#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ost n THR 3 N 0.00 0.00 -0.25 2.46 -2.24 -1.26 -3.68 114.28 109.31 2ost n THR 3 Ca 0.00 0.00 0.28 0.00 -2.27 0.00 0.00 64.05 62.06 2ost n THR 3 Cb 0.00 -0.37 0.66 0.00 -2.10 0.00 0.00 70.33 68.52 2ost n THR 3 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2ost h LYS 4 N 0.00 0.12 -0.38 -0.78 1.79 -2.06 0.10 116.57 115.37 2ost h LYS 4 Ca 0.00 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2ost h LYS 4 Cb 0.00 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.60 2ost h LYS 4 CO 0.00 0.08 0.25 1.25 -1.08 0.00 0.00 179.45 179.95 2ost h LEU 5 N 0.13 0.44 -0.37 2.94 5.85 -1.99 -0.70 115.31 121.60 2ost h LEU 5 Ca 0.50 -0.02 0.07 0.00 0.84 0.00 0.00 57.88 59.27 2ost h LEU 5 Cb 1.75 -0.11 -0.07 0.00 0.37 0.00 0.00 40.66 42.60 2ost h LEU 5 CO -0.08 0.33 -0.07 0.11 -0.34 0.00 0.00 178.44 178.39 2ost h LYS 6 N 0.51 0.02 -0.42 1.25 6.56 -1.09 0.80 116.57 124.20 2ost h LYS 6 Ca 0.14 -0.00 0.04 0.00 -1.06 0.00 0.00 60.65 59.77 2ost h LYS 6 Cb -0.05 -0.00 -0.04 0.00 -0.57 0.00 0.00 32.23 31.57 2ost h LYS 6 CO -0.03 0.01 0.18 0.78 -2.06 0.00 0.00 179.45 178.33 2ost h GLY 7 N 0.02 0.56 0.41 3.86 0.00 -1.38 -1.84 103.07 104.70 2ost h GLY 7 Ca 0.18 -0.11 0.10 0.00 0.00 0.00 0.00 47.33 47.50 2ost h GLY 7 CO -0.36 0.06 0.36 -0.55 0.00 0.00 0.00 176.54 176.04 2ost h ASP 8 N 0.36 0.45 -0.53 0.19 3.32 0.16 -0.80 116.42 119.57 2ost h ASP 8 Ca 0.19 0.07 -0.11 0.00 0.02 0.00 0.00 57.03 57.20 2ost h ASP 8 Cb 0.14 -0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 2ost h ASP 8 CO -0.17 0.24 -0.10 0.40 -1.72 0.00 0.00 179.24 177.89 2ost h ILE 9 N 0.59 1.27 -0.55 0.35 2.04 -0.52 -1.96 117.51 118.73 2ost h ILE 9 Ca 0.37 -1.26 0.00 0.00 1.00 0.00 0.00 64.86 64.97 2ost h ILE 9 Cb 0.42 0.96 -0.03 0.00 -0.74 0.00 0.00 36.82 37.43 2ost h ILE 9 CO -0.29 0.44 0.35 0.00 0.00 0.00 0.00 178.15 178.65 2ost h ALA 10 N 0.96 0.71 -0.08 1.87 0.00 -0.57 -1.63 119.26 120.52 2ost h ALA 10 Ca 0.14 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2ost h ALA 10 Cb 0.67 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 2ost h ALA 10 CO 0.05 0.17 0.02 0.37 0.00 0.00 0.00 179.25 179.86 2ost h GLN 11 N 0.75 0.12 0.00 0.00 4.15 -1.00 -1.66 115.11 117.47 2ost h GLN 11 Ca 0.20 -0.03 -0.05 0.00 0.77 0.00 0.00 58.65 59.54 2ost h GLN 11 Cb -0.05 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.62 2ost h GLN 11 CO -0.04 0.28 -0.24 1.96 -1.93 0.00 0.00 178.83 178.86 2ost h GLN 12 N -0.06 0.00 -0.24 1.69 1.08 -1.25 0.97 115.11 117.29 2ost h GLN 12 Ca 0.03 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.18 2ost h GLN 12 Cb 0.21 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.63 2ost h GLN 12 CO -0.00 0.24 -0.03 0.00 -0.95 0.00 0.00 178.83 178.09 2ost h ALA 13 N 1.76 0.33 0.29 3.87 0.00 -1.16 -2.08 119.26 122.28 2ost h ALA 13 Ca -0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 2ost h ALA 13 Cb 0.44 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2ost h ALA 13 CO 0.03 0.09 -0.19 0.00 0.00 0.00 0.00 179.25 179.18 2ost h ALA 14 N 0.78 -0.46 -0.69 0.00 0.00 -0.28 -1.16 119.26 117.46 2ost h ALA 14 Ca 0.06 -0.09 0.15 0.00 0.00 0.00 0.00 54.91 55.04 2ost h ALA 14 Cb 0.46 0.24 -0.12 0.00 0.00 0.00 0.00 17.79 18.38 2ost h ALA 14 CO 0.02 -0.77 0.03 0.82 0.00 0.00 0.00 179.25 179.35 2ost h ILE 15 N -0.47 0.44 -0.94 0.00 2.04 -0.88 0.39 117.51 118.10 2ost h ILE 15 Ca -0.03 -0.05 0.02 0.00 1.00 0.00 0.00 64.86 65.80 2ost h ILE 15 Cb 0.40 0.29 -0.05 0.00 -0.74 0.00 0.00 36.82 36.72 2ost h ILE 15 CO 0.02 0.03 0.62 -0.03 0.00 0.00 0.00 178.15 178.79 2ost h MET 16 N 0.14 1.21 -0.66 2.37 4.05 -0.97 -2.35 114.93 118.73 2ost h MET 16 Ca 0.37 -0.07 -0.05 0.00 -0.28 0.00 0.00 59.70 59.67 2ost h MET 16 Cb 0.63 -0.27 -0.03 0.00 -0.80 0.00 0.00 31.60 31.13 2ost h MET 16 CO -0.57 0.80 0.22 0.00 0.23 0.00 0.00 176.91 177.59 2ost h ARG 17 N 1.25 1.01 -0.49 0.39 2.47 0.31 0.60 114.38 119.92 2ost h ARG 17 Ca 0.35 -0.21 -0.00 0.00 -1.26 0.00 0.00 59.98 58.86 2ost h ARG 17 Cb -0.11 -0.15 -0.02 0.00 -1.65 0.00 0.00 29.97 28.03 2ost h ARG 17 CO -0.08 0.88 0.29 0.00 0.56 0.00 0.00 179.97 181.61 2ost h ALA 18 N 1.09 0.62 -0.09 0.04 0.00 -1.09 -2.55 119.26 117.28 2ost h ALA 18 Ca 0.21 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 2ost h ALA 18 Cb 0.28 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2ost h ALA 18 CO -0.01 0.12 -0.45 -0.07 0.00 0.00 0.00 179.25 178.84 2ost h LEU 19 N 0.65 0.24 -2.35 