#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a5w s GLU 3 N 0.00 1.10 -0.11 0.54 -1.05 -1.26 -0.70 118.70 117.22 2a5w s GLU 3 Ca 0.00 -1.53 0.01 0.00 -0.15 0.00 0.00 54.97 53.30 2a5w s GLU 3 Cb 0.00 -0.15 0.02 0.00 -0.44 0.00 0.00 34.13 33.56 2a5w s GLU 3 CO 0.00 -0.18 -0.14 -1.17 0.95 0.00 0.00 175.26 174.73 2a5w s LEU 4 N -3.16 1.63 -0.33 1.83 2.96 0.12 -4.88 118.68 116.85 2a5w s LEU 4 Ca 0.25 -0.40 -0.24 0.00 -0.22 0.00 0.00 54.13 53.52 2a5w s LEU 4 Cb 0.07 -1.04 0.00 0.00 0.50 0.00 0.00 46.19 45.72 2a5w s LEU 4 CO 0.04 -0.01 0.81 -0.70 -1.32 0.00 0.00 176.35 175.18 2a5w s GLU 5 N 1.13 3.91 -0.30 1.98 2.56 -1.26 -1.04 118.70 125.67 2a5w s GLU 5 Ca -0.04 0.55 -0.02 0.00 0.00 0.00 0.00 54.97 55.45 2a5w s GLU 5 Cb -0.14 -3.75 0.10 0.00 2.00 0.00 0.00 34.13 32.33 2a5w s GLU 5 CO -0.03 -0.75 0.12 0.08 -0.56 0.00 0.00 175.26 174.11 2a5w s VAL 6 N 3.07 0.38 -0.23 3.70 1.01 -0.58 -4.86 120.40 122.89 2a5w s VAL 6 Ca 0.33 -1.09 0.00 0.00 0.00 0.00 0.00 61.98 61.22 2a5w s VAL 6 Cb -0.14 -1.31 0.00 0.00 0.00 0.00 0.00 36.38 34.93 2a5w s VAL 6 CO 0.14 -0.71 0.00 0.29 0.00 0.00 0.00 175.10 174.82 2a5w n LYS 7 N 5.03 -0.38 -0.07 2.72 5.02 -1.26 -2.70 118.16 126.52 2a5w n LYS 7 Ca -0.04 0.38 0.00 0.00 -2.02 0.00 0.00 58.31 56.63 2a5w n LYS 7 Cb 0.42 -3.88 0.00 0.00 -0.02 0.00 0.00 35.03 31.55 2a5w n LYS 7 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2a5w n GLY 8 N -2.28 0.56 3.78 0.72 0.00 -1.26 -5.07 105.19 101.65 2a5w n GLY 8 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 2a5w n GLY 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a5w s LYS 9 N -0.82 4.04 -0.26 1.61 1.02 -1.10 -5.08 119.74 119.14 2a5w s LYS 9 Ca 0.00 0.16 -0.11 0.00 0.02 0.00 0.00 55.97 56.04 2a5w s LYS 9 Cb 0.00 -3.33 -0.05 0.00 -0.52 0.00 0.00 37.83 33.93 2a5w s LYS 9 CO 0.00 0.44 0.20 0.15 -0.92 0.00 0.00 175.35 175.22 2a5w s LYS 10 N -0.18 4.00 -0.12 1.68 1.02 -1.26 -1.53 119.74 123.34 2a5w s LYS 10 Ca 0.19 -0.27 -0.02 0.00 0.02 0.00 0.00 55.97 55.89 2a5w s LYS 10 Cb -0.14 -3.62 -0.03 0.00 -0.52 0.00 0.00 37.83 33.52 2a5w s LYS 10 CO 0.07 -0.11 -0.06 -0.51 -0.92 0.00 0.00 175.35 173.82 2a5w s LEU 11 N 1.55 3.19 0.18 3.17 1.43 -0.21 -4.91 118.68 123.08 2a5w s LEU 11 Ca 0.08 -0.10 -0.30 0.00 -1.03 0.00 0.00 54.13 52.78 2a5w s LEU 11 Cb -0.15 -1.74 -0.08 0.00 0.03 0.00 0.00 46.19 44.26 2a5w s LEU 11 CO 0.09 0.25 1.08 -0.13 0.23 0.00 0.00 176.35 177.87 2a5w s ARG 12 N -0.10 4.61 0.21 1.70 0.52 -1.26 0.12 118.95 124.75 2a5w s ARG 12 Ca 0.02 1.69 0.09 0.00 -0.52 0.00 0.00 55.73 57.00 2a5w s ARG 12 Cb -0.13 -3.28 -0.04 0.00 0.52 0.00 0.00 34.95 32.01 2a5w s ARG 12 CO 0.03 0.11 -0.03 -0.51 0.02 0.00 0.00 175.30 174.92 2a5w s LEU 13 N -0.39 3.18 0.97 2.53 1.43 0.13 -1.61 118.68 124.91 2a5w s LEU 13 Ca 0.49 -0.53 -0.16 0.00 -1.03 0.00 0.00 54.13 52.90 2a5w s LEU 13 Cb -0.29 -1.80 0.20 0.00 0.03 0.00 0.00 46.19 44.33 2a5w s LEU 13 CO 0.34 0.06 1.31 1.51 0.23 0.00 0.00 176.35 179.80 2a5w s ASP 14 N -3.18 3.08 0.64 2.29 1.47 0.99 -3.31 116.67 118.65 2a5w s ASP 14 Ca 0.28 0.31 0.34 0.00 1.18 0.00 0.00 52.55 54.67 2a5w s ASP 14 Cb -0.08 -0.39 1.91 0.00 -0.34 0.00 0.00 42.92 44.02 2a5w s ASP 14 CO 0.18 -2.76 2.15 1.05 0.68 0.00 0.00 175.17 176.47 2a5w h GLU 15 N -1.66 0.00 -0.66 2.11 4.11 -1.95 -0.85 114.58 115.68 2a5w h GLU 15 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.98 2a5w h GLU 15 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 2a5w h GLU 15 CO 0.39 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 179.22 2a5w n ASP 16 N -3.33 4.33 0.00 3.06 8.00 -1.26 -4.94 116.55 122.41 2a5w n ASP 16 Ca -0.01 -2.26 0.00 0.00 0.71 0.00 0.00 54.79 53.24 2a5w n ASP 16 Cb 0.25 -0.52 0.00 0.00 -0.02 0.00 0.00 