#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ost n SER 2 N 0.00 1.37 0.00 1.61 7.64 -1.26 -4.24 113.62 118.74 2ost n SER 2 Ca 0.00 0.38 0.00 0.00 1.01 0.00 0.00 58.87 60.26 2ost n SER 2 Cb 0.00 -1.11 0.00 0.00 -1.01 0.00 0.00 64.21 62.09 2ost n SER 2 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 2ost n THR 3 N 7.09 0.00 0.15 0.44 5.66 -1.26 -1.81 114.28 124.55 2ost n THR 3 Ca 0.50 0.00 0.05 0.00 -3.05 0.00 0.00 64.05 61.55 2ost n THR 3 Cb 0.13 0.00 0.51 0.00 -1.55 0.00 0.00 70.33 69.42 2ost n THR 3 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 175.07 172.13 2ost h LYS 4 N 0.00 0.20 -0.53 1.09 1.57 -2.00 -1.74 116.57 115.16 2ost h LYS 4 Ca 0.00 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 2ost h LYS 4 Cb 0.00 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 2ost h LYS 4 CO 0.00 0.20 0.29 1.25 -0.57 0.00 0.00 179.45 180.63 2ost h LEU 5 N 0.20 0.65 -0.43 2.94 5.85 -1.60 -1.54 115.31 121.38 2ost h LEU 5 Ca 0.05 -0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.68 2ost h LEU 5 Cb 0.11 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 2ost h LEU 5 CO -0.00 0.55 0.26 0.50 -0.34 0.00 0.00 178.44 179.41 2ost h LYS 6 N 0.70 0.58 -0.49 1.25 3.64 -1.50 -2.00 116.57 118.75 2ost h LYS 6 Ca 0.19 -0.05 0.05 0.00 -1.27 0.00 0.00 60.65 59.56 2ost h LYS 6 Cb 0.04 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 31.69 2ost h LYS 6 CO -0.03 0.43 0.23 0.78 -2.27 0.00 0.00 179.45 178.59 2ost h GLY 7 N 0.56 0.68 1.71 5.01 0.00 -1.29 -2.45 103.07 107.29 2ost h GLY 7 Ca 0.15 -0.16 -0.02 0.00 0.00 0.00 0.00 47.33 47.30 2ost h GLY 7 CO -0.03 0.09 0.06 -0.55 0.00 0.00 0.00 176.54 176.11 2ost h ASP 8 N 0.46 0.33 0.15 0.19 3.32 -0.90 0.55 116.42 120.52 2ost h ASP 8 Ca 0.22 -0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.22 2ost h ASP 8 Cb 0.15 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.61 2ost h ASP 8 CO -0.17 0.35 -0.07 0.40 -1.72 0.00 0.00 179.24 178.03 2ost h ILE 9 N 0.37 0.97 -0.52 0.35 2.04 -0.93 -0.17 117.51 119.62 2ost h ILE 9 Ca 0.09 -0.52 0.07 0.00 1.00 0.00 0.00 64.86 65.50 2ost h ILE 9 Cb 0.16 1.29 -0.06 0.00 -0.74 0.00 0.00 36.82 37.47 2ost h ILE 9 CO -0.00 0.12 0.19 0.00 0.00 0.00 0.00 178.15 178.46 2ost h ALA 10 N 0.36 0.64 -0.85 1.87 0.00 -0.99 0.10 119.26 120.39 2ost h ALA 10 Ca -0.02 0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.99 2ost h ALA 10 Cb 0.35 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 2ost h ALA 10 CO 0.03 -0.20 0.55 0.37 0.00 0.00 0.00 