0.00 3.38 -1.16 -1.35 115.31 114.71 2ost h LEU 19 Ca 0.17 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2ost h LEU 19 Cb 0.01 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 2ost h LEU 19 CO -0.03 0.66 -0.03 0.11 0.09 0.00 0.00 178.44 179.24 2ost h LYS 20 N 0.18 0.00 -0.28 1.13 1.79 -0.49 -1.42 116.57 117.48 2ost h LYS 20 Ca 0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 2ost h LYS 20 Cb 0.87 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.52 2ost h LYS 20 CO 0.07 0.03 0.00 -1.33 -1.08 0.00 0.00 179.45 177.14 2ost n MET 21 N -3.31 3.00 -1.08 3.15 2.81 -0.87 -4.98 117.12 115.84 2ost n MET 21 Ca -0.02 -2.81 -0.03 0.00 -1.81 0.00 0.00 57.70 53.04 2ost n MET 21 Cb 0.16 -1.83 -0.01 0.00 -0.71 0.00 0.00 33.22 30.83 2ost n MET 21 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2ost n GLY 22 N -0.40 0.51 3.89 3.03 0.00 -0.54 -5.01 105.19 106.68 2ost n GLY 22 Ca 0.21 -0.18 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 2ost n GLY 22 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2ost s TRP 23 N -1.80 3.09 0.21 1.61 0.51 -0.56 -4.92 118.94 117.09 2ost s TRP 23 Ca 0.00 0.89 -0.06 0.00 -2.12 0.00 0.00 56.10 54.81 2ost s TRP 23 Cb 0.00 -3.30 -0.06 0.00 -0.81 0.00 0.00 33.47 29.30 2ost s TRP 23 CO 0.00 -1.54 0.48 0.20 -0.51 0.00 0.00 176.95 175.58 2ost s GLY 24 N -4.45 2.12 -0.05 0.98 0.00 -0.49 -4.44 107.32 100.97 2ost s GLY 24 Ca 0.60 -0.49 0.04 0.00 0.00 0.00 0.00 44.72 44.87 2ost s GLY 24 CO 0.50 -0.39 -0.18 0.14 0.00 0.00 0.00 173.10 173.18 2ost s VAL 25 N -1.84 1.52 0.02 1.40 1.01 -1.26 0.06 120.40 121.31 2ost s VAL 25 Ca 0.44 -0.75 0.08 0.00 0.00 0.00 0.00 61.98 61.75 2ost s VAL 25 Cb -0.11 -1.31 -0.02 0.00 0.00 0.00 0.00 36.38 34.93 2ost s VAL 25 CO 0.25 0.44 -0.25 -0.76 0.00 0.00 0.00 175.10 174.78 2ost s LEU 26 N 0.15 2.13 -0.15 3.92 1.02 -0.27 -4.98 118.68 120.50 2ost s LEU 26 Ca -0.07 -0.53 -0.01 0.00 0.02 0.00 0.00 54.13 53.54 2ost s LEU 26 Cb -0.13 -1.23 0.04 0.00 0.02 0.00 0.00 46.19 44.89 2ost s LEU 26 CO 0.03 0.26 -0.03 -0.54 0.02 0.00 0.00 176.35 176.09 2ost s LYS 27 N -1.00 1.14 0.29 1.70 1.02 -1.26 -2.68 119.74 118.95 2ost s LYS 27 Ca 0.10 -0.35 -0.29 0.00 0.02 0.00 0.00 55.97 55.45 2ost s LYS 27 Cb -0.10 -1.77 -0.10 0.00 -0.52 0.00 0.00 37.83 35.34 2ost s LYS 27 CO 0.01 -0.42 1.30 -1.25 -0.92 0.00 0.00 175.35 174.07 2ost s PRO 28 N 1.75 4.38 -0.06 -1.68 0.04 -1.26 -5.00 135.00 133.18 2ost s PRO 28 Ca 0.02 2.15 -0.30 0.00 0.04 0.00 0.00 61.00 62.91 2ost s PRO 28 Cb -0.15 -3.11 -0.02 0.00 0.04 0.00 0.00 34.50 31.26 2ost s PRO 28 CO -0.07 -0.18 1.06 -0.51 0.04 0.00 0.00 177.00 177.33 2ost s LEU 29 N -1.25 4.29 0.14 -3.56 1.43 -1.26 -4.84 118.68 113.64 2ost s LEU 29 Ca 0.51 1.67 0.00 0.00 -1.03 0.00 0.00 54.13 55.28 2ost s LEU 29 Cb -0.38 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.27 2ost s LEU 29 CO 0.47 -0.44 0.00 0.61 0.23 0.00 0.00 176.35 177.23 2ost n GLY 30 N 3.12 -1.75 2.47 -3.19 0.00 -1.26 -4.67 105.19 99.91 2ost n GLY 30 Ca 0.09 -1.38 -0.28 0.00 0.00 0.00 0.00 46.02 44.44 2ost n GLY 30 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ost n ASP 31 N -2.53 5.18 0.04 1.61 9.92 -1.26 -4.67 116.55 124.85 2ost n ASP 31 Ca -0.00 -3.74 -0.04 0.00 -0.53 0.00 0.00 54.79 50.48 2ost n ASP 31 Cb 0.24 -0.54 -0.09 0.00 -0.64 0.00 0.00 41.12 40.10 2ost n ASP 31 CO 0.00 0.00 0.00 0.03 0.13 0.00 0.00 177.20 177.36 2ost h ARG 32 N 2.57 0.00 -7.33 -1.24 3.08 -1.96 -3.48 114.38 106.01 2ost h ARG 32 Ca 0.35 0.00 -0.49 0.00 0.07 0.00 0.00 59.98 59.91 2ost h ARG 32 Cb 0.89 0.00 0.07 0.00 0.08 0.00 0.00 29.97 31.00 2ost h ARG 32 CO 0.93 0.56 0.35 -0.51 -1.07 0.00 0.00 179.97 180.23 2ost s LEU 33 N -6.23 3.11 0.00 3.04 1.43 -1.26 -4.98 118.68 113.79 2ost s LEU 33 Ca -0.01 1.11 0.23 0.00 -1.03 0.00 0.00 54.13 54.42 2ost s LEU 33 Cb 0.09 -3.99 0.95 0.00 0.03 0.00 0.00 46.19 43.27 2ost s LEU 33 CO 0.81 -1.10 1.66 -1.54 0.23 0.00 0.00 176.35 176.41 2ost n SER 34 N -2.80 1.22 -4.20 2.29 3.41 -1.26 -4.86 113.62 107.42 2ost n SER 34 Ca 0.06 -1.57 -0.14 0.00 -0.26 0.00 0.00 58.87 56.96 2ost n SER 34 Cb 0.56 -0.06 -0.10 0.00 -0.26 0.00 0.00 64.21 64.35 2ost n SER 34 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 2ost s TYR 35 N -1.88 1.11 -0.17 7.33 1.13 -1.26 -4.80 117.35 118.81 2ost s TYR 35 Ca 0.34 -0.73 0.08 0.00 -1.41 0.00 0.00 57.07 55.35 2ost s TYR 35 Cb 0.18 -0.59 -0.23 0.00 -1.10 0.00 0.00 41.96 40.22 2ost s TYR 35 CO 0.28 0.01 0.16 -0.25 -2.51 0.00 0.00 175.55 