#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v58 s LEU 3 N 0.00 3.81 0.52 -1.84 1.43 -1.26 -5.00 118.68 116.34 1v58 s LEU 3 Ca 0.00 2.25 -0.23 0.00 -1.03 0.00 0.00 54.13 55.13 1v58 s LEU 3 Cb 0.00 -4.48 -0.06 0.00 0.03 0.00 0.00 46.19 41.68 1v58 s LEU 3 CO 0.00 -1.19 1.36 -2.84 0.23 0.00 0.00 176.35 173.91 1v58 s PRO 4 N -3.12 3.28 0.25 1.29 0.02 -1.26 -4.71 135.00 130.75 1v58 s PRO 4 Ca 0.71 2.25 -0.07 0.00 0.02 0.00 0.00 61.00 63.91 1v58 s PRO 4 Cb -0.26 -2.35 0.44 0.00 0.02 0.00 0.00 34.50 32.34 1v58 s PRO 4 CO 0.30 -1.08 1.63 0.00 -0.33 0.00 0.00 177.00 177.52 1v58 h ALA 5 N 1.67 0.78 -0.67 -1.55 0.00 -1.94 -0.81 119.26 116.73 1v58 h ALA 5 Ca -0.51 0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.66 1v58 h ALA 5 Cb 1.29 0.43 -0.03 0.00 0.00 0.00 0.00 17.79 19.47 1v58 h ALA 5 CO 0.58 -0.42 0.45 -1.35 0.00 0.00 0.00 179.25 178.50 1v58 h PRO 6 N 0.10 0.86 -0.10 0.00 0.11 -1.90 -1.12 132.00 129.95 1v58 h PRO 6 Ca 0.41 -0.05 -0.20 0.00 0.11 0.00 0.00 66.00 66.27 1v58 h PRO 6 Cb 0.73 -0.20 -0.00 0.00 0.11 0.00 0.00 31.00 31.64 1v58 h PRO 6 CO -0.67 0.57 -0.75 0.28 -0.21 0.00 0.00 178.00 177.22 1v58 h VAL 7 N 0.89 1.35 -0.55 3.15 2.07 -1.55 -2.72 116.25 118.89 1v58 h VAL 7 Ca 0.25 -2.10 -0.04 0.00 0.82 0.00 0.00 66.70 65.64 1v58 h VAL 7 Cb -0.07 2.08 -0.03 0.00 -1.52 0.00 0.00 31.29 31.76 1v58 h VAL 7 CO -0.06 0.64 0.19 0.11 0.02 0.00 0.00 177.57 178.48 1v58 h LYS 8 N 0.35 0.81 -0.67 1.57 1.57 -0.66 -0.69 116.57 118.85 1v58 h LYS 8 Ca -0.04 -0.13 -0.06 0.00 -1.87 0.00 0.00 60.65 58.55 1v58 h LYS 8 Cb 1.34 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 33.49 1v58 h LYS 8 CO 0.14 0.69 0.18 0.00 -0.57 0.00 0.00 179.45 179.88 1v58 h ALA 9 N 1.42 1.04 -0.20 3.86 0.00 -1.05 -2.60 119.26 121.73 1v58 h ALA 9 Ca 0.19 -0.23 -0.15 0.00 0.00 0.00 0.00 54.91 54.72 1v58 h ALA 9 Cb 0.20 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1v58 h ALA 9 CO -0.01 0.64 -0.49 0.82 0.00 0.00 0.00 179.25 180.20 1v58 h ILE 10 N 1.01 1.32 -1.00 0.00 2.04 -1.07 -2.90 117.51 116.90 1v58 h ILE 10 Ca 0.22 -1.71 0.12 0.00 1.00 0.00 0.00 64.86 64.49 1v58 h ILE 10 Cb 0.33 1.69 -0.08 0.00 -0.74 0.00 0.00 36.82 38.02 1v58 h ILE 10 CO -0.00 0.53 0.63 -0.33 0.00 0.00 0.00 178.15 178.98 1v58 h GLU 11 N 0.42 0.96 0.00 2.37 5.08 -0.77 0.16 114.58 122.80 1v58 h GLU 11 Ca 0.02 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1v58 h GLU 11 Cb 1.01 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 30.05 1v58 h GLU 11 CO 0.09 0.63 0.00 1.63 -1.00 0.00 0.00 179.01 180.37 1v58 n LYS 12 N -4.62 0.02 -0.25 2.33 5.02 -1.09 -1.51 118.16 118.06 1v58 n LYS 12 Ca 0.19 0.33 0.05 0.00 -2.02 0.00 0.00 58.31 56.85 1v58 n LYS 12 Cb 0.36 -1.50 0.16 0.00 -0.02 0.00 0.00 35.03 34.03 1v58 n LYS 12 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1v58 n GLN 13 N -1.46 2.10 -0.28 1.97 1.13 0.57 -4.85 117.38 116.57 1v58 n GLN 13 Ca 0.02 -1.26 0.00 0.00 -1.94 0.00 0.00 57.00 53.82 1v58 n GLN 13 Cb 0.09 -1.46 0.00 0.00 0.11 0.00 0.00 30.24 28.98 1v58 n GLN 13 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1v58 n GLY 14 N 0.76 1.24 3.52 1.08 0.00 -0.57 -5.08 105.19 106.15 1v58 n GLY 14 Ca 0.11 -0.19 -0.34 0.00 0.00 0.00 0.00 46.02 45.60 1v58 n GLY 14 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1v58 s ILE 15 N -2.00 3.77 -0.21 -0.61 1.01 -0.69 -4.29 121.20 118.18 1v58 s ILE 15 Ca 0.00 -0.42 -0.04 0.00 0.00 0.00 0.00 60.65 60.18 1v58 s ILE 15 Cb 0.00 -2.61 -0.02 0.00 0.01 0.00 0.00 42.46 39.85 1v58 s ILE 15 CO 0.00 0.54 -0.02 -0.89 0.00 0.00 0.00 174.94 174.57 1v58 s THR 16 N -0.10 3.67 0.18 2.92 2.01 -0.39 -4.55 115.64 119.37 1v58 s THR 16 Ca 0.02 -0.40 -0.30 0.00 0.31 0.00 0.00 61.69 61.31 1v58 s THR 16 Cb -0.13 -2.66 -0.08 0.00 0.01 0.00 0.00 72.50 69.64 1v58 s THR 16 CO 0.03 0.42 0.98 -0.63 -0.69 0.00 0.00 174.62 174.73 1v58 s ILE 17 N 1.27 4.19 -0.22 1.82 1.01 -1.26 -0.88 121.20 127.13 1v58 s ILE 17 Ca 0.03 1.99 -0.16 0.00 0.00 0.00 0.00 60.65 62.51 1v58 s ILE 17 Cb -0.14 -4.27 -0.11 0.00 0.01 0.00 0.00 42.46 37.95 1v58 s ILE 17 CO -0.00 0.39 -0.21 -0.38 0.00 0.00 0.00 174.94 174.74 1v58 n ILE 18 N 2.13 1.51 -3.83 2.92 5.41 0.14 -4.94 119.36 122.70 1v58 n ILE 18 Ca 0.00 -0.12 -0.04 0.00 1.00 0.00 0.00 62.75 63.60 1v58 n ILE 18 Cb 0.48 -2.08 0.01 0.00 -0.71 0.00 0.00 39.64 37.33 1v58 n ILE 18 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 176.55 174.96 1v58 s LYS 19 N -2.53 1.35 0.22 0.38 -2.85 -1.08 -5.02 119.74 110.21 1v58 s LYS 19 Ca -0.32 -0.83 0.06 0.00 -1.00 0.00 0.00 55.97 53.88 1v58 s LYS 19 Cb 0.09 0.40 -0.03 0.00 -2.06 0.00 0.00 37.83 36.23 1v58 s LYS 19 CO 0.47 -0.63 0.23 0.95 0.10 0.00 0.00 175.35 176.47 1v58 s THR 20 N -2.55 4.77 0.12 3.79 -4.23 -1.26 -0.55 115.64 115.72 1v58 s THR 20 Ca 0.18 -1.14 -0.14 0.00 -1.18 0.00 0.00 61.69 59.42 1v58 s THR 20 Cb -0.02 -3.53 0.02 0.00 1.34 0.00 0.00 72.50 70.30 1v58 s THR 20 CO 0.05 -0.26 0.33 0.72 -0.54 0.00 0.00 174.62 174.92 1v58 s PHE 21 N -1.96 -0.07 -0.01 3.99 -0.12 -0.20 -4.89 117.98 114.71 1v58 s PHE 21 Ca 0.33 -0.28 -0.28 0.00 -0.05 0.00 0.00 56.93 56.64 1v58 s PHE 21 Cb -0.09 0.15 -0.03 0.00 -0.63 0.00 0.00 43.02 42.42 1v58 s PHE 21 CO 0.26 -0.66 0.91 -0.51 -0.05 0.00 0.00 175.22 175.18 1v58 s ASP 22 N -2.83 7.29 0.31 1.98 -0.00 -1.26 -1.10 116.67 121.06 1v58 s ASP 22 Ca 0.04 1.56 0.09 0.00 -0.00 0.00 0.00 52.55 54.24 1v58 s ASP 22 Cb 0.03 -2.53 -0.06 0.00 -0.00 0.00 0.00 42.92 40.35 1v58 s ASP 22 CO -0.11 -0.22 -0.10 0.00 -0.00 0.00 0.00 175.17 174.74 1v58 s ALA 23 N 0.91 2.75 1.04 5.23 0.00 -1.18 -4.85 121.76 125.67 1v58 s ALA 23 Ca 0.48 -2.00 -0.15 0.00 0.00 0.00 0.00 51.96 50.29 1v58 s ALA 23 Cb -0.20 -0.02 0.21 0.00 0.00 0.00 0.00 23.12 23.11 1v58 s ALA 23 CO 0.26 0.07 1.13 -2.14 0.00 0.00 0.00 175.76 175.08 1v58 s PRO 24 N -3.63 0.05 -2.06 0.00 0.02 -1.26 -4.03 135.00 124.09 1v58 s PRO 24 Ca 0.31 0.19 0.00 0.00 0.02 0.00 0.00 61.00 61.52 1v58 s PRO 24 Cb 0.02 -1.72 0.00 0.00 0.02 0.00 0.00 34.50 32.81 1v58 s PRO 24 CO 0.15 -2.92 0.00 0.41 -0.33 0.00 0.00 177.00 174.31 1v58 n GLY 25 N -1.52 1.33 2.14 0.52 0.00 -1.26 -1.68 105.19 104.72 1v58 n GLY 25 Ca 0.09 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.10 1v58 n GLY 25 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1v58 n GLY 26 N -0.54 0.50 3.88 -0.02 0.00 -1.26 -4.79 105.19 102.95 1v58 n GLY 26 Ca -0.21 -0.31 -0.31 0.00 0.00 0.00 0.00 46.02 45.18 1v58 n GLY 26 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1v58 s MET 27 N -0.99 3.77 -0.12 1.61 -1.94 -0.68 -4.63 119.30 116.31 1v58 s MET 27 Ca 0.00 0.23 -0.04 0.00 -1.71 0.00 0.00 55.69 54.17 1v58 s MET 27 Cb 0.00 -2.65 -0.03 0.00 2.01 0.00 0.00 34.83 34.16 1v58 s MET 27 CO 0.00 0.30 0.01 0.21 -0.01 0.00 0.00 175.02 175.53 1v58 s LYS 28 N -2.94 3.38 0.12 2.03 2.20 -1.15 -3.11 119.74 120.27 1v58 s LYS 28 Ca 0.47 -0.41 0.04 0.00 -0.36 0.00 0.00 55.97 55.70 1v58 s LYS 28 Cb -0.11 -2.92 -0.04 0.00 -1.51 0.00 0.00 37.83 33.25 1v58 s LYS 28 CO 0.23 0.50 0.12 0.20 -0.36 0.00 0.00 175.35 176.03 1v58 s GLY 29 N -0.30 1.86 -0.06 5.54 0.00 -0.26 -0.47 107.32 113.63 1v58 s GLY 29 Ca 0.07 -1.11 0.01 0.00 0.00 0.00 0.00 44.72 43.69 1v58 s GLY 29 CO 0.02 -1.10 -0.05 -0.19 0.00 0.00 0.00 173.10 171.77 1v58 s TYR 30 N -1.58 0.95 -0.15 1.90 1.51 0.35 -1.04 117.35 119.30 1v58 s TYR 30 Ca 0.30 -0.33 -0.07 0.00 -1.01 0.00 0.00 57.07 55.96 1v58 s TYR 30 Cb -0.11 -0.84 -0.04 0.00 -0.11 0.00 0.00 41.96 40.86 1v58 s TYR 30 CO 0.23 -0.28 0.12 -1.17 -1.11 0.00 0.00 175.55 173.34 1v58 s LEU 31 N 1.18 4.21 0.00 -1.29 2.96 0.29 -0.96 118.68 125.07 1v58 s LEU 31 Ca -0.07 0.34 0.00 0.00 -0.22 0.00 0.00 54.13 54.18 1v58 s LEU 31 Cb -0.14 -2.04 0.00 0.00 0.50 0.00 0.00 46.19 44.51 1v58 s LEU 31 CO -0.01 0.32 0.00 0.61 -1.32 0.00 0.00 176.35 175.94 1v58 n GLY 