#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dsl h PRO 4 N 0.00 -0.11 -0.80 -0.67 0.11 -2.04 -1.54 132.00 126.95 2dsl h PRO 4 Ca 0.00 0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.08 2dsl h PRO 4 Cb 0.00 0.02 -0.04 0.00 0.11 0.00 0.00 31.00 31.10 2dsl h PRO 4 CO 0.00 -0.07 0.35 0.35 -0.21 0.00 0.00 178.00 178.42 2dsl h PHE 5 N -0.11 1.18 -0.18 0.65 3.57 -2.04 0.19 116.94 120.20 2dsl h PHE 5 Ca 0.17 -0.08 0.02 0.00 3.53 0.00 0.00 57.97 61.62 2dsl h PHE 5 Cb 0.37 -0.36 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 2dsl h PHE 5 CO -0.37 0.88 0.04 0.52 -2.23 0.00 0.00 178.31 177.15 2dsl h MET 6 N 1.14 0.11 -0.65 1.11 2.86 -1.84 -1.85 114.93 115.81 2dsl h MET 6 Ca 0.27 -0.01 -0.05 0.00 -2.06 0.00 0.00 59.70 57.86 2dsl h MET 6 Cb 0.17 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.78 2dsl h MET 6 CO -0.03 0.07 0.23 0.93 1.06 0.00 0.00 176.91 179.17 2dsl h GLU 7 N 0.12 0.99 0.00 1.72 5.08 -0.94 -1.60 114.58 119.95 2dsl h GLU 7 Ca 0.08 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.23 2dsl h GLU 7 Cb 0.07 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.17 2dsl h GLU 7 CO -0.11 0.85 -0.05 0.00 -1.00 0.00 0.00 179.01 178.71 2dsl h ALA 8 N 1.09 1.48 -0.02 3.43 0.00 -0.63 -0.93 119.26 123.68 2dsl h ALA 8 Ca 0.21 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2dsl h ALA 8 Cb 0.25 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2dsl h ALA 8 CO -0.01 0.06 0.00 1.28 0.00 0.00 0.00 179.25 180.58 2dsl n LEU 9 N -3.83 2.21 -0.23 0.00 4.32 -0.73 -4.95 117.00 113.79 2dsl n LEU 9 Ca -0.03 -0.74 -0.03 0.00 -0.02 0.00 0.00 56.01 55.20 2dsl n LEU 9 Cb 0.14 -0.00 -0.01 0.00 -1.62 0.00 0.00 43.42 41.92 2dsl n LEU 9 CO 0.29 0.37 -0.03 0.61 -1.22 0.00 0.00 177.39 177.41 2dsl n GLY 10 N 1.26 0.62 3.79 -0.72 0.00 -0.35 -4.80 105.19 104.99 2dsl n GLY 10 Ca 0.17 -0.74 -0.36 0.00 0.00 0.00 0.00 46.02 45.09 2dsl n GLY 10 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dsl s LEU 11 N -0.70 4.23 0.04 0.99 1.43 -0.65 -4.67 118.68 119.35 2dsl s LEU 11 Ca 0.00 1.78 0.05 0.00 -1.03 0.00 0.00 54.13 54.93 2dsl s LEU 11 Cb 0.00 -4.15 -0.02 0.00 0.03 0.00 0.00 46.19 42.05 2dsl s LEU 11 CO 0.00 -0.14 -0.14 -0.54 0.23 0.00 0.00 176.35 175.75 2dsl s LYS 12 N -2.36 0.98 -0.18 1.70 -0.14 -0.09 -4.58 119.74 115.07 2dsl s LYS 12 Ca 0.53 -0.75 -0.22 0.00 -1.36 0.00 0.00 55.97 54.17 2dsl s LYS 12 Cb -0.16 -0.99 -0.02 0.00 -1.68 0.00 0.00 37.83 34.98 2dsl s LYS 12 CO 0.21 0.25 0.70 0.08 -0.76 0.00 0.00 175.35 175.82 2dsl s VAL 13 N -0.81 4.98 -0.02 3.17 1.01 -1.26 -0.56 120.40 126.91 2dsl s VAL 13 Ca 0.02 1.34 0.14 0.00 0.00 0.00 0.00 61.98 63.49 2dsl s VAL 13 Cb -0.08 -4.01 -0.22 0.00 0.00 0.00 0.00 36.38 32.07 2dsl s VAL 13 CO 0.01 0.09 0.31 0.18 0.00 0.00 0.00 175.10 175.70 2dsl n LEU 14 N 5.01 0.00 -3.72 3.92 4.77 0.41 -4.96 117.00 122.43 2dsl n LEU 14 Ca 0.00 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.85 2dsl n LEU 14 Cb 0.49 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.49 2dsl n LEU 14 CO 0.45 0.00 0.12 -2.28 -1.33 0.00 0.00 177.39 174.35 2dsl s HIS 15 N -2.98 -0.46 -0.16 -1.77 5.04 -1.11 -4.93 115.29 108.93 2dsl s HIS 15 Ca -0.05 1.09 -0.11 0.00 -1.54 0.00 0.00 55.06 54.45 2dsl s HIS 15 Cb 0.09 0.17 0.05 0.00 0.04 0.00 0.00 32.58 32.93 2dsl s HIS 15 CO 0.59 -0.26 0.39 -1.17 -2.34 0.00 0.00 174.74 171.95 2dsl s LEU 16 N 0.04 0.18 0.12 8.88 2.96 -1.26 -0.89 118.68 128.71 2dsl s LEU 16 Ca -0.02 0.83 -0.25 0.00 -0.22 0.00 0.00 54.13 54.47 2dsl s LEU 16 Cb -0.03 1.31 0.07 0.00 0.50 0.00 0.00 46.19 48.04 2dsl s LEU 16 CO 0.01 -0.17 0.89 0.00 -1.32 0.00 0.00 176.35 175.76 2dsl s ALA 17 N 0.91 -1.65 -0.20 5.97 0.00 -0.80 -4.98 121.76 121.01 2dsl s ALA 17 Ca -0.06 0.34 -0.36 0.00 0.00 0.00 0.00 51.96 51.89 2dsl s ALA 17 Cb -0.06 0.62 -0.12 0.00 