#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lm8 s ASP 2 N 0.00 7.26 -0.03 6.12 -0.00 -1.26 -0.46 116.67 128.30 1lm8 s ASP 2 Ca 0.00 1.74 0.07 0.00 -0.00 0.00 0.00 52.55 54.36 1lm8 s ASP 2 Cb 0.00 -2.54 -0.02 0.00 -0.00 0.00 0.00 42.92 40.36 1lm8 s ASP 2 CO 0.00 -0.06 -0.23 0.68 -0.00 0.00 0.00 175.17 175.56 1lm8 s VAL 3 N -1.63 2.35 -0.18 -1.27 -7.23 0.13 -4.37 120.40 108.20 1lm8 s VAL 3 Ca 0.49 -0.99 -0.06 0.00 -1.81 0.00 0.00 61.98 59.61 1lm8 s VAL 3 Cb -0.18 -1.85 -0.03 0.00 0.56 0.00 0.00 36.38 34.88 1lm8 s VAL 3 CO 0.23 0.58 0.03 -0.36 -0.31 0.00 0.00 175.10 175.26 1lm8 s PHE 4 N -0.62 3.15 0.30 2.82 0.40 -0.16 -1.57 117.98 122.30 1lm8 s PHE 4 Ca 0.10 -0.13 0.06 0.00 -0.60 0.00 0.00 56.93 56.36 1lm8 s PHE 4 Cb -0.10 -2.05 -0.06 0.00 0.51 0.00 0.00 43.02 41.31 1lm8 s PHE 4 CO -0.00 0.02 -0.04 -0.51 0.70 0.00 0.00 175.22 175.39 1lm8 s LEU 5 N 0.51 2.48 -0.22 -0.37 1.43 0.68 -1.54 118.68 121.65 1lm8 s LEU 5 Ca 0.01 -1.23 -0.01 0.00 -1.03 0.00 0.00 54.13 51.86 1lm8 s LEU 5 Cb -0.13 -0.64 0.06 0.00 0.03 0.00 0.00 46.19 45.51 1lm8 s LEU 5 CO 0.02 -0.38 0.01 -0.04 0.23 0.00 0.00 176.35 176.18 1lm8 s MET 6 N -3.74 1.01 -0.34 1.70 -1.94 -0.35 -2.12 119.30 113.53 1lm8 s MET 6 Ca 0.31 -0.67 -0.16 0.00 -1.71 0.00 0.00 55.69 53.46 1lm8 s MET 6 Cb 0.05 -2.29 -0.01 0.00 2.01 0.00 0.00 34.83 34.59 1lm8 s MET 6 CO 0.13 -0.65 0.42 0.42 -0.01 0.00 0.00 175.02 175.33 1lm8 s ILE 7 N 1.67 5.11 -0.03 2.53 1.01 0.09 -0.53 121.20 131.05 1lm8 s ILE 7 Ca -0.02 0.22 0.07 0.00 0.00 0.00 0.00 60.65 60.92 1lm8 s ILE 7 Cb -0.18 -3.86 -0.02 0.00 0.01 0.00 0.00 42.46 38.42 1lm8 s ILE 7 CO -0.08 -0.11 -0.25 -0.13 0.00 0.00 0.00 174.94 174.38 1lm8 s ARG 8 N 2.16 2.17 -0.14 2.79 0.52 -0.09 -0.67 118.95 125.70 1lm8 s ARG 8 Ca 0.15 -0.89 -0.06 0.00 -0.52 0.00 0.00 55.73 54.41 1lm8 s ARG 8 Cb -0.16 -2.01 0.06 0.00 0.52 0.00 0.00 34.95 33.36 1lm8 s ARG 8 CO 0.12 0.48 0.31 0.50 0.02 0.00 0.00 175.30 176.73 1lm8 s ARG 9 N -0.44 0.24 3.94 3.54 3.52 -0.49 -1.26 118.95 127.99 1lm8 s ARG 9 Ca 0.05 0.72 0.00 0.00 -0.13 0.00 0.00 55.73 56.38 1lm8 s ARG 9 Cb -0.11 -0.01 0.00 0.00 -1.56 0.00 0.00 34.95 33.27 1lm8 s ARG 9 CO 0.01 -0.21 0.00 0.72 -0.81 0.00 0.00 175.30 175.00 1lm8 n HIS 10 N 4.76 0.00 -1.06 5.12 8.25 0.36 -0.86 115.22 131.80 1lm8 n HIS 10 Ca -0.16 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.27 1lm8 n HIS 10 Cb 0.52 0.00 0.30 0.00 1.12 0.00 0.00 29.99 31.93 1lm8 n HIS 10 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1lm8 n LYS 11 N 13.13 3.60 -5.25 -0.41 5.02 -1.26 -1.40 118.16 131.58 1lm8 n LYS 11 Ca 0.00 -3.08 -0.32 0.00 -2.02 0.00 0.00 58.31 52.89 1lm8 n LYS 11 Cb 0.00 -2.14 -0.17 0.00 -0.02 0.00 0.00 35.03 32.70 1lm8 n LYS 11 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1lm8 s THR 12 N -2.98 2.07 -0.02 -0.18 2.01 -0.04 -5.09 115.64 111.43 1lm8 s THR 12 Ca 0.53 -1.05 0.00 0.00 0.31 0.00 0.00 61.69 61.48 1lm8 s THR 12 Cb 0.42 -1.75 0.02 0.00 0.01 0.00 0.00 72.50 71.20 1lm8 s THR 12 CO 0.12 0.57 0.00 0.28 -0.69 0.00 0.00 174.62 174.90 1lm8 s THR 13 N -0.06 0.12 -0.21 -0.82 -1.32 -1.26 -1.39 115.64 110.70 1lm8 s THR 13 Ca -0.07 0.07 -0.06 0.00 -1.21 0.00 0.00 61.69 60.42 1lm8 s THR 13 Cb -0.15 -0.19 -0.03 0.00 -1.51 0.00 0.00 72.50 70.62 1lm8 s THR 13 CO 0.05 0.11 0.04 -0.63 -2.21 0.00 0.00 174.62 171.97 1lm8 s ILE 14 N 0.76 4.33 -0.22 5.08 1.01 0.16 -4.92 121.20 127.40 1lm8 s ILE 14 Ca -0.07 -0.18 -0.14 0.00 0.00 0.00 0.00 60.65 60.26 1lm8 s ILE 14 Cb -0.10 -2.98 -0.04 0.00 0.01 0.00 0.00 42.46 39.35 1lm8 s ILE 14 CO -0.02 0.41 0.31 -0.36 0.00 0.00 0.00 174.94 175.29 1lm8 s PHE 15 N 0.95 3.34 0.20 3.97 0.40 -1.26 -0.73 117.98 124.84 1lm8 s PHE 15 Ca 0.03 0.46 -0.18 0.00 -0.60 0.00 0.00 56.93 56.64 1lm8 s PHE 15 Cb -0.14 -2.44 0.03 0.00 0.51 0.00 0.00 43.02 40.98 1lm8 s PHE 15 CO 0.02 -0.01 0.52 -0.08 0.70 0.00 0.00 175.22 176.38 1lm8 s THR 16 N 1.30 0.03 0.23 0.64 -1.32 -0.90 -5.02 115.64 110.59 1lm8 s THR 16 Ca 0.15 -0.77 0.10 0.00 -1.21 0.00 0.00 61.69 59.96 1lm8 s THR 16 Cb -0.14 -1.57 -0.05 0.00 -1.51 0.00 0.00 72.50 69.23 1lm8 s THR 16 CO 0.07 -0.11 -0.19 1.51 -2.21 0.00 0.00 174.62 173.69 1lm8 s ASP 17 N -2.87 3.17 0.20 8.08 -4.77 -1.26 -0.23 116.67 118.99 1lm8 s ASP 17 Ca 0.09 -0.98 -0.18 0.00 -3.30 0.00 0.00 52.55 48.18 1lm8 s ASP 17 Cb -0.01 -0.23 0.03 0.00 -1.09 0.00 0.00 42.92 41.62 1lm8 s ASP 17 CO -0.03 -0.01 0.54 0.00 0.70 0.00 0.00 175.17 176.37 1lm8 s ALA 18 N -2.45 -1.04 0.19 2.11 0.00 -0.61 -4.97 121.76 114.99 1lm8 s ALA 18 Ca 0.25 -0.14 -0.24 0.00 0.00 0.00 0.00 51.96 51.83 1lm8 s ALA 18 Cb -0.04 0.85 -0.08 0.00 0.00 0.00 0.00 23.12 23.85 1lm8 s ALA 18 CO 0.11 -0.81 0.77 0.15 0.00 0.00 0.00 175.76 175.98 1lm8 s LYS 19 N -3.86 4.50 0.58 0.00 1.02 -1.26 0.17 119.74 120.88 1lm8 s LYS 19 Ca 0.08 1.10 0.28 0.00 0.02 0.00 0.00 55.97 57.45 1lm8 s LYS 19 Cb -0.01 -3.15 1.56 0.00 -0.52 0.00 0.00 37.83 35.71 1lm8 s LYS 19 CO -0.04 0.52 2.03 0.93 -0.92 0.00 0.00 175.35 177.87 1lm8 h GLU 20 N 4.06 0.00 -0.00 1.68 5.08 -1.10 0.14 114.58 124.44 1lm8 h GLU 20 Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 1lm8 h GLU 20 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1lm8 h GLU 20 CO 0.66 0.00 -0.23 -1.13 -1.00 0.00 0.00 179.01 177.31 1lm8 n SER 21 N -3.87 0.24 -4.86 1.42 3.41 -1.26 -1.39 113.62 107.31 1lm8 n SER 21 Ca 0.04 0.12 -0.31 0.00 -0.26 0.00 0.00 58.87 58.46 1lm8 n SER 21 Cb 0.45 -0.15 0.03 0.00 -0.26 0.00 0.00 64.21 64.28 1lm8 n SER 21 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1lm8 s SER 22 N -2.97 5.90 0.50 4.04 1.04 0.50 -4.80 113.70 117.90 1lm8 s SER 22 Ca 0.13 1.40 0.02 0.00 0.48 0.00 0.00 55.95 57.99 1lm8 s SER 22 Cb 0.18 -2.37 0.02 0.00 0.10 0.00 0.00 66.02 63.96 1lm8 s SER 22 CO 0.60 -1.08 0.70 0.42 0.98 0.00 0.00 173.24 174.87 1lm8 s THR 23 N -3.19 3.07 0.18 2.02 -4.23 -1.26 -1.15 115.64 111.08 1lm8 s THR 23 Ca 0.56 -0.70 -0.11 0.00 -1.18 0.00 0.00 61.69 60.26 1lm8 s THR 23 Cb -0.12 -3.12 0.09 0.00 1.34 0.00 0.00 72.50 70.69 1lm8 s THR 23 CO 0.54 -0.08 1.73 0.58 -0.54 0.00 0.00 174.62 176.85 1lm8 h VAL 24 N 0.27 1.24 -0.93 2.29 2.07 -1.30 -1.68 116.25 118.20 1lm8 h VAL 24 Ca -0.43 -0.74 0.05 0.00 0.82 0.00 0.00 66.70 66.40 1lm8 h VAL 24 Cb 1.28 0.55 -0.06 0.00 -1.52 0.00 0.00 31.29 31.54 1lm8 h VAL 24 CO 0.52 0.29 0.60 0.15 0.02 0.00 0.00 177.57 179.15 1lm8 h PHE 25 N 0.88 1.11 0.00 1.57 3.57 -1.58 0.52 116.94 123.01 1lm8 h PHE 25 Ca 0.21 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.67 1lm8 h PHE 25 Cb 0.22 -0.37 -0.01 0.00 2.79 0.00 0.00 35.95 38.58 1lm8 h PHE 25 CO 0.01 0.60 -0.34 0.93 -2.23 0.00 0.00 178.31 177.29 1lm8 h GLU 26 N 1.12 0.00 -0.31 1.11 5.08 -1.68 -1.75 114.58 118.16 1lm8 h GLU 26 Ca 0.39 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.58 1lm8 h GLU 26 Cb 0.10 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 1lm8 h GLU 26 CO -0.15 0.34 -0.49 1.25 -1.00 0.00 0.00 179.01 178.95 1lm8 h LEU 27 N 0.00 0.93 -1.42 1.33 6.46 -0.10 -2.63 115.31 119.89 1lm8 