32 N 2.59 2.73 3.04 7.98 0.00 -0.38 0.29 105.19 121.44 1v58 n GLY 32 Ca -0.18 -1.06 -0.14 0.00 0.00 0.00 0.00 46.02 44.64 1v58 n GLY 32 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v58 s LYS 33 N -1.02 0.51 -0.11 1.61 1.02 -0.06 -0.34 119.74 121.35 1v58 s LYS 33 Ca 0.00 -0.66 -0.00 0.00 0.02 0.00 0.00 55.97 55.33 1v58 s LYS 33 Cb 0.00 -0.31 0.02 0.00 -0.52 0.00 0.00 37.83 37.02 1v58 s LYS 33 CO 0.00 0.06 -0.09 -0.47 -0.92 0.00 0.00 175.35 173.94 1v58 s TYR 34 N -1.16 1.55 -1.51 3.18 5.04 0.60 -1.26 117.35 123.80 1v58 s TYR 34 Ca -0.08 -0.78 -0.06 0.00 -2.44 0.00 0.00 57.07 53.72 1v58 s TYR 34 Cb -0.09 -1.26 0.05 0.00 0.35 0.00 0.00 41.96 41.01 1v58 s TYR 34 CO 0.00 -0.51 0.52 1.04 -1.34 0.00 0.00 175.55 175.26 1v58 n GLN 35 N 4.84 -3.17 -1.17 4.97 6.02 -1.26 -0.65 117.38 126.96 1v58 n GLN 35 Ca -0.14 0.38 -0.06 0.00 -0.01 0.00 0.00 57.00 57.17 1v58 n GLN 35 Cb 0.50 -4.67 -0.03 0.00 1.02 0.00 0.00 30.24 27.07 1v58 n GLN 35 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1v58 n ASP 36 N -2.88 -4.75 -4.51 1.08 2.03 -1.26 -5.00 116.55 101.25 1v58 n ASP 36 Ca -0.19 0.15 -0.33 0.00 0.52 0.00 0.00 54.79 54.94 1v58 n ASP 36 Cb 0.62 -2.78 -0.12 0.00 -0.72 0.00 0.00 41.12 38.13 1v58 n ASP 36 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 1v58 s MET 37 N -2.09 2.81 0.36 -0.67 -1.94 0.18 -5.06 119.30 112.88 1v58 s MET 37 Ca 0.00 -0.61 -0.28 0.00 -1.71 0.00 0.00 55.69 53.09 1v58 s MET 37 Cb 0.00 -2.54 -0.10 0.00 2.01 0.00 0.00 34.83 34.19 1v58 s MET 37 CO 0.00 0.57 1.35 0.20 -0.01 0.00 0.00 175.02 177.12 1v58 s GLY 38 N -0.56 2.97 0.06 -0.03 0.00 -1.26 -0.29 107.32 108.21 1v58 s GLY 38 Ca 0.08 1.33 -0.05 0.00 0.00 0.00 0.00 44.72 46.08 1v58 s GLY 38 CO 0.02 1.97 0.08 -1.34 0.00 0.00 0.00 173.10 173.83 1v58 s VAL 39 N -1.16 0.17 0.01 1.40 -7.23 0.54 -4.83 120.40 109.29 1v58 s VAL 39 Ca 0.52 -1.37 0.06 0.00 -1.81 0.00 0.00 61.98 59.37 1v58 s VAL 39 Cb -0.41 -1.27 -0.02 0.00 0.56 0.00 0.00 36.38 35.25 1v58 s VAL 39 CO 0.54 -0.76 -0.18 0.42 -0.31 0.00 0.00 175.10 174.81 1v58 s THR 40 N -3.50 1.46 -0.04 5.32 -4.23 -1.26 -1.25 115.64 112.14 1v58 s THR 40 Ca 0.03 -0.93 0.05 0.00 -1.18 0.00 0.00 61.69 59.66 1v58 s THR 40 Cb 0.04 -1.24 -0.01 0.00 1.34 0.00 0.00 72.50 72.63 1v58 s THR 40 CO -0.09 0.30 -0.18 -0.63 -0.54 0.00 0.00 174.62 173.48 1v58 s ILE 41 N -0.59 1.46 -0.13 2.99 1.01 -0.13 -2.13 121.20 123.69 1v58 s ILE 41 Ca 0.06 -0.75 0.02 0.00 0.00 0.00 0.00 60.65 59.99 1v58 s ILE 41 Cb -0.08 -1.24 0.01 0.00 0.01 0.00 0.00 42.46 41.16 1v58 s ILE 41 CO 0.00 0.42 -0.20 -0.31 0.00 0.00 0.00 174.94 174.85 1v58 s TYR 42 N -0.11 2.47 -0.05 3.97 1.51 0.22 -0.50 117.35 124.85 1v58 s TYR 42 Ca -0.01 -1.20 -0.25 0.00 -1.01 0.00 0.00 57.07 54.60 1v58 s TYR 42 Cb -0.10 -1.69 -0.03 0.00 -0.11 0.00 0.00 41.96 40.02 1v58 s TYR 42 CO 0.01 -0.55 0.79 -1.17 -1.11 0.00 0.00 175.55 173.52 1v58 s LEU 43 N 0.80 4.32 0.87 -1.29 2.96 0.37 -0.17 118.68 126.55 1v58 s LEU 43 Ca -0.08 1.32 -0.12 0.00 -0.22 0.00 0.00 54.13 55.03 1v58 s LEU 43 Cb -0.16 -3.23 0.12 0.00 0.50 0.00 0.00 46.19 43.42 1v58 s LEU 43 CO -0.01 -0.17 1.10 0.42 -1.32 0.00 0.00 176.35 176.37 1v58 s THR 44 N 0.95 2.71 0.23 3.68 -4.23 0.32 -2.93 115.64 116.38 1v58 s THR 44 Ca 0.42 0.23 -0.06 0.00 -1.18 0.00 0.00 61.69 61.10 1v58 s THR 44 Cb -0.19 -2.80 0.19 0.00 1.34 0.00 0.00 72.50 71.04 1v58 s THR 44 CO 0.20 -0.30 1.78 -0.65 -0.54 0.00 0.00 174.62 175.12 1v58 h PRO 45 N -1.44 0.62 0.00 3.99 0.11 -1.87 -0.73 132.00 132.69 1v58 h PRO 45 Ca -0.49 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.58 1v58 h PRO 45 Cb 1.28 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1v58 h PRO 45 CO 0.56 0.41 0.00 0.38 -0.21 0.00 0.00 178.00 179.15 1v58 h ASP 46 N 0.64 0.00 0.00 -2.05 2.03 -1.93 -3.45 116.42 111.66 1v58 h ASP 46 Ca 0.37 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.67 1v58 h ASP 46 Cb 0.38 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.88 1v58 h ASP 46 CO -0.27 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 178.55 1v58 n GLY 47 N -0.74 0.48 0.64 7.15 0.00 -0.28 -4.81 105.19 107.64 1v58 n GLY 47 Ca -0.00 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.08 1v58 n GLY 47 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1v58 n LYS 48 N -1.77 2.35 -3.95 1.61 5.02 -1.26 -4.90 118.16 115.26 1v58 n LYS 48 Ca 0.00 -1.89 -0.09 0.00 -2.02 0.00 0.00 58.31 54.31 1v58 n LYS 48 Cb 0.07 -1.28 -0.09 0.00 -0.02 0.00 0.00 35.03 33.72 1v58 n LYS 48 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1v58 s HIS 49 N -1.00 0.26 -0.02 2.13 3.76 -1.26 -4.76 115.29 114.39 1v58 s HIS 49 Ca 0.22 -0.63 -0.06 0.00 -0.15 0.00 0.00 55.06 54.44 1v58 s HIS 49 Cb 0.12 -0.18 0.01 0.00 1.11 0.00 0.00 32.58 33.64 1v58 s HIS 49 CO 0.17 -0.40 0.13 0.00 -0.85 0.00 0.00 174.74 173.78 1v58 s ALA 50 N -3.11 -0.31 -0.14 -1.40 0.00 -1.26 -0.52 121.76 115.02 1v58 s ALA 50 Ca -0.01 0.09 0.02 0.00 0.00 0.00 0.00 51.96 52.06 1v58 s ALA 50 Cb 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 23.12 23.09 1v58 s ALA 50 CO -0.07 -0.14 -0.20 0.42 0.00 0.00 0.00 175.76 175.77 1v58 s ILE 51 N -0.70 2.27 -0.35 0.00 1.01 0.76 -4.94 121.20 119.25 1v58 s ILE 51 Ca -0.08 -0.91 -0.15 0.00 0.00 0.00 0.00 60.65 59.51 1v58 s ILE 51 Cb -0.05 -1.92 -0.01 0.00 0.01 0.00 0.00 42.46 40.49 1v58 s ILE 51 CO 0.01 0.54 0.36 -0.55 0.00 0.00 0.00 174.94 175.30 1v58 s SER 52 N 0.74 6.17 0.00 3.58 0.15 -1.26 -0.61 113.70 122.48 1v58 s SER 52 Ca -0.08 -0.27 0.00 0.00 0.70 0.00 0.00 55.95 56.30 1v58 s SER 52 Cb -0.16 -2.20 0.00 0.00 -1.71 0.00 0.00 66.02 61.96 1v58 s SER 52 CO 0.00 -0.35 0.00 0.61 1.20 0.00 0.00 173.24 174.70 1v58 n GLY 53 N 4.97 -0.53 3.39 9.45 0.00 -0.90 -5.04 105.19 116.53 1v58 n GLY 53 Ca -0.09 -0.82 -0.33 0.00 0.00 0.00 0.00 46.02 44.79 1v58 n GLY 53 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1v58 s TYR 54 N -3.00 2.75 -0.14 1.61 1.51 -1.26 -4.27 117.35 114.55 1v58 s TYR 54 Ca 0.00 -0.51 -0.11 0.00 -1.01 0.00 0.00 57.07 55.44 1v58 s TYR 54 Cb 0.00 -1.76 -0.05 0.00 -0.11 0.00 0.00 41.96 40.04 1v58 s TYR 54 CO 0.00 -0.10 0.22 1.41 -1.11 0.00 0.00 175.55 175.97 1v58 s MET 55 N -0.00 3.97 0.17 -0.62 1.75 -1.26 -4.97 119.30 118.33 1v58 s MET 55 Ca -0.04 -0.02 0.11 0.00 -1.25 0.00 0.00 55.69 54.49 1v58 s MET 55 Cb -0.14 -3.33 -0.04 0.00 2.84 0.00 0.00 34.83 34.15 1v58 s MET 55 CO 0.04 0.46 -0.23 0.71 -0.65 0.00 0.00 175.02 175.35 1v58 s TYR 56 N -0.16 2.35 0.19 4.11 1.51 -1.26 -0.11 117.35 123.98 1v58 s TYR 56 Ca 0.15 -0.35 0.02 0.00 -1.01 0.00 0.00 57.07 55.88 1v58 s TYR 56 Cb -0.13 -1.20 0.02 0.00 -0.11 0.00 0.00 41.96 40.55 1v58 s TYR 56 CO 0.03 0.44 0.18 0.27 -1.11 0.00 0.00 175.55 175.37 1v58 n ASN 57 N 0.48 1.27 0.00 2.29 0.23 -0.84 -4.92 115.26 113.78 1v58 n ASN 57 Ca -0.14 -1.59 0.00 0.00 -0.53 0.00 0.00 54.58 52.32 1v58 n ASN 57 Cb 0.55 -0.06 0.31 0.00 -2.08 0.00 0.00 39.78 38.50 1v58 n ASN 57 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1v58 h GLU 58 N 0.00 0.51 0.00 -3.83 5.08 -2.02 -1.96 114.58 112.37 1v58 h GLU 58 Ca -0.11 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.15 1v58 h GLU 58 Cb 0.42 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1v58 h GLU 58 CO 0.16 0.53 0.00 1.63 -1.00 0.00 0.00 179.01 180.33 1v58 n LYS 59 N -4.30 0.24 -0.50 2.33 5.02 -1.26 -4.87 118.16 114.81 1v58 n LYS 59 Ca 0.02 0.08 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 1v58 n LYS 59 Cb 0.23 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.74 1v58 n LYS 59 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1v58 n GLY 60 N 0.70 0.74 3.73 0.72 0.00 -0.74 -5.05 105.19 105.29 1v58 n GLY 60 Ca 0.09 -0.07 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 1v58 n GLY 60 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1v58 s GLU 61 N -0.56 