0.00 0.00 0.00 23.12 23.55 2dsl s ALA 17 CO -0.07 -0.93 1.93 -2.30 0.00 0.00 0.00 175.76 174.39 2dsl n PRO 18 N -0.40 1.70 -0.98 0.00 -0.02 -1.26 -0.97 135.00 133.06 2dsl n PRO 18 Ca -0.07 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 2dsl n PRO 18 Cb 0.61 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 2dsl n PRO 18 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dsl n GLY 19 N 4.86 0.62 3.29 -1.23 0.00 -1.26 -5.01 105.19 106.45 2dsl n GLY 19 Ca 0.28 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.20 2dsl n GLY 19 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2dsl s GLU 20 N -0.17 1.02 -0.17 1.61 -1.05 -0.15 -2.85 118.70 116.94 2dsl s GLU 20 Ca 0.00 -0.95 -0.30 0.00 -0.15 0.00 0.00 54.97 53.57 2dsl s GLU 20 Cb 0.00 0.39 0.14 0.00 -0.44 0.00 0.00 34.13 34.22 2dsl s GLU 20 CO 0.00 -0.37 1.06 0.00 0.95 0.00 0.00 175.26 176.91 2dsl s ALA 21 N -3.88 -1.97 -0.08 -0.84 0.00 -1.14 -1.90 121.76 111.97 2dsl s ALA 21 Ca 0.08 1.61 0.02 0.00 0.00 0.00 0.00 51.96 53.67 2dsl s ALA 21 Cb 0.03 -0.77 0.01 0.00 0.00 0.00 0.00 23.12 22.40 2dsl s ALA 21 CO -0.08 -0.33 -0.12 0.08 0.00 0.00 0.00 175.76 175.31 2dsl s VAL 22 N -1.26 1.17 -0.05 0.00 1.01 -0.07 -0.49 120.40 120.71 2dsl s VAL 22 Ca 0.01 -0.48 0.06 0.00 0.00 0.00 0.00 61.98 61.57 2dsl s VAL 22 Cb -0.01 -1.08 -0.01 0.00 0.00 0.00 0.00 36.38 35.28 2dsl s VAL 22 CO -0.01 0.37 -0.23 -0.69 0.00 0.00 0.00 175.10 174.54 2dsl s VAL 23 N 0.81 1.88 0.15 2.92 1.01 -0.35 -0.44 120.40 126.37 2dsl s VAL 23 Ca -0.12 -0.97 0.09 0.00 0.00 0.00 0.00 61.98 60.97 2dsl s VAL 23 Cb -0.15 -1.59 -0.04 0.00 0.00 0.00 0.00 36.38 34.60 2dsl s VAL 23 CO 0.02 0.53 -0.19 0.00 0.00 0.00 0.00 175.10 175.45 2dsl s ALA 24 N -0.17 2.01 0.23 5.51 0.00 0.27 -0.01 121.76 129.60 2dsl s ALA 24 Ca -0.02 -1.45 -0.23 0.00 0.00 0.00 0.00 51.96 50.27 2dsl s ALA 24 Cb -0.13 -0.21 0.04 0.00 0.00 0.00 0.00 23.12 22.82 2dsl s ALA 24 CO 0.03 0.28 0.81 0.20 0.00 0.00 0.00 175.76 177.08 2dsl s GLY 25 N -2.50 -0.15 0.02 0.00 0.00 -0.25 -0.91 107.32 103.54 2dsl s GLY 25 Ca 0.14 -0.13 0.09 0.00 0.00 0.00 0.00 44.72 44.81 2dsl s GLY 25 CO 0.06 -0.05 -0.26 1.85 0.00 0.00 0.00 173.10 174.70 2dsl s GLU 26 N -3.67 1.87 -0.51 2.90 2.12 -1.26 -0.57 118.70 119.58 2dsl s GLU 26 Ca 0.11 -1.04 -0.28 0.00 0.36 0.00 0.00 54.97 54.12 2dsl s GLU 26 Cb -0.04 -1.96 0.01 0.00 0.26 0.00 0.00 34.13 32.39 2dsl s GLU 26 CO 0.05 0.52 1.47 0.08 -0.54 0.00 0.00 175.26 176.84 2dsl s VAL 27 N -0.74 3.76 0.62 3.70 1.01 0.30 -4.96 120.40 124.09 2dsl s VAL 27 Ca 0.11 0.68 0.01 0.00 0.00 0.00 0.00 61.98 62.78 2dsl s VAL 27 Cb -0.10 -4.29 0.07 0.00 0.00 0.00 0.00 36.38 32.06 2dsl s VAL 27 CO 0.01 -1.00 0.86 -0.13 0.00 0.00 0.00 175.10 174.84 2dsl s ARG 28 N 5.50 2.21 0.51 2.72 0.52 -1.26 -0.42 118.95 128.73 2dsl s ARG 28 Ca 0.57 -0.92 0.17 0.00 -0.52 0.00 0.00 55.73 55.04 2dsl s ARG 28 Cb -0.12 -2.43 1.26 0.00 0.52 0.00 0.00 34.95 34.18 2dsl s ARG 28 CO 0.27 -1.00 2.11 0.00 0.02 0.00 0.00 175.30 176.69 2dsl h ALA 29 N -0.16 2.08 -0.23 2.13 0.00 -2.00 -0.45 119.26 120.63 2dsl h ALA 29 Ca -0.40 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2dsl h ALA 29 Cb 1.29 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2dsl h ALA 29 CO 0.48 -0.12 0.00 -0.40 0.00 0.00 0.00 179.25 179.21 2dsl n ASP 30 N -4.50 1.36 -0.27 0.00 5.75 -1.26 -3.54 116.55 114.09 2dsl n ASP 30 Ca 0.00 -2.03 0.03 0.00 -0.01 0.00 0.00 54.79 52.79 2dsl n ASP 30 Cb 0.20 -0.19 0.04 0.00 -1.03 0.00 0.00 41.12 40.14 2dsl n ASP 30 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 2dsl n HIS 31 N 0.19 0.05 -2.44 2.11 8.25 -0.18 -5.04 115.22 118.16 2dsl n HIS 31 Ca 0.08 -0.09 -0.30 0.00 -0.26 0.00 0.00 57.72 57.15 2dsl n HIS 31 Cb 0.23 -0.01 -0.01 0.00 1.12 0.00 0.00 29.99 31.32 2dsl n HIS 31 