41.12 40.83 2a5w n ASP 16 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2a5w n GLY 17 N 1.27 0.58 3.86 0.44 0.00 -0.33 -4.98 105.19 106.04 2a5w n GLY 17 Ca 0.24 -0.24 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2a5w n GLY 17 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2a5w s PHE 18 N -2.00 3.60 0.28 1.61 0.40 -1.26 -4.82 117.98 115.78 2a5w s PHE 18 Ca 0.00 0.84 -0.30 0.00 -0.60 0.00 0.00 56.93 56.87 2a5w s PHE 18 Cb 0.00 -2.20 -0.13 0.00 0.51 0.00 0.00 43.02 41.20 2a5w s PHE 18 CO 0.00 0.51 1.37 1.28 0.70 0.00 0.00 175.22 179.08 2a5w n LEU 19 N 0.95 3.26 -0.05 -0.37 4.32 -1.26 -0.01 117.00 123.84 2a5w n LEU 19 Ca -0.08 1.16 -0.10 0.00 -0.02 0.00 0.00 56.01 56.97 2a5w n LEU 19 Cb 0.52 -1.45 0.04 0.00 -1.62 0.00 0.00 43.42 40.91 2a5w n LEU 19 CO 0.42 -0.48 0.55 1.56 -1.22 0.00 0.00 177.39 178.21 2a5w h GLN 20 N 3.65 0.72 -4.38 3.23 1.08 -1.61 -3.42 115.11 114.39 2a5w h GLN 20 Ca -0.45 -0.39 -0.62 0.00 -1.45 0.00 0.00 58.65 55.74 2a5w h GLN 20 Cb 1.28 0.02 -0.38 0.00 -0.05 0.00 0.00 27.48 28.34 2a5w h GLN 20 CO 0.71 1.01 -0.78 0.34 -0.95 0.00 0.00 178.83 179.17 2a5w s ASP 21 N -6.87 4.06 0.61 1.46 3.68 -1.26 -5.00 116.67 113.35 2a5w s ASP 21 Ca -0.09 -1.38 0.35 0.00 2.13 0.00 0.00 52.55 53.56 2a5w s ASP 21 Cb 0.12 -1.25 2.00 0.00 -1.45 0.00 0.00 42.92 42.33 2a5w s ASP 21 CO 0.85 -0.27 2.28 4.11 0.13 0.00 0.00 175.17 182.27 2a5w h TRP 22 N 7.90 0.00 -0.00 -5.34 5.08 -1.80 -2.17 115.95 119.61 2a5w h TRP 22 Ca -0.16 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.81 2a5w h TRP 22 Cb 1.06 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.22 2a5w h TRP 22 CO 0.50 0.01 -0.02 0.39 -1.28 0.00 0.00 178.44 178.03 2a5w n GLU 23 N -3.57 0.72 0.00 0.12 1.02 -1.26 -2.92 120.64 114.74 2a5w n GLU 23 Ca -0.03 -0.09 0.14 0.00 -0.02 0.00 0.00 57.16 57.16 2a5w n GLU 23 Cb 0.09 -1.50 0.63 0.00 -0.02 0.00 0.00 31.44 30.64 2a5w n GLU 23 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2a5w n GLU 24 N -1.06 0.81 -2.63 3.49 1.02 -0.82 -4.92 120.64 116.53 2a5w n GLU 24 Ca 0.18 -0.29 -0.38 0.00 -0.02 0.00 0.00 57.16 56.65 2a5w n GLU 24 Cb 0.21 -1.49 -0.05 0.00 -0.02 0.00 0.00 31.44 30.09 2a5w n GLU 24 CO 0.00 0.00 0.00 -0.46 1.18 0.00 0.00 177.13 177.85 2a5w s TRP 25 N -2.39 3.57 0.13 -0.32 -0.00 -1.15 -4.94 118.94 113.85 2a5w s TRP 25 Ca 0.31 1.74 -0.02 0.00 -0.00 0.00 0.00 56.10 58.14 2a5w s TRP 25 Cb 0.20 -3.08 0.01 0.00 -0.00 0.00 0.00 33.47 30.60 2a5w s TRP 25 CO 0.45 -0.20 0.20 -0.40 -0.00 0.00 0.00 176.95 177.00 2a5w n ASP 26 N 0.63 -0.57 -0.07 5.86 5.68 -1.26 -5.01 116.55 121.82 2a5w n ASP 26 Ca 0.02 -1.69 0.04 0.00 -0.50 0.00 0.00 54.79 52.66 2a5w n ASP 26 Cb 0.48 1.04 0.39 0.00 -1.14 0.00 0.00 41.12 41.89 2a5w n ASP 26 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2a5w h GLU 27 N 0.00 0.63 -0.18 0.11 5.08 -1.99 -0.45 114.58 117.78 2a5w h GLU 27 Ca -0.11 -0.04 -0.16 0.00 -1.00 0.00 0.00 59.36 58.05 2a5w h GLU 27 Cb 0.45 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.56 2a5w h GLU 27 CO 0.14 0.42 -0.53 0.93 -1.00 0.00 0.00 179.01 178.97 2a5w h GLU 28 N 0.65 0.68 -0.34 2.33 3.07 -1.99 -2.25 114.58 116.73 2a5w h GLU 28 Ca 0.20 -0.49 0.05 0.00 -0.50 0.00 0.00 59.36 58.62 2a5w h GLU 28 Cb 0.02 0.08 -0.04 0.00 -0.84 0.00 0.00 28.75 27.97 2a5w h GLU 28 CO -0.05 1.11 0.08 0.28 -1.40 0.00 0.00 179.01 179.03 2a5w h VAL 29 N 0.37 0.85 -0.67 3.13 2.07 -1.77 -0.82 116.25 119.40 2a5w h VAL 29 Ca -0.01 -0.07 0.13 0.00 0.82 0.00 0.00 66.70 67.57 2a5w h VAL 29 Cb 1.15 0.63 -0.10 0.00 -1.52 0.00 0.00 31.29 31.45 2a5w h VAL 29 CO 0.11 0.04 0.17 0.00 0.02 0.00 0.00 177.57 177.91 2a5w h ALA 30 N 1.25 0.84 -0.47 1.67 0.00 -1.01 0.13 119.26 121.67 2a5w h ALA 30 Ca 0.16 0.14 -0.05 0.00 0.00 0.00 0.00 54.91 55.17 2a5w h ALA 30 Cb 0.17 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2a5w h ALA 30 CO -0.20 -0.30 0.11 1.49 0.00 0.00 0.00 179.25 180.34 2a5w h GLU 31 N 0.29 0.76 -0.25 0.00 4.57 -0.92 -0.86 114.58 118.17 2a5w h GLU 31 Ca 0.37 -0.19 -0.10 0.00 -1.18 0.00 0.00 59.36 58.26 2a5w h GLU 31 Cb 0.58 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.05 2a5w h GLU 31 CO -0.44 0.75 -0.26 0.00 -1.18 0.00 0.00 179.01 177.87 2a5w h ALA 32 N 0.98 1.09 -0.53 2.92 0.00 -0.37 -2.72 119.26 120.63 2a5w h ALA 32 Ca 0.15 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 2a5w h ALA 32 Cb 0.34 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2a5w h ALA 32 CO 0.00 0.56 0.16 -0.07 0.00 0.00 0.00 179.25 179.90 2a5w h LEU 33 N 0.42 0.79 -1.50 0.00 3.38 -0.52 -2.66 115.31 115.22 2a5w h LEU 33 Ca 0.06 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.77 2a5w h LEU 33 Cb 0.68 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 2a5w h LEU 33 CO 0.05 0.79 -0.21 0.00 0.09 0.00 0.00 178.44 179.16 2a5w h ALA 34 N 1.02 1.59 -0.25 1.53 0.00 -0.96 -2.42 119.26 119.77 2a5w h ALA 34 Ca 0.17 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2a5w h ALA 34 Cb 0.30 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2a5w h ALA 34 CO -0.00 0.31 0.00 0.36 0.00 0.00 0.00 179.25 179.91 2a5w n LYS 35 N -4.27 2.10 -2.53 0.00 2.85 -1.04 -0.27 118.16 115.00 2a5w n LYS 35 Ca -0.02 -1.66 -0.41 0.00 -1.05 0.00 0.00 58.31 55.17 2a5w n LYS 35 Cb 0.28 -1.45 -0.03 0.00 -0.65 0.00 0.00 35.03 33.18 2a5w n LYS 35 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 2a5w s ASP 36 N -1.56 6.26 0.00 -5.58 2.15 -0.91 -4.79 116.67 112.24 2a5w s ASP 36 Ca 0.35 -0.86 0.21 0.00 0.43 0.00 0.00 52.55 52.67 2a5w s ASP 36 Cb 0.20 -2.56 1.09 0.00 -0.30 0.00 0.00 42.92 41.34 2a5w s ASP 36 CO 0.29 -1.73 1.72 0.35 -0.17 0.00 0.00 175.17 175.63 2a5w n THR 37 N 6.65 0.06 0.19 1.71 -2.24 -1.26 -3.00 114.28 116.39 2a5w n THR 37 Ca 0.17 -0.11 0.06 0.00 -2.27 0.00 0.00 64.05 61.90 2a5w n THR 37 Cb 0.50 -0.09 0.31 0.00 -2.10 0.00 0.00 70.33 68.95 2a5w n THR 37 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 2a5w h ARG 38 N 0.72 0.00 0.00 -0.78 3.08 -1.94 -3.33 114.38 112.13 2a5w h ARG 38 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2a5w h ARG 38 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.21 2a5w h ARG 38 CO 0.00 0.37 0.00 1.19 -1.07 0.00 0.00 179.97 180.46 2a5w n PHE 39 N -3.48 0.00 -3.70 3.04 3.01 -1.16 -4.99 117.46 110.18 2a5w n PHE 39 Ca 0.00 -0.35 -0.11 0.00 1.01 0.00 0.00 57.45 58.00 2a5w n PHE 39 Cb 0.53 -0.04 -0.11 0.00 -0.01 0.00 0.00 39.48 39.85 2a5w n PHE 39 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 2a5w s SER 40 N -0.70 -0.49 0.29 4.37 0.15 -1.20 -5.01 113.70 111.11 2a5w s SER 40 Ca 0.00 0.86 -0.02 0.00 0.70 0.00 0.00 55.95 57.49 2a5w s SER 40 Cb 0.00 0.75 0.44 0.00 -1.71 0.00 0.00 66.02 65.51 2a5w s SER 40 CO 0.00 -0.19 1.94 1.55 1.20 0.00 0.00 173.24 177.75 2a5w h PRO 41 N 6.96 1.10 -5.60 5.44 0.13 -1.91 -3.37 132.00 134.74 2a5w h PRO 41 Ca -0.36 -0.07 -0.45 0.00 -0.87 0.00 0.00 66.00 64.25 2a5w h PRO 41 Cb 1.18 -0.25 -0.19 0.00 0.13 0.00 0.00 31.00 31.87 2a5w h PRO 41 CO 0.30 0.73 -0.78 -0.65 -0.23 0.00 0.00 178.00 177.37 2a5w s GLN 42 N -5.95 1.05 0.72 0.86 -1.52 -1.26 -4.94 119.66 108.61 2a5w s GLN 42 Ca -0.12 -1.21 -0.12 0.00 -1.95 0.00 0.00 55.36 51.96 2a5w s GLN 42 Cb 0.19 -1.03 0.03 0.00 -0.22 0.00 0.00 33.01 31.97 2a5w s GLN 42 CO 0.80 0.21 1.09 -1.25 -0.25 0.00 0.00 175.29 175.89 2a5w s PRO 43 N -2.43 2.55 -0.16 2.91 0.04 -1.26 -4.90 135.00 131.74 2a5w s PRO 43 Ca 0.08 1.22 -0.04 0.00 0.04 0.00 0.00 61.00 62.30 2a5w s PRO 43 Cb -0.07 -1.93 -0.02 