#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 2.50 -0.11 0.54 -1.05 -1.26 -0.14 118.70 119.18 2a5w s GLU 3 Ca 0.00 -1.26 0.01 0.00 -0.15 0.00 0.00 54.97 53.58 2a5w s GLU 3 Cb 0.00 -2.31 0.02 0.00 -0.44 0.00 0.00 34.13 31.39 2a5w s GLU 3 CO 0.00 0.39 -0.14 -1.17 0.95 0.00 0.00 175.26 175.29 2a5w s LEU 4 N -3.59 1.68 -0.22 1.83 2.96 0.93 -4.83 118.68 117.44 2a5w s LEU 4 Ca 0.31 -0.42 -0.14 0.00 -0.22 0.00 0.00 54.13 53.65 2a5w s LEU 4 Cb -0.07 -1.08 -0.04 0.00 0.50 0.00 0.00 46.19 45.50 2a5w s LEU 4 CO 0.21 -0.00 0.34 -1.83 -1.32 0.00 0.00 176.35 173.75 2a5w s GLU 5 N 1.10 4.12 -0.09 1.98 4.04 -1.26 -0.02 118.70 128.57 2a5w s GLU 5 Ca -0.04 0.07 -0.04 0.00 0.04 0.00 0.00 54.97 55.00 2a5w s GLU 5 Cb -0.14 -3.56 0.05 0.00 0.02 0.00 0.00 34.13 30.50 2a5w s GLU 5 CO -0.03 -0.06 0.19 0.54 -1.84 0.00 0.00 175.26 174.06 2a5w s VAL 6 N 1.38 -0.20 -1.34 1.83 0.11 0.95 -4.89 120.40 118.25 2a5w s VAL 6 Ca 0.16 0.26 -0.05 0.00 -2.93 0.00 0.00 61.98 59.42 2a5w s VAL 6 Cb -0.15 -0.32 -0.00 0.00 -1.53 0.00 0.00 36.38 34.38 2a5w s VAL 6 CO 0.07 0.11 0.52 0.29 -3.33 0.00 0.00 175.10 172.76 2a5w n LYS 7 N 4.84 -2.91 -0.50 1.54 5.02 -1.26 -0.99 118.16 123.90 2a5w n LYS 7 Ca -0.14 0.42 0.00 0.00 -2.02 0.00 0.00 58.31 56.57 2a5w n LYS 7 Cb 0.51 -4.44 0.00 0.00 -0.02 0.00 0.00 35.03 31.08 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 -1.90 0.05 3.85 0.72 0.00 -1.26 -4.95 105.19 101.69 2a5w n GLY 8 Ca -0.26 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.91 3.98 -0.34 1.61 1.02 -0.16 -5.07 119.74 119.88 2a5w s LYS 9 Ca 0.00 0.51 -0.01 0.00 0.02 0.00 0.00 55.97 56.49 2a5w s LYS 9 Cb 0.00 -2.82 0.08 0.00 -0.52 0.00 0.00 37.83 34.57 2a5w s LYS 9 CO 0.00 0.40 0.06 0.15 -0.92 0.00 0.00 175.35 175.05 2a5w s LYS 10 N -2.23 2.13 0.34 1.68 1.02 -1.26 -0.03 119.74 121.38 2a5w s LYS 10 Ca 0.42 -1.54 -0.05 0.00 0.02 0.00 0.00 55.97 54.82 2a5w s LYS 10 Cb -0.14 -3.29 -0.05 0.00 -0.52 0.00 0.00 37.83 33.83 2a5w s LYS 10 CO 0.20 -0.81 0.62 -0.51 -0.92 0.00 0.00 175.35 173.93 2a5w s LEU 11 N 1.15 3.96 -0.13 3.17 1.43 0.97 -4.85 118.68 124.38 2a5w s LEU 11 Ca 0.01 0.78 -0.17 0.00 -1.03 0.00 0.00 54.13 53.72 2a5w s LEU 11 Cb -0.21 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.34 2a5w s LEU 11 CO -0.03 -0.29 0.43 -0.13 0.23 0.00 0.00 176.35 176.55 2a5w s ARG 12 N -3.86 4.31 0.06 1.70 1.81 -1.26 -0.05 118.95 121.67 2a5w s ARG 12 Ca 0.45 0.35 0.02 0.00 -1.72 0.00 0.00 55.73 54.83 2a5w s ARG 12 Cb -0.10 -3.44 -0.04 0.00 -0.45 0.00 0.00 34.95 30.92 2a5w s ARG 12 CO 0.33 0.17 0.08 -0.51 -0.68 0.00 0.00 175.30 174.69 2a5w s LEU 13 N 0.61 3.80 0.00 2.53 1.43 0.81 -1.15 118.68 126.71 2a5w s LEU 13 Ca 0.23 0.01 -0.18 0.00 -1.03 0.00 0.00 54.13 53.16 2a5w s LEU 13 Cb -0.14 -2.44 0.25 0.00 0.03 0.00 0.00 46.19 43.89 2a5w s LEU 13 CO 0.08 0.19 1.28 -0.90 0.23 0.00 0.00 176.35 177.23 2a5w n ASP 14 N 0.60 -0.56 0.00 2.29 5.68 0.65 -1.92 116.55 123.28 2a5w n ASP 14 Ca -0.09 -1.39 0.05 0.00 -0.50 0.00 0.00 54.79 52.85 2a5w n ASP 14 Cb 0.52 -1.03 0.25 0.00 -1.14 0.00 0.00 41.12 39.72 2a5w n ASP 14 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 2a5w n GLU 15 N -4.17 0.13 -0.09 0.11 0.28 -1.26 -1.71 120.64 113.93 2a5w n GLU 15 Ca 0.16 0.20 0.05 0.00 -0.16 0.00 0.00 57.16 57.42 2a5w n GLU 15 Cb 0.59 -1.50 0.10 0.00 1.43 0.00 0.00 31.44 32.06 2a5w n GLU 15 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2a5w n ASP 16 N -1.30 2.42 0.00 -1.84 8.00 -1.26 -4.99 116.55 117.58 2a5w n ASP 16 Ca 0.05 -1.74 0.00 0.00 0.71 0.00 0.00 54.79 53.81 2a5w n ASP 16 Cb 0.08 -0.12 0.00 0.00 -0.02 0.00 0.00 41.12 41.07 