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2dsl s LEU 32 N -0.61 3.57 0.00 2.41 1.43 -1.23 -0.78 118.68 123.46 2dsl s LEU 32 Ca 0.08 1.20 0.00 0.00 -1.03 0.00 0.00 54.13 54.39 2dsl s LEU 32 Cb 0.05 -4.16 0.00 0.00 0.03 0.00 0.00 46.19 42.11 2dsl s LEU 32 CO 0.08 -0.62 0.00 -0.90 0.23 0.00 0.00 176.35 175.14 2dsl n ASP 33 N -2.07 1.31 0.27 2.29 5.68 0.08 -4.64 116.55 119.46 2dsl n ASP 33 Ca 0.03 -0.17 0.18 0.00 -0.50 0.00 0.00 54.79 54.34 2dsl n ASP 33 Cb 0.54 0.00 0.91 0.00 -1.14 0.00 0.00 41.12 41.43 2dsl n ASP 33 CO 0.00 0.00 0.00 0.17 -1.33 0.00 0.00 177.20 176.04 2dsl h LEU 34 N 0.00 0.00 0.00 -2.12 8.10 -1.99 -2.01 115.31 117.29 2dsl h LEU 34 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.99 2dsl h LEU 34 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.22 2dsl h LEU 34 CO 0.00 0.00 -0.83 1.41 -4.11 0.00 0.00 178.44 174.91 2dsl n HIS 35 N -2.86 0.48 -0.32 0.17 8.25 -1.26 -4.94 115.22 114.73 2dsl n HIS 35 Ca -0.01 0.14 0.00 0.00 -0.26 0.00 0.00 57.72 57.59 2dsl n HIS 35 Cb 0.14 -0.60 0.00 0.00 1.12 0.00 0.00 29.99 30.65 2dsl n HIS 35 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dsl n GLY 36 N 1.33 0.79 3.74 -1.41 0.00 -0.76 -5.06 105.19 103.83 2dsl n GLY 36 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 2dsl n GLY 36 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dsl s THR 37 N -2.17 1.51 0.05 2.61 -4.23 -1.26 -4.48 115.64 107.67 2dsl s THR 37 Ca 0.00 -1.92 -0.33 0.00 -1.18 0.00 0.00 61.69 58.25 2dsl s THR 37 Cb 0.00 -2.44 -0.12 0.00 1.34 0.00 0.00 72.50 71.28 2dsl s THR 37 CO 0.00 0.00 1.79 0.00 -0.54 0.00 0.00 174.62 175.87 2dsl n ALA 38 N -1.24 1.40 -1.77 3.99 0.00 0.55 -0.74 120.51 122.69 2dsl n ALA 38 Ca -0.12 0.33 -0.41 0.00 0.00 0.00 0.00 53.44 53.24 2dsl n ALA 38 Cb 0.67 -2.49 -0.01 0.00 0.00 0.00 0.00 19.45 17.61 2dsl n ALA 38 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2dsl s HIS 39 N 2.85 2.76 0.51 0.00 2.46 0.04 -4.76 115.29 119.14 2dsl s HIS 39 Ca 0.86 1.29 0.22 0.00 0.47 0.00 0.00 55.06 57.89 2dsl s HIS 39 Cb -0.62 -3.86 1.31 0.00 -0.13 0.00 0.00 32.58 29.28 2dsl s HIS 39 CO 0.43 -2.50 2.01 0.78 -2.47 0.00 0.00 174.74 172.99 2dsl h GLY 40 N 3.04 0.12 1.99 1.59 0.00 -1.91 -0.56 103.07 107.35 2dsl h GLY 40 Ca -0.50 -0.03 -0.12 0.00 0.00 0.00 0.00 47.33 46.68 2dsl h GLY 40 CO 0.64 0.02 -0.57 -1.33 0.00 0.00 0.00 176.54 175.29 2dsl h GLY 41 N 0.08 0.01 0.55 4.60 0.00 -1.95 -1.47 103.07 104.88 2dsl h GLY 41 Ca 0.23 -0.01 -0.02 0.00 0.00 0.00 0.00 47.33 47.52 2dsl h GLY 41 CO -0.02 0.01 -0.07 -2.75 0.00 0.00 0.00 176.54 173.71 2dsl h PHE 42 N 0.01 0.15 -0.77 5.60 3.57 -1.43 0.42 116.94 124.49 2dsl h PHE 42 Ca -0.01 -0.05 -0.02 0.00 3.53 0.00 0.00 57.97 61.42 2dsl h PHE 42 Cb 1.02 -0.03 -0.04 0.00 2.79 0.00 0.00 35.95 39.69 2dsl h PHE 42 CO 0.00 0.64 0.40 -0.07 -2.23 0.00 0.00 178.31 177.05 2dsl h LEU 43 N -0.38 0.97 -0.38 0.59 3.38 -1.48 -0.66 115.31 117.35 2dsl h LEU 43 Ca 0.00 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 57.82 2dsl h LEU 43 Cb 0.62 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 2dsl h LEU 43 CO 0.02 0.80 -0.01 0.22 0.09 0.00 0.00 178.44 179.55 2dsl h TYR 44 N 1.08 0.75 -1.00 1.13 5.03 -1.27 -1.98 116.97 120.71 2dsl h TYR 44 Ca 0.27 -0.14 0.08 0.00 2.58 0.00 0.00 58.73 61.52 2dsl h TYR 44 Cb 0.06 -0.19 -0.07 0.00 1.55 0.00 0.00 36.73 38.08 2dsl h TYR 44 CO 0.01 0.78 0.65 0.00 -1.32 0.00 0.00 178.16 178.28 2dsl h ALA 45 N 0.87 1.43 0.41 1.82 0.00 -0.38 0.43 119.26 123.84 2dsl h ALA 45 Ca 0.11 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2dsl h ALA 45 Cb 0.49 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2dsl h ALA 45 CO 0.02 0.40 -0.20 1.25 0.00 0.00 0.00 179.25 180.73 2dsl h LEU 46 N 1.14 -0.47 -0.55 0.00 5.85 -0.92 -0.46 115.31 119.91 2dsl h LEU 46 Ca 0.45 