173.23 2ost n ASP 36 N 0.21 1.08 -4.02 -0.18 8.00 -0.86 -4.95 116.55 115.83 2ost n ASP 36 Ca -0.13 0.08 -0.09 0.00 0.71 0.00 0.00 54.79 55.36 2ost n ASP 36 Cb 0.59 0.08 -0.08 0.00 -0.02 0.00 0.00 41.12 41.69 2ost n ASP 36 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2ost s LEU 37 N -6.16 1.46 -0.08 0.64 1.02 -0.01 -4.52 118.68 111.02 2ost s LEU 37 Ca -0.18 -0.96 -0.04 0.00 0.02 0.00 0.00 54.13 52.97 2ost s LEU 37 Cb 0.07 0.77 0.05 0.00 0.02 0.00 0.00 46.19 47.10 2ost s LEU 37 CO 0.76 -0.78 0.18 0.54 0.02 0.00 0.00 176.35 177.06 2ost s VAL 38 N -3.97 -0.16 -0.07 -1.59 0.11 -1.09 0.58 120.40 114.20 2ost s VAL 38 Ca 0.17 0.25 -0.12 0.00 -2.93 0.00 0.00 61.98 59.34 2ost s VAL 38 Cb 0.05 -0.30 -0.05 0.00 -1.53 0.00 0.00 36.38 34.56 2ost s VAL 38 CO -0.02 0.10 0.31 -0.36 -3.33 0.00 0.00 175.10 171.80 2ost s PHE 39 N 1.71 3.64 -0.72 1.54 0.08 0.43 -1.11 117.98 123.56 2ost s PHE 39 Ca -0.04 0.78 -0.19 0.00 0.12 0.00 0.00 56.93 57.60 2ost s PHE 39 Cb -0.12 -2.19 0.12 0.00 -0.57 0.00 0.00 43.02 40.26 2ost s PHE 39 CO -0.06 0.60 0.88 0.34 -0.10 0.00 0.00 175.22 176.87 2ost s ASP 40 N -0.78 6.36 -0.47 1.36 3.68 0.11 -1.04 116.67 125.89 2ost s ASP 40 Ca 0.20 -1.64 -0.19 0.00 2.13 0.00 0.00 52.55 53.05 2ost s ASP 40 Cb -0.15 -2.34 0.04 0.00 -1.45 0.00 0.00 42.92 39.03 2ost s ASP 40 CO 0.09 -1.11 0.57 -0.69 0.13 0.00 0.00 175.17 174.16 2ost s VAL 41 N 2.69 4.93 -0.47 1.11 1.01 0.83 -1.40 120.40 129.11 2ost s VAL 41 Ca 0.20 -0.37 0.00 0.00 0.00 0.00 0.00 61.98 61.81 2ost s VAL 41 Cb -0.16 -4.21 0.00 0.00 0.00 0.00 0.00 36.38 32.01 2ost s VAL 41 CO 0.01 -0.66 0.00 -0.62 0.00 0.00 0.00 175.10 173.83 2ost n GLU 42 N 6.01 -2.41 0.00 2.72 1.02 -1.26 0.29 120.64 127.01 2ost n GLU 42 Ca -0.06 0.27 0.00 0.00 -0.02 0.00 0.00 57.16 57.35 2ost n GLU 42 Cb 0.46 -4.74 0.00 0.00 -0.02 0.00 0.00 31.44 27.15 2ost n GLU 42 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ost n GLY 43 N -0.54 1.76 3.70 0.62 0.00 -1.26 -5.09 105.19 104.38 2ost n GLY 43 Ca -0.06 -0.53 -0.41 0.00 0.00 0.00 0.00 46.02 45.02 2ost n GLY 43 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ost s ILE 44 N -0.65 4.93 -0.37 -0.61 -1.09 0.15 -4.99 121.20 118.57 2ost s ILE 44 Ca 0.00 1.74 -0.19 0.00 -2.23 0.00 0.00 60.65 59.97 2ost s ILE 44 Cb 0.00 -4.18 0.00 0.00 -1.58 0.00 0.00 42.46 36.71 2ost s ILE 44 CO 0.00 0.16 0.55 -0.76 -1.23 0.00 0.00 174.94 173.66 2ost s LEU 45 N 1.21 4.38 -0.18 2.97 1.43 -1.26 -0.12 118.68 127.11 2ost s LEU 45 Ca 0.44 -0.07 -0.02 0.00 -1.03 0.00 0.00 54.13 53.45 2ost s LEU 45 Cb -0.19 -2.64 -0.00 0.00 0.03 0.00 0.00 46.19 43.39 2ost s LEU 45 CO 0.20 -0.55 -0.11 -0.76 0.23 0.00 0.00 176.35 175.37 2ost s LEU 46 N 2.50 2.65 0.78 1.79 2.01 -0.21 -4.94 118.68 123.28 2ost s LEU 46 Ca 0.20 -0.44 -0.13 0.00 0.01 0.00 0.00 54.13 53.77 2ost s LEU 46 Cb -0.15 -1.64 0.07 0.00 0.01 0.00 0.00 46.19 44.48 2ost s LEU 46 CO 0.14 0.04 1.17 -0.54 1.01 0.00 0.00 176.35 178.17 2ost s LYS 47 N 1.11 1.87 -0.22 1.70 1.02 -1.26 -0.43 119.74 123.54 2ost s LYS 47 Ca 0.01 1.59 -0.14 0.00 0.02 0.00 0.00 55.97 57.45 2ost s LYS 47 Cb -0.14 -1.82 0.07 0.00 -0.52 0.00 0.00 37.83 35.41 2ost s LYS 47 CO -0.03 -2.00 0.54 0.54 -0.92 0.00 0.00 175.35 173.48 2ost s VAL 48 N -2.33 -0.01 -0.08 3.17 0.11 0.20 -3.47 120.40 117.99 2ost s VAL 48 Ca 0.70 0.04 -0.14 0.00 -2.93 0.00 0.00 61.98 59.65 2ost s VAL 48 Cb -0.25 -0.78 -0.05 0.00 -1.53 0.00 0.00 36.38 33.77 2ost s VAL 48 CO 0.50 0.02 0.35 -1.58 -3.33 0.00 0.00 175.10 171.06 2ost s GLN 49 N 1.26 4.02 -0.23 1.54 2.00 -0.68 -0.83 119.66 126.74 2ost s GLN 49 Ca -0.08 0.26 -0.04 0.00 -2.00 0.00 0.00 55.36 53.50 2ost s GLN 49 Cb -0.06 -3.31 -0.01 0.00 0.80 0.00 0.00 33.01 30.43 2ost s GLN 49 CO -0.13 0.49 -0.03 0.08 -0.50 0.00 0.00 175.29 175.21 2ost s VAL 50 N -0.37 3.50 0.01 1.34 1.01 -1.26 -0.39 120.40 124.23 2ost s VAL 50 Ca 0.21 -0.46 0.05 0.00 0.00 0.00 0.00 61.98 61.78 2ost s VAL 50 Cb -0.15 -2.60 -0.02 0.00 0.00 0.00 0.00 36.38 33.61 2ost s VAL 50 CO 0.09 0.40 -0.16 -0.54 0.00 0.00 0.00 175.10 174.90 2ost s LYS 51 N 1.50 1.20 0.25 2.72 -0.14 -0.59 -4.93 119.74 119.74 2ost s LYS 51 Ca 0.06 -0.65 0.04 0.00 -1.36 0.00 0.00 55.97 54.06 2ost s LYS 51 Cb -0.14 -1.19 -0.03 0.00 -1.68 0.00 0.00 37.83 34.79 2ost s LYS 51 CO -0.02 0.32 0.39 -1.54 -0.76 0.00 0.00 175.35 173.73 2ost s SER 52 N -0.64 6.32 0.19 2.83 1.04 -1.26 -1.16 113.70 121.01 2ost s SER 52 Ca 0.05 0.14 0.11 0.00 0.48 0.00 0.00 55.95 56.73 2ost s SER 52 Cb -0.07 -1.89 -0.04 0.00 0.10 0.00 0.00 66.02 64.12 2ost s SER 52 CO 0.00 -0.10 -0.21 -0.94 0.98 0.00 0.00 173.24 172.97 2ost s SER 53 N -3.94 3.62 0.13 7.02 1.04 -0.14 -4.73 113.70 116.71 2ost s SER 53 Ca 0.35 -0.79 0.09 0.00 0.48 0.00 0.00 55.95 56.08 2ost s SER 53 Cb -0.09 -0.36 -0.04 0.00 0.10 0.00 0.00 66.02 65.63 2ost s SER 53 CO 0.30 0.12 -0.17 -1.66 0.98 0.00 0.00 173.24 172.81 2ost s TRP 54 N -1.65 2.54 0.29 5.02 -2.14 -1.00 -4.76 118.94 117.25 2ost s TRP 54 Ca 0.21 -0.26 -0.29 0.00 2.66 0.00 0.00 56.10 58.42 2ost s TRP 54 Cb -0.08 -1.32 -0.10 0.00 -3.10 0.00 0.00 33.47 28.87 2ost s TRP 54 CO 0.11 0.42 1.18 -1.59 -2.66 0.00 0.00 176.95 174.41 2ost s LYS 55 N -2.30 4.52 0.30 3.25 0.00 -1.26 -1.59 119.74 122.67 2ost s LYS 55 Ca 0.19 1.97 -0.29 0.00 0.00 0.00 0.00 55.97 57.84 2ost s LYS 55 Cb -0.10 -3.15 -0.10 0.00 0.00 0.00 0.00 37.83 34.48 2ost s LYS 55 CO 0.11 0.04 1.23 0.45 0.00 0.00 0.00 175.35 177.18 2ost s SER 56 N -0.66 6.97 0.03 0.03 0.15 0.16 -4.90 113.70 115.47 2ost s SER 56 Ca 0.47 2.51 -0.28 0.00 0.70 0.00 0.00 55.95 59.34 2ost s SER 56 Cb -0.35 -2.64 -0.16 0.00 -1.71 0.00 0.00 66.02 61.16 2ost s SER 56 CO 0.45 -0.38 1.26 -0.33 1.20 0.00 0.00 173.24 175.44 2ost h GLU 57 N 3.71 -0.83 0.00 5.44 5.08 -1.95 -3.40 114.58 122.62 2ost h GLU 57 Ca -0.48 0.06 0.00 0.00 -1.00 0.00 0.00 59.36 57.94 2ost h GLU 57 Cb 1.22 0.19 0.00 0.00 0.50 0.00 0.00 28.75 30.66 2ost h GLU 57 CO 0.67 -0.51 0.00 1.63 -1.00 0.00 0.00 179.01 179.80 2ost n LYS 58 N -5.38 0.00 -1.83 2.33 5.02 -1.26 -4.90 118.16 112.14 2ost n LYS 58 Ca -0.12 0.24 -0.32 0.00 -2.02 0.00 0.00 58.31 56.09 2ost n LYS 58 Cb 0.36 -0.93 0.03 0.00 -0.02 0.00 0.00 35.03 34.47 2ost n LYS 58 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 2ost s THR 59 N -1.04 4.04 -0.85 -0.18 -1.32 -1.26 -4.94 115.64 110.08 2ost s THR 59 Ca 0.00 0.79 -0.07 0.00 -1.21 0.00 0.00 61.69 61.20 2ost s THR 59 Cb 0.00 -3.45 -0.13 0.00 -1.51 0.00 0.00 72.50 67.41 2ost s THR 59 CO 0.00 -0.74 3.17 0.61 -2.21 0.00 0.00 174.62 175.45 2ost n GLY 60 N -1.64 3.84 3.53 6.08 0.00 -1.26 -4.33 105.19 111.41 2ost n GLY 60 Ca 0.08 -1.46 -0.25 0.00 0.00 0.00 0.00 46.02 44.38 2ost n GLY 60 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2ost s ASN 61 N 1.80 2.91 0.01 1.61 0.01 -1.26 -4.59 114.94 115.42 2ost s ASN 61 Ca 0.67 -1.49 0.07 0.00 -0.71 0.00 0.00 52.86 51.40 2ost s ASN 61 Cb 0.25 0.10 -0.02 0.00 0.41 0.00 0.00 41.25 41.99 2ost s ASN 61 CO -0.05 -0.70 -0.23 -0.31 -1.51 0.00 0.00 177.10 174.30 2ost s TYR 62 N -3.14 2.00 0.01 2.20 2.02 -0.35 0.38 117.35 120.47 2ost s TYR 62 Ca 0.29 -0.38 0.05 0.00 -0.37 0.00 0.00 57.07 56.66 2ost s TYR 62 Cb 0.06 -1.25 -0.02 0.00 -0.40 0.00 0.00 41.96 40.35 2ost s TYR 62 CO 0.14 0.02 -0.15 0.54 -1.57 0.00 0.00 175.55 174.53 2ost s VAL 63 N -0.62 1.15 -0.06 0.71 0.11 -0.62 0.78 120.40 121.84 2ost s VAL 63 Ca 0.09 -0.79 0.02 0.00 -2.93 0.00 0.00 61.98 58.37 2ost s VAL 63 Cb -0.09 -0.99 0.02 0.00 -1.53 0.00 0.00 36.38 33.79 2ost s VAL 63 CO 0.00 0.19 -0.09 0.54 -3.33 0.00 0.00 175.10 172.41 2ost s VAL 64 N -0.55 0.91 0.02 2.04 0.11 -0.57 -2.37 120.40 119.99 2ost s VAL 64 Ca 0.04 -0.35 -0.00 0.00 -2.93 0.00 0.00 61.98 58.74 2ost s VAL 64 Cb -0.07 -0.85 -0.04 0.00 -1.53 0.00 0.00 36.38 33.89 2ost s VAL 64 CO 0.00 0.30 0.13 -0.62 -3.33 0.00 0.00 175.10 171.59 2ost s ASP 65 N 0.72 5.95 -0.05 3.54 -1.08 -1.26 -1.95 116.67 122.54 2ost s ASP 65 Ca -0.13 0.19 0.02 0.00 -0.52 0.00 0.00 52.55 52.11 2ost s ASP 65 Cb -0.15 -1.75 0.01 0.00 -1.46 0.00 0.00 42.92 39.57 2ost s ASP 65 CO 0.02 0.23 -0.09 0.54 0.52 0.00 0.00 175.17 176.40 2ost s ASN 66 N -2.06 1.33 -0.41 -0.34 4.22 -1.24 -5.01 114.94 111.44 2ost s ASN 66 Ca 0.27 -0.21 0.07 0.00 -2.14 0.00 0.00 52.86 50.85 2ost s ASN 66 Cb -0.12 -0.55 0.23 0.00 1.28 0.00 0.00 41.25 42.09 2ost s ASN 66 CO 0.19 0.02 0.49 -1.14 -2.04 0.00 0.00 177.10 174.62 2ost n ARG 67 N 3.71 0.67 0.00 3.55 0.63 -1.26 -4.98 116.66 118.98 2ost n ARG 67 Ca -0.22 -3.27 0.00 0.00 -0.92 0.00 0.00 57.85 53.43 2ost n ARG 67 Cb 0.52 -1.36 0.00 0.00 0.45 0.00 0.00 32.46 32.07 2ost n ARG 67 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2ost n GLY 83 N 1.72 1.58 3.61 5.14 0.00 -1.26 -5.27 105.19 110.72 2ost n GLY 83 Ca 0.23 0.38 -0.41 0.00 0.00 0.00 0.00 46.02 46.23 2ost n GLY 83 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2ost n ASN 84 N 2.45 1.21 -1.23 1.61 0.23 -1.26 -4.63 115.26 113.63 2ost n ASN 84 Ca 0.00 0.99 0.17 0.00 -0.53 0.00 0.00 