.72 0.90 -0.49 1.15 -1.40 0.00 0.00 179.01 178.45 3lal h THR 397 N 0.42 0.06 -0.84 1.13 2.02 -1.84 0.14 112.91 114.00 3lal h THR 397 Ca 0.06 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.34 3lal h THR 397 Cb 0.72 0.06 -0.07 0.00 -1.74 0.00 0.00 68.15 67.11 3lal h THR 397 CO 0.05 0.00 0.48 -0.25 0.37 0.00 0.00 175.52 176.17 3lal h TRP 398 N -0.82 0.87 -0.91 3.16 2.91 -1.32 -1.03 115.95 118.81 3lal h TRP 398 Ca -0.02 0.03 0.03 0.00 1.13 0.00 0.00 58.89 60.06 3lal h TRP 398 Cb 0.78 -0.26 -0.05 0.00 -0.51 0.00 0.00 29.16 29.11 3lal h TRP 398 CO -0.35 0.35 0.59 0.93 -1.03 0.00 0.00 178.44 178.93 3lal h GLU 399 N 0.80 1.14 -0.11 2.65 4.39 0.29 -1.58 114.58 122.16 3lal h GLU 399 Ca 0.41 -0.07 -0.19 0.00 0.34 0.00 0.00 59.36 59.85 3lal h GLU 399 Cb 0.39 -0.26 -0.00 0.00 -0.10 0.00 0.00 28.75 28.78 3lal h GLU 399 CO -0.26 0.76 -0.72 1.15 -1.16 0.00 0.00 179.01 178.78 3lal h THR 400 N 1.18 1.34 0.00 1.13 2.02 0.28 -3.40 112.91 115.47 3lal h THR 400 Ca 0.35 -2.05 0.00 0.00 0.77 0.00 0.00 66.41 65.48 3lal h THR 400 Cb -0.05 2.03 0.00 0.00 -1.74 0.00 0.00 68.15 68.39 3lal h THR 400 CO -0.10 0.63 -1.28 0.79 0.37 0.00 0.00 175.52 175.93 3lal n TRP 401 N -3.88 0.00 -0.09 3.16 7.02 -0.49 -4.61 117.44 118.55 3lal n TRP 401 Ca -0.05 0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.55 3lal n TRP 401 Cb 0.70 -0.20 0.50 0.00 -2.42 0.00 0.00 31.31 29.89 3lal n TRP 401 CO 0.00 0.00 0.00 0.11 -2.02 0.00 0.00 177.69 175.78 3lal h TRP 402 N 0.00 0.44 0.00 -5.99 5.08 -1.51 -1.17 115.95 112.80 3lal h TRP 402 Ca 0.00 0.01 -0.01 0.00 1.08 0.00 0.00 58.89 59.97 3lal h TRP 402 Cb 0.47 -0.14 -0.00 0.00 -3.00 0.00 0.00 29.16 26.49 3lal h TRP 402 CO 0.00 0.21 -0.04 1.15 -1.28 0.00 0.00 178.44 178.48 3lal h THR 403 N 0.41 0.14 0.00 0.12 2.02 -1.84 -2.67 112.91 111.09 3lal h THR 403 Ca 0.28 -0.41 0.00 0.00 0.77 0.00 0.00 66.41 67.06 3lal h THR 403 Cb 0.56 1.35 0.00 0.00 -1.74 0.00 0.00 68.15 68.32 3lal h THR 403 CO -0.08 0.03 0.00 -0.33 0.37 0.00 0.00 175.52 175.52 3lal h GLU 404 N 0.00 0.00 0.00 6.66 4.39 -1.53 -3.30 114.58 120.80 3lal h GLU 404 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3lal h GLU 404 Cb 0.35 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.00 3lal h GLU 404 CO 0.00 0.00 -0.03 0.66 -1.16 0.00 0.00 179.01 178.49 3lal n TYR 405 N -2.95 0.00 -2.07 4.33 4.01 -1.09 -4.94 117.16 114.45 3lal n TYR 405 Ca 0.00 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.33 3lal n TYR 405 Cb 0.26 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.26 3lal n TYR 405 CO 0.00 0.00 0.00 -0.46 -0.46 0.00 0.00 176.86 175.94 3lal s TRP 406 N -0.62 3.10 0.00 -0.72 -0.11 -1.03 -4.92 118.94 114.64 3lal s TRP 406 Ca 0.00 1.03 0.00 0.00 1.22 0.00 0.00 56.10 58.35 3lal s TRP 406 Cb 0.00 -3.77 0.00 0.00 -1.50 0.00 0.00 33.47 28.20 3lal s TRP 406 CO 0.00 -2.52 0.00 1.04 -4.62 0.00 0.00 176.95 170.85 3lal n GLN 407 N 2.67 4.30 -1.61 5.86 3.00 -1.26 -4.45 117.38 125.88 3lal n GLN 407 Ca 0.08 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.76 