0.00 0.04 0.00 0.00 34.50 32.52 2a5w s PRO 43 CO 0.04 -1.42 -0.04 0.42 0.04 0.00 0.00 177.00 176.03 2a5w s ILE 44 N -2.72 3.76 -0.27 0.56 1.01 0.63 -4.99 121.20 119.18 2a5w s ILE 44 Ca 0.63 -0.40 -0.20 0.00 0.00 0.00 0.00 60.65 60.68 2a5w s ILE 44 Cb -0.18 -2.66 -0.02 0.00 0.01 0.00 0.00 42.46 39.62 2a5w s ILE 44 CO 0.50 0.48 0.63 -0.70 0.00 0.00 0.00 174.94 175.85 2a5w s GLU 45 N 0.55 4.05 -0.76 2.79 2.56 -1.26 -4.52 118.70 122.12 2a5w s GLU 45 Ca -0.03 0.47 -0.25 0.00 0.00 0.00 0.00 54.97 55.17 2a5w s GLU 45 Cb -0.14 -3.67 0.05 0.00 2.00 0.00 0.00 34.13 32.36 2a5w s GLU 45 CO 0.03 -0.46 1.19 -0.51 -0.56 0.00 0.00 175.26 174.95 2a5w s LEU 46 N 2.53 3.68 0.93 2.70 1.43 -1.26 -4.99 118.68 123.70 2a5w s LEU 46 Ca 0.26 -0.81 -0.14 0.00 -1.03 0.00 0.00 54.13 52.40 2a5w s LEU 46 Cb -0.15 -2.51 0.16 0.00 0.03 0.00 0.00 46.19 43.72 2a5w s LEU 46 CO 0.09 -1.64 1.22 0.42 0.23 0.00 0.00 176.35 176.67 2a5w s THR 47 N 4.97 1.96 0.39 5.49 -4.23 -1.26 -4.86 115.64 118.10 2a5w s THR 47 Ca 0.32 0.00 0.06 0.00 -1.18 0.00 0.00 61.69 60.89 2a5w s THR 47 Cb -0.10 -2.89 0.26 0.00 1.34 0.00 0.00 72.50 71.12 2a5w s THR 47 CO 0.09 0.00 2.04 -0.33 -0.54 0.00 0.00 174.62 175.88 2a5w h GLU 48 N -1.55 0.62 -0.48 3.99 4.39 -1.99 -1.94 114.58 117.62 2a5w h GLU 48 Ca -0.46 -0.04 0.01 0.00 0.34 0.00 0.00 59.36 59.21 2a5w h GLU 48 Cb 1.29 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 29.78 2a5w h GLU 48 CO 0.51 0.42 0.31 0.93 -1.16 0.00 0.00 179.01 180.02 2a5w h GLU 49 N 0.64 0.61 -0.49 2.33 5.08 -1.98 -0.17 114.58 120.59 2a5w h GLU 49 Ca 0.17 -0.04 0.08 0.00 -1.00 0.00 0.00 59.36 58.57 2a5w h GLU 49 Cb -0.06 -0.14 -0.06 0.00 0.50 0.00 0.00 28.75 28.99 2a5w h GLU 49 CO -0.04 0.40 0.12 0.45 -1.00 0.00 0.00 179.01 178.95 2a5w h HIS 50 N 0.62 0.20 -0.63 4.33 3.86 -1.73 -2.40 115.15 119.40 2a5w h HIS 50 Ca 0.18 0.03 -0.05 0.00 -1.16 0.00 0.00 60.37 59.37 2a5w h HIS 50 Cb -0.04 -0.02 -0.03 0.00 1.06 0.00 0.00 27.41 28.38 2a5w h HIS 50 CO -0.05 0.02 0.20 -1.49 0.86 0.00 0.00 177.93 177.48 2a5w h TRP 51 N 0.27 1.01 -0.65 2.45 4.06 -0.74 0.20 115.95 122.54 2a5w h TRP 51 Ca 0.24 -0.10 0.06 0.00 2.06 0.00 0.00 58.89 61.15 2a5w h TRP 51 Cb 0.31 -0.29 -0.05 0.00 -1.00 0.00 0.00 29.16 28.12 2a5w h TRP 51 CO -0.21 0.82 0.36 0.87 -3.56 0.00 0.00 178.44 176.72 2a5w h LYS 52 N 0.90 0.65 0.06 0.49 1.57 -0.82 -0.04 116.57 119.38 2a5w h LYS 52 Ca 0.20 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.94 2a5w h LYS 52 Cb 0.28 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.44 2a5w h LYS 52 CO -0.01 0.43 -0.03 0.82 -0.57 0.00 0.00 179.45 180.09 2a5w h ILE 53 N 0.67 1.16 -0.71 1.86 2.04 -0.95 -1.83 117.51 119.75 2a5w h ILE 53 Ca 0.29 -0.76 0.11 0.00 1.00 0.00 0.00 64.86 65.49 2a5w h ILE 53 Cb 0.17 1.66 -0.08 0.00 -0.74 0.00 0.00 36.82 37.84 2a5w h ILE 53 CO -0.18 0.19 0.32 0.40 0.00 0.00 0.00 178.15 178.89 2a5w h ILE 54 N -0.42 0.78 -0.11 -0.67 2.04 -0.82 -0.39 117.51 117.92 2a5w h ILE 54 Ca -0.01 -0.18 -0.15 0.00 1.00 0.00 0.00 64.86 65.52 2a5w h ILE 54 Cb 0.37 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.65 2a5w h ILE 54 CO 0.01 0.10 -0.57 0.03 0.00 0.00 0.00 178.15 177.72 2a5w h ARG 55 N 0.53 0.33 -0.58 2.37 3.08 -0.97 -2.50 114.38 116.64 2a5w h ARG 55 Ca 0.36 -0.21 -0.05 0.00 0.07 0.00 0.00 59.98 60.15 2a5w h ARG 55 Cb 0.45 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.50 2a5w h ARG 55 CO -0.31 0.81 0.17 -0.92 -1.07 0.00 0.00 179.97 178.65 2a5w h TYR 56 N 0.25 0.94 -0.38 3.04 3.20 -0.78 -0.82 116.97 122.42 2a5w h TYR 56 Ca -0.00 -0.10 0.03 0.00 3.14 0.00 0.00 58.73 61.80 2a5w h TYR 56 Cb 1.07 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 39.04 2a5w h TYR 56 CO 0.03 0.79 0.18 -0.07 -1.64 0.00 