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 0.54 0.71 3.84 0.44 0.00 -0.70 -4.95 105.19 105.08 2a5w n GLY 17 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.16 3.60 0.12 1.61 0.40 -1.26 -4.83 117.98 115.45 2a5w s PHE 18 Ca 0.00 1.09 -0.35 0.00 -0.60 0.00 0.00 56.93 57.07 2a5w s PHE 18 Cb 0.00 -2.40 -0.16 0.00 0.51 0.00 0.00 43.02 40.98 2a5w s PHE 18 CO 0.00 0.40 1.39 1.28 0.70 0.00 0.00 175.22 178.99 2a5w n LEU 19 N 0.72 2.06 -0.13 -0.37 4.32 -1.26 -0.26 117.00 122.09 2a5w n LEU 19 Ca -0.04 1.11 -0.11 0.00 -0.02 0.00 0.00 56.01 56.94 2a5w n LEU 19 Cb 0.52 -1.26 0.01 0.00 -1.62 0.00 0.00 43.42 41.07 2a5w n LEU 19 CO 0.43 -0.85 0.62 -0.61 -1.22 0.00 0.00 177.39 175.76 2a5w h GLN 20 N 4.81 0.92 -4.69 3.23 5.75 -1.44 -3.41 115.11 120.27 2a5w h GLN 20 Ca -0.47 -0.43 -0.67 0.00 -0.15 0.00 0.00 58.65 56.93 2a5w h GLN 20 Cb 1.31 -0.01 -0.37 0.00 1.07 0.00 0.00 27.48 29.48 2a5w h GLN 20 CO 0.80 1.09 -0.69 0.34 -2.65 0.00 0.00 178.83 177.72 2a5w s ASP 21 N -6.78 4.85 0.58 -0.69 2.15 -1.26 -4.98 116.67 110.54 2a5w s ASP 21 Ca -0.11 -1.81 0.28 0.00 0.43 0.00 0.00 52.55 51.35 2a5w s ASP 21 Cb 0.12 -1.68 1.59 0.00 -0.30 0.00 0.00 42.92 42.65 2a5w s ASP 21 CO 0.87 -0.36 2.06 4.11 -0.17 0.00 0.00 175.17 181.68 2a5w h TRP 22 N 7.82 0.00 0.00 -5.34 5.08 -1.79 -1.67 115.95 120.05 2a5w h TRP 22 Ca -0.12 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.85 2a5w h TRP 22 Cb 1.04 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.20 2a5w h TRP 22 CO 0.55 0.00 0.00 0.39 -1.28 0.00 0.00 178.44 178.10 2a5w n GLU 23 N -3.88 0.13 0.00 0.12 1.02 -1.26 -2.84 120.64 113.93 2a5w n GLU 23 Ca 0.03 0.24 0.14 0.00 -0.02 0.00 0.00 57.16 57.55 2a5w n GLU 23 Cb 0.40 -1.69 0.69 0.00 -0.02 0.00 0.00 31.44 30.82 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 -1.92 0.49 -2.25 3.49 1.02 -0.63 -4.92 120.64 115.93 2a5w n GLU 24 Ca 0.04 -0.08 -0.38 0.00 -0.02 0.00 0.00 57.16 56.72 2a5w n GLU 24 Cb 0.30 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.20 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 -2.57 2.97 0.16 -0.32 -0.00 -1.13 -4.93 118.94 113.13 2a5w s TRP 25 Ca 0.28 1.53 -0.02 0.00 -0.00 0.00 0.00 56.10 57.89 2a5w s TRP 25 Cb 0.20 -3.43 0.01 0.00 -0.00 0.00 0.00 33.47 30.25 2a5w s TRP 25 CO 0.48 -1.49 0.25 -0.40 -0.00 0.00 0.00 176.95 175.78 2a5w n ASP 26 N -0.09 -0.70 0.15 5.86 5.68 -1.26 -4.99 116.55 121.20 2a5w n ASP 26 Ca 0.05 -1.85 0.03 0.00 -0.50 0.00 0.00 54.79 52.52 2a5w n ASP 26 Cb 0.47 1.26 0.41 0.00 -1.14 0.00 0.00 41.12 42.12 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 0.15 -0.31 0.11 5.08 -1.98 -0.72 114.58 116.91 2a5w h GLU 27 Ca -0.13 -0.04 -0.15 0.00 -1.00 0.00 0.00 59.36 58.04 2a5w h GLU 27 Cb 0.55 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 2a5w h GLU 27 CO 0.17 0.33 -0.41 0.93 -1.00 0.00 0.00 179.01 179.04 2a5w h GLU 28 N 0.15 0.77 -0.52 2.33 3.07 -2.00 -1.98 114.58 116.39 2a5w h GLU 28 Ca 0.03 -0.41 0.00 0.00 -0.50 0.00 0.00 59.36 58.48 2a5w h GLU 28 Cb 0.40 0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 28.30 2a5w h GLU 28 CO 0.03 1.04 0.34 0.28 -1.40 0.00 0.00 179.01 179.29 2a5w h VAL 29 N 0.63 1.14 -0.62 3.13 2.07 -1.80 -2.26 116.25 118.53 2a5w h VAL 29 Ca 0.05 -0.28 0.07 0.00 0.82 0.00 0.00 66.70 67.36 2a5w h VAL 29 Cb 0.97 0.39 -0.06 0.00 -1.52 0.00 0.00 31.29 31.07 2a5w h VAL 29 CO 0.09 0.14 0.30 0.00 0.02 0.00 0.00 177.57 178.12 2a5w h ALA 30 N 1.18 0.82 -0.59 1.67 0.00 -0.97 -1.40 119.26 119.98 2a5w h ALA 30 Ca 0.19 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.08 2a5w h ALA 30 Cb -0.06 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2a5w h ALA 30 CO -0.04 -0.07 0.10 0.93 0.00 0.00 0.00 179.25 180.17 2a5w h GLU 31 N 0.55 0.95 -0.57 0.00 4.39 -1.11 -0.71 114.58 118.08 2a5w h GLU 31 Ca 0.29 -0.23 -0.10 0.00 0.34 0.00 0.00 59.36 59.66 2a5w h GLU 31 Cb 0.26 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.77 2a5w h GLU 31 CO -0.23 0.88 -0.02 0.00 -1.16 0.00 0.00 179.01 178.48 2a5w h ALA 32 N 1.20 0.88 -0.36 3.43 0.00 -1.10 -2.23 119.26 121.06 2a5w h ALA 32 Ca 0.18 -0.31 -0.15 0.00 0.00 0.00 0.00 54.91 54.63 2a5w h ALA 32 Cb 0.39 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2a5w h ALA 32 CO 0.01 0.66 -0.35 -0.07 0.00 0.00 0.00 179.25 179.49 2a5w h LEU 33 N 0.92 0.94 -1.80 0.00 3.38 -0.97 -2.02 115.31 115.76 2a5w h LEU 33 Ca 0.16 -0.46 0.03 0.00 0.09 0.00 0.00 57.88 57.70 2a5w h LEU 33 Cb 0.57 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 2a5w h LEU 33 CO 0.03 1.21 0.20 0.00 0.09 0.00 0.00 178.44 179.98 2a5w h ALA 34 N 0.76 1.95 -0.01 1.53 0.00 -1.03 -1.56 119.26 120.90 2a5w h ALA 34 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2a5w h ALA 34 Cb 0.94 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2a5w h ALA 34 CO 0.09 0.00 -0.22 1.63 0.00 0.00 0.00 179.25 180.76 2a5w n LYS 35 N -4.49 1.01 -2.41 0.00 4.76 -0.85 -0.71 118.16 115.47 2a5w n LYS 35 Ca 0.03 -0.60 -0.42 0.00 -2.87 0.00 0.00 58.31 54.45 2a5w n LYS 35 Cb 0.18 -1.49 -0.03 0.00 -1.84 0.00 0.00 35.03 31.86 2a5w n LYS 35 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2a5w s ASP 36 N -2.41 6.14 -0.12 4.39 -1.08 -0.59 -4.74 116.67 118.27 2a5w s ASP 36 Ca 0.27 0.22 0.18 0.00 -0.52 0.00 0.00 52.55 52.70 2a5w s ASP 36 Cb 0.20 -2.55 0.72 0.00 -1.46 0.00 0.00 42.92 39.83 2a5w s ASP 36 CO 0.49 -1.71 1.63 0.35 0.52 0.00 0.00 175.17 176.44 2a5w n THR 37 N 6.82 1.83 0.21 1.71 -2.24 -1.26 -3.40 114.28 117.95 2a5w n THR 37 Ca 0.12 -1.17 0.08 0.00 -2.27 0.00 0.00 64.05 60.81 2a5w n THR 37 Cb 0.49 0.10 0.46 0.00 -2.10 0.00 0.00 70.33 69.29 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 4.07 0.00 0.00 -0.78 3.08 -1.96 -3.35 114.38 115.44 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 1.46 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.51 2a5w h ARG 38 CO 0.24 0.27 -0.10 1.19 -1.07 0.00 0.00 179.97 180.50 2a5w n PHE 39 N -3.58 0.00 -3.82 3.04 3.01 -1.24 -5.03 117.46 109.84 2a5w n PHE 39 Ca -0.01 -0.33 -0.12 0.00 1.01 0.00 0.00 57.45 58.00 2a5w n PHE 39 Cb 0.41 -0.05 -0.12 0.00 -0.01 0.00 0.00 39.48 39.71 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 -1.01 -0.16 0.31 4.37 0.15 -1.22 -5.00 113.70 111.13 2a5w s SER 40 Ca 0.06 0.30 0.03 0.00 0.70 0.00 0.00 55.95 57.04 2a5w s SER 40 Cb 0.05 0.32 0.50 0.00 -1.71 0.00 0.00 66.02 65.18 2a5w s SER 40 CO 0.01 -0.07 1.79 -0.65 1.20 0.00 0.00 173.24 175.52 2a5w h PRO 41 N 5.83 0.50 -4.30 5.44 0.11 -1.90 -3.39 132.00 134.29 2a5w h PRO 41 Ca -0.25 -0.15 -0.15 0.00 0.11 0.00 0.00 66.00 65.55 2a5w h PRO 41 Cb 1.20 -0.05 -0.15 0.00 0.11 0.00 0.00 31.00 32.11 2a5w h PRO 41 CO 0.41 0.63 -0.61 -0.65 -0.21 0.00 0.00 178.00 177.57 2a5w s GLN 42 N -4.72 0.86 0.52 1.05 -1.52 -1.26 -4.99 119.66 109.60 2a5w s GLN 42 Ca -0.07 -1.33 -0.21 0.00 -1.95 0.00 0.00 55.36 51.79 2a5w s GLN 42 Cb 0.15 0.25 -0.06 0.00 -0.22 0.00 0.00 33.01 33.13 2a5w s GLN 42 CO 0.78 -0.23 1.21 -2.14 -0.25 0.00 0.00 175.29 174.65 2a5w s PRO 43 N -4.00 3.40 -0.20 2.91 0.02 -1.26 -4.85 135.00 131.02 2a5w s PRO 43 Ca 0.18 1.85 -0.05 0.00 0.02 0.00 0.00 61.00 63.00 2a5w s PRO 43 Cb 0.07 -2.21 -0.02 0.00 0.02 0.00 0.00 34.50 32.36 2a5w s PRO 43 CO -0.02 -0.87 0.00 0.42 -0.33 0.00 0.00 177.00 176.20 2a5w s ILE 44 N -1.54 3.96 -0.32 2.83 1.01 0.11 -5.00 121.20 