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 59.16 2dsl h LEU 46 Cb 0.23 0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.36 2dsl h LEU 46 CO -0.19 -0.32 0.31 0.00 -0.34 0.00 0.00 178.44 177.90 2dsl h ALA 47 N 0.01 0.70 -0.55 1.25 0.00 -0.87 -2.47 119.26 117.32 2dsl h ALA 47 Ca -0.06 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.77 2dsl h ALA 47 Cb 0.44 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 2dsl h ALA 47 CO 0.09 0.20 0.37 0.22 0.00 0.00 0.00 179.25 180.13 2dsl h ASP 48 N 0.73 0.64 -0.57 0.00 3.58 -0.09 -0.29 116.42 120.42 2dsl h ASP 48 Ca 0.19 -0.02 -0.08 0.00 0.42 0.00 0.00 57.03 57.54 2dsl h ASP 48 Cb 0.02 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 40.89 2dsl h ASP 48 CO -0.03 0.46 0.03 0.28 -2.88 0.00 0.00 179.24 177.10 2dsl h SER 49 N 0.75 0.95 -0.63 2.28 0.02 -0.64 0.26 113.55 116.55 2dsl h SER 49 Ca 0.20 -0.29 -0.08 0.00 -0.84 0.00 0.00 61.79 60.78 2dsl h SER 49 Cb -0.09 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.17 2dsl h SER 49 CO -0.04 1.01 0.09 0.00 -1.14 0.00 0.00 176.83 176.75 2dsl h ALA 50 N 0.98 0.95 -0.53 3.77 0.00 -1.07 -1.45 119.26 121.91 2dsl h ALA 50 Ca 0.17 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.81 2dsl h ALA 50 Cb 0.50 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2dsl h ALA 50 CO 0.02 0.65 0.35 0.35 0.00 0.00 0.00 179.25 180.62 2dsl h PHE 51 N 0.99 0.66 -0.48 0.00 3.57 -0.72 0.23 116.94 121.20 2dsl h PHE 51 Ca 0.20 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.68 2dsl h PHE 51 Cb 0.44 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.94 2dsl h PHE 51 CO 0.03 0.41 0.18 0.00 -2.23 0.00 0.00 178.31 176.71 2dsl h ALA 52 N 1.20 0.62 -0.05 2.41 0.00 -0.25 -1.00 119.26 122.18 2dsl h ALA 52 Ca 0.20 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2dsl h ALA 52 Cb -0.07 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 2dsl h ALA 52 CO -0.05 0.24 0.01 -0.07 0.00 0.00 0.00 179.25 179.38 2dsl h LEU 53 N 0.63 0.07 -0.18 0.00 3.38 -1.01 -1.62 115.31 116.58 2dsl h LEU 53 Ca 0.16 -0.23 0.01 0.00 0.09 0.00 0.00 57.88 57.90 2dsl h LEU 53 Cb 0.21 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 2dsl h LEU 53 CO -0.01 0.28 0.10 0.00 0.09 0.00 0.00 178.44 178.91 2dsl h ALA 54 N 0.79 0.22 -0.85 1.53 0.00 -0.93 -2.78 119.26 117.24 2dsl h ALA 54 Ca 0.01 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2dsl h ALA 54 Cb 0.24 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 2dsl h ALA 54 CO 0.00 -0.31 0.46 0.66 0.00 0.00 0.00 179.25 180.05 2dsl h SER 55 N 0.22 1.07 0.50 0.00 4.64 -1.18 -2.63 113.55 116.16 2dsl h SER 55 Ca 0.07 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2dsl h SER 55 Cb -0.00 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 61.81 2dsl h SER 55 CO -0.03 0.87 0.00 0.59 -0.87 0.00 0.00 176.83 177.38 2dsl n ASN 56 N -4.33 0.00 0.17 4.97 3.02 -0.61 -2.38 115.26 116.10 2dsl n ASN 56 Ca 0.09 -0.05 0.13 0.00 -0.03 0.00 0.00 54.58 54.73 2dsl n ASN 56 Cb 0.11 -0.30 0.55 0.00 -0.61 0.00 0.00 39.78 39.52 2dsl n ASN 56 CO 0.00 0.00 0.00 0.71 -2.62 0.00 0.00 177.26 175.35 2dsl h THR 57 N 0.00 0.00 -0.02 3.41 1.35 -1.20 -2.32 112.91 114.14 2dsl h THR 57 Ca 0.00 -0.32 0.00 0.00 -0.55 0.00 0.00 66.41 65.54 2dsl h THR 57 Cb 0.25 1.14 0.00 0.00 -1.73 0.00 0.00 68.15 67.81 2dsl h THR 57 CO 0.00 0.00 -0.15 0.54 -0.25 0.00 0.00 175.52 175.66 2dsl n ARG 58 N -2.49 1.65 0.00 4.72 5.12 -1.00 -4.80 116.66 119.86 2dsl n ARG 58 Ca 0.02 -1.21 0.00 0.00 -1.93 0.00 0.00 57.85 54.72 2dsl n ARG 58 Cb 0.26 -1.47 0.00 0.00 -1.16 0.00 0.00 32.46 30.08 2dsl n ARG 58 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2dsl n GLY 59 N 1.32 3.09 3.64 -0.13 0.00 -0.87 -5.05 105.19 107.18 2dsl n GLY 59 Ca 0.14 -1.94 -0.51 0.00 0.00 0.00 0.00 46.02 43.70 2dsl n GLY 59 