179.25 180.00 2ost h GLN 11 N 0.37 1.04 -0.56 0.00 4.15 -0.84 -0.66 115.11 118.61 2ost h GLN 11 Ca 0.25 -0.06 -0.10 0.00 0.77 0.00 0.00 58.65 59.51 2ost h GLN 11 Cb 0.27 -0.23 -0.02 0.00 0.21 0.00 0.00 27.48 27.70 2ost h GLN 11 CO -0.25 0.69 -0.04 0.37 -1.93 0.00 0.00 178.83 177.67 2ost h GLN 12 N 1.07 1.03 -0.44 1.69 5.75 -0.16 -2.19 115.11 121.85 2ost h GLN 12 Ca 0.34 -0.35 0.00 0.00 -0.15 0.00 0.00 58.65 58.49 2ost h GLN 12 Cb 0.00 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 28.45 2ost h GLN 12 CO -0.11 1.04 0.28 0.00 -2.65 0.00 0.00 178.83 177.38 2ost h ALA 13 N 0.95 0.56 -0.44 3.38 0.00 -0.14 -2.04 119.26 121.53 2ost h ALA 13 Ca 0.15 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.10 2ost h ALA 13 Cb 0.60 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.15 2ost h ALA 13 CO 0.04 0.02 0.06 0.00 0.00 0.00 0.00 179.25 179.37 2ost h ALA 14 N 1.15 0.46 -0.50 0.00 0.00 -0.99 -2.50 119.26 116.88 2ost h ALA 14 Ca 0.16 0.10 0.07 0.00 0.00 0.00 0.00 54.91 55.24 2ost h ALA 14 Cb -0.05 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.83 2ost h ALA 14 CO -0.03 -0.34 0.16 0.82 0.00 0.00 0.00 179.25 179.86 2ost h ILE 15 N 0.19 0.80 -0.90 0.00 2.04 -0.74 -1.82 117.51 117.08 2ost h ILE 15 Ca 0.22 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 65.95 2ost h ILE 15 Cb 0.29 0.45 -0.04 0.00 -0.74 0.00 0.00 36.82 36.77 2ost h ILE 15 CO -0.30 0.06 0.52 0.24 0.00 0.00 0.00 178.15 178.66 2ost h MET 16 N 0.33 1.25 -0.50 2.37 2.86 -1.02 -1.83 114.93 118.38 2ost h MET 16 Ca 0.24 -0.13 0.01 0.00 -2.06 0.00 0.00 59.70 57.76 2ost h MET 16 Cb 0.28 -0.25 -0.03 0.00 0.06 0.00 0.00 31.60 31.66 2ost h MET 16 CO -0.26 0.89 0.32 0.00 1.06 0.00 0.00 176.91 178.92 2ost h ARG 17 N 1.26 0.64 -0.52 1.72 2.47 -0.93 -1.40 114.38 117.61 2ost h ARG 17 Ca 0.32 -0.04 -0.07 0.00 -1.26 0.00 0.00 59.98 58.93 2ost h ARG 17 Cb -0.01 -0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.15 2ost h ARG 17 CO -0.06 0.42 0.04 0.00 0.56 0.00 0.00 179.97 180.94 2ost h ALA 18 N 1.19 1.08 -0.47 0.04 0.00 -0.99 -2.44 119.26 117.68 2ost h ALA 18 Ca 0.19 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 2ost h ALA 18 Cb -0.06 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2ost h ALA 18 CO -0.05 0.59 -0.17 -0.07 0.00 0.00 0.00 179.25 179.54 2ost h LEU 19 N 0.81 0.93 -1.50 0.00 3.38 -1.00 -0.15 115.31 117.77 2ost h LEU 19 Ca 0.16 -0.33 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 2ost h LEU 19 Cb 0.43 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 