4.71 -0.85 1.61 2.12 -1.26 -4.80 118.70 119.66 1v58 s GLU 61 Ca 0.00 1.45 -0.24 0.00 0.36 0.00 0.00 54.97 56.54 1v58 s GLU 61 Cb 0.00 -3.37 0.06 0.00 0.26 0.00 0.00 34.13 31.08 1v58 s GLU 61 CO 0.00 0.24 1.25 1.21 -0.54 0.00 0.00 175.26 177.42 1v58 s ASN 62 N -0.09 6.35 0.44 -1.70 3.84 -1.26 -1.99 114.94 120.52 1v58 s ASN 62 Ca 0.46 -1.14 0.12 0.00 0.21 0.00 0.00 52.86 52.52 1v58 s ASN 62 Cb -0.23 -2.51 0.99 0.00 -0.55 0.00 0.00 41.25 38.94 1v58 s ASN 62 CO 0.30 -1.53 2.03 -0.07 -2.79 0.00 0.00 177.10 175.04 1v58 h LEU 63 N 12.22 0.16 -0.28 3.21 3.38 -0.87 -2.05 115.31 131.09 1v58 h LEU 63 Ca -0.05 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 1v58 h LEU 63 Cb 1.04 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.73 1v58 h LEU 63 CO 1.28 0.22 0.05 0.28 0.09 0.00 0.00 178.44 180.36 1v58 h SER 64 N 0.18 0.44 -0.62 -0.43 0.02 -1.88 -0.37 113.55 110.88 1v58 h SER 64 Ca 0.04 -0.25 -0.01 0.00 -0.84 0.00 0.00 61.79 60.73 1v58 h SER 64 Cb 0.16 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.56 1v58 h SER 64 CO 0.00 0.58 0.34 -1.13 -1.14 0.00 0.00 176.83 175.48 1v58 h ASN 65 N 0.28 0.78 -0.50 3.07 -1.24 -1.79 0.54 115.58 116.73 1v58 h ASN 65 Ca 0.09 -0.10 -0.01 0.00 0.71 0.00 0.00 56.30 56.99 1v58 h ASN 65 Cb 0.32 -0.20 -0.02 0.00 0.73 0.00 0.00 38.32 39.15 1v58 h ASN 65 CO 0.00 0.66 0.28 0.74 -1.29 0.00 0.00 177.43 177.82 1v58 h THR 66 N 0.85 1.17 -0.33 -3.57 2.02 -1.18 -0.65 112.91 111.22 1v58 h THR 66 Ca 0.22 -0.43 -0.06 0.00 0.77 0.00 0.00 66.41 66.91 1v58 h THR 66 Cb 0.05 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 67.00 1v58 h THR 66 CO -0.03 0.18 -0.02 0.25 0.37 0.00 0.00 175.52 176.27 1v58 h LEU 67 N 0.66 0.59 -0.71 2.58 5.85 -0.70 -1.31 115.31 122.27 1v58 h LEU 67 Ca 0.18 -0.32 0.00 0.00 0.84 0.00 0.00 57.88 58.58 1v58 h LEU 67 Cb 0.04 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 40.88 1v58 h LEU 67 CO -0.03 0.77 0.46 0.40 -0.34 0.00 0.00 178.44 179.70 1v58 h ILE 68 N 0.40 1.19 -0.24 4.05 2.04 -0.75 0.10 117.51 124.30 1v58 h ILE 68 Ca 0.09 -0.37 -0.02 0.00 1.00 0.00 0.00 64.86 65.56 1v58 h ILE 68 Cb 0.48 0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 1v58 h ILE 68 CO 0.02 0.19 0.07 -0.33 0.00 0.00 0.00 178.15 178.10 1v58 h GLU 69 N 0.97 0.38 -0.53 2.37 5.08 -0.99 0.45 114.58 122.31 1v58 h GLU 69 Ca 0.26 -0.09 -0.10 0.00 -1.00 0.00 0.00 59.36 58.43 1v58 h GLU 69 Cb -0.09 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 1v58 h GLU 69 CO -0.05 0.47 -0.08 -0.22 -1.00 0.00 0.00 179.01 178.13 1v58 h LYS 70 N 0.21 0.97 0.00 2.33 3.64 -0.92 0.58 116.57 123.38 1v58 h LYS 70 Ca 0.08 -0.33 -0.21 0.00 -1.27 0.00 0.00 60.65 58.91 1v58 h LYS 70 Cb 0.26 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 31.96 1v58 h LYS 70 CO -0.00 1.00 -1.64 0.39 -2.27 0.00 0.00 179.45 176.93 1v58 n GLU 71 N -4.16 0.63 -0.07 1.90 -0.58 0.32 -4.33 120.64 114.35 1v58 n GLU 71 Ca 0.02 0.18 -0.12 0.00 -0.42 0.00 0.00 57.16 56.82 1v58 n GLU 71 Cb 0.38 -1.75 -0.06 0.00 -0.57 0.00 0.00 31.44 29.44 1v58 n GLU 71 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 1v58 n ILE 72 N -2.87 0.83 -0.09 -3.67 5.41 0.14 -4.85 119.36 114.26 1v58 n ILE 72 Ca -0.14 -0.28 -0.18 0.00 1.00 0.00 0.00 62.75 63.15 1v58 n ILE 72 Cb 0.91 -1.24 -0.13 0.00 -0.71 0.00 0.00 39.64 38.48 1v58 n ILE 72 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 1v58 n TYR 73 N -3.17 0.34 -0.23 1.39 0.53 -1.01 -4.65 117.16 110.37 1v58 n TYR 73 Ca -0.27 0.08 -0.03 0.00 -1.02 0.00 0.00 57.90 56.65 1v58 n TYR 73 Cb 0.75 -1.05 0.07 0.00 -1.03 0.00 0.00 39.34 38.09 1v58 n TYR 73 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1v58 h ALA 74 N 0.09 0.85 0.15 -0.72 0.00 -0.04 -2.85 119.26 116.75 1v58 h ALA 74 Ca -0.53 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.38 1v58 h ALA 74 Cb 1.96 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 19.52 1v58 h ALA 74 CO -0.03 0.13 -0.51 -1.35 0.00 0.00 0.00 179.25 177.48 1v58 h PRO 75 N 0.76 -0.74 0.00 0.00 0.11 -1.81 0.92 132.00 131.24 1v58 h PRO 75 Ca 0.27 0.05 -0.05 0.00 0.11 0.00 0.00 66.00 66.38 1v58 h PRO 75 Cb 0.06 0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.33 1v58 h PRO 75 CO -0.12 -0.49 -0.23 0.00 -0.21 0.00 0.00 178.00 176.94 1v58 h ALA 76 N -0.50 1.53 0.01 -0.75 0.00 -1.84 -1.86 119.26 115.85 1v58 h ALA 76 Ca -0.01 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 1v58 h ALA 76 Cb 0.76 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1v58 h ALA 76 CO -0.26 0.29 -0.00 0.78 0.00 0.00 0.00 179.25 180.05 1v58 h GLY 77 N 0.78 -0.01 1.52 0.00 0.00 -1.12 -1.40 103.07 102.84 1v58 h GLY 77 Ca -0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 1v58 h GLY 77 CO 0.03 -0.00 0.04 3.21 0.00 0.00 0.00 176.54 179.82 1v58 h ARG 78 N -0.27 0.60 0.04 4.80 3.08 -0.63 -1.19 114.38 120.82 1v58 h ARG 78 Ca -0.00 -0.12 -0.00 0.00 0.07 0.00 0.00 59.98 59.92 1v58 h ARG 78 Cb 0.26 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.22 1v58 h ARG 78 CO 0.00 0.59 -0.02 1.49 -1.07 0.00 0.00 179.97 180.97 1v58 h GLU 79 N 0.58 -0.05 -0.13 0.04 4.57 -1.15 -1.47 114.58 116.96 1v58 h GLU 79 Ca 0.13 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.21 1v58 h GLU 79 Cb 0.31 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.90 1v58 h GLU 79 CO 0.01 0.09 -0.35 0.52 -1.18 0.00 0.00 179.01 178.09 1v58 h MET 80 N -0.18 0.27 -0.74 1.92 2.86 -1.07 -1.28 114.93 116.70 1v58 h MET 80 Ca -0.01 -0.11 -0.05 0.00 -2.06 0.00 0.00 59.70 57.47 1v58 h MET 80 Cb 0.16 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.78 1v58 h MET 80 CO 0.01 0.59 0.29 2.35 1.06 0.00 0.00 176.91 181.21 1v58 h TRP 81 N 0.24 1.13 -0.31 -0.22 2.91 -1.06 -1.36 115.95 117.28 1v58 h TRP 81 Ca 0.03 -0.08 -0.15 0.00 1.13 0.00 0.00 58.89 59.81 1v58 h TRP 81 Cb 0.73 -0.34 -0.00 0.00 -0.51 0.00 0.00 29.16 29.04 1v58 h TRP 81 CO 0.01 0.86 -0.40 0.37 -1.03 0.00 0.00 178.44 178.26 1v58 h GLN 82 N 1.08 0.83 -0.84 2.65 5.75 -0.87 -1.78 115.11 121.93 1v58 h GLN 82 Ca 0.25 -0.47 -0.02 0.00 -0.15 0.00 0.00 58.65 58.26 1v58 h GLN 82 Cb 0.22 0.03 -0.04 0.00 1.07 0.00 0.00 27.48 28.76 1v58 h GLN 82 CO -0.02 1.11 0.44 0.00 -2.65 0.00 0.00 178.83 177.71 1v58 h ARG 83 N 0.60 1.18 -0.44 1.69 2.47 -0.90 -0.81 114.38 118.18 1v58 h ARG 83 Ca 0.04 -0.15 -0.14 0.00 -1.26 0.00 0.00 59.98 58.47 1v58 h ARG 83 Cb 1.00 -0.23 -0.01 0.00 -1.65 0.00 0.00 29.97 29.08 1v58 h ARG 83 CO 0.10 0.88 -0.29 0.52 0.56 0.00 0.00 179.97 181.73 1v58 h MET 84 N 1.18 0.96 -0.58 0.04 2.86 -1.19 -2.77 114.93 115.42 1v58 h MET 84 Ca 0.29 -0.45 0.01 0.00 -2.06 0.00 0.00 59.70 57.49 1v58 h MET 84 Cb 0.06 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.68 1v58 h MET 84 CO -0.04 1.12 0.39 1.49 1.06 0.00 0.00 176.91 180.92 1v58 h GLU 85 N 0.81 0.75 -0.01 1.72 4.22 -0.69 -1.39 114.58 119.99 1v58 h GLU 85 Ca 0.09 -0.05 0.00 0.00 0.08 0.00 0.00 59.36 59.48 1v58 h GLU 85 Cb 0.88 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.96 1v58 h GLU 85 CO 0.08 0.50 -0.02 1.04 -2.18 0.00 0.00 179.01 178.43 1v58 n GLN 86 N -4.45 1.21 -2.22 1.92 6.02 -0.37 -4.89 117.38 114.59 1v58 n GLN 86 Ca 0.06 -0.42 -0.26 0.00 -0.01 0.00 0.00 57.00 56.37 1v58 n GLN 86 Cb 0.06 -1.49 0.08 0.00 1.02 0.00 0.00 30.24 29.91 1v58 n GLN 86 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1v58 s SER 87 N -2.08 4.61 -1.22 1.08 0.01 -0.52 -4.98 113.70 110.60 1v58 s SER 87 Ca 0.41 0.34 -0.17 0.00 1.31 0.00 0.00 55.95 57.85 1v58 s SER 87 Cb 0.21 -0.91 0.11 0.00 0.21 0.00 0.00 66.02 65.65 1v58 s SER 87 CO 0.37 -1.73 1.55 -2.28 0.41 0.00 0.00 173.24 171.57 1v58 s HIS 88 N -3.29 3.09 0.22 2.43 2.46 -1.26 -4.98 115.29 113.95 1v58 s HIS 88 Ca 0.62 -1.77 0.05 0.00 0.47 0.00 0.00 55.06 54.42 1v58 s HIS 88 Cb -0.09 -4.54 -0.03 0.00 -0.13 0.00 0.00 32.58 27.78 1v58 s HIS 88 CO 0.45 -1.63 