h LEU 27 Ca -0.00 -0.47 -0.02 0.00 -0.12 0.00 0.00 57.88 57.26 1lm8 h LEU 27 Cb 0.61 -0.26 -0.02 0.00 -0.73 0.00 0.00 40.66 40.26 1lm8 h LEU 27 CO 0.04 1.26 0.14 0.11 -0.62 0.00 0.00 178.44 179.37 1lm8 h LYS 28 N 0.67 0.53 -0.60 1.25 1.57 -0.49 -1.43 116.57 118.07 1lm8 h LYS 28 Ca 0.03 -0.07 -0.05 0.00 -1.87 0.00 0.00 60.65 58.69 1lm8 h LYS 28 Cb 1.08 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 33.27 1lm8 h LYS 28 CO 0.11 0.45 0.15 0.00 -0.57 0.00 0.00 179.45 179.60 1lm8 h ARG 29 N 0.53 0.93 -0.37 3.15 2.47 -0.99 0.14 114.38 120.24 1lm8 h ARG 29 Ca 0.13 -0.20 -0.02 0.00 -1.26 0.00 0.00 59.98 58.64 1lm8 h ARG 29 Cb 0.12 -0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.29 1lm8 h ARG 29 CO -0.01 0.83 0.16 0.82 0.56 0.00 0.00 179.97 182.32 1lm8 h ILE 30 N 0.89 1.19 -0.49 2.04 1.08 -0.97 -2.25 117.51 118.99 1lm8 h ILE 30 Ca 0.19 -0.56 -0.04 0.00 -0.39 0.00 0.00 64.86 64.06 1lm8 h ILE 30 Cb 0.31 0.86 -0.02 0.00 -3.07 0.00 0.00 36.82 34.90 1lm8 h ILE 30 CO -0.00 0.20 0.13 0.58 -0.69 0.00 0.00 178.15 178.37 1lm8 h VAL 31 N 0.46 1.21 -0.72 1.67 2.07 -0.78 -2.67 116.25 117.49 1lm8 h VAL 31 Ca 0.13 -0.73 -0.05 0.00 0.82 0.00 0.00 66.70 66.86 1lm8 h VAL 31 Cb 0.17 0.69 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 1lm8 h VAL 31 CO -0.01 0.27 0.24 -0.08 0.02 0.00 0.00 177.57 178.01 1lm8 h GLU 32 N 0.72 1.10 0.00 1.57 4.81 -0.42 0.25 114.58 122.61 1lm8 h GLU 32 Ca 0.16 -0.22 -0.06 0.00 -0.13 0.00 0.00 59.36 59.11 1lm8 h GLU 32 Cb 0.25 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 1lm8 h GLU 32 CO -0.00 0.93 -0.29 0.78 -0.73 0.00 0.00 179.01 179.70 1lm8 h GLY 33 N 1.10 0.00 0.12 1.92 0.00 -1.07 0.03 103.07 105.17 1lm8 h GLY 33 Ca 0.24 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.30 1lm8 h GLY 33 CO -0.01 0.00 -1.46 1.39 0.00 0.00 0.00 176.54 176.46 1lm8 n ILE 34 N -4.00 1.58 0.56 2.60 5.41 -0.88 -4.56 119.36 120.08 1lm8 n ILE 34 Ca -0.02 -0.16 0.11 0.00 1.00 0.00 0.00 62.75 63.68 1lm8 n ILE 34 Cb 0.35 -1.98 0.15 0.00 -0.71 0.00 0.00 39.64 37.45 1lm8 n ILE 34 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1lm8 n LEU 35 N -4.24 3.06 -3.67 1.39 4.77 0.82 -5.01 117.00 114.12 1lm8 n LEU 35 Ca -0.33 -1.27 -0.24 0.00 -0.03 0.00 0.00 56.01 54.14 1lm8 n LEU 35 Cb 0.76 -0.12 0.06 0.00 -2.33 0.00 0.00 43.42 41.79 1lm8 n LEU 35 CO 0.23 0.60 0.13 0.29 -1.33 0.00 0.00 177.39 177.31 1lm8 n LYS 36 N 1.28 -6.57 -3.88 3.23 4.76 -0.00 -5.00 118.16 111.98 1lm8 n LYS 36 Ca 0.15 0.74 -0.22 0.00 -2.87 0.00 0.00 58.31 56.11 1lm8 n LYS 36 Cb 0.55 -5.66 -0.17 0.00 -1.84 0.00 0.00 35.03 27.91 1lm8 n LYS 36 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1lm8 s ARG 37 N -6.17 0.63 0.84 1.97 0.52 -1.25 -5.07 118.95 110.42 1lm8 s ARG 37 Ca 0.40 0.05 -0.13 0.00 -0.52 0.00 0.00 55.73 55.54 1lm8 s ARG 37 Cb -0.19 -0.89 0.08 0.00 0.52 0.00 0.00 34.95 34.48 1lm8 s ARG 37 CO 0.77 -0.23 1.04 -0.35 0.02 0.00 0.00 175.30 176.55 1lm8 n PRO 38 N 4.78 -0.02 -0.29 3.54 -0.04 -1.26 -4.13 135.00 137.59 1lm8 n PRO 38 Ca -0.13 0.07 0.15 0.00 -0.04 0.00 0.00 63.50 63.55 1lm8 n PRO 38 Cb 0.50 -2.31 0.42 0.00 -0.04 0.00 0.00 33.50 32.07 1lm8 n PRO 38 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 1lm8 h PRO 39 N -1.17 0.58 0.00 0.54 0.11 -1.95 -0.97 132.00 129.14 1lm8 h PRO 39 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1lm8 h PRO 39 Cb 1.29 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1lm8 h PRO 39 CO 0.43 0.39 0.00 -0.40 -0.21 0.00 0.00 178.00 178.21 