2ost h LEU 19 CO 0.01 1.08 -0.21 0.11 0.09 0.00 0.00 178.44 179.52 2ost h LYS 20 N 0.81 0.00 -0.64 1.13 1.57 -1.03 -1.55 116.57 116.86 2ost h LYS 20 Ca 0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 2ost h LYS 20 Cb 0.72 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.03 2ost h LYS 20 CO 0.06 0.21 0.00 -1.33 -0.57 0.00 0.00 179.45 177.82 2ost n MET 21 N -3.64 3.55 -1.12 3.15 2.81 -0.94 -4.94 117.12 116.00 2ost n MET 21 Ca -0.01 -2.39 -0.04 0.00 -1.81 0.00 0.00 57.70 53.44 2ost n MET 21 Cb 0.34 -1.90 -0.02 0.00 -0.71 0.00 0.00 33.22 30.93 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 0.81 0.54 3.84 3.03 0.00 -0.58 -4.99 105.19 107.84 2ost n GLY 22 Ca 0.21 -0.11 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.68 3.38 0.48 1.61 0.51 -0.10 -4.91 118.94 118.22 2ost s TRP 23 Ca 0.00 1.45 -0.20 0.00 -2.12 0.00 0.00 56.10 55.23 2ost s TRP 23 Cb 0.00 -2.75 -0.09 0.00 -0.81 0.00 0.00 33.47 29.83 2ost s TRP 23 CO 0.00 -0.15 1.02 0.20 -0.51 0.00 0.00 176.95 177.51 2ost s GLY 24 N -2.54 2.44 -0.10 0.98 0.00 -0.37 -4.27 107.32 103.46 2ost s GLY 24 Ca 0.59 0.53 0.02 0.00 0.00 0.00 0.00 44.72 45.87 2ost s GLY 24 CO 0.21 0.84 -0.17 0.14 0.00 0.00 0.00 173.10 174.12 2ost s VAL 25 N -2.08 1.60 -0.15 1.40 1.01 -1.26 -1.16 120.40 119.76 2ost s VAL 25 Ca 0.66 -0.72 -0.00 0.00 0.00 0.00 0.00 61.98 61.91 2ost s VAL 25 Cb -0.14 -1.43 -0.01 0.00 0.00 0.00 0.00 36.38 34.80 2ost s VAL 25 CO 0.20 0.46 -0.14 -0.76 0.00 0.00 0.00 175.10 174.86 2ost s LEU 26 N 0.75 2.58 -0.19 3.92 2.01 -0.50 -4.99 118.68 122.27 2ost s LEU 26 Ca -0.11 -0.42 -0.13 0.00 0.01 0.00 0.00 54.13 53.48 2ost s LEU 26 Cb -0.16 -1.59 -0.05 0.00 0.01 0.00 0.00 46.19 44.40 2ost s LEU 26 CO 0.02 0.10 0.25 -0.54 1.01 0.00 0.00 176.35 177.19 2ost s LYS 27 N 0.76 4.20 0.85 1.70 1.02 -1.26 -2.66 119.74 124.35 2ost s LYS 27 Ca -0.06 -0.01 -0.12 0.00 0.02 0.00 0.00 55.97 55.81 2ost s LYS 27 Cb -0.15 -3.46 0.10 0.00 -0.52 0.00 0.00 37.83 33.80 2ost s LYS 27 CO 0.01 0.18 1.10 -1.25 -0.92 0.00 0.00 175.35 174.47 2ost s PRO 28 N 0.67 1.62 -0.54 -1.68 0.04 -1.26 -5.02 135.00 128.82 2ost s PRO 28 Ca 0.14 0.66 -0.08 0.00 0.04 0.00 0.00 61.00 61.75 2ost s PRO 28 Cb -0.13 -1.86 0.14 0.00 0.04 0.00 0.00 34.50 32.69 2ost s PRO 28 CO 0.03 -1.95 0.41 -1.17 0.04 0.00 0.00 177.00 174.36 2ost s LEU 29 N -5.99 5.74 0.00 -3.56 2.96 -1.26 -4.95 118.68 111.61 2ost s LEU 29 Ca 0.62 -2.18 0.00 0.00 -0.22 0.00 0.00 54.13 52.35 2ost s LEU 29 Cb -0.16 -2.00 0.00 0.00 0.50 