0.00 178.16 177.44 2a5w h LEU 57 N 0.82 0.25 -0.56 2.82 3.38 -0.94 -0.50 115.31 120.58 2a5w h LEU 57 Ca 0.19 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.12 2a5w h LEU 57 Cb 0.30 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 2a5w h LEU 57 CO -0.00 0.19 0.14 0.03 0.09 0.00 0.00 178.44 178.88 2a5w h ARG 58 N 0.37 0.91 -0.60 1.13 3.08 -1.35 -0.88 114.38 117.04 2a5w h ARG 58 Ca 0.16 -0.22 -0.09 0.00 0.07 0.00 0.00 59.98 59.90 2a5w h ARG 58 Cb 0.08 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 2a5w h ARG 58 CO -0.12 0.85 0.03 -0.44 -1.07 0.00 0.00 179.97 179.21 2a5w h ASP 59 N 0.81 1.01 -0.27 7.04 3.32 -0.91 0.21 116.42 127.63 2a5w h ASP 59 Ca 0.18 -0.29 -0.01 0.00 0.02 0.00 0.00 57.03 56.92 2a5w h ASP 59 Cb 0.35 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 2a5w h ASP 59 CO 0.00 1.06 0.14 0.22 -1.72 0.00 0.00 179.24 178.94 2a5w h TYR 60 N 0.94 0.37 -0.55 4.55 3.20 -1.02 -2.05 116.97 122.40 2a5w h TYR 60 Ca 0.17 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.99 2a5w h TYR 60 Cb 0.52 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.65 2a5w h TYR 60 CO 0.04 0.34 0.18 0.35 -1.64 0.00 0.00 178.16 177.43 2a5w h PHE 61 N 0.30 0.88 -0.96 -3.82 3.57 -0.79 0.12 116.94 116.24 2a5w h PHE 61 Ca 0.09 -0.09 0.03 0.00 3.53 0.00 0.00 57.97 61.54 2a5w h PHE 61 Cb 0.10 -0.26 -0.05 0.00 2.79 0.00 0.00 35.95 38.52 2a5w h PHE 61 CO -0.03 0.74 0.63 0.82 -2.23 0.00 0.00 178.31 178.25 2a5w h ILE 62 N 0.77 1.18 0.16 1.41 2.04 -0.56 0.37 117.51 122.89 2a5w h ILE 62 Ca 0.18 -0.42 -0.29 0.00 1.00 0.00 0.00 64.86 65.33 2a5w h ILE 62 Cb 0.27 -0.16 0.01 0.00 -0.74 0.00 0.00 36.82 36.20 2a5w h ILE 62 CO -0.01 0.22 -1.30 0.50 0.00 0.00 0.00 178.15 177.56 2a5w h LYS 63 N 1.23 0.35 0.00 2.37 3.64 -0.88 -3.40 116.57 119.88 2a5w h LYS 63 Ca 0.38 -0.59 -0.02 0.00 -1.27 0.00 0.00 60.65 59.15 2a5w h LYS 63 Cb -0.02 0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 32.02 2a5w h LYS 63 CO -0.11 1.28 -1.21 0.66 -2.27 0.00 0.00 179.45 177.80 2a5w n TYR 64 N -3.59 0.00 -0.75 1.91 4.02 0.37 -5.03 117.16 114.09 2a5w n TYR 64 Ca -0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.78 2a5w n TYR 64 Cb 1.04 -0.12 0.00 0.00 -0.02 0.00 0.00 39.34 40.24 2a5w n TYR 64 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2a5w n GLY 65 N 2.39 0.61 3.19 2.72 0.00 0.13 -5.02 105.19 109.20 2a5w n GLY 65 Ca -0.02 -0.18 -0.11 0.00 0.00 0.00 0.00 46.02 45.70 2a5w n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a5w s VAL 66 N -2.00 0.10 0.50 1.61 0.11 -1.26 -5.05 120.40 114.41 2a5w s VAL 66 Ca 0.00 -0.80 -0.21 0.00 -2.93 0.00 0.00 61.98 58.04 2a5w s VAL 66 Cb 0.00 -0.82 -0.07 0.00 -1.53 0.00 0.00 36.38 33.96 2a5w s VAL 66 CO 0.00 -0.44 1.14 0.00 -3.33 0.00 0.00 175.10 172.47 2a5w s ALA 67 N -2.28 2.83 0.42 1.54 0.00 -1.26 -3.94 121.76 119.07 2a5w s ALA 67 Ca -0.07 0.87 -0.26 0.00 0.00 0.00 0.00 51.96 52.50 2a5w s ALA 67 Cb -0.02 -3.37 -0.09 0.00 0.00 0.00 0.00 23.12 19.64 2a5w s ALA 67 CO -0.02 -0.70 1.36 -1.25 0.00 0.00 0.00 175.76 175.15 2a5w s PRO 68 N -3.02 3.86 0.80 0.00 0.04 -1.26 -4.99 135.00 130.44 2a5w s PRO 68 Ca 0.68 2.28 -0.11 0.00 0.04 0.00 0.00 61.00 63.90 2a5w s PRO 68 Cb -0.26 -2.73 0.08 0.00 0.04 0.00 0.00 34.50 31.63 2a5w s PRO 68 CO 0.30 -0.63 1.11 -1.25 0.04 0.00 0.00 177.00 176.58 2a5w s PRO 69 N -2.32 1.94 0.27 0.56 0.04 -1.26 -4.78 135.00 129.46 2a5w s PRO 69 Ca 0.58 1.32 0.00 0.00 0.04 0.00 0.00 61.00 62.95 2a5w s PRO 69 Cb -0.41 -1.85 0.59 0.00 0.04 0.00 0.00 34.50 32.87 2a5w s PRO 69 CO 0.53 -1.91 1.73 0.28 0.04 0.00 0.00 177.00 177.67 2a5w h VAL 70 N -1.21 0.63 -0.58 -0.36 2.07 -2.00 -1.36 116.25 113.44 2a5w h VAL 70 Ca -0.44 -0.18 0.10 0.00 0.82 0.00 0.00 66.70 67.01 