0.31 1.67 -2.47 0.00 0.00 174.74 173.08 1v58 s TRP 89 N 3.07 3.41 -0.15 3.88 1.48 -1.26 -4.70 118.94 124.67 1v58 s TRP 89 Ca 0.47 0.00 -0.06 0.00 -1.06 0.00 0.00 56.10 55.46 1v58 s TRP 89 Cb 0.00 -1.57 -0.04 0.00 -1.16 0.00 0.00 33.47 30.70 1v58 s TRP 89 CO 0.02 0.47 0.06 -0.51 -4.06 0.00 0.00 176.95 172.94 1v58 s LEU 90 N -3.74 3.88 0.13 -4.66 1.43 0.05 -4.86 118.68 110.90 1v58 s LEU 90 Ca 0.34 0.18 -0.26 0.00 -1.03 0.00 0.00 54.13 53.36 1v58 s LEU 90 Cb -0.09 -1.95 -0.07 0.00 0.03 0.00 0.00 46.19 44.10 1v58 s LEU 90 CO 0.28 0.27 0.79 -0.22 0.23 0.00 0.00 176.35 177.70 1v58 s LEU 91 N -0.21 4.55 -0.28 1.79 2.96 -1.26 -1.05 118.68 125.17 1v58 s LEU 91 Ca 0.08 1.61 -0.02 0.00 -0.22 0.00 0.00 54.13 55.57 1v58 s LEU 91 Cb -0.12 -3.30 0.09 0.00 0.50 0.00 0.00 46.19 43.36 1v58 s LEU 91 CO 0.01 0.13 0.10 -0.62 -1.32 0.00 0.00 176.35 174.66 1v58 s ASP 92 N -0.75 3.66 0.00 3.68 2.15 -0.21 -4.85 116.67 120.35 1v58 s ASP 92 Ca 0.37 -1.38 0.00 0.00 0.43 0.00 0.00 52.55 51.98 1v58 s ASP 92 Cb -0.22 -0.63 0.00 0.00 -0.30 0.00 0.00 42.92 41.76 1v58 s ASP 92 CO 0.26 -0.41 0.00 0.61 -0.17 0.00 0.00 175.17 175.46 1v58 n GLY 93 N 5.03 0.12 3.74 2.66 0.00 -1.26 -0.68 105.19 114.80 1v58 n GLY 93 Ca -0.04 -2.29 -0.41 0.00 0.00 0.00 0.00 46.02 43.27 1v58 n GLY 93 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v58 s LYS 94 N -0.28 4.48 0.55 1.61 -0.14 -1.26 -4.92 119.74 119.79 1v58 s LYS 94 Ca 0.00 1.89 0.37 0.00 -1.36 0.00 0.00 55.97 56.86 1v58 s LYS 94 Cb 0.00 -3.24 1.83 0.00 -1.68 0.00 0.00 37.83 34.74 1v58 s LYS 94 CO 0.00 -0.11 2.11 1.57 -0.76 0.00 0.00 175.35 178.16 1v58 h LYS 95 N 5.30 0.00 -0.51 1.68 2.10 -1.98 -1.36 116.57 121.81 1v58 h LYS 95 Ca -0.44 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.21 1v58 h LYS 95 Cb 1.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 1v58 h LYS 95 CO 0.75 0.00 0.00 -0.40 -2.00 0.00 0.00 179.45 177.80 1v58 n ASP 96 N -2.91 3.57 -4.67 7.07 5.75 -1.26 -4.97 116.55 119.13 1v58 n ASP 96 Ca -0.01 -1.98 -0.46 0.00 -0.01 0.00 0.00 54.79 52.33 1v58 n ASP 96 Cb 0.15 -0.34 -0.04 0.00 -1.03 0.00 0.00 41.12 39.86 1v58 n ASP 96 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1v58 n ALA 97 N 1.43 1.33 0.03 2.12 0.00 -0.51 -4.87 120.51 120.04 1v58 n ALA 97 Ca 0.20 0.42 0.03 0.00 0.00 0.00 0.00 53.44 54.10 1v58 n ALA 97 Cb 0.58 -2.37 0.40 0.00 0.00 0.00 0.00 19.45 18.06 1v58 n ALA 97 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1v58 h PRO 98 N 6.36 0.47 -5.22 0.00 0.13 -1.76 -3.42 132.00 128.56 1v58 h PRO 98 Ca -0.45 -0.05 -0.61 0.00 -0.87 0.00 0.00 66.00 64.01 1v58 h PRO 98 Cb 1.25 -0.09 -0.13 0.00 0.13 0.00 0.00 31.00 32.16 1v58 h PRO 98 CO 0.90 0.39 -0.38 0.08 -0.23 0.00 0.00 178.00 178.76 1v58 s VAL 99 N -5.24 5.29 -0.14 1.56 1.01 -1.05 -5.04 120.40 116.78 1v58 s VAL 99 Ca -0.08 0.40 -0.02 0.00 0.00 0.00 0.00 61.98 62.29 1v58 s VAL 99 Cb 0.17 -3.60 -0.02 0.00 0.00 0.00 0.00 36.38 32.93 1v58 s VAL 99 CO 0.74 0.30 -0.08 -0.63 0.00 0.00 0.00 175.10 175.43 1v58 s ILE 100 N 1.18 3.52 -0.07 2.22 1.01 -1.26 -1.34 121.20 126.46 1v58 s ILE 100 Ca 0.12 -0.49 0.01 0.00 0.00 0.00 0.00 60.65 60.29 1v58 s ILE 100 Cb -0.14 -2.51 0.02 0.00 0.01 0.00 0.00 42.46 39.83 1v58 s ILE 100 CO 0.06 0.51 -0.09 -0.69 0.00 0.00 0.00 174.94 174.73 1v58 s VAL 101 N 0.34 0.92 -0.08 2.92 1.01 -0.82 -4.56 120.40 120.12 1v58 s VAL 101 Ca -0.07 -0.32 -0.09 0.00 0.00 0.00 0.00 61.98 61.51 1v58 s VAL 101 Cb -0.15 -0.89 -0.04 0.00 0.00 0.00 0.00 36.38 35.30 1v58 s VAL 101 CO 0.04 0.32 0.21 -0.31 0.00 0.00 0.00 175.10 175.36 1v58 s TYR 102 N 1.01 3.63 -0.05 5.22 1.51 -0.48 -0.13 117.35 128.05 1v58 s TYR 102 Ca -0.09 0.63 -0.00 0.00 -1.01 0.00 0.00 57.07 56.60 1v58 s TYR 102 Cb -0.15 -2.02 0.03 0.00 -0.11 0.00 0.00 41.96 39.71 1v58 s TYR 102 CO -0.00 0.71 -0.01 0.08 -1.11 0.00 0.00 175.55 175.21 1v58 s VAL 103 N -1.07 0.38 -0.26 0.71 1.01 -0.49 -0.59 120.40 120.09 1v58 s VAL 103 Ca 0.18 0.03 -0.18 0.00 0.00 0.00 0.00 61.98 62.01 1v58 s VAL 103 Cb -0.13 -0.48 -0.03 0.00 0.00 0.00 0.00 36.38 35.74 1v58 s VAL 103 CO 0.07 0.22 0.53 -0.36 0.00 0.00 0.00 175.10 175.57 1v58 s PHE 104 N 1.39 3.28 0.06 5.22 0.40 -0.23 -0.45 117.98 127.64 1v58 s PHE 104 Ca -0.04 0.67 0.04 0.00 -0.60 0.00 0.00 56.93 57.00 1v58 s PHE 104 Cb -0.13 -2.73 -0.03 0.00 0.51 0.00 0.00 43.02 40.64 1v58 s PHE 104 CO -0.03 -0.27 -0.12 0.00 0.70 0.00 0.00 175.22 175.50 1v58 s ALA 105 N 2.28 1.02 0.07 5.36 0.00 -1.01 -2.29 121.76 127.18 1v58 s ALA 105 Ca 0.22 -0.92 0.07 0.00 0.00 0.00 0.00 51.96 51.34 1v58 s ALA 105 Cb -0.16 -0.07 -0.04 0.00 0.00 0.00 0.00 23.12 22.86 1v58 s ALA 105 CO 0.09 0.12 -0.17 0.34 0.00 0.00 0.00 175.76 176.15 1v58 s ASP 106 N -1.63 3.94 0.56 0.00 -1.08 -1.26 -1.19 116.67 116.01 1v58 s ASP 106 Ca -0.04 -0.44 0.30 0.00 -0.52 0.00 0.00 52.55 51.85 1v58 s ASP 106 Cb -0.10 -0.64 1.64 0.00 -1.46 0.00 0.00 42.92 42.36 1v58 s ASP 106 CO 0.02 0.23 2.14 -0.65 0.52 0.00 0.00 175.17 177.42 1v58 h PRO 107 N 4.20 0.00 -2.50 4.34 0.11 -1.86 -3.26 132.00 133.03 1v58 h PRO 107 Ca -0.48 0.00 -0.65 0.00 0.11 0.00 0.00 66.00 64.97 1v58 h PRO 107 Cb 1.16 0.00 -0.39 0.00 0.11 0.00 0.00 31.00 31.88 1v58 h PRO 107 CO 0.48 0.07 -0.28 1.19 -0.21 0.00 0.00 178.00 179.25 1v58 n PHE 108 N -3.56 3.40 -3.44 0.65 3.01 -1.26 -4.94 117.46 111.32 1v58 n PHE 108 Ca -0.02 -3.87 -0.17 0.00 1.01 0.00 0.00 57.45 54.41 1v58 n PHE 108 Cb 0.19 -0.75 -0.11 0.00 -0.01 0.00 0.00 39.48 38.81 1v58 n PHE 108 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1v58 h PRO 110 N 8.28 0.45 0.00 0.00 0.11 -1.93 -2.15 132.00 136.76 1v58 h PRO 110 Ca -0.16 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.91 1v58 h PRO 110 Cb 1.13 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 1v58 h PRO 110 CO 0.30 0.30 -0.06 1.88 -0.21 0.00 0.00 178.00 180.21 1v58 h TYR 111 N 0.46 0.00 -0.46 0.65 0.05 -1.96 -2.07 116.97 113.65 1v58 h TYR 111 Ca 0.34 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 59.05 1v58 h TYR 111 Cb 0.43 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.16 1v58 h TYR 111 CO -0.15 0.06 0.02 0.00 -1.05 0.00 0.00 178.16 177.04 1v58 h LYS 113 N 0.64 0.87 -0.57 0.00 3.64 -1.42 -1.35 116.57 118.38 1v58 h LYS 113 Ca 0.13 -0.44 -0.09 0.00 -1.27 0.00 0.00 60.65 58.98 1v58 h LYS 113 Cb 0.47 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.27 1v58 h LYS 113 CO 0.02 1.08 -0.01 1.96 -2.27 0.00 0.00 179.45 180.23 1v58 h GLN 114 N 0.72 0.99 -0.37 1.90 4.20 -1.22 -1.18 115.11 120.15 1v58 h GLN 114 Ca 0.07 -0.31 -0.12 0.00 0.06 0.00 0.00 58.65 58.35 1v58 h GLN 114 Cb 0.93 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.61 1v58 h GLN 114 CO 0.09 0.98 -0.25 0.35 -0.67 0.00 0.00 178.83 179.33 1v58 h PHE 115 N 0.91 0.87 -0.55 2.96 3.57 -0.94 -1.01 116.94 122.76 1v58 h PHE 115 Ca 0.16 -0.21 0.06 0.00 3.53 0.00 0.00 57.97 61.52 1v58 h PHE 115 Cb 0.55 -0.20 -0.05 0.00 2.79 0.00 0.00 35.95 39.03 1v58 h PHE 115 CO 0.04 0.93 0.25 2.35 -2.23 0.00 0.00 178.31 179.65 1v58 h TRP 116 N 0.66 0.46 -0.61 0.41 7.01 -0.77 -1.82 115.95 121.29 1v58 h TRP 116 Ca 0.09 0.02 -0.05 0.00 2.11 0.00 0.00 58.89 61.06 1v58 h TRP 116 Cb 0.76 -0.13 -0.03 0.00 -2.10 0.00 0.00 29.16 27.67 1v58 h TRP 116 CO 0.04 0.20 0.20 0.37 -2.79 0.00 0.00 178.44 176.45 1v58 h GLN 117 N 0.48 0.95 -0.60 2.65 5.75 -0.82 -2.86 115.11 120.66 1v58 h GLN 117 Ca 0.25 -0.20 0.03 0.00 -0.15 0.00 0.00 58.65 58.58 1v58 h GLN 117 Cb 0.21 -0.14 -0.03 0.00 1.07 0.00 0.00 27.48 28.59 1v58 h GLN 117 CO -0.20 0.84 0.40 1.96 -2.65 0.00 0.00 178.83 179.17 1v58 h GLN 118 N 0.87 0.70 0.00 1.69 4.20 -0.50 -2.71 115.11 119.36 1v58 h GLN 118 Ca 0.20 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.87 1v58 h GLN 118 Cb 0.28 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 27.90 1v58 h GLN 118 CO -0.01 0.46 0.00 0.00 -0.67 0.00 0.00 178.83 178.62 1v58 h ALA 119 N 1.65 1.00 -0.84 3.87 0.00 -1.12 -3.38 119.26 120.44 1v58 h ALA 119 Ca 0.24 0.00 0.19 0.00 0.00 0.00 0.00 54.91 55.33 1v58 h ALA 119 Cb 0.06 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 17.69 1v58 h ALA 119 CO -0.06 0.00 -0.09 0.00 0.00 0.00 0.00 179.25 179.09 1v58 h ARG 120 N 0.00 0.04 -0.73 0.00 2.47 -1.46 -1.31 114.38 113.38 1v58 h ARG 120 Ca 0.00 -0.00 0.13 0.00 -1.26 0.00 0.00 59.98 58.85 1v58 h ARG 120 Cb 0.68 -0.01 -0.09 0.00 -1.65 0.00 0.00 29.97 28.90 1v58 h ARG 120 CO 0.00 0.02 0.29 -1.35 0.56 0.00 0.00 179.97 179.50 1v58 h PRO 121 N 0.04 0.44 0.18 0.04 0.11 -1.83 0.15 132.00 131.12 1v58 h PRO 121 Ca 0.44 -0.03 -0.30 0.00 0.11 0.00 0.00 66.00 66.22 1v58 h PRO 121 Cb 0.76 -0.10 0.02 0.00 0.11 0.00 0.00 31.00 31.79 1v58 h PRO 121 CO -0.81 0.29 -1.33 -1.49 -0.21 0.00 0.00 178.00 174.45 1v58 h TRP 122 N 0.45 0.74 -0.21 0.65 6.55 -1.66 -3.21 115.95 119.26 1v58 h TRP 122 Ca 0.40 -0.53 -0.11 0.00 0.95 0.00 0.00 58.89 59.60 1v58 h TRP 122 Cb 0.58 -0.03 -0.00 0.00 -0.86 0.00 0.00 29.16 28.84 1v58 h TRP 122 CO -0.16 1.41 -0.29 0.28 -1.05 0.00 0.00 178.44 178.62 1v58 h VAL 123 N 0.13 1.33 0.00 1.49 2.07 -0.96 -1.43 116.25 118.88 1v58 h VAL 123 Ca -0.19 -1.50 0.00 0.00 0.82 0.00 0.00 66.70 65.84 1v58 h VAL 123 Cb 2.04 1.79 0.00 0.00 -1.52 0.00 0.00 31.29 33.59 1v58 h VAL 123 CO 0.24 0.46 0.00 0.47 0.02 0.00 0.00 177.57 178.76 1v58 n ASP 124 N -4.33 0.00 -0.38 0.57 8.00 0.50 -2.34 116.55 118.56 1v58 n ASP 124 Ca -0.05 -0.65 0.05 0.00 0.71 0.00 0.00 54.79 54.84 1v58 n ASP 124 Cb 0.47 -0.04 0.04 0.00 -0.02 0.00 0.00 41.12 41.57 1v58 n ASP 124 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1v58 n SER 125 N -1.04 1.81 0.00 -2.24 3.41 -1.15 -4.99 113.62 109.42 1v58 n SER 125 Ca 0.17 -1.41 0.00 0.00 -0.26 0.00 0.00 58.87 57.37 1v58 n SER 125 Cb 0.10 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.04 1v58 n SER 125 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1v58 n GLY 126 N 0.53 0.53 0.11 5.00 0.00 -0.99 -4.92 105.19 105.46 1v58 n GLY 126 Ca 0.06 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.91 1v58 n GLY 126 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1v58 h LYS 127 N 1.13 0.27 -4.89 1.61 1.57 -1.52 -3.39 116.57 111.36 1v58 h LYS 127 Ca 0.00 -0.47 -0.38 0.00 -1.87 0.00 0.00 60.65 57.94 1v58 h LYS 127 Cb 0.01 0.17 -0.25 0.00 0.08 0.00 0.00 32.23 32.25 1v58 h LYS 127 CO 0.00 1.19 -0.77 0.08 -0.57 0.00 0.00 179.45 179.38 1v58 s VAL 128 N -2.64 0.80 -0.08 0.50 1.01 -0.98 -2.51 120.40 116.50 1v58 s VAL 128 Ca -0.06 -0.81 0.04 0.00 0.00 0.00 0.00 61.98 61.15 1v58 s VAL 128 Cb 0.07 -0.75 0.00 0.00 0.00 0.00 0.00 36.38 35.70 1v58 s VAL 128 CO 0.87 -0.05 -0.20 0.00 0.00 0.00 0.00 175.10 175.72 1v58 s GLN 129 N -0.96 2.47 -0.17 2.72 -2.07 -0.45 -4.08 119.66 117.13 1v58 s GLN 129 Ca -0.01 -0.73 -0.09 0.00 -1.82 0.00 0.00 55.36 52.70 1v58 s GLN 129 Cb -0.07 -1.96 -0.05 0.00 -1.09 0.00 0.00 33.01 29.85 1v58 s GLN 129 CO 0.01 0.18 0.15 -0.51 -1.32 0.00 0.00 175.29 173.80 1v58 s LEU 130 N 0.31 4.28 -0.34 2.60 1.43 0.15 -1.95 118.68 125.16 1v58 s LEU 130 Ca -0.14 0.35 -0.01 0.00 -1.03 0.00 0.00 54.13 53.30 1v58 s LEU 130 Cb -0.16 -2.12 0.08 0.00 0.03 0.00 0.00 46.19 44.02 1v58 s LEU 130 CO 0.06 0.25 0.06 -0.13 0.23 0.00 0.00 176.35 176.82 1v58 s ARG 131 N -0.12 2.13 -0.17 1.70 0.52 0.81 -1.04 118.95 122.78 1v58 s ARG 131 Ca 0.11 -1.54 -0.20 0.00 -0.52 0.00 0.00 55.73 53.58 1v58 s ARG 131 Cb -0.12 -3.28 -0.03 0.00 0.52 0.00 0.00 34.95 32.04 1v58 s ARG 131 CO 0.01 -0.80 0.60 0.99 0.02 0.00 0.00 175.30 176.12 1v58 s THR 132 N 1.15 5.06 -0.47 0.02 2.01 -0.21 -1.40 115.64 121.79 1v58 s THR 132 Ca 0.01 1.16 -0.10 0.00 0.31 0.00 0.00 61.69 63.07 1v58 s THR 132 Cb -0.21 -3.93 0.12 0.00 0.01 0.00 0.00 72.50 68.49 1v58 s THR 132 CO -0.03 0.16 0.36 -0.76 -0.69 0.00 0.00 174.62 173.66 1v58 s LEU 133 N 1.57 5.70 0.39 4.42 1.43 0.41 -0.77 118.68 131.83 1v58 s LEU 133 Ca 0.29 -1.85 -0.26 0.00 -1.03 0.00 0.00 54.13 51.28 1v58 s LEU 133 Cb -0.16 -2.03 -0.09 0.00 0.03 0.00 0.00 46.19 43.94 1v58 s LEU 133 CO 0.11 -0.70 1.20 -0.76 0.23 0.00 0.00 176.35 176.43 1v58 s LEU 134 N 1.40 4.23 0.08 1.79 1.43 -1.26 -2.41 118.68 123.94 1v58 s LEU 134 Ca 0.05 2.43 0.01 0.00 -1.03 0.00 0.00 54.13 55.59 1v58 s LEU 134 Cb -0.26 -3.96 -0.04 0.00 0.03 0.00 0.00 46.19 41.96 1v58 s LEU 134 CO 0.00 -0.68 -0.06 0.68 0.23 0.00 0.00 176.35 176.52 1v58 s VAL 135 N -1.35 0.56 -0.52 -1.59 -7.23 -0.33 -4.63 120.40 105.31 1v58 s VAL 135 Ca 0.56 -1.83 0.04 0.00 -1.81 0.00 0.00 61.98 58.93 1v58 s VAL 135 Cb -0.33 -1.55 0.15 0.00 0.56 0.00 0.00 36.38 35.21 1v58 s VAL 135 CO 0.42 -0.87 0.35 -0.83 -0.31 0.00 0.00 175.10 173.86 1v58 s GLY 136 N -2.89 2.00 0.00 2.32 0.00 -1.26 -4.30 107.32 103.18 1v58 s GLY 136 Ca 0.09 -2.99 0.00 0.00 0.00 0.00 0.00 44.72 41.81 1v58 s GLY 136 CO -0.06 1.52 0.01 3.33 0.00 0.00 0.00 173.10 177.90 1v58 n VAL 137 N 2.84 0.00 -0.08 1.40 0.24 -1.26 -4.28 118.33 117.18 1v58 n VAL 137 Ca 0.17 -0.13 -0.19 0.00 -2.04 0.00 0.00 64.34 62.16 1v58 n VAL 137 Cb 0.38 1.03 -0.12 0.00 -1.47 0.00 0.00 33.84 33.66 1v58 n VAL 137 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 1v58 h ILE 138 N 0.03 1.27 -2.10 1.34 1.08 -1.91 -3.49 117.51 113.73 1v58 h ILE 138 Ca 0.00 -2.26 -0.59 0.00 -0.39 0.00 0.00 64.86 61.62 1v58 h ILE 138 Cb 0.01 2.72 -0.14 0.00 -3.07 0.00 0.00 36.82 36.35 1v58 h ILE 138 CO 0.00 0.45 -0.69 -0.54 -0.69 0.00 0.00 178.15 176.69 1v58 s LYS 139 N -2.31 1.75 0.34 2.37 -0.14 -1.26 -5.01 119.74 115.47 1v58 s LYS 139 Ca -0.24 -1.89 0.07 0.00 -1.36 0.00 0.00 55.97 52.54 1v58 s LYS 139 Cb 0.02 -1.60 0.75 0.00 -1.68 0.00 0.00 37.83 35.32 1v58 s LYS 139 CO 0.64 0.14 1.86 -1.35 -0.76 0.00 0.00 175.35 175.88 1v58 h PRO 140 N 2.09 0.75 -0.01 -1.68 0.11 -1.98 -0.95 132.00 130.33 1v58 h PRO 140 Ca -0.41 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1v58 h PRO 140 Cb 1.25 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1v58 h PRO 140 CO 0.69 0.49 -0.20 -1.91 -0.21 0.00 0.00 178.00 176.87 1v58 n GLU 141 N -4.58 0.91 -0.17 1.05 4.07 -1.26 -4.39 120.64 116.26 1v58 n GLU 141 Ca 0.18 -0.49 -0.01 0.00 -0.06 0.00 0.00 57.16 56.77 1v58 n GLU 141 Cb 0.44 -1.49 0.07 0.00 -0.06 0.00 0.00 31.44 30.41 1v58 n GLU 141 CO 0.00 0.00 0.00 0.77 -0.06 0.00 0.00 177.13 177.84 1v58 h SER 142 N 1.20 -0.08 0.01 4.31 0.02 -1.52 -1.03 113.55 116.46 1v58 h SER 142 Ca 0.00 0.11 -0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1v58 h SER 142 Cb 0.47 0.17 0.00 0.00 0.14 0.00 0.00 62.40 63.18 1v58 h SER 142 CO 0.00 -0.02 -0.01 -0.65 -1.14 0.00 0.00 176.83 175.02 1v58 h PRO 143 N 0.19 -0.01 -0.74 3.45 0.11 -1.76 -0.29 132.00 132.95 1v58 h PRO 143 Ca 0.27 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.33 1v58 h PRO 143 Cb 0.39 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.47 1v58 h PRO 143 CO -0.38 -0.00 0.28 0.00 -0.21 0.00 0.00 178.00 177.69 1v58 h ALA 144 N 0.97 1.11 -0.26 -0.75 0.00 -1.79 -0.24 119.26 118.30 1v58 h ALA 144 Ca -0.00 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.62 1v58 h ALA 144 Cb 0.02 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.51 1v58 h ALA 144 CO 0.00 0.63 -0.22 1.15 0.00 0.00 0.00 179.25 180.82 1v58 h THR 145 N 1.07 1.31 -0.66 0.00 2.02 -1.07 -0.18 112.91 115.39 1v58 h THR 145 Ca 0.25 -1.37 -0.01 0.00 0.77 0.00 0.00 66.41 66.05 1v58 h THR 145 Cb 0.22 1.62 -0.03 0.00 -1.74 0.00 0.00 68.15 68.22 1v58 h THR 145 CO -0.02 0.43 0.38 0.00 0.37 0.00 0.00 175.52 176.68 1v58 h ALA 146 N 0.70 0.85 -0.61 6.16 0.00 -0.87 -1.99 119.26 123.49 1v58 h ALA 146 Ca 0.05 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1v58 h ALA 146 Cb 0.77 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 1v58 h ALA 146 CO 0.06 0.34 0.20 0.00 0.00 