0.00 0.00 46.19 44.53 2ost s LEU 29 CO 0.55 -0.62 0.00 0.61 -1.32 0.00 0.00 176.35 175.57 2ost n GLY 30 N 4.53 1.33 3.40 7.98 0.00 -1.26 -4.80 105.19 116.36 2ost n GLY 30 Ca -0.02 -1.48 -0.35 0.00 0.00 0.00 0.00 46.02 44.17 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 -0.13 2.90 0.00 1.61 9.92 -1.26 -4.02 116.55 125.58 2ost n ASP 31 Ca 0.00 -2.70 0.00 0.00 -0.53 0.00 0.00 54.79 51.56 2ost n ASP 31 Cb 0.00 -1.49 0.00 0.00 -0.64 0.00 0.00 41.12 38.99 2ost n ASP 31 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 2ost n ARG 32 N 7.79 1.07 -3.04 -1.24 0.63 -1.26 -5.09 116.66 115.52 2ost n ARG 32 Ca 0.47 0.00 -0.28 0.00 -0.92 0.00 0.00 57.85 57.12 2ost n ARG 32 Cb 0.44 -0.64 -0.02 0.00 0.45 0.00 0.00 32.46 32.69 2ost n ARG 32 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2ost s LEU 33 N -1.92 3.89 -0.02 6.15 1.43 -1.26 -4.98 118.68 121.97 2ost s LEU 33 Ca 0.00 0.86 0.01 0.00 -1.03 0.00 0.00 54.13 53.98 2ost s LEU 33 Cb 0.00 -3.74 0.07 0.00 0.03 0.00 0.00 46.19 42.55 2ost s LEU 33 CO 0.00 -0.35 0.65 -1.54 0.23 0.00 0.00 176.35 175.33 2ost n SER 34 N -1.43 1.30 -3.88 2.29 3.41 -1.26 -4.75 113.62 109.30 2ost n SER 34 Ca -0.00 -2.07 -0.10 0.00 -0.26 0.00 0.00 58.87 56.43 2ost n SER 34 Cb 0.54 -0.47 -0.09 0.00 -0.26 0.00 0.00 64.21 63.93 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 -1.22 0.08 -0.13 7.33 1.13 -1.26 -4.70 117.35 118.59 2ost s TYR 35 Ca 0.05 -0.27 0.16 0.00 -1.41 0.00 0.00 57.07 55.60 2ost s TYR 35 Cb 0.03 -0.07 -0.23 0.00 -1.10 0.00 0.00 41.96 40.59 2ost s TYR 35 CO 0.01 -0.35 0.40 -0.25 -2.51 0.00 0.00 175.55 172.85 2ost n ASP 36 N 1.05 0.41 -3.92 -0.18 8.00 -0.57 -4.92 116.55 116.42 2ost n ASP 36 Ca -0.21 0.19 -0.09 0.00 0.71 0.00 0.00 54.79 55.39 2ost n ASP 36 Cb 0.57 0.60 -0.07 0.00 -0.02 0.00 0.00 41.12 42.21 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 -5.66 0.87 -0.01 0.64 1.43 -0.64 -4.42 118.68 110.90 2ost s LEU 37 Ca -0.07 -0.80 -0.01 0.00 -1.03 0.00 0.00 54.13 52.22 2ost s LEU 37 Cb 0.08 1.31 0.00 0.00 0.03 0.00 0.00 46.19 47.61 2ost s LEU 37 CO 0.83 -0.90 0.03 0.68 0.23 0.00 0.00 176.35 177.22 2ost s VAL 38 N -3.94 0.01 -0.19 -1.59 -7.23 -1.09 0.01 120.40 106.37 2ost s VAL 38 Ca 0.15 -0.04 -0.05 0.00 -1.81 0.00 0.00 61.98 60.23 2ost s VAL 38 Cb 0.03 -0.07 -0.03 0.00 0.56 0.00 0.00 36.38 36.87 2ost s VAL 38 CO -0.01 -0.02 -0.00 -0.36 -0.31 0.00 0.00 175.10 174.39 2ost s PHE 39 N -0.06 3.05 -0.96 2.82 0.08 -0.82 -1.40 117.98 120.69 2ost s PHE 39 Ca -0.01 -0.37 -0.24 0.00 0.12 