1lm8 n ASP 40 N -4.60 0.00 -0.06 -2.05 3.85 -1.26 -2.07 116.55 110.36 1lm8 n ASP 40 Ca 0.20 -1.11 0.01 0.00 -0.71 0.00 0.00 54.79 53.18 1lm8 n ASP 40 Cb 0.60 0.00 0.01 0.00 -1.35 0.00 0.00 41.12 40.38 1lm8 n ASP 40 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 1lm8 n GLU 41 N -0.79 2.29 -4.46 0.11 1.02 -0.37 -4.95 120.64 113.47 1lm8 n GLU 41 Ca 0.11 -1.37 -0.30 0.00 -0.02 0.00 0.00 57.16 55.58 1lm8 n GLU 41 Cb 0.05 -1.03 -0.12 0.00 -0.02 0.00 0.00 31.44 30.33 1lm8 n GLU 41 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1lm8 s GLN 42 N -0.83 1.93 -0.12 3.49 -0.21 -0.88 -0.82 119.66 122.22 1lm8 s GLN 42 Ca 0.02 -1.08 -0.00 0.00 0.02 0.00 0.00 55.36 54.32 1lm8 s GLN 42 Cb 0.01 -2.16 0.02 0.00 1.00 0.00 0.00 33.01 31.89 1lm8 s GLN 42 CO 0.02 0.51 -0.09 1.03 -2.12 0.00 0.00 175.29 174.63 1lm8 s ARG 43 N -1.82 1.67 -0.03 2.91 0.52 -0.19 -4.95 118.95 117.06 1lm8 s ARG 43 Ca 0.17 -0.31 0.01 0.00 -0.52 0.00 0.00 55.73 55.07 1lm8 s ARG 43 Cb -0.11 -1.68 -0.03 0.00 0.52 0.00 0.00 34.95 33.65 1lm8 s ARG 43 CO 0.08 -0.25 -0.02 -0.51 0.02 0.00 0.00 175.30 174.62 1lm8 s LEU 44 N 1.63 3.43 0.07 2.53 1.43 -1.26 -1.37 118.68 125.13 1lm8 s LEU 44 Ca 0.04 0.00 0.04 0.00 -1.03 0.00 0.00 54.13 53.18 1lm8 s LEU 44 Cb -0.13 -1.89 -0.03 0.00 0.03 0.00 0.00 46.19 44.17 1lm8 s LEU 44 CO -0.08 0.32 -0.11 -0.31 0.23 0.00 0.00 176.35 176.40 1lm8 s TYR 45 N -0.99 0.98 -0.32 0.29 1.51 0.57 -0.68 117.35 118.72 1lm8 s TYR 45 Ca 0.17 -0.55 0.03 0.00 -1.01 0.00 0.00 57.07 55.71 1lm8 s TYR 45 Cb -0.11 -0.56 0.09 0.00 -0.11 0.00 0.00 41.96 41.27 1lm8 s TYR 45 CO 0.07 -0.01 0.01 0.21 -1.11 0.00 0.00 175.55 174.71 1lm8 s LYS 46 N -2.10 1.74 7.63 -0.62 2.20 -0.68 -0.59 119.74 127.32 1lm8 s LYS 46 Ca -0.02 -1.71 0.00 0.00 -0.36 0.00 0.00 55.97 53.88 1lm8 s LYS 46 Cb -0.07 -3.13 0.00 0.00 -1.51 0.00 0.00 37.83 33.12 1lm8 s LYS 46 CO 0.01 -0.83 0.00 -0.25 -0.36 0.00 0.00 175.35 173.92 1lm8 n ASP 47 N 4.32 0.00 -1.35 1.43 8.00 -1.26 -1.88 116.55 125.81 1lm8 n ASP 47 Ca -0.02 0.00 0.12 0.00 0.71 0.00 0.00 54.79 55.60 1lm8 n ASP 47 Cb 0.42 0.00 0.32 0.00 -0.02 0.00 0.00 41.12 41.84 1lm8 n ASP 47 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1lm8 n ASP 48 N 6.75 3.95 -4.63 -2.24 8.00 -1.26 -4.83 116.55 122.29 1lm8 n ASP 48 Ca 0.00 -2.00 -0.40 0.00 0.71 0.00 0.00 54.79 53.10 1lm8 n ASP 48 Cb 0.00 -0.48 -0.07 0.00 -0.02 0.00 0.00 41.12 40.55 1lm8 n ASP 48 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 1lm8 s GLN 49 N -1.02 4.12 0.05 -1.24 2.00 -0.79 -5.04 119.66 117.74 1lm8 s GLN 49 Ca 0.49 0.45 -0.31 0.00 -2.00 0.00 0.00 55.36 54.00 1lm8 s GLN 49 Cb 0.25 -3.63 -0.06 0.00 0.80 0.00 0.00 33.01 30.38 1lm8 s GLN 49 CO 0.33 -0.33 1.29 -1.17 -0.50 0.00 0.00 175.29 174.92 1lm8 s LEU 50 N 2.23 4.35 -0.08 3.68 0.20 -1.26 -1.68 118.68 126.11 1lm8 s LEU 50 Ca 0.24 2.09 -0.24 0.00 0.69 0.00 0.00 54.13 56.91 1lm8 s LEU 50 Cb -0.16 -3.57 -0.03 0.00 -0.43 0.00 0.00 46.19 42.00 1lm8 s LEU 50 CO 0.09 -0.59 0.74 -0.76 -0.29 0.00 0.00 176.35 175.55 1lm8 s LEU 51 N 1.52 4.30 0.18 -0.68 1.43 0.14 -4.97 118.68 120.60 1lm8 s LEU 51 Ca 0.61 1.22 -0.30 0.00 -1.03 0.00 0.00 54.13 54.63 1lm8 s LEU 51 Cb -0.31 -3.15 -0.08 0.00 0.03 0.00 0.00 46.19 42.69 1lm8 s LEU 51 CO 0.28 -0.18 1.11 -1.81 0.23 0.00 0.00 176.35 175.99 1lm8 s ASP 52 N 0.89 7.24 0.30 2.29 1.01 -1.26 -4.69 116.67 122.45 1lm8 s ASP 52 Ca 0.39 2.12 0.06 0.00 0.71 0.00 0.00 52.55 55.82 1lm8 s ASP 52 Cb -0.18 -2.61 0.79 0.00 1.01 0.00 0.00 42.92 41.94 1lm8 