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dsl n PRO 60 N -1.33 1.47 -3.77 1.61 -0.04 -1.26 -4.26 135.00 127.42 2dsl n PRO 60 Ca 0.00 0.53 -0.13 0.00 -0.04 0.00 0.00 63.50 63.86 2dsl n PRO 60 Cb 0.00 -2.23 -0.11 0.00 -0.04 0.00 0.00 33.50 31.12 2dsl n PRO 60 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dsl s ALA 61 N 1.51 -0.75 0.03 0.55 0.00 -1.26 -1.10 121.76 120.74 2dsl s ALA 61 Ca 0.87 0.82 0.08 0.00 0.00 0.00 0.00 51.96 53.72 2dsl s ALA 61 Cb -0.89 -0.46 -0.03 0.00 0.00 0.00 0.00 23.12 21.74 2dsl s ALA 61 CO 0.49 -0.15 -0.22 0.14 0.00 0.00 0.00 175.76 176.01 2dsl s VAL 62 N 0.05 2.44 0.31 0.00 -7.23 -0.46 -4.87 120.40 110.63 2dsl s VAL 62 Ca -0.01 -1.25 -0.29 0.00 -1.81 0.00 0.00 61.98 58.62 2dsl s VAL 62 Cb -0.02 -1.97 -0.10 0.00 0.56 0.00 0.00 36.38 34.84 2dsl s VAL 62 CO 0.01 0.39 1.23 0.00 -0.31 0.00 0.00 175.10 176.41 2dsl s ALA 63 N -0.83 3.46 -0.09 1.32 0.00 -1.26 0.16 121.76 124.52 2dsl s ALA 63 Ca 0.13 1.12 -0.10 0.00 0.00 0.00 0.00 51.96 53.10 2dsl s ALA 63 Cb -0.10 -3.42 -0.04 0.00 0.00 0.00 0.00 23.12 19.55 2dsl s ALA 63 CO 0.03 -0.46 -0.21 1.28 0.00 0.00 0.00 175.76 176.40 2dsl n LEU 64 N 0.94 1.50 -3.79 0.00 4.77 0.06 -4.82 117.00 115.66 2dsl n LEU 64 Ca -0.00 0.24 -0.14 0.00 -0.03 0.00 0.00 56.01 56.08 2dsl n LEU 64 Cb 0.43 -0.56 -0.15 0.00 -2.33 0.00 0.00 43.42 40.82 2dsl n LEU 64 CO 0.57 -0.28 -0.30 -0.55 -1.33 0.00 0.00 177.39 175.50 2dsl s SER 65 N -6.07 -0.02 0.04 -1.43 0.15 -1.14 -5.02 113.70 100.20 2dsl s SER 65 Ca -0.19 0.14 0.04 0.00 0.70 0.00 0.00 55.95 56.64 2dsl s SER 65 Cb 0.04 0.06 -0.02 0.00 -1.71 0.00 0.00 66.02 64.39 2dsl s SER 65 CO 0.26 -0.10 -0.11 0.00 1.20 0.00 0.00 173.24 174.50 2dsl s ARG 67 N -1.25 1.62 -0.10 0.00 3.52 0.16 -4.98 118.95 117.93 2dsl s ARG 67 Ca -0.03 -0.84 -0.00 0.00 -0.13 0.00 0.00 55.73 54.73 2dsl s ARG 67 Cb -0.08 -1.64 0.02 0.00 -1.56 0.00 0.00 34.95 31.69 2dsl s ARG 67 CO 0.01 0.44 -0.06 1.41 -0.81 0.00 0.00 175.30 176.28 2dsl s MET 68 N -0.77 1.33 -0.20 5.12 -2.45 -1.26 -1.03 119.30 120.05 2dsl s MET 68 Ca 0.08 -0.19 -0.03 0.00 -1.25 0.00 0.00 55.69 54.30 2dsl s MET 68 Cb -0.08 -1.41 -0.01 0.00 1.25 0.00 0.00 34.83 34.57 2dsl s MET 68 CO 0.00 -0.23 -0.05 -0.51 1.05 0.00 0.00 175.02 175.27 2dsl s ASP 69 N 1.61 4.30 -0.16 1.11 1.01 0.50 -4.98 116.67 120.06 2dsl s ASP 69 Ca 0.02 -0.36 -0.10 0.00 0.71 0.00 0.00 52.55 52.82 2dsl s ASP 69 Cb -0.13 -1.72 -0.05 0.00 1.01 0.00 0.00 42.92 42.03 2dsl s ASP 69 CO -0.06 0.02 0.17 -0.31 0.21 0.00 0.00 175.17 175.20 2dsl s TYR 70 N 1.22 3.49 -0.09 4.23 2.02 -1.26 -0.61 117.35 126.34 2dsl s TYR 70 Ca 0.03 0.46 0.06 0.00 -0.37 0.00 0.00 57.07 57.25 2dsl s TYR 70 Cb -0.14 -2.13 -0.10 0.00 -0.40 0.00 0.00 41.96 39.18 2dsl s TYR 70 CO -0.02 0.43 0.00 1.19 -1.57 0.00 0.00 175.55 175.58 2dsl n PHE 71 N 3.01 0.00 -3.70 2.71 3.72 -0.08 -4.98 117.46 118.14 2dsl n PHE 71 Ca -0.16 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.13 2dsl n PHE 71 Cb 0.53 -0.43 -0.10 0.00 -0.94 0.00 0.00 39.48 38.53 2dsl n PHE 71 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 2dsl s ARG 72 N -2.22 0.43 0.30 -1.08 3.52 -1.20 -5.05 118.95 113.66 2dsl s ARG 72 Ca -0.07 0.75 -0.29 0.00 -0.13 0.00 0.00 55.73 55.99 2dsl s ARG 72 Cb 0.03 0.05 -0.10 0.00 -1.56 0.00 0.00 34.95 33.37 2dsl s ARG 72 CO 0.34 -0.13 1.31 -1.25 -0.81 0.00 0.00 175.30 174.76 2dsl s PRO 73 N 1.09 4.36 -0.08 5.12 0.05 -1.26 -4.94 135.00 139.34 2dsl s PRO 73 Ca -0.07 2.19 -0.00 0.00 0.05 0.00 0.00 61.00 63.16 2dsl s PRO 73 Cb -0.07 -3.09 -0.03 0.00 0.05 0.00 0.00 34.50 31.36 2dsl s PRO 73 CO -0.09 -0.20 -0.03 -0.51 0.05 0.00 0.00 177.00 176.21 2dsl s LEU 74 N -1.42 3.37 0.64 -3.56 1.43 -1.26 -4.98 118.68 112.89 2dsl s LEU 74 Ca 0.51 0.06 -0.03 0.00 -1.03 0.00 0.00 54.13 53.63 2dsl s LEU 74 Cb -0.39 -1.75 0.05 0.00 0.03 0.00 0.00 