0.00 0.00 179.25 179.85 1v58 h ALA 147 N 1.19 1.20 -0.60 0.00 0.00 -0.91 -1.76 119.26 118.38 1v58 h ALA 147 Ca 0.24 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1v58 h ALA 147 Cb 0.01 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 1v58 h ALA 147 CO -0.04 0.56 0.20 0.00 0.00 0.00 0.00 179.25 179.97 1v58 h ALA 148 N 1.32 1.22 -0.32 0.00 0.00 -0.52 0.12 119.26 121.09 1v58 h ALA 148 Ca 0.20 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 1v58 h ALA 148 Cb 0.24 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1v58 h ALA 148 CO -0.01 0.55 -0.05 0.82 0.00 0.00 0.00 179.25 180.57 1v58 h ILE 149 N 0.88 1.27 0.00 0.00 2.04 -0.87 -2.36 117.51 118.47 1v58 h ILE 149 Ca 0.20 -1.06 -0.04 0.00 1.00 0.00 0.00 64.86 64.97 1v58 h ILE 149 Cb 0.23 1.32 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 1v58 h ILE 149 CO -0.01 0.34 -0.17 -0.07 0.00 0.00 0.00 178.15 178.24 1v58 h LEU 150 N 0.38 0.00 -0.00 1.44 3.38 -0.77 -2.65 115.31 117.08 1v58 h LEU 150 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1v58 h LEU 150 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1v58 h LEU 150 CO 0.03 0.17 -0.24 0.00 0.09 0.00 0.00 178.44 178.49 1v58 n ALA 151 N -2.33 2.91 -1.05 1.53 0.00 0.35 -4.78 120.51 117.14 1v58 n ALA 151 Ca -0.02 -0.22 -0.30 0.00 0.00 0.00 0.00 53.44 52.90 1v58 n ALA 151 Cb 0.28 -1.30 0.13 0.00 0.00 0.00 0.00 19.45 18.56 1v58 n ALA 151 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1v58 s SER 152 N -2.99 3.57 0.24 0.00 0.01 -0.93 -4.94 113.70 108.66 1v58 s SER 152 Ca 0.13 1.80 -0.06 0.00 1.31 0.00 0.00 55.95 59.13 1v58 s SER 152 Cb 0.18 -2.42 0.31 0.00 0.21 0.00 0.00 66.02 64.30 1v58 s SER 152 CO 0.61 -2.63 1.87 0.11 0.41 0.00 0.00 173.24 173.61 1v58 h LYS 153 N -1.54 1.01 -2.81 12.44 1.57 -1.91 -3.31 116.57 122.02 1v58 h LYS 153 Ca -0.46 -0.06 -0.61 0.00 -1.87 0.00 0.00 60.65 57.65 1v58 h LYS 153 Cb 1.26 -0.23 -0.40 0.00 0.08 0.00 0.00 32.23 32.94 1v58 h LYS 153 CO 0.50 0.67 -0.77 0.34 -0.57 0.00 0.00 179.45 179.62 1v58 s ASP 154 N -5.84 3.27 0.22 0.86 -1.08 -1.26 -5.01 116.67 107.84 1v58 s ASP 154 Ca -0.13 -3.09 -0.08 0.00 -0.52 0.00 0.00 52.55 48.74 1v58 s ASP 154 Cb 0.18 -1.00 0.36 0.00 -1.46 0.00 0.00 42.92 41.00 1v58 s ASP 154 CO 0.79 -0.19 1.69 -0.65 0.52 0.00 0.00 175.17 177.33 1v58 h PRO 155 N 6.04 0.23 -0.65 4.34 0.11 -1.75 -0.24 132.00 140.07 1v58 h PRO 155 Ca 0.12 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.23 1v58 h PRO 155 Cb 0.88 -0.05 -0.04 0.00 0.11 0.00 0.00 31.00 31.90 1v58 h PRO 155 CO 0.51 0.15 0.42 0.00 -0.21 0.00 0.00 178.00 178.87 1v58 h ALA 156 N 1.55 0.83 -0.39 -0.75 0.00 -1.89 -0.04 119.26 118.57 1v58 h ALA 156 Ca 0.36 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 55.11 1v58 h ALA 156 Cb 0.57 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1v58 h ALA 156 CO -0.47 0.22 -0.21 -0.22 0.00 0.00 0.00 179.25 178.57 1v58 h LYS 157 N 0.85 0.83 -0.66 0.00 3.64 -1.72 -2.16 116.57 117.36 1v58 h LYS 157 Ca 0.25 -0.37 -0.02 0.00 -1.27 0.00 0.00 60.65 59.23 1v58 h LYS 157 Cb -0.06 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.71 1v58 h LYS 157 CO -0.07 1.01 0.32 1.15 -2.27 0.00 0.00 179.45 179.59 1v58 h THR 158 N 0.64 1.21 -0.52 1.00 2.02 -0.68 -1.31 112.91 115.27 1v58 h THR 158 Ca 0.08 -0.59 -0.09 0.00 0.77 0.00 0.00 66.41 66.58 1v58 h THR 158 Cb 0.77 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 67.53 1v58 h THR 158 CO 0.06 0.25 -0.02 -0.25 0.37 0.00 0.00 175.52 175.93 1v58 h TRP 159 N 0.93 1.03 -0.74 3.16 2.91 -0.83 0.35 115.95 122.76 1v58 h TRP 159 Ca 0.23 -0.19 -0.02 0.00 1.13 0.00 0.00 58.89 60.05 1v58 h TRP 159 Cb 0.09 -0.27 -0.03 0.00 -0.51 0.00 0.00 29.16 28.44 1v58 h TRP 159 CO 0.01 0.95 0.40 1.96 -1.03 0.00 0.00 178.44 180.74 1v58 h GLN 160 N 0.81 1.04 -0.39 2.65 4.20 -0.80 -0.23 115.11 122.38 1v58 h GLN 160 Ca 0.15 -0.12 -0.12 0.00 0.06 0.00 0.00 58.65 58.61 1v58 h GLN 160 Cb 0.56 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 1v58 h GLN 160 CO 0.03 0.77 -0.24 1.96 -0.67 0.00 0.00 178.83 180.68 1v58 h GLN 161 N 1.02 0.80 -0.02 1.46 4.20 -1.05 -0.16 115.11 121.37 1v58 h GLN 161 Ca 0.26 -0.34 -0.00 0.00 0.06 0.00 0.00 58.65 58.63 1v58 h GLN 161 Cb 0.04 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 27.79 1v58 h GLN 161 CO -0.04 0.96 0.01 -0.92 -0.67 0.00 0.00 178.83 178.17 1v58 h TYR 162 N 0.70 0.03 -0.35 2.96 3.20 -0.35 -0.58 116.97 122.57 1v58 h TYR 162 Ca 0.09 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.88 1v58 h TYR 162 Cb 0.77 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 39.02 1v58 h TYR 162 CO 0.04 0.11 -0.08 0.93 -1.64 0.00 0.00 178.16 177.53 1v58 h GLU 163 N -0.07 0.67 -0.24 1.82 4.39 -0.99 0.12 114.58 120.27 1v58 h GLU 163 Ca 0.01 -0.25 -0.04 0.00 0.34 0.00 0.00 59.36 59.41 1v58 h GLU 163 Cb 0.09 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.69 1v58 h GLU 163 CO -0.00 0.83 -0.03 0.00 -1.16 0.00 0.00 179.01 178.65 1v58 h ALA 164 N 0.82 1.51 -0.08 3.43 0.00 -0.95 -2.20 119.26 121.79 1v58 h ALA 164 Ca 0.09 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1v58 h ALA 164 Cb 0.58 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1v58 h ALA 164 CO 0.03 0.35 0.00 0.43 0.00 0.00 0.00 179.25 180.07 1v58 n SER 165 N -4.31 1.04 -1.41 0.00 7.64 -0.23 -4.89 113.62 111.45 1v58 n SER 165 Ca 0.00 -1.54 -0.15 0.00 1.01 0.00 0.00 58.87 58.20 1v58 n SER 165 Cb 0.22 -0.05 -0.04 0.00 -1.01 0.00 0.00 64.21 63.34 1v58 n SER 165 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v58 n GLY 166 N 1.03 0.67 1.62 0.23 0.00 -0.83 -2.02 105.19 105.89 1v58 n GLY 166 Ca 0.17 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1v58 n GLY 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1v58 n GLY 167 N -1.09 0.65 0.08 -0.02 0.00 0.01 -4.92 105.19 99.91 1v58 n GLY 167 Ca -0.16 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.99 1v58 n GLY 167 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1v58 n LYS 168 N -2.67 0.20 -1.69 1.61 5.02 -0.85 -4.84 118.16 114.93 1v58 n LYS 168 Ca 0.00 0.16 -0.44 0.00 -2.02 0.00 0.00 58.31 56.01 1v58 n LYS 168 Cb 0.00 -1.73 -0.04 0.00 -0.02 0.00 0.00 35.03 33.24 1v58 n LYS 168 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1v58 n LEU 169 N -2.08 3.69 -4.80 -0.35 7.94 -1.26 -4.96 117.00 115.19 1v58 n LEU 169 Ca 0.06 1.02 -0.36 0.00 -1.11 0.00 0.00 56.01 55.62 1v58 n LEU 169 Cb 0.41 -1.49 -0.06 0.00 0.53 0.00 0.00 43.42 42.80 1v58 n LEU 169 CO 0.30 0.01 0.61 -0.54 -1.11 0.00 0.00 177.39 176.66 1v58 s LYS 170 N 2.19 4.44 0.21 1.96 1.02 -1.26 -5.03 119.74 123.29 1v58 s LYS 170 Ca 0.82 1.19 0.04 0.00 0.02 0.00 0.00 55.97 58.04 1v58 s LYS 170 Cb -0.57 -2.67 -0.05 0.00 -0.52 0.00 0.00 37.83 34.02 1v58 s LYS 170 CO 0.39 0.23 -0.03 -0.51 -0.92 0.00 0.00 175.35 174.50 1v58 s LEU 171 N -2.31 2.29 -0.74 3.17 1.43 -1.26 -5.09 118.68 116.18 1v58 s LEU 171 Ca 0.52 -1.17 -0.07 0.00 -1.03 0.00 0.00 54.13 52.38 1v58 s LEU 171 Cb -0.16 -0.32 0.19 0.00 0.03 0.00 0.00 46.19 45.93 1v58 s LEU 171 CO 0.21 -0.45 0.61 0.21 0.23 0.00 0.00 176.35 177.16 1v58 s ASN 172 N -3.29 5.94 -0.12 2.29 3.84 -1.26 -5.05 114.94 117.31 1v58 s ASN 172 Ca 0.26 -2.88 -0.30 0.00 0.21 0.00 0.00 52.86 50.15 1v58 s ASN 172 Cb 0.05 -2.01 -0.02 0.00 -0.55 0.00 0.00 41.25 38.72 1v58 s ASN 172 CO 0.07 -0.43 1.22 -0.69 -2.79 0.00 0.00 177.10 174.48 1v58 s VAL 173 N -0.12 4.30 0.96 -5.21 1.01 -1.26 -4.94 120.40 115.15 1v58 s VAL 173 Ca 0.19 1.60 -0.11 0.00 0.00 0.00 0.00 61.98 63.66 1v58 s VAL 173 Cb -0.15 -4.03 0.17 0.00 0.00 0.00 0.00 36.38 32.37 1v58 s VAL 173 CO -0.06 -0.07 1.12 -2.84 0.00 0.00 0.00 175.10 173.25 1v58 s PRO 174 N 2.84 0.66 0.59 2.72 0.02 -1.26 -4.89 135.00 135.67 1v58 s PRO 174 Ca 0.55 1.42 0.29 0.00 0.02 0.00 0.00 61.00 63.28 1v58 s PRO 174 Cb -0.23 -1.70 1.79 0.00 