s ASP 52 CO 0.18 -0.24 1.69 0.44 0.21 0.00 0.00 175.17 177.45 1lm8 h ASP 53 N 5.07 0.35 0.69 0.27 3.45 -1.96 -2.65 116.42 121.64 1lm8 h ASP 53 Ca -0.44 0.16 0.00 0.00 0.43 0.00 0.00 57.03 57.18 1lm8 h ASP 53 Cb 1.21 0.14 0.00 0.00 -0.56 0.00 0.00 39.33 40.12 1lm8 h ASP 53 CO 0.72 -0.03 -0.11 0.61 -1.57 0.00 0.00 179.24 178.86 1lm8 n GLY 54 N -1.33 -1.29 3.86 2.75 0.00 -1.26 -1.64 105.19 106.27 1lm8 n GLY 54 Ca 0.24 -0.19 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 1lm8 n GLY 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lm8 s LYS 55 N -2.80 3.94 0.57 1.61 1.02 -1.00 -4.87 119.74 118.20 1lm8 s LYS 55 Ca 0.20 0.64 -0.09 0.00 0.02 0.00 0.00 55.97 56.74 1lm8 s LYS 55 Cb 0.19 -2.39 -0.03 0.00 -0.52 0.00 0.00 37.83 35.08 1lm8 s LYS 55 CO 0.53 0.06 0.93 0.95 -0.92 0.00 0.00 175.35 176.91 1lm8 s THR 56 N -2.15 4.66 0.39 2.17 -4.23 -1.26 -1.47 115.64 113.75 1lm8 s THR 56 Ca 0.54 0.55 0.06 0.00 -1.18 0.00 0.00 61.69 61.65 1lm8 s THR 56 Cb -0.10 -3.82 0.27 0.00 1.34 0.00 0.00 72.50 70.18 1lm8 s THR 56 CO 0.22 -0.97 2.04 -0.07 -0.54 0.00 0.00 174.62 175.30 1lm8 h LEU 57 N -0.12 0.55 -0.19 4.79 3.38 -1.10 -1.19 115.31 121.43 1lm8 h LEU 57 Ca -0.45 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.48 1lm8 h LEU 57 Cb 1.20 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 1lm8 h LEU 57 CO 0.62 0.40 0.01 1.23 0.09 0.00 0.00 178.44 180.78 1lm8 h GLY 58 N 0.65 0.35 2.00 0.83 0.00 -1.37 -1.49 103.07 104.04 1lm8 h GLY 58 Ca 0.19 -0.25 -0.00 0.00 0.00 0.00 0.00 47.33 47.26 1lm8 h GLY 58 CO -0.04 0.23 -0.01 0.83 0.00 0.00 0.00 176.54 177.55 1lm8 h GLU 59 N 0.09 0.00 -0.00 4.80 5.08 -1.59 -0.51 114.58 122.45 1lm8 h GLU 59 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1lm8 h GLU 59 Cb 0.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1lm8 h GLU 59 CO 0.01 0.01 -0.19 0.00 -1.00 0.00 0.00 179.01 177.84 1lm8 n GLY 61 N 1.39 0.68 3.76 0.00 0.00 -0.20 -5.03 105.19 105.79 1lm8 n GLY 61 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 1lm8 n GLY 61 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1lm8 s PHE 62 N -2.00 3.83 0.01 1.61 0.40 -0.62 -5.01 117.98 116.20 1lm8 s PHE 62 Ca 0.00 1.58 0.00 0.00 -0.60 0.00 0.00 56.93 57.91 1lm8 s PHE 62 Cb 0.00 -2.80 -0.01 0.00 0.51 0.00 0.00 43.02 40.72 1lm8 s PHE 62 CO 0.00 0.40 -0.01 0.95 0.70 0.00 0.00 175.22 177.25 1lm8 s THR 63 N -0.62 0.06 0.58 0.64 -4.23 -1.26 -4.07 115.64 106.74 1lm8 s THR 63 Ca 0.37 -0.31 0.27 0.00 -1.18 0.00 0.00 61.69 60.85 1lm8 s THR 63 Cb -0.22 -0.11 0.35 0.00 1.34 0.00 0.00 72.50 73.86 1lm8 s THR 63 CO 0.25 -0.15 2.18 0.77 -0.54 0.00 0.00 174.62 177.12 1lm8 h SER 64 N 5.66 0.00 0.57 3.99 4.64 -1.84 0.55 113.55 127.12 1lm8 h SER 64 Ca -0.27 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.03 1lm8 h SER 64 Cb 1.21 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1lm8 h SER 64 CO 0.48 0.00 -0.09 -0.61 -0.87 0.00 0.00 176.83 175.74 1lm8 h GLN 65 N 0.00 0.00 0.00 4.77 4.15 -1.95 -3.30 115.11 118.78 1lm8 h GLN 65 Ca 0.04 0.00 -0.14 0.00 0.77 0.00 0.00 58.65 59.32 1lm8 h GLN 65 Cb 0.21 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.88 1lm8 h GLN 65 CO -0.00 0.09 -1.54 0.25 -1.93 0.00 0.00 178.83 175.70 1lm8 n THR 66 N -3.37 0.54 -2.54 2.39 -2.24 -0.39 -4.79 114.28 103.87 1lm8 n THR 66 Ca -0.01 -0.22 -0.43 0.00 -2.27 0.00 0.00 64.05 61.12 1lm8 n THR 66 Cb 0.26 -0.83 0.00 0.00 -2.10 0.00 0.00 70.33 67.66 1lm8 n THR 66 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1lm8 