46.19 44.12 2dsl s LEU 74 CO 0.50 0.37 0.91 -0.83 0.23 0.00 0.00 176.35 177.53 2dsl s GLY 75 N -0.85 1.73 0.27 -3.19 0.00 -1.26 -0.33 107.32 103.70 2dsl s GLY 75 Ca 0.13 -1.07 -0.30 0.00 0.00 0.00 0.00 44.72 43.47 2dsl s GLY 75 CO 0.02 -0.72 1.50 0.00 0.00 0.00 0.00 173.10 173.90 2dsl n ALA 76 N -2.67 1.86 0.00 3.20 0.00 -1.26 -2.25 120.51 119.39 2dsl n ALA 76 Ca 0.08 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.90 2dsl n ALA 76 Cb 0.60 -2.37 0.00 0.00 0.00 0.00 0.00 19.45 17.68 2dsl n ALA 76 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dsl n GLY 77 N 2.06 0.95 3.77 0.00 0.00 0.44 -5.00 105.19 107.41 2dsl n GLY 77 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 2dsl n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dsl n ALA 78 N -1.74 2.24 -2.71 4.61 0.00 -0.95 -4.55 120.51 117.40 2dsl n ALA 78 Ca 0.00 0.33 -0.36 0.00 0.00 0.00 0.00 53.44 53.40 2dsl n ALA 78 Cb 0.00 -2.40 -0.07 0.00 0.00 0.00 0.00 19.45 16.97 2dsl n ALA 78 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2dsl s ARG 79 N -2.15 4.22 0.04 0.00 3.52 -1.26 -0.54 118.95 122.78 2dsl s ARG 79 Ca 0.55 0.03 0.07 0.00 -0.13 0.00 0.00 55.73 56.24 2dsl s ARG 79 Cb -0.48 -3.45 -0.02 0.00 -1.56 0.00 0.00 34.95 29.44 2dsl s ARG 79 CO 0.63 0.19 -0.19 0.14 -0.81 0.00 0.00 175.30 175.25 2dsl s VAL 80 N 0.63 1.56 -0.04 7.11 -7.23 0.27 -4.49 120.40 118.21 2dsl s VAL 80 Ca 0.15 -1.14 0.03 0.00 -1.81 0.00 0.00 61.98 59.21 2dsl s VAL 80 Cb -0.13 -1.36 0.00 0.00 0.56 0.00 0.00 36.38 35.45 2dsl s VAL 80 CO 0.04 0.19 -0.13 -0.70 -0.31 0.00 0.00 175.10 174.18 2dsl s GLU 81 N -1.12 1.48 -0.24 4.82 2.12 -0.48 -1.09 118.70 124.19 2dsl s GLU 81 Ca 0.06 -0.45 -0.03 0.00 0.36 0.00 0.00 54.97 54.91 2dsl s GLU 81 Cb -0.09 -1.29 0.01 0.00 0.26 0.00 0.00 34.13 33.02 2dsl s GLU 81 CO 0.02 0.14 -0.03 0.00 -0.54 0.00 0.00 175.26 174.85 2dsl s ALA 82 N 0.25 2.80 -0.34 6.30 0.00 0.98 -0.32 121.76 131.43 2dsl s ALA 82 Ca -0.06 -1.33 -0.07 0.00 0.00 0.00 0.00 51.96 50.50 2dsl s ALA 82 Cb -0.12 -1.76 0.04 0.00 0.00 0.00 0.00 23.12 21.28 2dsl s ALA 82 CO 0.02 -0.65 0.11 1.03 0.00 0.00 0.00 175.76 176.27 2dsl s ARG 83 N 1.42 2.68 -0.12 0.00 0.52 0.23 -1.22 118.95 122.46 2dsl s ARG 83 Ca 0.03 -1.14 -0.13 0.00 -0.52 0.00 0.00 55.73 53.97 2dsl s ARG 83 Cb -0.16 -3.48 -0.05 0.00 0.52 0.00 0.00 34.95 31.79 2dsl s ARG 83 CO -0.03 -0.65 0.29 0.00 0.02 0.00 0.00 175.30 174.93 2dsl s ALA 84 N 1.42 3.66 0.03 2.13 0.00 0.35 -1.35 121.76 128.00 2dsl s ALA 84 Ca -0.01 -0.44 0.03 0.00 0.00 0.00 0.00 51.96 51.55 2dsl s ALA 84 Cb -0.19 -2.32 -0.02 0.00 0.00 0.00 0.00 23.12 20.59 2dsl s ALA 84 CO 0.03 0.25 -0.10 0.14 0.00 0.00 0.00 175.76 176.09 2dsl s VAL 85 N -0.09 0.74 -0.14 0.00 -7.23 -0.08 -2.86 120.40 110.73 2dsl s VAL 85 Ca 0.18 -0.78 -0.29 0.00 -1.81 0.00 0.00 61.98 59.27 2dsl s VAL 85 Cb -0.14 -0.69 -0.01 0.00 0.56 0.00 0.00 36.38 36.11 2dsl s VAL 85 CO 0.06 -0.07 1.01 -0.70 -0.31 0.00 0.00 175.10 175.09 2dsl s GLU 86 N -0.95 4.38 -0.21 4.82 2.12 -1.13 -1.10 118.70 126.63 2dsl s GLU 86 Ca -0.02 1.38 -0.00 0.00 0.36 0.00 0.00 54.97 56.69 2dsl s GLU 86 Cb -0.07 -3.57 -0.20 0.00 0.26 0.00 0.00 34.13 30.55 2dsl s GLU 86 CO 0.00 -0.39 -0.01 0.28 -0.54 0.00 0.00 175.26 174.60 2dsl n VAL 87 N 4.74 1.59 -3.73 3.70 0.31 0.40 -4.93 118.33 120.41 2dsl n VAL 87 Ca 0.09 -0.61 -0.13 0.00 -0.01 0.00 0.00 64.34 63.69 2dsl n VAL 87 Cb 0.48 -1.50 -0.10 0.00 -0.91 0.00 0.00 33.84 31.81 2dsl n VAL 87 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2dsl s ASN 88 N -6.67 -0.43 -0.25 4.52 2.47 -0.89 -4.97 114.94 108.72 2dsl s ASN 88 Ca -0.30 0.83 -0.00 0.00 0.42 0.00 0.00 52.86 53.81 2dsl s ASN 88 Cb 0.08 0.84 0.07 0.00 -1.45 0.00 0.00 41.25 40.79 2dsl s ASN 88 CO 0.67 -0.15 0.02 -0.22 -3.72 0.00 0.00 177.10 173.70 2dsl s LEU 89 N 0.29 2.23 