54.58 55.21 2ost n ASN 84 Cb 0.00 -1.37 -0.04 0.00 -2.08 0.00 0.00 39.78 36.29 2ost n ASN 84 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 2ost n ASP 85 N 0.26 -7.28 0.00 0.53 5.68 -1.26 -4.76 116.55 109.72 2ost n ASP 85 Ca 0.10 0.51 0.00 0.00 -0.50 0.00 0.00 54.79 54.90 2ost n ASP 85 Cb 0.41 -3.82 0.00 0.00 -1.14 0.00 0.00 41.12 36.57 2ost n ASP 85 CO 0.00 0.00 0.00 0.33 -1.33 0.00 0.00 177.20 176.20 2ost n PHE 86 N -3.69 0.00 0.00 2.11 7.35 -1.26 -4.80 117.46 117.17 2ost n PHE 86 Ca 0.01 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.70 2ost n PHE 86 Cb 0.64 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.47 2ost n PHE 86 CO 0.00 0.00 0.00 -0.40 -0.76 0.00 0.00 176.76 175.60 2ost n ASP 87 N 2.30 0.00 -3.68 -2.13 5.68 -1.26 -3.76 116.55 113.70 2ost n ASP 87 Ca 0.00 0.00 -0.12 0.00 -0.50 0.00 0.00 54.79 54.17 2ost n ASP 87 Cb 0.00 -0.07 -0.06 0.00 -1.14 0.00 0.00 41.12 39.85 2ost n ASP 87 CO 0.00 0.00 0.00 -0.36 -1.33 0.00 0.00 177.20 175.51 2ost s PHE 88 N 0.00 -0.21 -0.11 2.11 0.40 -1.23 -3.09 117.98 115.86 2ost s PHE 88 Ca 0.00 0.10 -0.05 0.00 -0.60 0.00 0.00 56.93 56.38 2ost s PHE 88 Cb 0.00 0.19 0.05 0.00 0.51 0.00 0.00 43.02 43.77 2ost s PHE 88 CO 0.00 -0.58 0.25 0.00 0.70 0.00 0.00 175.22 175.59 2ost s ALA 89 N -2.73 -0.57 -0.12 5.36 0.00 0.17 -1.68 121.76 122.19 2ost s ALA 89 Ca -0.04 1.01 -0.00 0.00 0.00 0.00 0.00 51.96 52.93 2ost s ALA 89 Cb -0.00 -0.66 -0.02 0.00 0.00 0.00 0.00 23.12 22.43 2ost s ALA 89 CO -0.04 -0.22 -0.10 0.14 0.00 0.00 0.00 175.76 175.54 2ost s VAL 90 N 1.32 3.37 -0.14 0.00 -7.23 0.48 -0.04 120.40 118.17 2ost s VAL 90 Ca -0.09 -0.56 -0.02 0.00 -1.81 0.00 0.00 61.98 59.50 2ost s VAL 90 Cb -0.10 -2.41 -0.02 0.00 0.56 0.00 0.00 36.38 34.40 2ost s VAL 90 CO -0.09 0.54 -0.07 0.00 -0.31 0.00 0.00 175.10 175.17 2ost s ALA 91 N 0.03 2.87 -0.07 1.32 0.00 0.25 -1.55 121.76 124.61 2ost s ALA 91 Ca -0.03 -0.85 0.00 0.00 0.00 0.00 0.00 51.96 51.08 2ost s ALA 91 Cb -0.14 -1.41 -0.03 0.00 0.00 0.00 0.00 23.12 21.54 2ost s ALA 91 CO 0.04 0.26 -0.05 -0.47 0.00 0.00 0.00 175.76 175.54 2ost s TYR 92 N 0.24 3.00 -0.22 0.00 6.04 -0.31 -0.41 117.35 125.68 2ost s TYR 92 Ca -0.05 0.06 0.02 0.00 0.04 0.00 0.00 57.07 57.14 2ost s TYR 92 Cb -0.14 -1.74 0.04 0.00 -1.04 0.00 0.00 41.96 39.08 2ost s TYR 92 CO 0.04 0.36 -0.13 0.08 -1.54 0.00 0.00 175.55 174.36 2ost s VAL 93 N -0.81 1.99 0.00 3.14 1.01 -1.06 -0.96 120.40 123.70 2ost s VAL 93 Ca 0.12 -1.27 0.00 0.00 0.00 0.00 0.00 61.98 60.83 2ost s VAL 93 Cb -0.11 -2.01 0.00 0.00 0.00 0.00 0.00 36.38 34.26 2ost s VAL 93 CO 0.02 0.19 0.67 -0.62 0.00 0.00 0.00 175.10 175.36 2ost n GLU 94 N 4.55 0.00 -0.35 2.72 1.02 -1.26 -3.46 120.64 123.86 2ost n GLU 94 Ca -0.16 0.20 0.01 0.00 -0.02 0.00 0.00 57.16 57.19 2ost n GLU 94 Cb 0.46 -1.17 0.07 0.00 -0.02 0.00 0.00 31.44 30.77 2ost n GLU 94 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 2ost n GLU 95 N -1.06 -0.17 -3.15 3.49 0.00 -1.26 -2.38 120.64 116.10 2ost n GLU 95 Ca 0.00 1.44 -0.45 0.00 0.00 0.00 0.00 57.16 58.15 2ost n GLU 95 Cb 0.00 -2.14 -0.04 0.00 0.00 0.00 0.00 31.44 29.26 2ost n GLU 95 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 2ost s LEU 96 N -10.84 5.74 -1.04 -1.84 1.43 -1.25 -4.98 118.68 105.89 2ost s LEU 96 Ca -0.13 -1.85 -0.26 0.00 -1.03 0.00 0.00 54.13 50.85 2ost s LEU 96 Cb 0.21 -2.29 -0.22 0.00 0.03 0.00 0.00 46.19 43.93 2ost s LEU 96 CO 0.69 -0.96 2.05 -0.62 0.23 0.00 0.00 176.35 177.74 2ost n GLU 97 N 5.72 0.41 -3.88 1.70 1.02 -1.00 -4.45 120.64 120.16 2ost n GLU 97 Ca 0.01 -1.82 -0.09 0.00 -0.02 0.00 0.00 57.16 55.24 2ost n GLU 97 Cb 0.44 -3.81 -0.08 0.00 -0.02 0.00 0.00 31.44 27.98 2ost n GLU 97 CO 0.00 0.00 0.00 -0.48 1.18 0.00 0.00 177.13 177.83 2ost s LEU 98 N 14.96 1.51 0.00 -4.62 -0.00 -1.22 -5.06 118.68 124.25 2ost s LEU 98 Ca 0.78 -0.67 0.05 0.00 -0.00 0.00 0.00 54.13 54.30 2ost s LEU 98 Cb -0.03 0.96 -0.03 0.00 -0.00 0.00 0.00 46.19 47.09 2ost s LEU 98 CO 0.19 -0.71 -0.14 -0.36 -0.00 0.00 0.00 176.35 175.33 2ost s PHE 99 N -3.79 2.68 -0.29 3.48 0.40 -1.26 -2.57 117.98 116.62 2ost s PHE 99 Ca 0.05 -0.18 -0.07 0.00 -0.60 0.00 0.00 56.93 56.12 2ost s PHE 99 Cb 0.05 -1.55 0.00 0.00 0.51 0.00 0.00 43.02 42.03 2ost s PHE 99 CO -0.11 0.26 0.09 0.71 0.70 0.00 0.00 175.22 176.88 2ost s TYR 100 N -0.88 3.14 -0.37 0.36 1.51 0.45 -1.63 117.35 119.93 2ost s TYR 100 Ca 0.14 -0.84 -0.11 0.00 -1.01 0.00 0.00 57.07 55.25 2ost s TYR 100 Cb -0.11 -2.27 0.02 0.00 -0.11 0.00 