n ALA 67 N -2.71 4.58 -2.81 6.98 0.00 0.05 -4.62 120.51 121.98 1lm8 n ALA 67 Ca -0.16 -4.19 -0.21 0.00 0.00 0.00 0.00 53.44 48.88 1lm8 n ALA 67 Cb 0.69 -3.14 -0.01 0.00 0.00 0.00 0.00 19.45 16.98 1lm8 n ALA 67 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1lm8 s ARG 68 N 1.60 3.38 0.22 0.00 1.81 -1.14 -0.99 118.95 123.83 1lm8 s ARG 68 Ca 0.43 -0.74 -0.10 0.00 -1.72 0.00 0.00 55.73 53.61 1lm8 s ARG 68 Cb 0.05 -2.83 0.34 0.00 -0.45 0.00 0.00 34.95 32.05 1lm8 s ARG 68 CO 0.00 0.30 1.65 -1.35 -0.68 0.00 0.00 175.30 175.22 1lm8 h PRO 69 N 1.04 0.10 -0.00 3.54 0.11 -1.92 0.05 132.00 134.91 1lm8 h PRO 69 Ca -0.50 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1lm8 h PRO 69 Cb 1.23 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1lm8 h PRO 69 CO 0.59 0.07 -0.08 0.00 -0.21 0.00 0.00 178.00 178.37 1lm8 n GLN 70 N -5.31 0.72 -2.85 1.05 0.00 -1.26 -4.23 117.38 105.49 1lm8 n GLN 70 Ca 0.10 -0.20 -0.12 0.00 0.00 0.00 0.00 57.00 56.78 1lm8 n GLN 70 Cb 0.39 -1.50 0.03 0.00 0.00 0.00 0.00 30.24 29.17 1lm8 n GLN 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1lm8 n ALA 71 N -0.96 -0.37 -1.59 2.61 0.00 -0.53 -5.15 120.51 114.50 1lm8 n ALA 71 Ca 0.16 -1.90 -0.36 0.00 0.00 0.00 0.00 53.44 51.33 1lm8 n ALA 71 Cb 0.26 -1.18 0.08 0.00 0.00 0.00 0.00 19.45 18.61 1lm8 n ALA 71 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1lm8 s PRO 72 N 0.05 2.38 0.27 0.00 0.04 -0.11 -2.90 135.00 134.73 1lm8 s PRO 72 Ca 0.31 1.98 -0.22 0.00 0.04 0.00 0.00 61.00 63.10 1lm8 s PRO 72 Cb 0.24 -1.84 -0.09 0.00 0.04 0.00 0.00 34.50 32.86 1lm8 s PRO 72 CO -0.17 -1.71 0.82 0.00 0.04 0.00 0.00 177.00 175.99 1lm8 s ALA 73 N -1.58 3.32 -0.06 8.56 0.00 -0.59 -4.76 121.76 126.66 1lm8 s ALA 73 Ca 0.80 0.32 -0.20 0.00 0.00 0.00 0.00 51.96 52.88 1lm8 s ALA 73 Cb -0.35 -2.98 -0.05 0.00 0.00 0.00 0.00 23.12 19.74 1lm8 s ALA 73 CO 0.42 0.26 0.58 0.99 0.00 0.00 0.00 175.76 178.01 1lm8 s THR 74 N -1.57 5.04 -0.20 0.00 2.01 -1.26 -1.21 115.64 118.45 1lm8 s THR 74 Ca 0.46 1.19 -0.01 0.00 0.31 0.00 0.00 61.69 63.65 1lm8 s THR 74 Cb -0.17 -3.92 0.01 0.00 0.01 0.00 0.00 72.50 68.43 1lm8 s THR 74 CO 0.22 0.35 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.68 1lm8 s VAL 75 N 0.30 2.58 0.39 3.82 1.01 0.31 -4.60 120.40 124.20 1lm8 s VAL 75 Ca 0.31 -0.81 -0.24 0.00 0.00 0.00 0.00 61.98 61.24 1lm8 s VAL 75 Cb -0.17 -2.15 -0.10 0.00 0.00 0.00 0.00 36.38 33.96 1lm8 s VAL 75 CO 0.15 0.46 1.00 -0.83 0.00 0.00 0.00 175.10 175.87 1lm8 s GLY 76 N 1.35 2.66 -0.02 4.51 0.00 0.24 -0.92 107.32 115.15 1lm8 s GLY 76 Ca 0.04 0.58 0.02 0.00 0.00 0.00 0.00 44.72 45.36 1lm8 s GLY 76 CO -0.09 0.97 -0.06 -2.27 0.00 0.00 0.00 173.10 171.65 1lm8 s LEU 77 N -2.66 1.69 0.03 0.66 2.96 -0.39 -0.31 118.68 120.66 1lm8 s LEU 77 Ca 0.57 -0.14 0.02 0.00 -0.22 0.00 0.00 54.13 54.36 1lm8 s LEU 77 Cb -0.18 -0.42 -0.02 0.00 0.50 0.00 0.00 46.19 46.07 1lm8 s LEU 77 CO 0.23 0.02 -0.06 0.00 -1.32 0.00 0.00 176.35 175.22 1lm8 s ALA 78 N 0.34 0.44 0.07 5.97 0.00 -0.47 -4.47 121.76 123.63 1lm8 s ALA 78 Ca -0.04 -0.64 0.04 0.00 0.00 0.00 0.00 51.96 51.31 1lm8 s ALA 78 Cb -0.09 0.05 -0.04 0.00 0.00 0.00 0.00 23.12 23.04 1lm8 s ALA 78 CO 0.00 -0.04 0.02 -0.06 0.00 0.00 0.00 175.76 175.69 1lm8 s PHE 79 N -1.21 3.06 0.43 0.00 2.99 -1.26 -1.02 117.98 120.97 1lm8 s PHE 79 Ca -0.10 0.02 -0.15 0.00 0.00 0.00 0.00 56.93 56.71 1lm8 s PHE 79 Cb -0.09 -1.58 -0.08 0.00 0.00 0.00 0.00 43.02 41.27 1lm8 s PHE 79 CO 0.00 0.49 0.86 0.50 -0.00 0.00 0.00 175.22 