2a5w h VAL 70 Cb 1.25 0.07 -0.08 0.00 -1.52 0.00 0.00 31.29 31.00 2a5w h VAL 70 CO 0.49 0.09 0.15 -0.09 0.02 0.00 0.00 177.57 178.23 2a5w h ARG 71 N 0.52 0.28 0.02 1.57 2.43 -2.00 -1.76 114.38 115.45 2a5w h ARG 71 Ca 0.49 -0.02 -0.21 0.00 -0.81 0.00 0.00 59.98 59.43 2a5w h ARG 71 Cb 0.79 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.27 2a5w h ARG 71 CO -0.43 0.19 -0.95 0.52 -1.51 0.00 0.00 179.97 177.79 2a5w h MET 72 N 0.29 0.22 0.01 0.20 0.00 -1.62 -1.61 114.93 112.43 2a5w h MET 72 Ca 0.30 -0.26 0.00 0.00 0.00 0.00 0.00 59.70 59.74 2a5w h MET 72 Cb 0.42 0.08 -0.00 0.00 0.00 0.00 0.00 31.60 32.10 2a5w h MET 72 CO -0.36 1.01 -0.02 1.25 0.00 0.00 0.00 176.91 178.79 2a5w h LEU 73 N 0.11 -0.07 -0.71 1.22 6.46 -1.25 -1.12 115.31 119.95 2a5w h LEU 73 Ca -0.06 0.01 -0.03 0.00 -0.12 0.00 0.00 57.88 57.68 2a5w h LEU 73 Cb 1.60 0.03 -0.03 0.00 -0.73 0.00 0.00 40.66 41.53 2a5w h LEU 73 CO 0.15 -0.04 0.33 0.58 -0.62 0.00 0.00 178.44 178.83 2a5w h VAL 74 N -0.05 1.24 -0.64 1.05 2.07 -1.26 0.22 116.25 118.89 2a5w h VAL 74 Ca 0.01 -0.69 0.01 0.00 0.82 0.00 0.00 66.70 66.85 2a5w h VAL 74 Cb 0.06 0.38 -0.03 0.00 -1.52 0.00 0.00 31.29 30.17 2a5w h VAL 74 CO -0.02 0.28 0.42 0.50 0.02 0.00 0.00 177.57 178.77 2a5w h LYS 75 N 0.99 0.84 -0.26 1.57 3.64 -1.26 -0.74 116.57 121.36 2a5w h LYS 75 Ca 0.24 -0.05 -0.19 0.00 -1.27 0.00 0.00 60.65 59.38 2a5w h LYS 75 Cb 0.14 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.78 2a5w h LYS 75 CO -0.03 0.56 -0.58 1.25 -2.27 0.00 0.00 179.45 178.38 2a5w h HIS 76 N 0.86 1.05 -0.57 1.91 2.76 -0.80 -2.36 115.15 118.00 2a5w h HIS 76 Ca 0.23 -0.39 0.02 0.00 -2.20 0.00 0.00 60.37 58.03 2a5w h HIS 76 Cb -0.09 -0.19 -0.03 0.00 1.55 0.00 0.00 27.41 28.64 2a5w h HIS 76 CO -0.03 1.21 0.36 0.00 -1.30 0.00 0.00 177.93 178.17 2a5w h LYS 78 N 0.72 0.95 0.02 0.00 1.57 -1.07 0.49 116.57 119.26 2a5w h LYS 78 Ca 0.22 -0.10 -0.25 0.00 -1.87 0.00 0.00 60.65 58.65 2a5w h LYS 78 Cb -0.03 -0.19 0.01 0.00 0.08 0.00 0.00 32.23 32.11 2a5w h LYS 78 CO -0.08 0.69 -1.03 -0.22 -0.57 0.00 0.00 179.45 178.25 2a5w h LYS 79 N 0.96 0.54 0.00 3.15 3.64 -0.85 -3.20 116.57 120.81 2a5w h LYS 79 Ca 0.25 -0.61 0.00 0.00 -1.27 0.00 0.00 60.65 59.01 2a5w h LYS 79 Cb 0.02 0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 2a5w h LYS 79 CO -0.04 1.23 -0.91 0.39 -2.27 0.00 0.00 179.45 177.85 2a5w n GLU 80 N -3.78 0.62 -0.05 1.90 -0.58 0.28 -4.89 120.64 114.14 2a5w n GLU 80 Ca -0.09 0.00 -0.05 0.00 -0.42 0.00 0.00 57.16 56.60 2a5w n GLU 80 Cb 0.88 -0.95 -0.02 0.00 -0.57 0.00 0.00 31.44 30.78 2a5w n GLU 80 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2a5w n VAL 81 N -1.43 0.88 -3.68 2.62 0.31 0.09 -5.05 118.33 112.08 2a5w n VAL 81 Ca 0.00 0.29 -0.13 0.00 -0.01 0.00 0.00 64.34 64.50 2a5w n VAL 81 Cb 0.00 -2.00 -0.09 0.00 -0.91 0.00 0.00 33.84 30.84 2a5w n VAL 81 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2a5w s ARG 82 N -2.09 0.62 0.64 5.55 1.70 -0.77 -5.05 118.95 119.54 2a5w s ARG 82 Ca -0.16 0.81 0.33 0.00 -0.47 0.00 0.00 55.73 56.24 2a5w s ARG 82 Cb 0.02 0.26 1.83 0.00 -0.57 0.00 0.00 34.95 36.49 2a5w s ARG 82 CO 0.24 -0.09 2.09 -1.00 -1.08 0.00 0.00 175.30 175.46 2a5w h PRO 83 N 5.64 0.00 -0.04 3.89 0.13 -1.80 -1.69 132.00 138.13 2a5w h PRO 83 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2a5w h PRO 83 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2a5w h PRO 83 CO 0.17 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.54 2a5w n ASP 84 N -3.28 2.89 -4.70 1.44 5.75 -1.26 -4.83 116.55 112.56 2a5w n ASP 84 Ca -0.00 -1.94 -0.44 0.00 -0.01 0.00 0.00 54.79 52.40 2a5w n ASP 84 Cb 0.30 -0.01 -0.03 0.00 -1.03 0.00 0.00 41.12 40.36 2a5w n ASP 84 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2a5w