122.25 2a5w s ILE 44 Ca 0.70 -0.31 -0.25 0.00 0.00 0.00 0.00 60.65 60.79 2a5w s ILE 44 Cb -0.31 -2.79 0.01 0.00 0.01 0.00 0.00 42.46 39.38 2a5w s ILE 44 CO 0.36 0.43 0.87 -0.70 0.00 0.00 0.00 174.94 175.90 2a5w s GLU 45 N 0.98 3.97 -0.70 2.79 2.12 -1.26 -4.50 118.70 122.11 2a5w s GLU 45 Ca 0.02 0.70 -0.27 0.00 0.36 0.00 0.00 54.97 55.78 2a5w s GLU 45 Cb -0.14 -3.74 0.03 0.00 0.26 0.00 0.00 34.13 30.54 2a5w s GLU 45 CO 0.02 -0.76 1.24 -0.51 -0.54 0.00 0.00 175.26 174.70 2a5w s LEU 46 N 3.18 3.31 0.79 2.70 1.43 -1.26 -4.97 118.68 123.86 2a5w s LEU 46 Ca 0.36 -0.35 -0.08 0.00 -1.03 0.00 0.00 54.13 53.03 2a5w s LEU 46 Cb -0.13 -2.70 0.12 0.00 0.03 0.00 0.00 46.19 43.51 2a5w s LEU 46 CO 0.14 -1.73 1.11 0.42 0.23 0.00 0.00 176.35 176.52 2a5w s THR 47 N 5.44 2.14 0.35 5.49 -4.23 -1.26 -4.86 115.64 118.71 2a5w s THR 47 Ca 0.36 -0.26 0.08 0.00 -1.18 0.00 0.00 61.69 60.69 2a5w s THR 47 Cb -0.08 -2.88 0.32 0.00 1.34 0.00 0.00 72.50 71.19 2a5w s THR 47 CO 0.17 0.00 1.87 -0.08 -0.54 0.00 0.00 174.62 176.04 2a5w h GLU 48 N -0.92 0.71 -0.48 3.99 4.57 -1.99 -1.42 114.58 119.03 2a5w h GLU 48 Ca -0.42 -0.04 -0.05 0.00 -1.18 0.00 0.00 59.36 57.66 2a5w h GLU 48 Cb 1.28 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 29.69 2a5w h GLU 48 CO 0.48 0.47 0.10 0.93 -1.18 0.00 0.00 179.01 179.81 2a5w h GLU 49 N 0.73 0.78 -0.53 1.92 5.08 -1.98 -0.66 114.58 119.91 2a5w h GLU 49 Ca 0.45 -0.20 0.05 0.00 -1.00 0.00 0.00 59.36 58.66 2a5w h GLU 49 Cb 0.67 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.78 2a5w h GLU 49 CO -0.21 0.77 0.27 0.45 -1.00 0.00 0.00 179.01 179.29 2a5w h HIS 50 N 0.66 0.48 -0.55 4.33 3.86 -1.68 -2.77 115.15 119.48 2a5w h HIS 50 Ca 0.15 0.02 -0.06 0.00 -1.16 0.00 0.00 60.37 59.32 2a5w h HIS 50 Cb 0.35 -0.14 -0.02 0.00 1.06 0.00 0.00 27.41 28.66 2a5w h HIS 50 CO 0.02 0.23 0.10 -1.49 0.86 0.00 0.00 177.93 177.65 2a5w h TRP 51 N 0.51 0.96 -0.65 2.45 4.06 -0.87 -0.30 115.95 122.10 2a5w h TRP 51 Ca 0.24 -0.13 0.12 0.00 2.06 0.00 0.00 58.89 61.18 2a5w h TRP 51 Cb 0.15 -0.26 -0.09 0.00 -1.00 0.00 0.00 29.16 27.96 2a5w h TRP 51 CO -0.10 0.84 0.21 0.87 -3.56 0.00 0.00 178.44 176.70 2a5w h LYS 52 N 0.79 0.34 -0.31 0.49 1.57 -1.01 0.15 116.57 118.59 2a5w h LYS 52 Ca 0.17 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.88 2a5w h LYS 52 Cb 0.40 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 2a5w h LYS 52 CO 0.01 0.23 0.03 0.82 -0.57 0.00 0.00 179.45 179.97 2a5w h ILE 53 N 0.35 1.24 -0.02 1.86 1.08 -1.14 -2.22 117.51 118.67 2a5w h ILE 53 Ca 0.35 -0.87 -0.00 0.00 -0.39 0.00 0.00 64.86 63.95 2a5w h ILE 53 Cb 0.50 1.21 -0.00 0.00 -3.07 0.00 0.00 36.82 35.46 2a5w h ILE 53 CO -0.38 0.28 0.01 0.40 -0.69 0.00 0.00 178.15 177.77 2a5w h ILE 54 N 0.34 1.10 -0.55 -0.67 2.04 -0.60 -1.28 117.51 117.89 2a5w h ILE 54 Ca 0.09 -0.30 0.05 0.00 1.00 0.00 0.00 64.86 65.70 2a5w h ILE 54 Cb 0.39 1.28 -0.05 0.00 -0.74 0.00 0.00 36.82 37.70 2a5w h ILE 54 CO 0.01 0.08 0.29 0.03 0.00 0.00 0.00 178.15 178.56 2a5w h ARG 55 N -0.10 0.53 -0.10 2.37 3.08 -0.72 -1.31 114.38 118.13 2a5w h ARG 55 Ca 0.01 -0.03 0.01 0.00 0.07 0.00 0.00 59.98 60.04 2a5w h ARG 55 Cb 0.13 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 2a5w h ARG 55 CO -0.00 0.35 0.01 -0.92 -1.07 0.00 0.00 179.97 178.34 2a5w h TYR 56 N 0.55 0.02 -0.65 3.04 3.20 -1.25 -1.48 116.97 120.40 2a5w h TYR 56 Ca 0.24 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.11 2a5w h TYR 56 Cb 0.15 0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.39 2a5w h TYR 56 CO -0.10 0.00 0.36 -0.07 -1.64 0.00 0.00 178.16 176.71 2a5w h LEU 57 N 0.05 0.82 -0.36 2.82 3.38 -0.95 -1.54 