177.07 1lm8 s ARG 80 N -2.22 3.94 0.15 0.44 6.06 0.00 -4.43 118.95 122.89 1lm8 s ARG 80 Ca 0.26 0.76 0.07 0.00 -2.50 0.00 0.00 55.73 54.32 1lm8 s ARG 80 Cb -0.12 -2.28 -0.04 0.00 0.06 0.00 0.00 34.95 32.57 1lm8 s ARG 80 CO 0.18 -0.08 -0.16 0.00 -2.50 0.00 0.00 175.30 172.74 1lm8 s ALA 81 N -2.37 1.75 -0.02 6.12 0.00 -1.25 -5.02 121.76 120.96 1lm8 s ALA 81 Ca 0.56 -1.41 0.21 0.00 0.00 0.00 0.00 51.96 51.32 1lm8 s ALA 81 Cb -0.10 -0.12 0.57 0.00 0.00 0.00 0.00 23.12 23.48 1lm8 s ALA 81 CO 0.26 0.15 1.68 0.22 0.00 0.00 0.00 175.76 178.07 1lm8 h ASP 82 N 3.31 0.00 0.00 0.00 3.58 -2.04 -3.37 116.42 117.91 1lm8 h ASP 82 Ca -0.41 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.04 1lm8 h ASP 82 Cb 1.20 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.25 1lm8 h ASP 82 CO 0.52 0.30 0.00 -0.90 -2.88 0.00 0.00 179.24 176.28 1lm8 n ASP 83 N -3.31 0.29 -4.32 2.28 5.68 -1.26 -5.10 116.55 110.82 1lm8 n ASP 83 Ca 0.01 -1.01 -0.17 0.00 -0.50 0.00 0.00 54.79 53.13 1lm8 n ASP 83 Cb 0.54 0.00 -0.10 0.00 -1.14 0.00 0.00 41.12 40.42 1lm8 n ASP 83 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 1lm8 s THR 84 N -0.01 0.83 -0.20 2.12 -1.32 -1.26 -5.14 115.64 110.66 1lm8 s THR 84 Ca 0.00 -2.01 -0.02 0.00 -1.21 0.00 0.00 61.69 58.45 1lm8 s THR 84 Cb 0.00 -2.44 -0.00 0.00 -1.51 0.00 0.00 72.50 68.54 1lm8 s THR 84 CO 0.00 -0.22 -0.09 0.12 -2.21 0.00 0.00 174.62 172.23 1lm8 s PHE 85 N -3.56 2.90 0.01 9.09 5.36 -1.26 -3.89 117.98 126.63 1lm8 s PHE 85 Ca 0.31 -1.03 -0.25 0.00 -0.96 0.00 0.00 56.93 55.01 1lm8 s PHE 85 Cb 0.07 -2.03 -0.19 0.00 -0.34 0.00 0.00 43.02 40.53 1lm8 s PHE 85 CO 0.10 -0.55 1.40 1.49 -1.46 0.00 0.00 175.22 176.20 1lm8 h GLU 86 N 7.86 0.02 -0.75 10.12 4.81 -1.96 -3.50 114.58 131.17 1lm8 h GLU 86 Ca -0.40 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.82 1lm8 h GLU 86 Cb 1.16 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.54 1lm8 h GLU 86 CO 0.60 0.37 0.00 0.00 -0.73 0.00 0.00 179.01 179.25 1lm8 n ALA 87 N -2.28 -2.74 -1.69 2.92 0.00 -1.26 -4.92 120.51 110.53 1lm8 n ALA 87 Ca -0.08 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.93 1lm8 n ALA 87 Cb 0.19 -0.46 -0.03 0.00 0.00 0.00 0.00 19.45 19.15 1lm8 n ALA 87 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1lm8 n LEU 88 N -0.08 3.99 -3.62 0.00 7.94 -1.26 -4.99 117.00 118.98 1lm8 n LEU 88 Ca 0.00 0.99 -0.17 0.00 -1.11 0.00 0.00 56.01 55.71 1lm8 n LEU 88 Cb 0.00 -1.53 -0.15 0.00 0.53 0.00 0.00 43.42 42.27 1lm8 n LEU 88 CO 0.00 0.15 -0.22 0.00 -1.11 0.00 0.00 177.39 176.21 1lm8 s ILE 90 N 2.31 3.20 0.10 0.00 1.01 -1.26 -0.49 121.20 126.06 1lm8 s ILE 90 Ca 0.04 -1.14 -0.31 0.00 0.00 0.00 0.00 60.65 59.24 1lm8 s ILE 90 Cb -0.13 -2.74 -0.07 0.00 0.01 0.00 0.00 42.46 39.53 1lm8 s ILE 90 CO -0.08 0.00 1.31 -1.61 0.00 0.00 0.00 174.94 174.57 1lm8 s GLU 91 N 1.33 4.37 0.68 2.79 0.41 -0.50 -4.92 118.70 122.86 1lm8 s GLU 91 Ca -0.02 1.96 -0.16 0.00 -0.41 0.00 0.00 54.97 56.34 1lm8 s GLU 91 Cb -0.18 -3.28 0.01 0.00 -1.78 0.00 0.00 34.13 28.89 1lm8 s GLU 91 CO -0.01 -0.36 1.18 -2.14 -0.49 0.00 0.00 175.26 173.44 1lm8 s PRO 92 N 1.04 2.51 0.98 0.39 0.02 -1.26 -4.87 135.00 133.81 1lm8 s PRO 92 Ca 0.62 1.67 -0.15 0.00 0.02 0.00 0.00 61.00 63.16 1lm8 s PRO 92 Cb -0.34 -1.89 0.19 0.00 0.02 0.00 0.00 34.50 32.48 1lm8 s PRO 92 CO 0.30 -1.53 1.22 -0.06 -0.33 0.00 0.00 177.00 176.61 1lm8 s PHE 93 N -1.99 1.74 0.98 6.54 2.99 -1.26 -5.05 117.98 121.93 1lm8 s PHE 93 Ca 0.73 0.52 -0.14 0.00 0.00 0.00 0.00 56.93 