0.54 3.21 2.96 -1.26 -0.68 118.68 125.97 2dsl s LEU 89 Ca -0.01 -1.27 0.07 0.00 -0.22 0.00 0.00 54.13 52.71 2dsl s LEU 89 Cb -0.03 -0.96 0.05 0.00 0.50 0.00 0.00 46.19 45.75 2dsl s LEU 89 CO -0.00 -0.31 0.52 -0.44 -1.32 0.00 0.00 176.35 174.79 2dsl s SER 90 N 1.56 4.80 0.19 3.68 0.01 0.11 -5.01 113.70 119.03 2dsl s SER 90 Ca 0.01 -1.10 0.03 0.00 1.31 0.00 0.00 55.95 56.21 2dsl s SER 90 Cb -0.18 0.32 0.10 0.00 0.21 0.00 0.00 66.02 66.47 2dsl s SER 90 CO -0.12 -1.14 1.45 -0.09 0.41 0.00 0.00 173.24 173.75 2dsl h ARG 91 N 0.60 0.21 0.00 12.44 2.43 -2.01 -3.34 114.38 124.71 2dsl h ARG 91 Ca -0.35 -0.19 0.00 0.00 -0.81 0.00 0.00 59.98 58.63 2dsl h ARG 91 Cb 1.30 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.89 2dsl h ARG 91 CO 0.52 0.87 -0.56 0.54 -1.51 0.00 0.00 179.97 179.83 2dsl n ARG 92 N -3.74 3.40 -3.97 0.20 5.12 -1.26 -4.79 116.66 111.62 2dsl n ARG 92 Ca -0.03 -0.01 -0.09 0.00 -1.93 0.00 0.00 57.85 55.79 2dsl n ARG 92 Cb 0.73 -0.99 -0.08 0.00 -1.16 0.00 0.00 32.46 30.96 2dsl n ARG 92 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 2dsl s THR 93 N -2.01 0.13 -0.03 0.55 -4.23 -1.25 -0.17 115.64 108.62 2dsl s THR 93 Ca 0.03 -1.45 -0.19 0.00 -1.18 0.00 0.00 61.69 58.89 2dsl s THR 93 Cb 0.07 -1.62 0.04 0.00 1.34 0.00 0.00 72.50 72.33 2dsl s THR 93 CO 0.41 -0.58 0.42 0.00 -0.54 0.00 0.00 174.62 174.33 2dsl s ALA 94 N -3.93 -1.08 -0.02 3.99 0.00 -0.99 0.05 121.76 119.79 2dsl s ALA 94 Ca 0.12 0.66 0.05 0.00 0.00 0.00 0.00 51.96 52.79 2dsl s ALA 94 Cb 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 23.12 23.16 2dsl s ALA 94 CO -0.06 -0.29 -0.17 0.99 0.00 0.00 0.00 175.76 176.24 2dsl s THR 95 N -1.18 1.33 0.08 0.00 2.01 0.14 -0.57 115.64 117.44 2dsl s THR 95 Ca -0.12 -0.71 0.05 0.00 0.31 0.00 0.00 61.69 61.22 2dsl s THR 95 Cb -0.04 -1.11 -0.03 0.00 0.01 0.00 0.00 72.50 71.33 2dsl s THR 95 CO 0.06 0.38 -0.15 -0.31 -0.69 0.00 0.00 174.62 173.91 2dsl s TYR 96 N -0.34 1.27 -0.12 4.92 1.51 0.11 -0.45 117.35 124.24 2dsl s TYR 96 Ca 0.05 -0.46 -0.01 0.00 -1.01 0.00 0.00 57.07 55.64 2dsl s TYR 96 Cb -0.07 -0.71 -0.03 0.00 -0.11 0.00 0.00 41.96 41.04 2dsl s TYR 96 CO -0.00 0.07 -0.06 0.50 -1.11 0.00 0.00 175.55 174.95 2dsl s ARG 97 N -1.80 3.25 -0.18 -0.62 3.52 -0.26 -1.60 118.95 121.26 2dsl s ARG 97 Ca -0.01 -0.55 -0.00 0.00 -0.13 0.00 0.00 55.73 55.04 2dsl s ARG 97 Cb -0.10 -2.75 0.04 0.00 -1.56 0.00 0.00 34.95 30.59 2dsl s ARG 97 CO 0.02 0.42 -0.06 0.08 -0.81 0.00 0.00 175.30 174.95 2dsl s VAL 98 N -0.14 1.25 -0.15 7.11 1.01 0.71 -0.91 120.40 129.28 2dsl s VAL 98 Ca 0.02 -0.75 -0.18 0.00 0.00 0.00 0.00 61.98 61.07 2dsl s VAL 98 Cb -0.13 -1.41 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 2dsl s VAL 98 CO 0.03 0.11 0.46 -1.61 0.00 0.00 0.00 175.10 174.10 2dsl s GLU 99 N 1.57 4.28 -0.31 2.72 2.02 -0.46 -0.87 118.70 127.66 2dsl s GLU 99 Ca -0.00 0.39 -0.11 0.00 0.02 0.00 0.00 54.97 55.27 2dsl s GLU 99 Cb -0.16 -3.47 -0.02 0.00 0.10 0.00 0.00 34.13 30.58 2dsl s GLU 99 CO -0.08 0.07 0.18 0.08 0.02 0.00 0.00 175.26 175.54 2dsl s VAL 100 N 0.92 4.94 -0.02 2.63 1.01 -0.52 -0.60 120.40 128.76 2dsl s VAL 100 Ca 0.24 -0.21 0.07 0.00 0.00 0.00 0.00 61.98 62.09 2dsl s VAL 100 Cb -0.15 -3.47 -0.02 0.00 0.00 0.00 0.00 36.38 32.74 2dsl s VAL 100 CO 0.09 0.11 -0.23 -0.69 0.00 0.00 0.00 175.10 174.39 2dsl s VAL 101 N 1.68 2.36 -0.07 2.92 1.01 0.56 -0.28 120.40 128.59 2dsl s VAL 101 Ca 0.06 -1.05 -0.04 0.00 0.00 0.00 0.00 61.98 60.95 2dsl s VAL 101 Cb -0.17 -1.87 0.03 0.00 0.00 0.00 0.00 36.38 34.37 2dsl s VAL 101 CO 0.08 0.54 0.16 -0.55 0.00 0.00 0.00 175.10 175.34 2dsl s SER 102 N -0.76 -0.15 -1.41 3.32 0.15 -0.52 -1.39 113.70 112.94 2dsl s SER 102 Ca 0.11 0.34 -0.09 0.00 0.70 0.00 0.00 55.95 57.00 2dsl s SER 102 Cb -0.10 0.26 0.06 0.00 -1.71 0.00 0.00 66.02 64.53 2dsl s