3lal n GLN 407 Cb 0.41 -0.61 0.07 0.00 0.00 0.00 0.00 30.24 30.10 3lal n GLN 407 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3lal s ALA 408 N -1.18 2.53 -1.02 -1.58 0.00 -1.26 -4.82 121.76 114.43 3lal s ALA 408 Ca 0.00 -0.10 0.22 0.00 0.00 0.00 0.00 51.96 52.08 3lal s ALA 408 Cb 0.00 -3.12 -0.11 0.00 0.00 0.00 0.00 23.12 19.89 3lal s ALA 408 CO 0.00 -1.42 0.99 0.25 0.00 0.00 0.00 175.76 175.58 3lal n THR 409 N -3.24 0.00 -3.57 0.00 -2.24 -1.26 -4.92 114.28 99.05 3lal n THR 409 Ca 0.07 -0.01 -0.22 0.00 -2.27 0.00 0.00 64.05 61.63 3lal n THR 409 Cb 0.55 0.89 -0.02 0.00 -2.10 0.00 0.00 70.33 69.65 3lal n THR 409 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 3lal s TRP 410 N -2.99 2.34 -0.05 4.78 1.48 -1.26 -4.66 118.94 118.59 3lal s TRP 410 Ca 0.09 -0.59 -0.01 0.00 -1.06 0.00 0.00 56.10 54.52 3lal s TRP 410 Cb 0.16 -2.12 0.03 0.00 -1.16 0.00 0.00 33.47 30.38 3lal s TRP 410 CO 0.84 -0.31 0.03 0.42 -4.06 0.00 0.00 176.95 173.87 3lal s ILE 411 N -2.56 0.08 0.81 0.66 1.01 -1.26 -5.06 121.20 114.87 3lal s ILE 411 Ca 0.46 0.28 -0.11 0.00 0.00 0.00 0.00 60.65 61.28 3lal s ILE 411 Cb -0.03 -0.28 0.08 0.00 0.01 0.00 0.00 42.46 42.24 3lal s ILE 411 CO 0.28 0.19 1.09 -2.16 0.00 0.00 0.00 174.94 174.34 3lal s PRO 412 N 1.87 1.99 0.35 2.79 0.04 -1.26 -4.88 135.00 135.90 3lal s PRO 412 Ca 0.02 1.04 -0.26 0.00 0.04 0.00 0.00 61.00 61.84 3lal s PRO 412 Cb -0.12 -1.88 -0.09 0.00 0.04 0.00 0.00 34.50 32.45 3lal s PRO 412 CO -0.03 -1.79 1.02 -1.21 0.04 0.00 0.00 177.00 175.03 3lal s GLU 413 N -4.93 4.41 0.05 4.56 2.02 -1.26 -4.96 118.70 118.60 3lal s GLU 413 Ca 0.62 1.50 -0.07 0.00 0.02 0.00 0.00 54.97 57.05 3lal s GLU 413 Cb -0.17 -2.77 -0.01 0.00 0.10 0.00 0.00 34.13 31.28 3lal s GLU 413 CO 0.56 0.09 0.12 1.67 0.02 0.00 0.00 175.26 177.72 3lal s TRP 414 N -1.54 0.18 0.32 1.61 -2.14 -1.26 -0.17 118.94 115.95 3lal s TRP 414 Ca 0.52 -0.50 0.04 0.00 2.66 0.00 0.00 56.10 58.83 3lal s TRP 414 Cb -0.23 -0.12 -0.02 0.00 -3.10 0.00 0.00 33.47 30.00 3lal s TRP 414 CO 0.29 -0.41 0.16 -0.85 -2.66 0.00 0.00 176.95 173.49 3lal n GLU 415 N 0.59 0.53 -4.86 3.25 0.28 0.29 -4.88 120.64 115.83 3lal n GLU 415 Ca -0.18 -2.88 -0.27 0.00 -0.16 0.00 0.00 57.16 53.67 3lal n GLU 415 Cb 0.59 1.83 -0.17 0.00 1.43 0.00 0.00 31.44 35.13 3lal n GLU 415 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 3lal s PHE 416 N -2.95 1.88 0.03 -1.84 0.08 -1.26 -1.30 117.98 112.62 3lal s PHE 416 Ca 0.23 -0.68 0.01 0.00 0.12 0.00 0.00 56.93 56.61 3lal s PHE 416 Cb 0.01 -1.30 -0.02 0.00 -0.57 0.00 0.00 43.02 41.14 3lal s PHE 416 CO 0.16 -0.29 -0.05 0.08 -0.10 0.00 0.00 175.22 175.02 3lal s VAL 417 N 0.38 0.32 -0.25 -0.44 1.01 0.35 -4.86 120.40 116.91 3lal s VAL 417 Ca -0.13 -0.84 -0.19 0.00 0.00 0.00 0.00 61.98 60.82 3lal s VAL 417 Cb -0.15 -0.40 -0.02 0.00 0.00 0.00 0.00 36.38 35.81 3lal s VAL 417 CO 0.05 -0.35 0.57 0.20 0.00 0.00 0.00 175.10 175.57 3lal s ASN 418 N -1.25 6.51 0.16 3.32 0.01 -1.26 -3.87 114.94 118.55 3lal s ASN 418 Ca -0.10 0.62 -0.31 