115.31 119.52 2a5w h LEU 57 Ca 0.04 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 57.83 2a5w h LEU 57 Cb 0.04 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 2a5w h LEU 57 CO -0.07 0.68 -0.11 -0.09 0.09 0.00 0.00 178.44 178.95 2a5w h ARG 58 N 0.89 0.71 -0.42 1.13 2.43 -1.19 -1.55 114.38 116.38 2a5w h ARG 58 Ca 0.23 -0.28 -0.09 0.00 -0.81 0.00 0.00 59.98 59.02 2a5w h ARG 58 Cb 0.05 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 2a5w h ARG 58 CO -0.04 0.88 -0.12 -0.44 -1.51 0.00 0.00 179.97 178.73 2a5w h ASP 59 N 0.50 0.75 -0.15 -3.80 3.32 -1.13 -1.79 116.42 114.12 2a5w h ASP 59 Ca 0.09 -0.23 -0.01 0.00 0.02 0.00 0.00 57.03 56.90 2a5w h ASP 59 Cb 0.62 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 2a5w h ASP 59 CO 0.04 0.90 0.07 0.22 -1.72 0.00 0.00 179.24 178.75 2a5w h TYR 60 N 0.69 0.23 -0.16 4.55 3.20 -1.17 -2.41 116.97 121.90 2a5w h TYR 60 Ca 0.11 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.99 2a5w h TYR 60 Cb 0.60 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.78 2a5w h TYR 60 CO 0.03 0.29 0.01 0.35 -1.64 0.00 0.00 178.16 177.20 2a5w h PHE 61 N 0.11 0.02 -0.68 -3.82 3.57 -1.15 0.27 116.94 115.25 2a5w h PHE 61 Ca 0.05 0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.65 2a5w h PHE 61 Cb 0.15 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 38.86 2a5w h PHE 61 CO -0.02 -0.00 0.45 0.82 -2.23 0.00 0.00 178.31 177.33 2a5w h ILE 62 N 0.07 0.94 0.18 1.41 2.04 -1.31 0.71 117.51 121.56 2a5w h ILE 62 Ca 0.07 -0.20 -0.35 0.00 1.00 0.00 0.00 64.86 65.38 2a5w h ILE 62 Cb 0.08 0.31 0.01 0.00 -0.74 0.00 0.00 36.82 36.47 2a5w h ILE 62 CO -0.11 0.11 -1.77 0.50 0.00 0.00 0.00 178.15 176.88 2a5w h LYS 63 N 0.58 0.37 0.00 2.37 3.64 -1.01 -3.41 116.57 119.11 2a5w h LYS 63 Ca 0.31 -0.64 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 2a5w h LYS 63 Cb 0.45 0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 2a5w h LYS 63 CO -0.10 1.29 -0.59 0.66 -2.27 0.00 0.00 179.45 178.44 2a5w n TYR 64 N -3.57 0.00 -1.00 1.91 4.02 0.90 -5.03 117.16 114.40 2a5w n TYR 64 Ca -0.25 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.64 2a5w n TYR 64 Cb 1.07 -0.04 0.00 0.00 -0.02 0.00 0.00 39.34 40.35 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 1.38 0.58 3.28 2.72 0.00 0.25 -4.98 105.19 108.41 2a5w n GLY 65 Ca 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.34 0.09 0.40 1.61 0.11 -1.26 -5.04 120.40 113.98 2a5w s VAL 66 Ca 0.00 -0.75 -0.24 0.00 -2.93 0.00 0.00 61.98 58.06 2a5w s VAL 66 Cb 0.00 -1.16 -0.09 0.00 -1.53 0.00 0.00 36.38 33.60 2a5w s VAL 66 CO 0.00 -0.41 1.10 0.00 -3.33 0.00 0.00 175.10 172.46 2a5w s ALA 67 N -3.52 3.10 0.65 1.54 0.00 -1.26 -3.83 121.76 118.43 2a5w s ALA 67 Ca 0.02 0.82 -0.16 0.00 0.00 0.00 0.00 51.96 52.63 2a5w s ALA 67 Cb 0.02 -3.32 -0.00 0.00 0.00 0.00 0.00 23.12 19.82 2a5w s ALA 67 CO -0.10 -0.37 1.16 -1.25 0.00 0.00 0.00 175.76 175.20 2a5w s PRO 68 N -2.43 2.71 0.57 0.00 0.04 -1.26 -4.96 135.00 129.66 2a5w s PRO 68 Ca 0.58 1.61 -0.20 0.00 0.04 0.00 0.00 61.00 63.03 2a5w s PRO 68 Cb -0.26 -1.92 -0.05 0.00 0.04 0.00 0.00 34.50 32.31 2a5w s PRO 68 CO 0.32 -1.36 1.14 -2.30 0.04 0.00 0.00 177.00 174.84 2a5w n PRO 69 N -2.19 1.25 0.17 0.56 -0.02 -1.26 -4.77 135.00 128.74 2a5w n PRO 69 Ca 0.12 0.47 0.05 0.00 -2.02 0.00 0.00 63.50 62.12 2a5w n PRO 69 Cb 0.51 -2.33 0.48 0.00 -0.02 0.00 0.00 33.50 32.14 2a5w n PRO 69 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2a5w h VAL 70 N 0.95 1.12 -0.43 -1.45 2.07 -2.00 -1.36 116.25 115.15 2a5w h VAL 70 Ca -0.49 -0.52 -0.14 0.00 0.82 0.00 0.00 66.70 66.37 2a5w h VAL 70 Cb 1.34 1.15 -0.01 