SER 102 CO 0.00 -0.12 0.64 -0.62 1.20 0.00 0.00 173.24 174.34 2dsl n GLU 103 N 3.81 -4.26 -1.00 5.44 1.02 -1.26 -1.62 120.64 122.77 2dsl n GLU 103 Ca -0.22 0.60 -0.00 0.00 -0.02 0.00 0.00 57.16 57.53 2dsl n GLU 103 Cb 0.54 -5.39 -0.00 0.00 -0.02 0.00 0.00 31.44 26.57 2dsl n GLU 103 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dsl n GLY 104 N -1.38 0.35 3.29 0.62 0.00 -1.26 -5.01 105.19 101.80 2dsl n GLY 104 Ca -0.02 -0.02 -0.23 0.00 0.00 0.00 0.00 46.02 45.75 2dsl n GLY 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dsl s LYS 105 N -0.66 1.14 -0.26 1.61 1.02 -0.64 -5.10 119.74 116.84 2dsl s LYS 105 Ca 0.00 -1.21 -0.29 0.00 0.02 0.00 0.00 55.97 54.49 2dsl s LYS 105 Cb 0.00 -1.34 0.00 0.00 -0.52 0.00 0.00 37.83 35.97 2dsl s LYS 105 CO 0.00 0.30 1.19 -1.17 -0.92 0.00 0.00 175.35 174.75 2dsl s LEU 106 N -2.09 4.00 -0.00 3.17 2.96 -1.26 -1.43 118.68 124.03 2dsl s LEU 106 Ca 0.08 1.31 0.16 0.00 -0.22 0.00 0.00 54.13 55.46 2dsl s LEU 106 Cb -0.09 -3.54 -0.18 0.00 0.50 0.00 0.00 46.19 42.88 2dsl s LEU 106 CO 0.05 -0.88 0.64 1.33 -1.32 0.00 0.00 176.35 176.16 2dsl n VAL 107 N 5.77 0.00 -3.51 1.68 0.24 0.62 -4.87 118.33 118.26 2dsl n VAL 107 Ca 0.13 -0.15 -0.14 0.00 -2.04 0.00 0.00 64.34 62.14 2dsl n VAL 107 Cb 0.46 0.92 -0.05 0.00 -1.47 0.00 0.00 33.84 33.71 2dsl n VAL 107 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dsl s ALA 108 N -2.54 -1.78 -0.07 2.33 0.00 -1.14 -0.90 121.76 117.66 2dsl s ALA 108 Ca 0.05 1.18 0.01 0.00 0.00 0.00 0.00 51.96 53.20 2dsl s ALA 108 Cb 0.12 0.06 0.02 0.00 0.00 0.00 0.00 23.12 23.32 2dsl s ALA 108 CO 0.65 -0.47 -0.08 -1.17 0.00 0.00 0.00 175.76 174.68 2dsl s LEU 109 N -1.62 1.38 -0.07 0.00 2.96 0.22 -1.44 118.68 120.11 2dsl s LEU 109 Ca -0.05 -0.25 0.03 0.00 -0.22 0.00 0.00 54.13 53.64 2dsl s LEU 109 Cb -0.00 -0.72 -0.02 0.00 0.50 0.00 0.00 46.19 45.94 2dsl s LEU 109 CO 0.02 -0.04 -0.16 0.12 -1.32 0.00 0.00 176.35 174.97 2dsl s PHE 110 N 1.10 2.68 -0.07 5.38 2.19 -0.05 -0.37 117.98 128.84 2dsl s PHE 110 Ca -0.07 -0.35 0.01 0.00 0.33 0.00 0.00 56.93 56.85 2dsl s PHE 110 Cb -0.14 -1.67 0.02 0.00 -1.31 0.00 0.00 43.02 39.91 2dsl s PHE 110 CO -0.01 0.03 -0.09 0.99 1.83 0.00 0.00 175.22 177.97 2dsl s THR 111 N -0.40 0.96 -0.00 0.12 2.01 -0.19 -0.21 115.64 117.93 2dsl s THR 111 Ca 0.04 -0.34 -0.06 0.00 0.31 0.00 0.00 61.69 61.64 2dsl s THR 111 Cb -0.12 -0.92 -0.00 0.00 0.01 0.00 0.00 72.50 71.47 2dsl s THR 111 CO 0.02 0.33 0.11 -0.83 -0.69 0.00 0.00 174.62 173.56 2dsl s GLY 112 N 1.00 0.05 -0.04 4.40 0.00 -0.63 0.36 107.32 112.46 2dsl s GLY 112 Ca -0.09 -0.13 0.05 0.00 0.00 0.00 0.00 44.72 44.55 2dsl s GLY 112 CO -0.00 -0.25 -0.19 -1.59 0.00 0.00 0.00 173.10 171.07 2dsl s THR 113 N -1.19 1.57 0.32 0.90 2.01 -0.24 -0.71 115.64 118.30 2dsl s THR 113 Ca -0.13 -0.80 0.09 0.00 0.31 0.00 0.00 61.69 61.16 2dsl s THR 113 Cb -0.07 -1.34 -0.05 0.00 0.01 0.00 0.00 72.50 71.06 2dsl s THR 113 CO 0.01 0.45 0.03 0.68 -0.69 0.00 0.00 174.62 175.09 2dsl s VAL 114 N -0.08 2.85 -0.19 3.82 -7.23 0.26 -0.76 120.40 119.07 2dsl s VAL 114 Ca -0.02 -1.93 -0.06 0.00 -1.81 0.00 0.00 61.98 58.17 2dsl s VAL 114 Cb -0.11 -2.82 -0.03 0.00 0.56 0.00 0.00 36.38 33.98 2dsl s VAL 114 CO 0.02 -0.24 0.02 0.12 -0.31 0.00 0.00 175.10 174.71 2dsl s PHE 115 N -2.46 3.11 -0.18 2.82 2.19 0.12 -2.34 117.98 121.24 2dsl s PHE 115 Ca 0.34 -0.23 -0.24 0.00 0.33 0.00 0.00 56.93 57.14 2dsl s PHE 115 Cb -0.02 -2.06 -0.02 0.00 -1.31 0.00 0.00 43.02 39.61 2dsl s PHE 115 CO 0.20 -0.07 0.76 1.03 1.83 0.00 0.00 175.22 178.97 2dsl s ARG 116 N 0.69 4.26 0.00 10.12 0.52 0.76 -1.36 118.95 133.94 2dsl s ARG 116 Ca 0.01 0.86 0.27 0.00 -0.52 0.00 0.00 55.73 56.35 2dsl s ARG 116 Cb -0.14 -3.58 1.62 0.00 0.52 0.00 0.00 34.95 33.37 2dsl s ARG 116 CO 0.02 -0.30 1.97 1.28 0.02 0.00 0.00 175.30 178.29