0.00 41.96 39.49 2ost s TYR 100 CO 0.04 -0.53 0.21 0.54 -1.11 0.00 0.00 175.55 174.71 2ost s VAL 101 N 1.53 4.66 -0.15 0.71 0.11 -0.97 0.86 120.40 127.16 2ost s VAL 101 Ca 0.03 -0.80 -0.05 0.00 -2.93 0.00 0.00 61.98 58.24 2ost s VAL 101 Cb -0.17 -3.59 -0.03 0.00 -1.53 0.00 0.00 36.38 31.06 2ost s VAL 101 CO 0.03 -0.22 0.02 -0.36 -3.33 0.00 0.00 175.10 171.24 2ost s PHE 102 N 1.57 3.17 0.49 1.54 0.40 0.95 -4.77 117.98 121.33 2ost s PHE 102 Ca 0.03 0.00 -0.23 0.00 -0.60 0.00 0.00 56.93 56.13 2ost s PHE 102 Cb -0.19 -1.96 -0.06 0.00 0.51 0.00 0.00 43.02 41.31 2ost s PHE 102 CO 0.07 0.20 1.24 -2.14 0.70 0.00 0.00 175.22 175.29 2ost s PRO 103 N 0.00 3.54 0.24 0.24 0.02 -1.26 -0.66 135.00 137.12 2ost s PRO 103 Ca 0.04 1.96 -0.08 0.00 0.02 0.00 0.00 61.00 62.93 2ost s PRO 103 Cb -0.13 -2.36 0.40 0.00 0.02 0.00 0.00 34.50 32.43 2ost s PRO 103 CO 0.02 -0.78 1.64 -0.24 -0.33 0.00 0.00 177.00 177.30 2ost h VAL 104 N 1.73 0.38 0.17 3.83 3.04 -1.86 -1.07 116.25 122.47 2ost h VAL 104 Ca -0.50 -0.04 -0.00 0.00 -1.01 0.00 0.00 66.70 65.15 2ost h VAL 104 Cb 1.27 0.26 -0.00 0.00 -2.01 0.00 0.00 31.29 30.81 2ost h VAL 104 CO 0.59 0.02 -0.11 -2.24 -1.01 0.00 0.00 177.57 174.82 2ost h ASP 105 N 0.11 -0.28 -0.77 3.17 2.03 -1.91 0.07 116.42 118.83 2ost h ASP 105 Ca 0.39 0.02 0.10 0.00 -0.73 0.00 0.00 57.03 56.81 2ost h ASP 105 Cb 0.67 0.08 -0.08 0.00 -0.83 0.00 0.00 39.33 39.17 2ost h ASP 105 CO -0.63 -0.18 0.41 0.58 -1.03 0.00 0.00 179.24 178.39 2ost h VAL 106 N -0.28 0.85 0.02 4.15 2.07 -1.80 -2.03 116.25 119.23 2ost h VAL 106 Ca -0.01 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.28 2ost h VAL 106 Cb 0.23 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.12 2ost h VAL 106 CO 0.01 0.12 -0.01 0.15 0.02 0.00 0.00 177.57 177.86 2ost h PHE 107 N 0.67 -0.03 0.00 1.57 3.57 -0.40 -2.78 116.94 119.55 2ost h PHE 107 Ca 0.38 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.87 2ost h PHE 107 Cb 0.41 0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.16 2ost h PHE 107 CO -0.09 0.17 -0.05 -0.84 -2.23 0.00 0.00 178.31 175.27 2ost h ILE 108 N -0.22 0.13 0.00 1.41 -0.00 -0.96 -3.23 117.51 114.64 2ost h ILE 108 Ca -0.00 -0.62 -0.00 0.00 -0.00 0.00 0.00 64.86 64.23 2ost h ILE 108 Cb 0.21 1.55 -0.00 0.00 -0.00 0.00 0.00 36.82 38.58 2ost h ILE 108 CO 0.01 0.05 -0.00 -1.54 -0.00 0.00 0.00 178.15 176.66 2ost n SER 109 N -3.17 4.07 -4.21 2.16 3.41 -0.77 -4.75 113.62 110.35 2ost n SER 109 Ca 0.00 -2.07 -0.16 0.00 -0.26 0.00 0.00 58.87 56.38 2ost n SER 109 Cb 0.32 -0.86 -0.11 0.00 -0.26 0.00 0.00 64.21 63.30 2ost n SER 109 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 2ost s TYR 110 N 0.50 1.23 0.00 7.33 2.02 -1.22 -5.02 117.35 122.19 2ost s TYR 110 Ca 0.01 -0.62 0.00 0.00 -0.37 0.00 0.00 57.07 56.08 2ost s TYR 110 Cb 0.00 -0.65 0.00 0.00 -0.40 0.00 0.00 41.96 40.91 2ost s TYR 110 CO 0.00 0.07 0.57 0.41 -1.57 0.00 0.00 175.55 175.03 2ost n GLY 111 N 0.44 -2.27 2.01 0.71 0.00 -1.26 -4.97 105.19 99.85 2ost n GLY 111 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2ost n GLY 111 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ost n SER 112 N -0.97 -0.24 -4.26 1.61 7.64 -1.26 -5.07 113.62 111.07 2ost n SER 112 Ca 0.00 0.19 -0.44 0.00 1.01 0.00 0.00 58.87 59.63 2ost n SER 112 Cb 0.00 0.34 -0.06 0.00 -1.01 0.00 0.00 64.21 63.47 2ost n SER 112 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2ost s GLU 113 N -1.33 2.84 0.09 1.43 2.02 -1.26 -3.68 118.70 118.80 2ost s GLU 113 Ca 0.00 -1.88 -0.30 0.00 0.02 0.00 0.00 54.97 52.81 2ost s GLU 113 Cb 0.00 -4.13 -0.06 0.00 0.10 0.00 0.00 34.13 30.04 2ost s GLU 113 CO 0.00 -1.26 1.18 -1.50 0.02 0.00 0.00 175.26 173.70 2ost s ILE 114 N 1.22 4.00 -0.05 -1.63 1.10 -0.82 -4.86 121.20 120.15 2ost s ILE 114 Ca 0.07 1.49 -0.04 0.00 -0.51 0.00 0.00 60.65 61.66 2ost s ILE 114 Cb -0.25 -3.95 -0.04 0.00 0.15 0.00 0.00 42.46 38.36 2ost s ILE 114 CO -0.01 0.15 0.14 -1.00 -2.11 0.00 0.00 174.94 172.11 2ost s HIS 115 N 0.77 3.51 -0.09 3.50 3.76 -1.26 -1.51 115.29 123.97 2ost s HIS 115 Ca 0.57 0.39 0.03 0.00 -0.15 0.00 0.00 55.06 55.90 2ost s HIS 115 Cb -0.29 -1.86 0.00 0.00 1.11 0.00 0.00 32.58 31.54 2ost s HIS 115 CO 0.31 0.66 -0.21 -0.51 -0.85 0.00 0.00 174.74 174.14 2ost s LEU 116 N -1.51 1.96 -0.23 0.89 1.43 0.23 -4.76 118.68 116.69 2ost s LEU 116 Ca 0.21 -0.48 -0.03 0.00 -1.03 0.00 0.00 54.13 52.80 2ost s LEU 116 Cb -0.12 -1.24 0.00 0.00 0.03 0.00 0.00 46.19 44.87 2ost s LEU 116 CO 0.12 0.12 -0.05 -0.69 0.23 0.00 0.00 176.35 176.07 2ost s VAL 117 N 0.44 3.16 -0.20 -1.59 1.01 -1.26 -1.21 120.40 120.75 2ost s VAL 117 Ca -0.18 -0.68 0.08 0.00 0.00 0.00 0.00 61.98 61.19 2ost s VAL 117 Cb -0.17 -2.49 -0.10 0.00 0.00 0.00 0.00 36.38 33.62 2ost s VAL 117 CO 0.07 0.35 0.25 1.21 0.00 0.00 0.00 175.10 176.99 2ost n GLU 118 N 4.75 2.62 -1.52 2.72 4.07 -1.26 -4.91 120.64 127.10 2ost n GLU 118 Ca -0.18 -0.03 -0.32 0.00 -0.06 0.00 0.00 57.16 56.57 2ost n GLU 118 Cb 0.50 -1.00 0.07 0.00 -0.06 0.00 0.00 31.44 30.95 2ost n GLU 118 CO 0.00 0.00 0.00 -0.08 -0.06 0.00 0.00 177.13 176.99 2ost s THR 119 N -2.08 3.15 -1.11 6.31 -1.32 -1.26 -4.96 115.64 114.37 2ost s THR 119 Ca 0.00 0.47 -0.02 0.00 -1.21 0.00 0.00 61.69 60.93 2ost s THR 119 Cb 0.05 -2.97 0.26 0.00 -1.51 0.00 0.00 72.50 68.33 2ost s THR 119 CO 0.31 -0.39 2.01 -0.67 -2.21 0.00 0.00 174.62 173.67 2ost n ASP 120 N -2.88 7.58 -1.80 8.08 2.03 -1.26 -4.78 116.55 123.51 2ost n ASP 120 Ca 0.10 -3.52 -0.16 0.00 0.52 0.00 0.00 54.79 51.73 2ost n ASP 120 Cb 0.52 -1.23 0.11 0.00 -0.72 0.00 0.00 41.12 39.80 2ost n ASP 120 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2ost n LYS 121 N 0.49 1.82 0.00 -0.67 4.01 -1.26 -4.92 118.16 117.62 2ost n LYS 121 Ca 0.52 -1.93 0.00 0.00 -0.51 0.00 0.00 58.31 56.39 2ost n LYS 121 Cb 0.26 -1.76 0.00 0.00 -0.51 0.00 0.00 35.03 33.02 2ost n LYS 121 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 2ost n ARG 122 N -0.51 0.00 -0.94 1.97 3.00 -1.26 -4.88 116.66 114.03 2ost n ARG 122 Ca 0.38 0.00 -0.33 0.00 -0.01 0.00 0.00 57.85 57.89 2ost n ARG 122 Cb 1.20 -0.44 0.12 0.00 0.00 0.00 0.00 32.46 33.34 2ost n ARG 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2ost n GLN 123 N 0.00 -0.08 -1.55 5.56 0.00 -1.26 -4.80 117.38 115.24 2ost n GLN 123 Ca 0.00 0.03 -0.42 0.00 0.00 0.00 0.00 57.00 56.62 2ost n GLN 123 Cb 0.00 -2.06 -0.04 0.00 0.00 0.00 0.00 30.24 28.14 2ost n GLN 123 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.06 179.95 2ost n ARG 124 N -2.23 1.41 -2.22 2.61 -4.01 -1.26 -4.92 116.66 106.05 2ost n ARG 124 Ca 0.10 0.28 -0.41 0.00 -1.04 0.00 0.00 57.85 56.78 2ost n ARG 124 Cb 0.52 -3.11 -0.03 0.00 -3.04 0.00 0.00 32.46 26.80 2ost n ARG 124 CO 0.00 0.00 0.00 -1.59 -3.04 0.00 0.00 177.63 173.00 2ost s LYS 125 N 7.13 4.40 1.24 2.89 -2.85 -1.26 -4.99 119.74 126.30 2ost s LYS 125 Ca 1.03 2.06 -0.17 0.00 -1.00 0.00 0.00 55.97 57.89 2ost s LYS 125 Cb -0.40 -3.18 0.27 0.00 -2.06 0.00 0.00 37.83 32.46 2ost s LYS 125 CO 0.35 -0.21 0.70 -2.30 0.10 0.00 0.00 175.35 173.98 2ost n PRO 126 N 2.28 -2.92 -0.30 1.78 -0.02 -1.26 -4.82 135.00 129.74 2ost n PRO 126 Ca 0.05 -0.84 0.10 0.00 -2.02 0.00 0.00 63.50 60.79 2ost n PRO 126 Cb 0.43 -1.95 0.33 0.00 -0.02 0.00 0.00 33.50 32.29 2ost n PRO 126 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 2ost h ARG 127 N -2.82 0.77 -0.64 -0.52 1.12 -1.94 -2.64 114.38 107.71 2ost h ARG 127 Ca -0.53 -0.05 0.13 0.00 -1.11 0.00 0.00 59.98 58.42 2ost h ARG 127 Cb 1.30 -0.17 -0.11 0.00 -0.01 0.00 0.00 29.97 30.97 2ost h ARG 127 CO 0.39 0.51 -0.03 0.66 -3.11 0.00 0.00 179.97 178.39 2ost h SER 128 N 0.79 -0.35 -1.34 -3.80 4.64 -1.90 -2.80 113.55 108.80 2ost h SER 128 Ca 0.46 0.17 0.39 0.00 -0.47 0.00 0.00 61.79 62.34 2ost h SER 128 Cb 0.64 0.31 -0.08 0.00 -0.31 0.00 0.00 62.40 62.96 2ost h SER 128 CO -0.23 -0.14 0.94 0.15 -0.87 0.00 0.00 176.83 176.68 2ost h PHE 129 N 0.09 0.21 0.00 4.77 3.04 -1.78 0.25 116.94 123.51 2ost h PHE 129 Ca 0.33 0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.29 2ost h PHE 129 Cb 0.54 -0.06 0.00 0.00 2.56 0.00 0.00 35.95 39.00 2ost h PHE 129 CO -0.40 -0.03 0.00 0.41 -2.02 0.00 0.00 178.31 176.27 2ost n GLY 130 N -1.71 -0.79 1.35 2.40 0.00 -1.06 -2.27 105.19 103.12 2ost n GLY 130 Ca 0.31 0.06 0.05 0.00 0.00 0.00 0.00 46.02 46.44 2ost n GLY 130 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2ost n TYR 131 N -1.80 1.50 -1.94 1.61 4.02 0.08 -4.86 117.16 115.77 2ost n TYR 131 Ca 0.01 -0.96 -0.42 0.00 -0.01 0.00 0.00 57.90 56.51 2ost n TYR 131 Cb 0.07 -0.44 -0.03 0.00 -0.02 0.00 0.00 39.34 38.92 2ost n TYR 131 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 2ost s ARG 132 N -2.89 4.18 -0.43 -0.72 1.81 -0.96 -2.28 118.95 117.65 2ost s ARG 132 Ca 0.48 2.29 0.00 0.00 -1.72 0.00 0.00 55.73 56.77 2ost s ARG 132 Cb 0.38 -3.96 0.00 0.00 -0.45 0.00 0.00 34.95 30.92 2ost s ARG 132 CO 0.11 -0.85 0.00 0.39 -0.68 0.00 0.00 175.30 174.27 2ost n GLU 133 N 6.99 -2.48 -0.94 3.54 