0.00 -1.52 0.00 0.00 31.29 32.24 2a5w h VAL 70 CO 0.54 0.16 -0.27 -0.09 0.02 0.00 0.00 177.57 177.93 2a5w h ARG 71 N 0.14 0.95 -0.34 1.57 9.65 -2.00 -1.80 114.38 122.55 2a5w h ARG 71 Ca 0.03 -0.44 0.04 0.00 -1.10 0.00 0.00 59.98 58.51 2a5w h ARG 71 Cb 0.24 -0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 28.77 2a5w h ARG 71 CO 0.01 1.11 0.10 0.52 2.80 0.00 0.00 179.97 184.51 2a5w h MET 72 N 0.79 0.23 -0.49 0.20 2.86 -1.63 -1.90 114.93 114.98 2a5w h MET 72 Ca 0.09 -0.01 0.10 0.00 -2.06 0.00 0.00 59.70 57.81 2a5w h MET 72 Cb 0.86 -0.05 -0.09 0.00 0.06 0.00 0.00 31.60 32.38 2a5w h MET 72 CO 0.08 0.15 -0.05 1.25 1.06 0.00 0.00 176.91 179.40 2a5w h LEU 73 N 0.23 -0.31 -0.83 1.22 5.85 -1.05 -2.10 115.31 118.31 2a5w h LEU 73 Ca 0.16 0.13 -0.08 0.00 0.84 0.00 0.00 57.88 58.93 2a5w h LEU 73 Cb 0.15 0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 2a5w h LEU 73 CO -0.18 -0.11 0.03 0.58 -0.34 0.00 0.00 178.44 178.42 2a5w h VAL 74 N 0.07 1.25 0.00 1.05 2.07 -1.08 -1.21 116.25 118.39 2a5w h VAL 74 Ca 0.25 -1.02 -0.08 0.00 0.82 0.00 0.00 66.70 66.67 2a5w h VAL 74 Cb 0.38 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 2a5w h VAL 74 CO -0.45 0.37 -0.36 0.11 0.02 0.00 0.00 177.57 177.25 2a5w h LYS 75 N 0.85 0.00 -0.06 1.57 1.57 -1.02 0.06 116.57 119.54 2a5w h LYS 75 Ca 0.17 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.76 2a5w h LYS 75 Cb 0.45 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 2a5w h LYS 75 CO 0.02 0.36 -0.77 1.25 -0.57 0.00 0.00 179.45 179.74 2a5w h HIS 76 N 0.00 0.50 -0.34 -1.35 2.76 -0.78 -2.56 115.15 113.38 2a5w h HIS 76 Ca -0.00 -0.23 -0.03 0.00 -2.20 0.00 0.00 60.37 57.90 2a5w h HIS 76 Cb 0.66 -0.07 -0.01 0.00 1.55 0.00 0.00 27.41 29.53 2a5w h HIS 76 CO 0.00 0.99 0.09 0.00 -1.30 0.00 0.00 177.93 177.71 2a5w h LYS 78 N 0.39 1.06 -0.19 0.00 1.57 -1.02 0.13 116.57 118.52 2a5w h LYS 78 Ca 0.11 -0.06 -0.17 0.00 -1.87 0.00 0.00 60.65 58.65 2a5w h LYS 78 Cb 0.29 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.36 2a5w h LYS 78 CO 0.00 0.70 -0.55 -0.22 -0.57 0.00 0.00 179.45 178.82 2a5w h LYS 79 N 1.09 0.70 0.00 3.15 1.63 -1.15 -3.21 116.57 118.79 2a5w h LYS 79 Ca 0.43 -0.50 0.00 0.00 -0.85 0.00 0.00 60.65 59.73 2a5w h LYS 79 Cb 0.22 0.08 0.00 0.00 -0.60 0.00 0.00 32.23 31.94 2a5w h LYS 79 CO -0.19 1.12 -0.52 0.39 -3.45 0.00 0.00 179.45 176.81 2a5w n GLU 80 N -4.12 3.65 -0.01 1.90 -0.58 -0.16 -4.89 120.64 116.43 2a5w n GLU 80 Ca -0.06 -0.01 -0.02 0.00 -0.42 0.00 0.00 57.16 56.65 2a5w n GLU 80 Cb 0.62 -0.78 -0.01 0.00 -0.57 0.00 0.00 31.44 30.71 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 -1.27 0.44 -3.71 2.62 0.31 0.38 -5.04 118.33 112.05 2a5w n VAL 81 Ca 0.00 0.28 -0.13 0.00 -0.01 0.00 0.00 64.34 64.48 2a5w n VAL 81 Cb 0.03 -1.53 -0.09 0.00 -0.91 0.00 0.00 33.84 31.34 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 -1.48 0.55 0.58 5.55 1.70 -0.77 -5.04 118.95 120.04 2a5w s ARG 82 Ca -0.05 0.66 0.33 0.00 -0.47 0.00 0.00 55.73 56.19 2a5w s ARG 82 Cb 0.01 0.27 1.76 0.00 -0.57 0.00 0.00 34.95 36.41 2a5w s ARG 82 CO 0.08 -0.07 2.17 -1.00 -1.08 0.00 0.00 175.30 175.41 2a5w h PRO 83 N 5.39 0.00 -0.65 3.89 0.13 -1.81 -1.31 132.00 137.65 2a5w h PRO 83 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 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 0.21 0.05 0.00 -0.40 -0.23 0.00 0.00 178.00 177.63 2a5w n ASP 84 N -3.48 4.40 -4.70 1.44 5.75 -1.26 -4.79 116.55 113.91 2a5w n ASP 84 Ca -0.02 -2.39 -0.43 0.00 -0.01 0.00 0.00 54.79 51.94 2a5w n ASP 84 Cb 0.17 -0.55 -0.01 0.00 -1.03 0.00 0.00 41.12 39.70 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 