58.04 1lm8 s PHE 93 Cb -0.27 -3.75 0.18 0.00 0.00 0.00 0.00 43.02 39.18 1lm8 s PHE 93 CO 0.41 -2.73 1.16 -1.54 -0.00 0.00 0.00 175.22 172.52 1lm8 s SER 94 N -4.47 2.92 0.03 1.36 1.04 -1.26 -5.07 113.70 108.25 1lm8 s SER 94 Ca 0.70 0.82 0.07 0.00 0.48 0.00 0.00 55.95 58.02 1lm8 s SER 94 Cb -0.08 -1.27 -0.03 0.00 0.10 0.00 0.00 66.02 64.74 1lm8 s SER 94 CO 0.53 -2.90 -0.19 -0.44 0.98 0.00 0.00 173.24 171.22 1lm8 s SER 95 N -4.09 3.71 0.73 7.02 0.01 -1.26 -5.14 113.70 114.69 1lm8 s SER 95 Ca 0.67 -0.43 -0.11 0.00 1.31 0.00 0.00 55.95 57.38 1lm8 s SER 95 Cb -0.13 -0.58 0.03 0.00 0.21 0.00 0.00 66.02 65.55 1lm8 s SER 95 CO 0.54 0.26 1.08 -2.16 0.41 0.00 0.00 173.24 173.37 1lm8 s PRO 96 N -1.34 2.69 1.04 12.44 0.04 -1.26 -5.06 135.00 143.56 1lm8 s PRO 96 Ca 0.14 0.69 -0.16 0.00 0.04 0.00 0.00 61.00 61.71 1lm8 s PRO 96 Cb -0.10 -1.98 0.22 0.00 0.04 0.00 0.00 34.50 32.67 1lm8 s PRO 96 CO 0.04 -1.20 1.19 -1.25 0.04 0.00 0.00 177.00 175.82 1lm8 s PRO 97 N -5.18 0.03 0.35 0.56 0.04 -1.26 -4.97 135.00 124.57 1lm8 s PRO 97 Ca 0.59 -0.11 -0.28 0.00 0.04 0.00 0.00 61.00 61.24 1lm8 s PRO 97 Cb -0.13 -1.75 -0.11 0.00 0.04 0.00 0.00 34.50 32.56 1lm8 s PRO 97 CO 0.54 -2.87 1.42 -2.00 0.04 0.00 0.00 177.00 174.12 1lm8 s GLU 98 N -5.55 4.21 0.04 4.56 2.56 -1.26 -4.90 118.70 118.36 1lm8 s GLU 98 Ca 0.70 2.42 -0.31 0.00 0.00 0.00 0.00 54.97 57.78 1lm8 s GLU 98 Cb -0.09 -3.01 -0.10 0.00 2.00 0.00 0.00 34.13 32.93 1lm8 s GLU 98 CO 0.54 -0.40 1.91 -0.11 -0.56 0.00 0.00 175.26 176.65 1lm8 n LEU 99 N 0.70 3.98 -4.71 2.70 -0.00 -1.26 -4.90 117.00 113.52 1lm8 n LEU 99 Ca 0.01 0.94 -0.41 0.00 -0.00 0.00 0.00 56.01 56.55 1lm8 n LEU 99 Cb 0.40 -1.50 0.01 0.00 -0.00 0.00 0.00 43.42 42.33 1lm8 n LEU 99 CO 0.62 0.14 0.92 -0.81 -0.00 0.00 0.00 177.39 178.26 1lm8 n PRO 100 N 6.73 2.02 -0.32 1.96 -0.04 -1.26 -4.83 135.00 139.26 1lm8 n PRO 100 Ca 0.20 0.72 0.17 0.00 -0.04 0.00 0.00 63.50 64.54 1lm8 n PRO 100 Cb 0.37 -2.43 0.36 0.00 -0.04 0.00 0.00 33.50 31.76 1lm8 n PRO 100 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1lm8 h ASP 101 N 2.18 0.34 0.30 3.54 3.32 -1.96 0.18 116.42 124.32 1lm8 h ASP 101 Ca -0.48 0.17 0.00 0.00 0.02 0.00 0.00 57.03 56.74 1lm8 h ASP 101 Cb 1.29 0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.99 1lm8 h ASP 101 CO 0.60 -0.06 0.00 0.58 -1.72 0.00 0.00 179.24 178.64 1lm8 h VAL 102 N 0.35 0.00 -0.02 -1.35 2.07 -2.02 -1.89 116.25 113.39 1lm8 h VAL 102 Ca 0.62 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 68.00 1lm8 h VAL 102 Cb 1.27 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 32.02 1lm8 h VAL 102 CO -0.58 0.00 -0.08 0.23 0.02 0.00 0.00 177.57 177.16 1lm8 n MET 103 N -2.79 1.82 -3.12 1.57 2.81 0.61 -4.95 117.12 113.07 1lm8 n MET 103 Ca -0.01 -1.59 -0.35 0.00 -1.81 0.00 0.00 57.70 53.94 1lm8 n MET 103 Cb 0.13 -1.40 -0.06 0.00 -0.71 0.00 0.00 33.22 31.18 1lm8 n MET 103 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1lm8 s LYS 104 N -1.85 4.17 -0.92 0.03 1.02 -0.71 -4.92 119.74 116.55 1lm8 s LYS 104 Ca 0.23 0.80 -0.24 0.00 0.02 0.00 0.00 55.97 56.78 1lm8 s LYS 104 Cb 0.17 -2.75 -0.20 0.00 -0.52 0.00 0.00 37.83 34.54 1lm8 s LYS 104 CO 0.31 0.33 2.09 -2.30 -0.92 0.00 0.00 175.35 174.86 1lm8 n PRO 105 N 0.40 0.19 0.00 -1.68 -0.02 -1.26 -5.03 135.00 127.59 1lm8 n PRO 105 Ca -0.01 -1.31 0.08 0.00 -2.02 0.00 0.00 63.50 60.24 1lm8 n PRO 105 Cb 0.52 -3.55 0.06 0.00 -0.02 0.00 0.00 33.50 30.51 1lm8 n PRO 105 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52