0.00 0.00 56.93 56.43 2ost s PHE 39 Cb -0.01 -2.06 0.04 0.00 -0.57 0.00 0.00 43.02 40.43 2ost s PHE 39 CO 0.00 -0.16 1.42 0.34 -0.10 0.00 0.00 175.22 176.73 2ost s ASP 40 N 0.80 6.41 -0.41 1.36 -1.08 -0.31 -1.68 116.67 121.76 2ost s ASP 40 Ca 0.00 -1.24 -0.22 0.00 -0.52 0.00 0.00 52.55 50.57 2ost s ASP 40 Cb -0.14 -2.57 0.02 0.00 -1.46 0.00 0.00 42.92 38.77 2ost s ASP 40 CO 0.02 -1.59 0.72 0.68 0.52 0.00 0.00 175.17 175.52 2ost s VAL 41 N 5.20 4.76 -1.14 1.11 -7.23 0.55 -1.23 120.40 122.41 2ost s VAL 41 Ca 0.44 0.47 -0.11 0.00 -1.81 0.00 0.00 61.98 60.97 2ost s VAL 41 Cb -0.02 -4.22 0.11 0.00 0.56 0.00 0.00 36.38 32.81 2ost s VAL 41 CO -0.05 -0.55 0.28 1.21 -0.31 0.00 0.00 175.10 175.68 2ost n GLU 42 N 6.42 -0.85 0.00 4.82 4.07 -1.26 -0.76 120.64 133.07 2ost n GLU 42 Ca 0.01 0.08 0.00 0.00 -0.06 0.00 0.00 57.16 57.19 2ost n GLU 42 Cb 0.48 -2.80 0.00 0.00 -0.06 0.00 0.00 31.44 29.06 2ost n GLU 42 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2ost n GLY 43 N -1.14 3.44 3.90 8.31 0.00 -1.26 -5.07 105.19 113.37 2ost n GLY 43 Ca 0.00 -1.02 -0.28 0.00 0.00 0.00 0.00 46.02 44.72 2ost n GLY 43 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2ost s ILE 44 N 0.00 5.01 -0.13 -0.61 -4.36 0.06 -5.02 121.20 116.15 2ost s ILE 44 Ca 0.00 0.07 -0.03 0.00 -0.26 0.00 0.00 60.65 60.43 2ost s ILE 44 Cb 0.00 -3.74 -0.03 0.00 1.25 0.00 0.00 42.46 39.94 2ost s ILE 44 CO 0.00 -0.36 -0.01 -0.76 0.24 0.00 0.00 174.94 174.05 2ost s LEU 45 N -3.63 3.43 -0.16 0.37 1.43 -1.26 -0.33 118.68 118.54 2ost s LEU 45 Ca 0.44 -0.01 -0.01 0.00 -1.03 0.00 0.00 54.13 53.53 2ost s LEU 45 Cb -0.11 -1.82 0.04 0.00 0.03 0.00 0.00 46.19 44.34 2ost s LEU 45 CO 0.31 0.25 -0.05 -0.76 0.23 0.00 0.00 176.35 176.32 2ost s LEU 46 N -0.09 1.50 0.39 1.79 1.43 -0.68 -4.94 118.68 118.07 2ost s LEU 46 Ca 0.03 -0.60 -0.27 0.00 -1.03 0.00 0.00 54.13 52.27 2ost s LEU 46 Cb -0.13 -0.87 -0.10 0.00 0.03 0.00 0.00 46.19 45.12 2ost s LEU 46 CO 0.02 -0.18 1.37 -0.54 0.23 0.00 0.00 176.35 177.25 2ost s LYS 47 N 1.66 4.05 -0.05 1.70 1.02 -1.26 -1.94 119.74 124.93 2ost s LYS 47 Ca 0.01 2.32 0.01 0.00 0.02 0.00 0.00 55.97 58.34 2ost s LYS 47 Cb -0.15 -2.87 0.02 0.00 -0.52 0.00 0.00 37.83 34.31 2ost s LYS 47 CO -0.08 -0.48 -0.06 0.08 -0.92 0.00 0.00 175.35 173.89 2ost s VAL 48 N -1.19 0.65 -0.20 3.17 1.01 0.10 -1.32 120.40 122.63 2ost s VAL 48 Ca 0.55 -0.19 -0.09 0.00 0.00 0.00 0.00 61.98 62.24 2ost s VAL 48 Cb -0.42 -0.65 -0.05 0.00 0.00 0.00 0.00 36.38 35.26 2ost s VAL 48 CO 0.55 