4.71 -0.65 -4.78 120.64 127.03 2ost n GLU 133 Ca 0.17 0.25 -0.19 0.00 -0.01 0.00 0.00 57.16 57.38 2ost n GLU 133 Cb 0.42 -4.73 -0.10 0.00 -1.01 0.00 0.00 31.44 26.03 2ost n GLU 133 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2ost n ALA 134 N -2.13 5.91 0.34 0.62 0.00 -1.24 -4.51 120.51 119.50 2ost n ALA 134 Ca -0.06 -2.08 0.10 0.00 0.00 0.00 0.00 53.44 51.40 2ost n ALA 134 Cb 0.49 -2.67 0.46 0.00 0.00 0.00 0.00 19.45 17.73 2ost n ALA 134 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 2ost n TRP 135 N 3.05 0.63 0.21 0.00 7.02 -1.26 -1.61 117.44 125.48 2ost n TRP 135 Ca 0.48 0.27 0.05 0.00 -1.02 0.00 0.00 57.50 57.27 2ost n TRP 135 Cb 0.55 -0.93 0.45 0.00 -2.42 0.00 0.00 31.31 28.96 2ost n TRP 135 CO 0.00 0.00 0.00 1.12 -2.02 0.00 0.00 177.69 176.79 2ost h HIS 136 N 0.00 0.00 -0.64 -5.99 2.07 -1.99 -2.79 115.15 105.81 2ost h HIS 136 Ca 0.00 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.50 2ost h HIS 136 Cb 0.26 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 30.21 2ost h HIS 136 CO 0.00 0.28 0.33 -0.07 -3.07 0.00 0.00 177.93 175.40 2ost h LEU 137 N 0.00 0.81 -0.06 6.12 3.38 -1.69 0.59 115.31 124.45 2ost h LEU 137 Ca -0.00 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 2ost h LEU 137 Cb 0.52 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 2ost h LEU 137 CO 0.04 0.67 0.02 0.40 0.09 0.00 0.00 178.44 179.66 2ost h ILE 138 N 0.90 1.16 -0.88 1.22 1.08 -1.66 -1.87 117.51 117.46 2ost h ILE 138 Ca 0.23 -0.49 -0.01 0.00 -0.39 0.00 0.00 64.86 64.19 2ost h ILE 138 Cb 0.06 1.38 -0.04 0.00 -3.07 0.00 0.00 36.82 35.16 2ost h ILE 138 CO -0.03 0.14 0.50 0.25 -0.69 0.00 0.00 178.15 178.31 2ost h LEU 139 N -0.09 1.09 0.61 1.44 6.46 -1.17 -1.35 115.31 122.29 2ost h LEU 139 Ca 0.02 -0.09 -0.03 0.00 -0.12 0.00 0.00 57.88 57.66 2ost h LEU 139 Cb 0.20 -0.28 0.01 0.00 -0.73 0.00 0.00 40.66 39.86 2ost h LEU 139 CO -0.00 0.86 -0.29 1.56 -0.62 0.00 0.00 178.44 179.94 2ost h GLN 140 N 1.23 -0.79 -0.30 1.25 4.20 0.22 -0.04 115.11 120.87 2ost h GLN 140 Ca 0.31 0.05 0.09 0.00 0.06 0.00 0.00 58.65 59.16 2ost h GLN 140 Cb 0.00 0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 2ost h GLN 140 CO -0.05 -0.48 0.24 -0.22 -0.67 0.00 0.00 178.83 177.65 2ost h LYS 141 N -0.98 0.00 -0.06 1.46 3.11 -1.26 0.21 116.57 119.04 2ost h LYS 141 Ca -0.08 0.00 -0.07 0.00 -2.81 0.00 0.00 60.65 57.69 2ost h LYS 141 Cb 0.68 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.91 2ost h LYS 141 CO 0.14 0.00 -0.23 0.78 -2.81 0.00 0.00 179.45 177.32 2ost h GLY 142 N 0.00 0.30 1.41 5.01 0.00 -0.93 -2.06 103.07 106.79 2ost h GLY 142 Ca 0.14 -0.40 -0.12 0.00 0.00 0.00 0.00 47.33 46.95 2ost h GLY 142 CO -0.00 0.36 -0.29 0.00 0.00 0.00 0.00 176.54 176.60 2ost h ALA 143 N 0.43 0.89 0.00 3.60 0.00 -0.13 -2.96 119.26 121.09 2ost h ALA 143 Ca -0.01 -0.39 -0.07 0.00 0.00 0.00 0.00 54.91 54.43 2ost h ALA 143 Cb 0.87 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2ost h ALA 143 CO 0.05 0.63 -0.35 0.00 0.00 0.00 0.00 179.25 179.57 2ost h ALA 144 N 1.10 1.31 0.00 0.00 0.00 -0.68 -2.88 119.26 118.11 2ost h ALA 144 Ca 0.07 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 2ost h ALA 144 Cb 0.79 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 2ost h ALA 144 CO 0.06 0.44 -0.12 0.37 0.00 0.00 0.00 179.25 180.00 2ost h GLN 145 N 0.00 0.00 0.00 0.00 5.75 -1.19 -2.30 115.11 117.37 2ost h GLN 145 Ca -0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2ost h GLN 145 Cb 0.66 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.21 2ost h GLN 145 CO 0.05 0.12 0.00 0.87 -2.65 0.00 0.00 178.83 177.22 2ost h LYS 146 N 0.00 0.00 0.00 1.69 1.57 -1.56 -3.21 116.57 115.06 2ost h LYS 146 Ca -0.00 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.67 2ost h LYS 146 Cb 0.49 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.78 2ost h LYS 146 CO 0.02 0.00 -0.50 0.93 -0.57 0.00 0.00 179.45 179.32 2ost h GLU 147 N 0.00 0.00 0.00 3.15 3.07 -1.53 -2.89 114.58 116.38 2ost h GLU 147 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2ost h GLU 147 Cb 0.75 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.66 2ost h GLU 147 CO 0.00 0.50 0.00 1.15 -1.40 0.00 0.00 179.01 179.26 2ost h THR 148 N 0.00 0.00 0.00 1.13 2.02 -1.66 -3.53 112.91 110.87 2ost h THR 148 Ca -0.01 -0.53 0.00 0.00 0.77 0.00 0.00 66.41 66.64 2ost h THR 148 Cb 1.00 1.46 0.00 0.00 -1.74 0.00 0.00 68.15 68.87 2ost h THR 148 CO 0.07 0.00 0.00 -1.20 0.37 0.00 0.00 175.52 174.76