0.00 -0.71 0.00 0.00 52.86 52.36 3lal s ASN 418 Cb -0.08 -2.31 -0.08 0.00 0.41 0.00 0.00 41.25 39.18 3lal s ASN 418 CO -0.00 -0.32 1.35 -0.89 -1.51 0.00 0.00 177.10 175.73 3lal s THR 419 N 2.36 3.24 0.09 1.60 2.01 -1.26 -4.96 115.64 118.72 3lal s THR 419 Ca 0.24 0.96 -0.31 0.00 0.31 0.00 0.00 61.69 62.89 3lal s THR 419 Cb -0.16 -3.61 -0.09 0.00 0.01 0.00 0.00 72.50 68.65 3lal s THR 419 CO 0.09 0.11 1.66 -2.84 -0.69 0.00 0.00 174.62 172.95 3lal s PRO 420 N 0.46 4.19 0.59 4.92 0.02 -1.26 -4.86 135.00 139.06 3lal s PRO 420 Ca 0.60 2.37 0.29 0.00 0.02 0.00 0.00 61.00 64.28 3lal s PRO 420 Cb -0.37 -3.52 1.64 0.00 0.02 0.00 0.00 34.50 32.27 3lal s PRO 420 CO 0.35 -0.73 2.08 -1.35 -0.33 0.00 0.00 177.00 177.02 3lal h PRO 421 N 8.09 0.00 0.62 5.54 0.11 -2.01 -2.57 132.00 141.78 3lal h PRO 421 Ca -0.43 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.65 3lal h PRO 421 Cb 1.20 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.32 3lal h PRO 421 CO 0.93 0.00 -0.30 -0.07 -0.21 0.00 0.00 178.00 178.35 3lal h LEU 422 N 0.00 -0.71 -0.84 2.35 4.07 -2.00 -3.12 115.31 115.05 3lal h LEU 422 Ca 0.10 0.02 0.21 0.00 0.08 0.00 0.00 57.88 58.30 3lal h LEU 422 Cb 0.57 0.18 -0.14 0.00 1.08 0.00 0.00 40.66 42.35 3lal h LEU 422 CO -0.00 -0.40 0.14 0.58 -1.08 0.00 0.00 178.44 177.68 3lal h VAL 423 N -1.05 0.30 -1.00 1.22 2.07 -1.86 0.22 116.25 116.16 3lal h VAL 423 Ca -0.09 -0.05 0.10 0.00 0.82 0.00 0.00 66.70 67.48 3lal h VAL 423 Cb 0.64 0.13 -0.08 0.00 -1.52 0.00 0.00 31.29 30.46 3lal h VAL 423 CO 0.14 0.03 0.64 0.50 0.02 0.00 0.00 177.57 178.90 3lal h LYS 424 N 0.16 1.02 0.00 1.57 3.64 -1.60 -1.98 116.57 119.38 3lal h LYS 424 Ca 0.51 -0.06 -0.10 0.00 -1.27 0.00 0.00 60.65 59.72 3lal h LYS 424 Cb 0.98 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.56 3lal h LYS 424 CO -0.68 0.68 -0.50 1.25 -2.27 0.00 0.00 179.45 177.93 3lal h LEU 425 N 1.05 0.00 0.00 5.20 5.85 -0.51 -3.16 115.31 123.74 3lal h LEU 425 Ca 0.48 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.20 3lal h LEU 425 Cb 0.38 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.41 3lal h LEU 425 CO -0.24 0.50 -0.31 -0.50 -0.34 0.00 0.00 178.44 177.55 3lal h TRP 426 N 0.00 0.00 -0.35 1.25 6.55 -0.70 -3.20 115.95 119.50 3lal h TRP 426 Ca -0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 3lal h TRP 426 Cb 1.12 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.42 3lal h TRP 426 CO 0.00 0.00 0.00 0.66 -1.05 0.00 0.00 178.44 178.05 3lal n TYR 427 N -2.33 0.71 -1.07 0.49 4.01 -1.08 -4.74 117.16 113.15 3lal n TYR 427 Ca 0.04 -0.63 -0.28 0.00 -0.16 0.00 0.00 57.90 56.87 3lal n TYR 427 Cb 0.45 -0.14 0.19 0.00 -0.31 0.00 0.00 39.34 39.54 3lal n TYR 427 CO 0.00 0.00 0.00 1.14 -0.46 0.00 0.00 176.86 177.54 3lal s GLN 428 N -1.66 0.08 0.00 -0.72 -2.07 -1.20 -4.91 119.66 109.18 3lal s GLN 428 Ca 0.32 0.51 0.01 0.00 -1.82 0.00 0.00 55.36 54.38 3lal s GLN 428 Cb 0.21 -1.70 0.01 0.00 -1.09 0.00 0.00 33.01 30.44 3lal s GLN 428 CO 0.15 -2.97 0.54 1.28 -1.32 0.00 0.00 175.29 172.97