1.17 0.04 -0.22 0.00 0.23 -1.26 -4.65 115.26 110.57 2a5w n ASN 86 Ca 0.06 -2.74 0.03 0.00 -0.53 0.00 0.00 54.58 51.41 2a5w n ASN 86 Cb 0.35 1.15 0.28 0.00 -2.08 0.00 0.00 39.78 39.49 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 0.80 -1.08 -4.53 5.85 -1.95 -1.82 115.31 112.58 2a5w h LEU 87 Ca -0.21 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.44 2a5w h LEU 87 Cb 0.96 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.78 2a5w h LEU 87 CO 0.32 0.55 0.01 -0.61 -0.34 0.00 0.00 178.44 178.37 2a5w h GLN 88 N 0.93 0.65 -0.49 1.25 5.75 -1.99 -1.63 115.11 119.58 2a5w h GLN 88 Ca 0.31 -0.15 0.00 0.00 -0.15 0.00 0.00 58.65 58.66 2a5w h GLN 88 Cb 0.07 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.51 2a5w h GLN 88 CO -0.09 0.67 0.32 -0.92 -2.65 0.00 0.00 178.83 176.16 2a5w h TYR 89 N 0.62 0.62 -0.99 3.99 3.20 -1.73 -1.12 116.97 121.56 2a5w h TYR 89 Ca 0.13 0.01 0.13 0.00 3.14 0.00 0.00 58.73 62.14 2a5w h TYR 89 Cb 0.38 -0.21 -0.09 0.00 1.54 0.00 0.00 36.73 38.35 2a5w h TYR 89 CO 0.02 0.40 0.62 0.82 -1.64 0.00 0.00 178.16 178.38 2a5w h ILE 90 N 0.66 0.88 -0.14 1.81 2.04 -0.93 -0.91 117.51 120.93 2a5w h ILE 90 Ca 0.18 -0.32 -0.10 0.00 1.00 0.00 0.00 64.86 65.62 2a5w h ILE 90 Cb -0.07 -0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 35.87 2a5w h ILE 90 CO -0.04 0.17 -0.34 1.88 0.00 0.00 0.00 178.15 179.82 2a5w h TYR 91 N 0.93 0.32 -0.76 1.37 -1.99 -0.80 0.10 116.97 116.14 2a5w h TYR 91 Ca 0.50 -0.07 -0.03 0.00 2.00 0.00 0.00 58.73 61.13 2a5w h TYR 91 Cb 0.57 -0.07 -0.04 0.00 2.00 0.00 0.00 36.73 39.19 2a5w h TYR 91 CO -0.00 0.59 0.36 -0.22 -0.00 0.00 0.00 178.16 178.89 2a5w h LYS 92 N 0.24 1.09 0.02 4.88 3.64 0.05 -2.49 116.57 124.01 2a5w h LYS 92 Ca 0.03 -0.16 -0.24 0.00 -1.27 0.00 0.00 60.65 59.01 2a5w h LYS 92 Cb 0.72 -0.20 0.01 0.00 -0.41 0.00 0.00 32.23 32.35 2a5w h LYS 92 CO 0.05 0.84 -1.01 -0.07 -2.27 0.00 0.00 179.45 177.00 2a5w h LEU 93 N 1.08 0.59 -6.84 5.20 3.38 -0.88 -3.41 115.31 114.44 2a5w h LEU 93 Ca 0.26 -0.49 -0.60 0.00 0.09 0.00 0.00 57.88 57.14 2a5w h LEU 93 Cb 0.12 -0.18 -0.40 0.00 0.09 0.00 0.00 40.66 40.29 2a5w h LEU 93 CO -0.03 1.30 -0.78 -0.36 0.09 0.00 0.00 178.44 178.66 2a5w s PHE 94 N -3.19 1.46 0.56 1.13 0.40 0.33 -4.98 117.98 113.69 2a5w s PHE 94 Ca -0.06 -2.06 0.26 0.00 -0.60 0.00 0.00 56.93 54.46 2a5w s PHE 94 Cb 0.08 -1.49 1.49 0.00 0.51 0.00 0.00 43.02 43.61 2a5w s PHE 94 CO 0.88 -0.81 2.04 -1.35 0.70 0.00 0.00 175.22 176.68 2a5w h PRO 95 N 6.92 0.00 -0.03 0.24 0.11 -1.69 0.13 132.00 137.68 2a5w h PRO 95 Ca 0.01 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.12 2a5w h PRO 95 Cb 0.95 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.06 2a5w h PRO 95 CO 0.40 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.23 2a5w n GLN 96 N -4.09 1.97 0.00 1.05 6.02 -1.26 -4.97 117.38 116.10 2a5w n GLN 96 Ca 0.05 -1.41 0.00 0.00 -0.01 0.00 0.00 57.00 55.64 2a5w n GLN 96 Cb 0.46 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 30.25 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 1.26 0.67 0.26 1.08 0.00 0.44 -4.23 105.19 104.67 2a5w n GLY 97 Ca 0.17 -2.15 0.15 0.00 0.00 0.00 0.00 46.02 44.19 2a5w n GLY 97 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2a5w h PRO 98 N 0.00 0.00 0.00 1.61 0.13 -1.88 -2.22 132.00 129.64 2a5w h PRO 98 Ca 0.00 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.98 2a5w h PRO 98 Cb 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.11 2a5w h PRO 98 CO 0.00 0.06 -1.07 0.00 -0.23 0.00 0.00 178.00 176.76 2a5w n ALA 99 N -2.13 0.70 0.16 -0.56 0.00 -1.26 -0.93 120.51 116.48 2a5w n ALA 99 Ca 0.00 -0.54 