0.02 0.00 0.00 34.50 34.39 1v58 s PRO 174 CO 0.18 -2.84 2.24 0.00 -0.33 0.00 0.00 177.00 176.25 1v58 h ALA 175 N -2.01 1.57 -2.99 -1.55 0.00 -2.02 -3.44 119.26 108.82 1v58 h ALA 175 Ca -0.46 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.49 1v58 h ALA 175 Cb 1.28 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 19.00 1v58 h ALA 175 CO 0.43 -0.03 0.23 0.54 0.00 0.00 0.00 179.25 180.42 1v58 s ASN 176 N -6.16 -0.35 -0.16 0.00 4.22 -1.26 -5.13 114.94 106.09 1v58 s ASN 176 Ca -0.05 -0.42 -0.24 0.00 -2.14 0.00 0.00 52.86 50.01 1v58 s ASN 176 Cb 0.15 0.69 -0.02 0.00 1.28 0.00 0.00 41.25 43.35 1v58 s ASN 176 CO 0.55 -1.22 0.76 -0.69 -2.04 0.00 0.00 177.10 174.46 1v58 s VAL 177 N -3.85 4.94 0.75 3.54 1.01 -1.26 -5.03 120.40 120.48 1v58 s VAL 177 Ca 0.08 1.50 -0.11 0.00 0.00 0.00 0.00 61.98 63.44 1v58 s VAL 177 Cb -0.04 -4.08 0.04 0.00 0.00 0.00 0.00 36.38 32.30 1v58 s VAL 177 CO 0.01 0.08 1.09 -0.94 0.00 0.00 0.00 175.10 175.34 1v58 s SER 178 N 1.12 4.69 0.26 3.32 1.04 -1.26 -4.79 113.70 118.07 1v58 s SER 178 Ca 0.36 1.83 -0.03 0.00 0.48 0.00 0.00 55.95 58.58 1v58 s SER 178 Cb -0.17 -2.52 0.37 0.00 0.10 0.00 0.00 66.02 63.80 1v58 s SER 178 CO 0.13 -1.91 1.88 0.74 0.98 0.00 0.00 173.24 175.06 1v58 h THR 179 N -0.91 1.11 -0.40 2.02 2.02 -1.99 0.86 112.91 115.61 1v58 h THR 179 Ca -0.44 -0.40 -0.03 0.00 0.77 0.00 0.00 66.41 66.30 1v58 h THR 179 Cb 1.23 -0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 67.46 1v58 h THR 179 CO 0.52 0.21 0.11 -0.33 0.37 0.00 0.00 175.52 176.41 1v58 h GLU 180 N 1.17 0.63 -0.56 6.66 3.07 -2.00 -2.19 114.58 121.36 1v58 h GLU 180 Ca 0.41 -0.14 -0.10 0.00 -0.50 0.00 0.00 59.36 59.03 1v58 h GLU 180 Cb 0.12 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 27.92 1v58 h GLU 180 CO -0.16 0.64 -0.05 1.96 -1.40 0.00 0.00 179.01 180.00 1v58 h GLN 181 N 0.50 1.01 -0.83 2.33 4.20 -1.74 -2.31 115.11 118.28 1v58 h GLN 181 Ca 0.13 -0.34 -0.02 0.00 0.06 0.00 0.00 58.65 58.47 1v58 h GLN 181 Cb 0.28 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 27.94 1v58 h GLN 181 CO -0.00 1.02 0.42 1.98 -0.67 0.00 0.00 178.83 181.59 1v58 h MET 182 N 0.91 1.17 -0.43 1.46 4.05 -0.73 -1.32 114.93 120.05 1v58 h MET 182 Ca 0.15 -0.15 -0.04 0.00 -0.28 0.00 0.00 59.70 59.38 1v58 h MET 182 Cb 0.60 -0.22 -0.02 0.00 -0.80 0.00 0.00 31.60 31.17 1v58 h MET 182 CO 0.04 0.88 0.10 -0.22 0.23 0.00 0.00 176.91 177.93 1v58 h LYS 183 N 1.17 0.70 0.14 0.39 3.64 -1.17 0.15 116.57 121.59 1v58 h LYS 183 Ca 0.29 -0.17 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 1v58 h LYS 183 Cb 0.07 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.81 1v58 h LYS 183 CO -0.04 0.71 -0.07 0.28 -2.27 0.00 0.00 179.45 178.06 1v58 h VAL 184 N 0.56 0.89 -0.77 2.00 2.07 -1.03 0.12 116.25 120.08 1v58 h VAL 184 Ca 0.13 -0.10 -0.02 0.00 0.82 0.00 0.00 66.70 67.53 1v58 h VAL 184 Cb 0.33 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 31.02 1v58 h VAL 184 CO 0.00 0.02 0.39 -0.07 0.02 0.00 0.00 177.57 177.94 1v58 h LEU 185 N -0.24 1.00 -0.15 2.57 3.38 -1.19 -1.15 115.31 119.53 1v58 h LEU 185 Ca -0.02 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 1v58 h LEU 185 Cb 0.18 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1v58 h LEU 185 CO 0.03 0.83 0.07 -1.28 0.09 0.00 0.00 178.44 178.18 1v58 h SER 186 N 1.08 0.20 -0.37 -0.43 0.87 -0.47 -1.29 113.55 113.14 1v58 h SER 186 Ca 0.27 -0.14 -0.02 0.00 -1.23 0.00 0.00 61.79 60.67 1v58 h SER 186 Cb 0.08 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 61.98 1v58 h SER 186 CO -0.04 0.29 0.15 0.44 -0.53 0.00 0.00 176.83 177.14 1v58 h ASP 187 N 0.10 0.50 -0.72 6.23 3.32 -0.61 -1.53 116.42 123.72 1v58 h ASP 187 Ca 0.05 -0.16 -0.02 0.00 0.02 0.00 0.00 57.03 56.93 1v58 h ASP 187 Cb 0.14 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.53 1v58 h ASP 187 CO -0.01 0.52 0.39 0.78 -1.72 0.00 0.00 179.24 179.21 1v58 h ASN 188 N 0.45 0.92 -0.33 6.45 2.35 -1.14 -1.74 115.58 122.55 1v58 h ASN 188 Ca 0.12 -0.08 -0.12 0.00 -0.55 0.00 0.00 56.30 55.68 1v58 h ASN 188 Cb 0.17 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.30 1v58 h ASN 188 CO -0.01 0.75 -0.21 -0.33 -1.65 0.00 0.00 177.43 175.97 1v58 h GLU 189 N 1.03 0.81 -0.55 0.81 5.08 -1.01 -0.75 114.58 120.01 1v58 h GLU 189 Ca 0.26 -0.33 -0.06 0.00 -1.00 0.00 0.00 59.36 58.24 1v58 h GLU 189 Cb 0.04 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1v58 h GLU 189 CO -0.04 0.95 0.12 -0.22 -1.00 0.00 0.00 179.01 178.82 1v58 h LYS 190 N 0.71 0.88 -0.52 2.33 3.64 -0.73 0.50 116.57 123.37 1v58 h LYS 190 Ca 0.10 -0.22 -0.05 0.00 -1.27 0.00 0.00 60.65 59.21 1v58 h LYS 190 Cb 0.73 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.42 1v58 h LYS 190 CO 0.06 0.83 0.11 -0.07 -2.27 0.00 0.00 179.45 178.11 1v58 h LEU 191 N 0.78 0.80 -0.84 5.20 3.38 -1.19 -0.37 115.31 123.07 1v58 h LEU 191 Ca 0.17 -0.24 0.02 0.00 0.09 0.00 0.00 57.88 57.92 1v58 h LEU 191 Cb 0.36 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.85 1v58 h LEU 191 CO 0.00 0.84 0.54 -0.03 0.09 0.00 0.00 178.44 179.88 1v58 h MET 192 N 0.73 1.04 -0.35 1.13 4.05 -0.78 -2.03 114.93 118.73 1v58 h MET 192 Ca 0.16 -0.06 -0.13 0.00 -0.28 0.00 0.00 59.70 59.39 1v58 h MET 192 Cb 0.36 -0.24 -0.01 0.00 -0.80 0.00 0.00 31.60 30.91 1v58 h MET 192 CO 0.00 0.69 -0.30 -0.44 0.23 0.00 0.00 176.91 177.10 1v58 h ASP 193 N 1.07 0.77 -0.63 1.39 3.32 -0.58 -2.77 116.42 118.99 1v58 h ASP 193 Ca 0.32 -0.30 0.01 0.00 0.02 0.00 0.00 57.03 57.08 1v58 h ASP 193 Cb -0.04 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.27 1v58 h ASP 193 CO -0.10 1.01 0.42 0.44 -1.72 0.00 0.00 179.24 179.30 1v58 h ASP 194 N 0.63 0.73 0.11 6.45 3.32 -0.45 -2.01 116.42 125.20 1v58 h ASP 194 Ca 0.07 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1v58 h ASP 194 Cb 0.82 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.18 1v58 h ASP 194 CO 0.07 0.53 0.00 0.18 -1.72 0.00 0.00 179.24 178.30 1v58 n LEU 195 N -4.44 0.00 0.00 1.55 4.77 -0.82 -4.94 117.00 113.12 1v58 n LEU 195 Ca 0.06 0.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 1v58 n LEU 195 Cb 0.04 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 1v58 n LEU 195 CO 0.36 -0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 1v58 n GLY 196 N 0.96 2.19 3.22 -0.72 0.00 -0.76 -5.01 105.19 105.07 1v58 n GLY 196 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 1v58 n GLY 196 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v58 s ALA 197 N -2.82 3.18 -2.19 4.61 0.00 -1.25 -4.91 121.76 118.38 1v58 s ALA 197 Ca 0.00 -2.17 0.30 0.00 0.00 0.00 0.00 51.96 50.09 1v58 s ALA 197 Cb 0.00 -2.48 1.51 0.00 0.00 0.00 0.00 23.12 22.15 1v58 s ALA 197 CO 0.00 -1.62 2.01 -1.71 0.00 0.00 0.00 175.76 174.44 1v58 n ASN 198 N 4.80 0.65 -4.85 0.00 4.05 -1.26 -4.72 115.26 113.93 1v58 n ASN 198 Ca -0.09 -1.19 -0.35 0.00 0.45 0.00 0.00 54.58 53.41 1v58 n ASN 198 Cb 0.43 -0.00 -0.06 0.00 1.23 0.00 0.00 39.78 41.37 1v58 n ASN 198 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1v58 s VAL 199 N -2.03 5.21 0.10 3.44 1.01 -1.26 -5.02 120.40 121.85 1v58 s VAL 199 Ca 0.43 -0.07 0.06 0.00 0.00 0.00 0.00 61.98 62.39 1v58 s VAL 199 Cb 0.21 -3.33 -0.04 0.00 0.00 0.00 0.00 36.38 33.22 1v58 s VAL 199 CO 0.36 0.48 -0.03 0.42 0.00 0.00 0.00 175.10 176.33 1v58 s THR 200 N -1.14 3.81 0.32 3.92 -4.23 -1.26 -3.68 115.64 113.38 1v58 s THR 200 Ca 0.20 -1.09 -0.26 0.00 -1.18 0.00 0.00 61.69 59.36 1v58 s THR 200 Cb -0.12 -2.81 -0.10 0.00 1.34 0.00 0.00 72.50 70.81 1v58 s THR 200 CO 0.10 0.11 0.95 -2.16 -0.54 0.00 0.00 174.62 173.09 1v58 s PRO 201 N -2.30 4.58 -0.31 3.99 0.04 -1.26 -4.63 135.00 135.11 1v58 s PRO 201 Ca 0.24 1.36 -0.04 0.00 0.04 0.00 0.00 61.00 62.61 1v58 s PRO 201 Cb -0.11 -2.83 0.04 0.00 0.04 0.00 0.00 34.50 31.64 1v58 s PRO 201 CO 0.17 0.27 0.03 0.00 0.04 0.00 