n ASN 86 N 3.13 1.16 0.01 0.00 0.23 -1.26 -4.54 115.26 113.98 2a5w n ASN 86 Ca 0.14 -1.66 -0.02 0.00 -0.53 0.00 0.00 54.58 52.51 2a5w n ASN 86 Cb 0.32 0.30 0.23 0.00 -2.08 0.00 0.00 39.78 38.55 2a5w n ASN 86 CO 0.00 0.00 0.00 0.25 -0.93 0.00 0.00 177.26 176.58 2a5w h LEU 87 N 0.00 0.49 -0.75 -4.53 5.85 -1.96 -1.82 115.31 112.59 2a5w h LEU 87 Ca -0.10 -0.14 0.09 0.00 0.84 0.00 0.00 57.88 58.57 2a5w h LEU 87 Cb 0.37 -0.13 -0.07 0.00 0.37 0.00 0.00 40.66 41.20 2a5w h LEU 87 CO 0.16 0.68 0.40 -0.61 -0.34 0.00 0.00 178.44 178.73 2a5w h GLN 88 N 0.46 0.67 -0.35 1.25 4.15 -1.99 -0.84 115.11 118.46 2a5w h GLN 88 Ca 0.08 -0.04 -0.09 0.00 0.77 0.00 0.00 58.65 59.37 2a5w h GLN 88 Cb 0.55 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 28.08 2a5w h GLN 88 CO 0.04 0.44 -0.17 -0.92 -1.93 0.00 0.00 178.83 176.29 2a5w h TYR 89 N 0.69 0.71 -0.69 3.99 3.20 -1.74 -0.37 116.97 122.76 2a5w h TYR 89 Ca 0.36 -0.14 -0.05 0.00 3.14 0.00 0.00 58.73 62.04 2a5w h TYR 89 Cb 0.34 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.40 2a5w h TYR 89 CO -0.09 0.77 0.22 0.82 -1.64 0.00 0.00 178.16 178.25 2a5w h ILE 90 N 0.58 1.25 -0.08 1.81 2.04 -1.04 -1.84 117.51 120.24 2a5w h ILE 90 Ca 0.09 -0.87 -0.06 0.00 1.00 0.00 0.00 64.86 65.02 2a5w h ILE 90 Cb 0.61 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 2a5w h ILE 90 CO 0.04 0.34 -0.24 1.88 0.00 0.00 0.00 178.15 180.17 2a5w h TYR 91 N 1.01 0.14 -0.21 1.37 -1.99 -0.74 0.37 116.97 116.92 2a5w h TYR 91 Ca 0.22 -0.02 -0.02 0.00 2.00 0.00 0.00 58.73 60.91 2a5w h TYR 91 Cb 0.29 -0.04 -0.01 0.00 2.00 0.00 0.00 36.73 38.98 2a5w h TYR 91 CO 0.02 0.37 0.05 0.87 -0.00 0.00 0.00 178.16 179.47 2a5w h LYS 92 N 0.12 0.33 -0.50 4.88 1.57 -0.65 -2.33 116.57 120.00 2a5w h LYS 92 Ca 0.02 -0.08 -0.09 0.00 -1.87 0.00 0.00 60.65 58.63 2a5w h LYS 92 Cb 0.50 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.75 2a5w h LYS 92 CO 0.03 0.45 -0.04 -0.07 -0.57 0.00 0.00 179.45 179.25 2a5w h LEU 93 N 0.16 0.90 -7.09 2.94 3.38 -1.15 -3.39 115.31 111.06 2a5w h LEU 93 Ca 0.07 -0.33 -0.62 0.00 0.09 0.00 0.00 57.88 57.09 2a5w h LEU 93 Cb 0.27 -0.24 -0.41 0.00 0.09 0.00 0.00 40.66 40.36 2a5w h LEU 93 CO 0.00 1.02 -0.68 -0.36 0.09 0.00 0.00 178.44 178.50 2a5w s PHE 94 N -4.93 2.66 0.35 1.13 0.40 0.13 -4.95 117.98 112.77 2a5w s PHE 94 Ca -0.12 -2.87 0.13 0.00 -0.60 0.00 0.00 56.93 53.47 2a5w s PHE 94 Cb 0.12 -2.30 0.95 0.00 0.51 0.00 0.00 43.02 42.30 2a5w s PHE 94 CO 0.84 -0.72 1.77 -1.35 0.70 0.00 0.00 175.22 176.45 2a5w h PRO 95 N 6.27 0.52 -0.00 0.24 0.11 -1.63 0.74 132.00 138.25 2a5w h PRO 95 Ca 0.02 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.10 2a5w h PRO 95 Cb 0.88 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.87 2a5w h PRO 95 CO 0.59 0.35 -0.13 1.04 -0.21 0.00 0.00 178.00 179.64 2a5w n GLN 96 N -4.72 0.50 0.00 1.05 6.02 -1.26 -4.95 117.38 114.02 2a5w n GLN 96 Ca 0.25 -0.16 0.00 0.00 -0.01 0.00 0.00 57.00 57.08 2a5w n GLN 96 Cb 0.75 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.51 2a5w n GLN 96 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2a5w n GLY 97 N 1.34 1.01 0.26 1.08 0.00 0.25 -4.39 105.19 104.74 2a5w n GLY 97 Ca 0.12 -2.17 0.07 0.00 0.00 0.00 0.00 46.02 44.04 2a5w n GLY 97 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2a5w h PRO 98 N 0.00 0.08 0.00 1.61 0.11 -1.89 -2.27 132.00 129.63 2a5w h PRO 98 Ca 0.00 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.07 2a5w h PRO 98 Cb 0.00 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.09 2a5w h PRO 98 CO 0.00 0.10 -0.46 0.00 -0.21 0.00 0.00 178.00 177.43 2a5w h ALA 99 N 1.91 0.04 0.00 -0.75 0.00 -1.95 0.17 119.26 118.68 2a5w h ALA 99 Ca 0.02 -0.49 -0.09 