0.02 0.00 0.00 0.00 0.00 53.44 52.92 2a5w n ALA 99 Cb 0.33 -0.23 0.23 0.00 0.00 0.00 0.00 19.45 19.79 2a5w n ALA 99 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2a5w h LYS 100 N -1.00 0.00 0.00 0.00 1.63 -1.73 -3.07 116.57 112.40 2a5w h LYS 100 Ca -0.22 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.58 2a5w h LYS 100 Cb 1.00 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.63 2a5w h LYS 100 CO -0.14 0.50 -0.59 -0.25 -3.45 0.00 0.00 179.45 175.52 2a5w n ASP 101 N -3.60 1.52 0.17 4.20 8.00 -0.86 -4.49 116.55 121.49 2a5w n ASP 101 Ca -0.00 0.24 -0.14 0.00 0.71 0.00 0.00 54.79 55.60 2a5w n ASP 101 Cb 0.58 -0.58 -0.08 0.00 -0.02 0.00 0.00 41.12 41.03 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 -0.69 -0.42 -0.74 2.24 0.00 -1.50 0.38 119.26 118.52 2a5w h ALA 102 Ca 0.00 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 2a5w h ALA 102 Cb 0.59 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 2a5w h ALA 102 CO 0.00 -0.61 0.45 0.00 0.00 0.00 0.00 179.25 179.09 2a5w h ARG 104 N 1.02 -0.18 -0.14 0.00 2.43 -1.43 -1.06 114.38 115.02 2a5w h ARG 104 Ca 0.27 0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.35 2a5w h ARG 104 Cb -0.03 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 2a5w h ARG 104 CO -0.05 -0.12 -0.33 0.82 -1.51 0.00 0.00 179.97 178.78 2a5w h ILE 105 N -0.19 1.28 0.00 1.20 2.04 -0.43 -1.29 117.51 120.12 2a5w h ILE 105 Ca 0.16 -1.34 0.00 0.00 1.00 0.00 0.00 64.86 64.67 2a5w h ILE 105 Cb 0.43 1.54 0.00 0.00 -0.74 0.00 0.00 36.82 38.05 2a5w h ILE 105 CO -0.41 0.41 0.00 0.00 0.00 0.00 0.00 178.15 178.15 2a5w n ALA 106 N -2.48 2.19 -1.01 1.87 0.00 -0.41 -4.31 120.51 116.35 2a5w n ALA 106 Ca -0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 53.44 53.31 2a5w n ALA 106 Cb 0.43 -1.35 -0.00 0.00 0.00 0.00 0.00 19.45 18.53 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 0.45 0.44 3.83 0.00 0.00 -0.49 -4.80 105.19 104.62 2a5w n GLY 107 Ca 0.13 -0.91 -0.32 0.00 0.00 0.00 0.00 46.02 44.92 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 -0.12 3.54 0.80 0.99 1.02 -0.45 -4.25 118.68 120.21 2a5w s LEU 108 Ca 0.00 1.61 -0.10 0.00 0.02 0.00 0.00 54.13 55.66 2a5w s LEU 108 Cb 0.00 -4.51 0.08 0.00 0.02 0.00 0.00 46.19 41.78 2a5w s LEU 108 CO 0.00 -0.78 1.10 -2.16 0.02 0.00 0.00 176.35 174.53 2a5w s PRO 109 N -4.22 2.00 0.32 1.29 0.04 -1.26 -4.41 135.00 128.76 2a5w s PRO 109 Ca 0.60 1.24 -0.29 0.00 0.04 0.00 0.00 61.00 62.58 2a5w s PRO 109 Cb -0.12 -1.86 -0.10 0.00 0.04 0.00 0.00 34.50 32.46 2a5w s PRO 109 CO 0.36 -1.85 1.32 -1.59 0.04 0.00 0.00 177.00 175.27 2a5w s LYS 110 N -4.86 4.35 0.42 4.56 -2.85 -1.26 -4.92 119.74 115.19 2a5w s LYS 110 Ca 0.62 2.21 -0.26 0.00 -1.00 0.00 0.00 55.97 57.54 2a5w s LYS 110 Cb -0.18 -3.08 -0.09 0.00 -2.06 0.00 0.00 37.83 32.41 2a5w s LYS 110 CO 0.56 -0.21 1.44 -1.25 0.10 0.00 0.00 175.35 176.00 2a5w s PRO 111 N -1.56 3.84 0.00 1.78 0.04 -1.26 -4.93 135.00 132.91 2a5w s PRO 111 Ca 0.50 2.46 0.15 0.00 0.04 0.00 0.00 61.00 64.16 2a5w s PRO 111 Cb -0.40 -2.77 -0.06 0.00 0.04 0.00 0.00 34.50 31.31 2a5w s PRO 111 CO 0.51 -0.71 0.76 -2.37 0.04 0.00 0.00 177.00 175.24 2a5w n THR 112 N 0.04 0.00 -0.54 1.26 5.66 -1.26 -5.03 114.28 114.42 2a5w n THR 112 Ca 0.04 -0.27 -0.28 0.00 -3.05 0.00 0.00 64.05 60.49 2a5w n THR 112 Cb 0.41 1.12 0.26 0.00 -1.55 0.00 0.00 70.33 70.57 2a5w n THR 112 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 2a5w s GLY 113 N -2.07 1.52 0.47 1.09 0.00 -1.26 -4.98 107.32 102.09 2a5w s GLY 113 Ca 0.10 -0.28 -0.23 0.00 0.00 0.00 0.00 44.72 44.31 2a5w s GLY 113 CO 0.48 0.50 1.19 0.00 0.00 0.00 0.00 173.10 175.26