0.00 177.00 177.51 1v58 s ALA 202 N -1.58 2.89 -0.17 8.56 0.00 -0.97 -1.74 121.76 128.75 1v58 s ALA 202 Ca 0.50 -1.70 -0.07 0.00 0.00 0.00 0.00 51.96 50.69 1v58 s ALA 202 Cb -0.20 -2.03 -0.04 0.00 0.00 0.00 0.00 23.12 20.85 1v58 s ALA 202 CO 0.25 -1.22 0.05 0.42 0.00 0.00 0.00 175.76 175.26 1v58 s ILE 203 N 1.33 4.72 -0.05 0.00 1.01 0.11 -1.07 121.20 127.25 1v58 s ILE 203 Ca -0.03 -0.06 0.05 0.00 0.00 0.00 0.00 60.65 60.60 1v58 s ILE 203 Cb -0.19 -3.11 -0.00 0.00 0.01 0.00 0.00 42.46 39.16 1v58 s ILE 203 CO 0.00 0.48 -0.19 -0.31 0.00 0.00 0.00 174.94 174.92 1v58 s TYR 204 N 0.22 1.91 0.13 3.97 1.51 0.24 -0.97 117.35 124.36 1v58 s TYR 204 Ca 0.04 -0.56 -0.06 0.00 -1.01 0.00 0.00 57.07 55.48 1v58 s TYR 204 Cb -0.12 -1.27 -0.02 0.00 -0.11 0.00 0.00 41.96 40.43 1v58 s TYR 204 CO 0.01 -0.19 0.18 1.52 -1.11 0.00 0.00 175.55 175.96 1v58 s TYR 205 N 0.00 0.52 -0.13 2.71 -0.85 -0.88 -1.38 117.35 117.34 1v58 s TYR 205 Ca -0.04 -0.91 -0.04 0.00 -0.52 0.00 0.00 57.07 55.57 1v58 s TYR 205 Cb -0.12 -0.21 -0.03 0.00 0.38 0.00 0.00 41.96 41.97 1v58 s TYR 205 CO 0.03 -0.61 -0.00 1.41 -1.52 0.00 0.00 175.55 174.85 1v58 s MET 206 N -3.97 3.46 0.79 -3.49 -2.45 -1.26 -0.27 119.30 112.10 1v58 s MET 206 Ca 0.17 -0.44 -0.11 0.00 -1.25 0.00 0.00 55.69 54.05 1v58 s MET 206 Cb 0.05 -2.92 0.07 0.00 1.25 0.00 0.00 34.83 33.28 1v58 s MET 206 CO -0.02 0.43 1.15 -1.54 1.05 0.00 0.00 175.02 176.09 1v58 s SER 207 N -0.13 4.66 0.60 1.11 1.04 -0.62 -4.93 113.70 115.44 1v58 s SER 207 Ca 0.04 0.79 0.38 0.00 0.48 0.00 0.00 55.95 57.65 1v58 s SER 207 Cb -0.13 -1.34 1.85 0.00 0.10 0.00 0.00 66.02 66.50 1v58 s SER 207 CO 0.02 -1.80 2.16 0.11 0.98 0.00 0.00 173.24 174.71 1v58 h LYS 208 N -0.96 0.00 -0.68 4.02 1.57 -2.00 -1.68 116.57 116.84 1v58 h LYS 208 Ca -0.46 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 1v58 h LYS 208 Cb 1.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.63 1v58 h LYS 208 CO 0.65 0.01 0.00 0.39 -0.57 0.00 0.00 179.45 179.93 1v58 n GLU 209 N -3.14 2.72 -2.25 3.15 4.71 -1.26 -4.89 120.64 119.68 1v58 n GLU 209 Ca -0.01 -1.56 -0.20 0.00 -0.01 0.00 0.00 57.16 55.38 1v58 n GLU 209 Cb 0.20 -1.74 -0.02 0.00 -1.01 0.00 0.00 31.44 28.87 1v58 n GLU 209 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1v58 n ASN 210 N 0.40 -5.58 -4.55 1.62 5.03 -0.63 -4.88 115.26 106.66 1v58 n ASN 210 Ca 0.14 0.06 -0.34 0.00 0.87 0.00 0.00 54.58 55.31 1v58 n ASN 210 Cb 0.63 -4.65 -0.12 0.00 -1.02 0.00 0.00 39.78 34.63 1v58 n ASN 210 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 1v58 s THR 211 N -2.94 3.79 0.10 3.41 -4.23 -1.26 -4.50 115.64 110.00 1v58 s THR 211 Ca 0.00 -0.43 -0.31 0.00 -1.18 0.00 0.00 61.69 59.77 1v58 s THR 211 Cb 0.00 -2.59 -0.07 0.00 1.34 0.00 0.00 72.50 71.18 1v58 s THR 211 CO 0.00 0.56 1.31 -0.22 -0.54 0.00 0.00 174.62 175.73 1v58 s LEU 212 N -0.38 4.37 0.28 4.79 2.96 -1.26 -1.59 118.68 127.85 1v58 s LEU 212 Ca 0.06 2.20 0.11 0.00 -0.22 0.00 0.00 54.13 56.28 1v58 s LEU 212 Cb -0.12 -3.58 -0.05 0.00 0.50 0.00 0.00 46.19 42.93 1v58 s LEU 212 CO 0.02 -0.57 -0.14 -1.10 -1.32 0.00 0.00 176.35 173.24 1v58 s GLN 213 N 1.03 1.87 0.06 1.98 -1.52 0.63 -4.96 119.66 118.74 1v58 s GLN 213 Ca 0.62 -1.67 0.02 0.00 -1.95 0.00 0.00 55.36 52.38 1v58 s GLN 213 Cb -0.34 -1.89 -0.03 0.00 -0.22 0.00 0.00 33.01 30.54 1v58 s GLN 213 CO 0.30 0.34 -0.07 -1.14 -0.25 0.00 0.00 175.29 174.47 1v58 s GLN 214 N -3.56 0.59 -0.10 2.91 0.74 -1.26 -2.06 119.66 116.92 1v58 s GLN 214 Ca 0.30 -0.93 -0.07 0.00 0.05 0.00 0.00 55.36 54.71 1v58 s GLN 214 Cb -0.05 -0.19 0.03 0.00 1.10 0.00 0.00 33.01 33.90 1v58 s GLN 214 CO 0.17 0.01 0.24 0.00 -0.55 0.00 0.00 175.29 175.16 1v58 s ALA 215 N -2.16 -0.59 -0.03 1.58 0.00 -0.14 -5.00 121.76 115.42 1v58 s ALA 215 Ca -0.04 0.78 0.03 0.00 0.00 0.00 0.00 51.96 52.73 1v58 s ALA 215 Cb -0.05 -0.47 0.01 0.00 0.00 0.00 0.00 23.12 22.61 1v58 s ALA 215 CO -0.02 -0.14 -0.10 0.08 0.00 0.00 0.00 175.76 175.58 1v58 s VAL 216 N 0.48 0.90 0.00 0.00 1.01 -1.26 0.10 120.40 121.63 1v58 s VAL 216 Ca -0.03 -0.40 0.00 0.00 0.00 0.00 0.00 61.98 61.55 1v58 s VAL 216 Cb -0.04 -0.80 0.00 0.00 0.00 0.00 0.00 36.38 35.53 1v58 s VAL 216 CO -0.02 0.28 0.00 0.61 0.00 0.00 0.00 175.10 175.97 1v58 n GLY 217 N 3.40 -0.62 3.55 4.51 0.00 -0.71 -4.77 105.19 110.55 1v58 n GLY 217 Ca -0.19 -1.48 -0.42 0.00 0.00 0.00 0.00 46.02 43.92 1v58 n GLY 217 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1v58 s LEU 218 N 0.00 4.35 0.50 0.99 2.96 -1.26 -4.63 118.68 121.60 1v58 s LEU 218 Ca 0.00 -0.02 -0.22 0.00 -0.22 0.00 0.00 54.13 53.66 1v58 s LEU 218 Cb 0.00 -2.67 -0.06 0.00 0.50 0.00 0.00 46.19 43.96 1v58 s LEU 218 CO 0.00 -0.56 1.28 -2.84 -1.32 0.00 0.00 176.35 172.91 1v58 s PRO 219 N 2.55 3.43 0.94 0.98 0.02 -1.26 -5.04 135.00 136.62 1v58 s PRO 219 Ca 0.21 2.06 -0.13 0.00 0.02 0.00 0.00 61.00 63.16 1v58 s PRO 219 Cb -0.15 -2.35 0.21 0.00 0.02 0.00 0.00 34.50 32.23 1v58 s PRO 219 CO 0.14 -0.90 1.28 0.16 -0.33 0.00 0.00 177.00 177.35 1v58 s ASP 220 N -1.09 3.11 0.19 2.53 1.47 -1.26 -4.73 116.67 116.90 1v58 s ASP 220 Ca 0.67 -0.02 -0.11 0.00 1.18 0.00 0.00 52.55 54.27 1v58 s ASP 220 Cb -0.36 0.01 0.19 0.00 -0.34 0.00 0.00 42.92 42.41 1v58 s ASP 220 CO 0.43 -2.71 1.79 -0.61 0.68 0.00 0.00 175.17 174.75 1v58 h GLN 221 N -1.50 0.53 0.04 2.11 5.75 -1.99 -0.30 115.11 119.75 1v58 h GLN 221 Ca -0.42 -0.03 -0.00 0.00 -0.15 0.00 0.00 58.65 58.05 1v58 h GLN 221 Cb 1.22 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 29.65 1v58 h GLN 221 CO 0.32 0.35 -0.02 -0.22 -2.65 0.00 0.00 178.83 176.61 1v58 h LYS 222 N 0.55 -0.06 -0.81 1.69 3.64 -2.00 -1.89 116.57 117.68 1v58 h LYS 222 Ca 0.26 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.64 1v58 h LYS 222 Cb 0.18 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 31.97 1v58 h LYS 222 CO -0.18 0.13 0.51 1.15 -2.27 0.00 0.00 179.45 178.79 1v58 h THR 223 N -0.24 1.22 -0.09 1.00 2.02 -1.89 -1.93 112.91 113.00 1v58 h THR 223 Ca -0.01 -0.44 0.02 0.00 0.77 0.00 0.00 66.41 66.74 1v58 h THR 223 Cb 0.22 0.05 -0.02 0.00 -1.74 0.00 0.00 68.15 66.66 1v58 h THR 223 CO 0.01 0.22 -0.01 0.25 0.37 0.00 0.00 175.52 176.36 1v58 h LEU 224 N 1.11 -0.05 -1.32 2.58 5.85 -0.94 0.07 115.31 122.61 1v58 h LEU 224 Ca 0.29 0.02 0.00 0.00 0.84 0.00 0.00 57.88 59.04 1v58 h LEU 224 Cb -0.08 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 40.96 1v58 h LEU 224 CO -0.06 -0.01 0.42 0.78 -0.34 0.00 0.00 178.44 179.23 1v58 h ASN 225 N 0.02 0.77 -0.29 1.25 2.35 -1.04 -0.84 115.58 117.80 1v58 h ASN 225 Ca 0.04 -0.03 -0.14 0.00 -0.55 0.00 0.00 56.30 55.62 1v58 h ASN 225 Cb 0.06 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.23 1v58 h ASN 225 CO -0.08 0.57 -0.37 0.40 -1.65 0.00 0.00 177.43 176.30 1v58 h ILE 226 N 0.90 1.30 -0.58 2.81 2.04 -0.94 0.13 117.51 123.18 1v58 h ILE 226 Ca 0.24 -1.56 0.00 0.00 1.00 0.00 0.00 64.86 64.55 1v58 h ILE 226 Cb -0.08 1.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.58 1v58 h ILE 226 CO -0.05 0.50 0.38 0.40 0.00 0.00 0.00 178.15 179.38 1v58 h ILE 227 N 0.52 1.15 0.00 -0.67 2.04 -0.53 -1.71 117.51 118.31 1v58 h ILE 227 Ca 0.04 -0.28 0.00 0.00 1.00 0.00 0.00 64.86 65.61 1v58 h ILE 227 Cb 0.96 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 37.35 1v58 h ILE 227 CO 0.09 0.15 0.00 0.23 0.00 0.00 0.00 178.15 178.62 1v58 n MET 228 N -4.68 0.54 -1.44 2.37 2.81 -0.36 -4.87 117.12 111.49 1v58 n MET 228 Ca 0.04 0.02 -0.02 0.00 -1.81 0.00 0.00 57.70 55.93 1v58 n MET 228 Cb 0.02 -1.50 -0.00 0.00 -0.71 0.00 0.00 33.22 31.03 1v58 n MET 228 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1v58 n GLY 229 N 0.23 0.43 0.00 3.03 0.00 -0.64 -4.86 105.19 103.38 1v58 n GLY 229 Ca 0.13 -0.93 0.11 0.00 0.00 0.00 0.00 46.02 45.33 1v58 n GLY 229 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02