0.00 0.00 0.00 0.00 54.91 54.35 2a5w h ALA 99 Cb 0.08 0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2a5w h ALA 99 CO 0.00 0.38 -0.41 0.87 0.00 0.00 0.00 179.25 180.09 2a5w h LYS 100 N -1.00 0.00 0.00 0.00 1.57 -1.76 -3.07 116.57 112.30 2a5w h LYS 100 Ca -0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2a5w h LYS 100 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.85 2a5w h LYS 100 CO -0.03 0.41 -0.41 -0.25 -0.57 0.00 0.00 179.45 178.60 2a5w n ASP 101 N -3.78 1.09 0.10 0.86 8.00 -0.89 -4.50 116.55 117.43 2a5w n ASP 101 Ca -0.01 0.17 -0.13 0.00 0.71 0.00 0.00 54.79 55.53 2a5w n ASP 101 Cb 0.48 -0.49 -0.08 0.00 -0.02 0.00 0.00 41.12 41.01 2a5w n ASP 101 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2a5w h ALA 102 N -0.79 -0.24 -0.89 2.24 0.00 -1.36 -1.13 119.26 117.09 2a5w h ALA 102 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2a5w h ALA 102 Cb 0.41 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 2a5w h ALA 102 CO 0.00 -0.50 0.57 0.00 0.00 0.00 0.00 179.25 179.31 2a5w h ARG 104 N 1.22 -0.69 0.00 0.00 2.43 -1.42 -0.44 114.38 115.49 2a5w h ARG 104 Ca 0.32 0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.46 2a5w h ARG 104 Cb -0.10 0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 2a5w h ARG 104 CO -0.07 -0.46 -0.38 0.82 -1.51 0.00 0.00 179.97 178.38 2a5w h ILE 105 N -0.71 1.19 0.00 1.20 2.04 -0.98 -1.83 117.51 118.42 2a5w h ILE 105 Ca -0.02 -1.34 0.00 0.00 1.00 0.00 0.00 64.86 64.50 2a5w h ILE 105 Cb 0.65 1.74 0.00 0.00 -0.74 0.00 0.00 36.82 38.47 2a5w h ILE 105 CO -0.08 0.37 0.00 0.00 0.00 0.00 0.00 178.15 178.44 2a5w n ALA 106 N -2.43 2.03 -0.79 1.87 0.00 0.11 -4.39 120.51 116.91 2a5w n ALA 106 Ca -0.02 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2a5w n ALA 106 Cb 0.43 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.55 2a5w n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2a5w n GLY 107 N 0.50 0.56 3.90 0.00 0.00 -0.69 -4.80 105.19 104.67 2a5w n GLY 107 Ca 0.08 -0.38 -0.28 0.00 0.00 0.00 0.00 46.02 45.44 2a5w n GLY 107 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2a5w s LEU 108 N 0.00 3.51 0.75 0.99 1.43 -0.23 -4.13 118.68 121.00 2a5w s LEU 108 Ca 0.00 1.07 -0.13 0.00 -1.03 0.00 0.00 54.13 54.05 2a5w s LEU 108 Cb 0.00 -4.06 0.05 0.00 0.03 0.00 0.00 46.19 42.21 2a5w s LEU 108 CO 0.00 -0.67 1.13 -2.84 0.23 0.00 0.00 176.35 174.20 2a5w s PRO 109 N -4.87 2.20 -0.02 1.29 0.02 -1.26 -4.34 135.00 128.00 2a5w s PRO 109 Ca 0.50 1.40 -0.34 0.00 0.02 0.00 0.00 61.00 62.58 2a5w s PRO 109 Cb -0.10 -1.87 -0.13 0.00 0.02 0.00 0.00 34.50 32.41 2a5w s PRO 109 CO 0.48 -1.72 1.78 1.17 -0.33 0.00 0.00 177.00 178.37 2a5w n LYS 110 N -3.16 2.09 -2.07 5.54 4.81 -1.26 -4.88 118.16 119.24 2a5w n LYS 110 Ca 0.11 0.76 -0.41 0.00 -0.87 0.00 0.00 58.31 57.90 2a5w n LYS 110 Cb 0.52 -2.58 -0.02 0.00 0.02 0.00 0.00 35.03 32.98 2a5w n LYS 110 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 2a5w s PRO 111 N 3.08 4.32 0.39 1.64 0.02 -1.26 -5.03 135.00 138.15 2a5w s PRO 111 Ca 0.89 2.27 0.04 0.00 0.02 0.00 0.00 61.00 64.22 2a5w s PRO 111 Cb -0.71 -3.05 -0.04 0.00 0.02 0.00 0.00 34.50 30.71 2a5w s PRO 111 CO 0.48 -0.24 0.08 0.95 -0.33 0.00 0.00 177.00 177.94 2a5w s THR 112 N -1.14 0.99 0.00 0.99 -4.23 -1.26 -4.91 115.64 106.09 2a5w s THR 112 Ca 0.49 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.00 2a5w s THR 112 Cb -0.41 -2.54 0.00 0.00 1.34 0.00 0.00 72.50 70.89 2a5w s THR 112 CO 0.55 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.24 2a5w n GLY 113 N -0.87 0.67 1.46 3.99 0.00 -1.26 -4.97 105.19 104.21 2a5w n GLY 113 Ca -0.06 -0.60 0.07 0.00 0.00 0.00 0.00 46.02 45.43 2a5w n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32