0.25 0.11 -1.58 0.00 0.00 0.00 175.10 174.43 2ost s GLN 49 N 0.87 4.13 -0.13 2.72 2.00 -0.11 -1.51 119.66 127.64 2ost s GLN 49 Ca -0.12 -0.25 -0.02 0.00 -2.00 0.00 0.00 55.36 52.97 2ost s GLN 49 Cb -0.15 -3.37 -0.02 0.00 0.80 0.00 0.00 33.01 30.27 2ost s GLN 49 CO 0.01 0.29 -0.07 0.08 -0.50 0.00 0.00 175.29 175.10 2ost s VAL 50 N 0.38 3.64 -0.02 1.34 1.01 -1.26 -1.03 120.40 124.46 2ost s VAL 50 Ca 0.07 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.61 2ost s VAL 50 Cb -0.11 -2.56 0.00 0.00 0.00 0.00 0.00 36.38 33.71 2ost s VAL 50 CO -0.01 0.52 -0.08 -0.54 0.00 0.00 0.00 175.10 174.99 2ost s LYS 51 N 0.12 0.82 -0.12 2.72 1.02 -0.78 -4.97 119.74 118.56 2ost s LYS 51 Ca -0.03 -0.26 -0.13 0.00 0.02 0.00 0.00 55.97 55.57 2ost s LYS 51 Cb -0.14 -0.79 -0.05 0.00 -0.52 0.00 0.00 37.83 36.34 2ost s LYS 51 CO 0.03 0.10 0.30 0.45 -0.92 0.00 0.00 175.35 175.32 2ost s SER 52 N 0.17 6.53 0.38 2.83 0.15 -1.26 -1.68 113.70 120.81 2ost s SER 52 Ca -0.02 0.62 -0.01 0.00 0.70 0.00 0.00 55.95 57.23 2ost s SER 52 Cb -0.08 -2.19 -0.03 0.00 -1.71 0.00 0.00 66.02 62.01 2ost s SER 52 CO 0.00 0.19 0.61 -0.94 1.20 0.00 0.00 173.24 174.30 2ost s SER 53 N -0.10 6.30 -0.02 5.45 1.04 -0.64 -4.88 113.70 120.84 2ost s SER 53 Ca 0.18 0.59 0.05 0.00 0.48 0.00 0.00 55.95 57.25 2ost s SER 53 Cb -0.14 -2.09 -0.01 0.00 0.10 0.00 0.00 66.02 63.88 2ost s SER 53 CO 0.06 -0.36 -0.19 -1.66 0.98 0.00 0.00 173.24 172.08 2ost s TRP 54 N -2.41 1.73 0.02 5.02 -2.14 -1.08 -4.79 118.94 115.29 2ost s TRP 54 Ca 0.42 -0.38 -0.30 0.00 2.66 0.00 0.00 56.10 58.50 2ost s TRP 54 Cb -0.10 -1.13 -0.06 0.00 -3.10 0.00 0.00 33.47 29.09 2ost s TRP 54 CO 0.38 -0.07 1.35 0.21 -2.66 0.00 0.00 176.95 176.16 2ost s LYS 55 N -0.32 4.32 0.06 3.25 2.20 -1.26 -1.41 119.74 126.57 2ost s LYS 55 Ca 0.04 1.92 -0.30 0.00 -0.36 0.00 0.00 55.97 57.27 2ost s LYS 55 Cb -0.09 -3.49 -0.04 0.00 -1.51 0.00 0.00 37.83 32.70 2ost s LYS 55 CO 0.00 -0.50 0.98 0.45 -0.36 0.00 0.00 175.35 175.92 2ost s SER 56 N 1.60 7.42 0.11 1.43 0.15 0.36 -4.96 113.70 119.82 2ost s SER 56 Ca 0.62 1.74 -0.27 0.00 0.70 0.00 0.00 55.95 58.74 2ost s SER 56 Cb -0.31 -2.58 -0.09 0.00 -1.71 0.00 0.00 66.02 61.33 2ost s SER 56 CO 0.27 -0.17 1.64 -0.08 1.20 0.00 0.00 173.24 176.10 2ost h GLU 57 N 6.19 -0.46 0.04 5.44 4.81 -1.94 -2.48 114.58 126.18 2ost h GLU 57 Ca -0.42 0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 58.84 2ost h GLU 57 Cb 1.22 0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.70 2ost h GLU 57 CO 0.74 -0.30 -0.02 1.57 -0.73 0.00 0.00 179.01 180.26 2ost h LYS 58 N -0.47 -0.05 0.00 1.92 2.10 -1.97 -3.36 116.57 114.73 2ost h LYS 58 Ca 0.03 0.00 -0.09 0.00 -2.00 0.00 0.00 60.65 58.59 2ost h LYS 58 Cb 0.49 0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 31.82 2ost h LYS 58 CO -0.14 0.61 -0.41 1.79 -2.00 0.00 0.00 179.45 179.30 2ost h THR 59 N -0.87 1.01 -0.67 0.07 1.35 -2.00 -3.47 112.91 108.33 2ost h THR 59 Ca -0.01 -1.56 -0.07 0.00 -0.55 0.00 0.00 66.41 64.23 2ost h THR 59 Cb 0.68 1.91 0.00 0.00 -1.73 0.00 0.00 68.15 69.02 2ost h THR 59 CO 0.01 0.40 -0.09 0.61 -0.25 0.00 0.00 175.52 176.20 2ost n GLY 60 N 0.12 0.29 3.30 5.82 0.00 -0.93 -5.05 105.19 108.73 2ost n GLY 60 Ca -0.01 -0.71 -0.09 0.00 0.00 0.00 0.00 46.02 45.21 2ost n GLY 60 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ost s ASN 61 N -2.87 0.07 0.07 1.61 4.22 -1.25 -4.84 114.94 111.95 2ost s ASN 61 Ca 0.01 -0.86 -0.15 0.00 -2.14 0.00 0.00 52.86 49.73 2ost s ASN 61 Cb -0.01 0.41 -0.06 0.00 1.28 0.00 0.00 41.25 42.87 2ost s ASN 61 CO 0.02 -0.85 0.48 -0.31 -2.04 0.00 0.00 177.10 174.39 2ost s TYR 62 N -3.96 3.69 -0.03 1.54 2.02 -0.98 -0.48 117.35 119.15 2ost s TYR 62 Ca 0.16 1.03 -0.03 0.00 -0.37 0.00 0.00 57.07 57.86 2ost s TYR 62 Cb 0.04 -2.33 0.01 0.00 -0.40 0.00 0.00 41.96 39.28 2ost s TYR 62 CO -0.02 0.56 0.08 0.54 -1.57 0.00 0.00 175.55 175.14 2ost s VAL 63 N -1.24 -0.00 0.38 0.71 0.11 -0.50 -0.25 120.40 119.61 2ost s VAL 63 Ca 0.30 0.01 0.08 0.00 -2.93 0.00 0.00 61.98 59.44 2ost s VAL 63 Cb -0.16 -0.12 -0.06 0.00 -1.53 0.00 0.00 36.38 34.51 2ost s VAL 63 CO 0.17 0.01 0.08 0.68 -3.33 0.00 0.00 175.10 172.70 2ost s VAL 64 N 0.13 2.39 0.10 2.04 -7.23 -1.01 -2.63 120.40 114.18 2ost s VAL 64 Ca -0.01 -1.87 0.08 0.00 -1.81 0.00 0.00 61.98 58.37 2ost s VAL 64 Cb -0.01 -2.91 -0.03 0.00 0.56 0.00 0.00 36.38 33.98 2ost s VAL 64 CO -0.00 -0.09 -0.21 -0.62 -0.31 0.00 0.00 175.10 173.87 2ost s ASP 65 N -3.79 2.54 -0.21 4.85 -1.08 -1.26 -0.40 116.67 117.32 2ost s ASP 65 Ca 0.37 -0.68 0.14 0.00 -0.52 0.00 0.00 52.55 51.86 2ost s ASP 65 Cb 0.03 -0.14 0.50 0.00 -1.46 0.00 0.00 42.92 41.86 2ost s ASP 65 CO 0.20 0.06 1.42 -0.46 0.52 0.00 0.00 175.17 176.91 2ost n ASN 66 N 1.11 3.30 -4.42 -0.34 2.04 -1.21 -4.99 115.26 110.74 2ost n ASN 66 Ca -0.19 -3.27 -0.30 0.00 -0.44 0.00 0.00 54.58 50.37 2ost n ASN 66 Cb 0.54 -0.57 -0.13 0.00 -2.53 0.00 0.00 39.78 37.09 2ost n ASN 66 CO 0.00 0.00 0.00 -0.13 -0.44 0.00 0.00 177.26 176.69 2ost s ARG 67 N -2.98 1.88 -0.03 -3.83 0.52 -1.26 -4.28 118.95 108.98 2ost s ARG 67 Ca 0.42 -1.08 -0.00 0.00 -0.52 0.00 0.00 55.73 54.55 2ost s ARG 67 Cb 0.36 -2.09 -0.04 0.00 0.52 0.00 0.00 34.95 33.70 2ost s ARG 67 CO 0.05 0.51 0.03 1.03 0.02 0.00 0.00 175.30 176.95 2ost s ARG 68 N -1.56 2.95 0.11 3.54 0.52 -1.02 -4.97 118.95 118.52 2ost s ARG 68 Ca 0.14 -0.50 0.09 0.00 -0.52 0.00 0.00 55.73 54.94 2ost s ARG 68 Cb -0.10 -2.78 -0.04 0.00 0.52 0.00 0.00 34.95 32.55 2ost s ARG 68 CO 0.05 0.66 -0.23 0.99 0.02 0.00 0.00 175.30 176.79 2ost s THR 69 N -1.07 1.91 -0.08 0.02 2.01 -1.26 -0.88 115.64 116.28 2ost s THR 69 Ca 0.19 -1.61 -0.03 0.00 0.31 0.00 0.00 61.69 60.54 2ost s THR 69 Cb -0.12 -1.71 0.04 0.00 0.01 0.00 0.00 72.50 70.72 2ost s THR 69 CO 0.09 -0.00 0.15 -0.60 -0.69 0.00 0.00 174.62 173.57 2ost s ARG 70 N -1.95 0.04 -0.44 4.92 3.52 -0.81 -5.00 118.95 119.24 2ost s ARG 70 Ca 0.09 0.50 0.03 0.00 -0.13 0.00 0.00 55.73 56.22 2ost s ARG 70 Cb -0.10 -0.26 0.12 0.00 -1.56 0.00 0.00 34.95 33.15 2ost s ARG 70 CO 0.05 -0.27 0.18 0.99 -0.81 0.00 0.00 175.30 175.44 2ost s THR 71 N 1.96 2.20 0.62 4.11 2.01 -1.26 -1.59 115.64 123.69 2ost s THR 71 Ca -0.00 -2.77 0.07 0.00 0.31 0.00 0.00 61.69 59.30 2ost s THR 71 Cb -0.12 -2.56 0.10 0.00 0.01 0.00 0.00 72.50 69.93 2ost s THR 71 CO -0.06 -0.74 0.86 0.20 -0.69 0.00 0.00 174.62 174.19 2ost s ASN 72 N 0.31 4.86 0.17 3.53 0.01 -1.11 -5.01 114.94 117.70 2ost s ASN 72 Ca 0.15 -0.75 -0.27 0.00 -0.71 0.00 0.00 52.86 51.28 2ost s ASN 72 Cb -0.23 0.28 0.03 0.00 0.41 0.00 0.00 41.25 41.73 2ost s ASN 72 CO -0.04 -1.52 1.55 0.03 -1.51 0.00 0.00 177.10 175.61 2ost h ARG 73 N -0.04 -0.13 0.00 -0.60 2.47 -2.06 -3.27 114.38 110.75 2ost h ARG 73 Ca -0.31 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.42 2ost h ARG 73 Cb 1.28 0.03 0.00 0.00 -1.65 0.00 0.00 29.97 29.63 2ost h ARG 73 CO 0.40 -0.09 0.00 0.54 0.56 0.00 0.00 179.97 181.38 2ost n ARG 74 N -5.37 0.00 -4.45 0.04 5.12 -1.26 -5.03 116.66 105.71 2ost n ARG 74 Ca 0.03 0.48 -0.22 0.00 -1.93 0.00 0.00 57.85 56.21 2ost n ARG 74 Cb 0.33 -1.07 -0.10 0.00 -1.16 0.00 0.00 32.46 30.46 2ost n ARG 74 CO 0.00 0.00 0.00 -0.80 -1.93 0.00 0.00 177.63 174.90 2ost s ASN 75 N -2.76 2.31 -0.07 0.55 -0.87 -1.24 -5.16 114.94 107.71 2ost s ASN 75 Ca 0.00 -1.48 0.06 0.00 -1.57 0.00 0.00 52.86 49.86 2ost s ASN 75 Cb 0.00 0.16 -0.01 0.00 -0.02 0.00 0.00 41.25 41.39 2ost s ASN 75 CO 0.00 -0.74 -0.24 -0.51 -2.57 0.00 0.00 177.10 173.03 2ost s ILE 76 N -3.35 2.08 0.07 0.60 2.07 -1.26 -2.75 121.20 118.66 2ost s ILE 76 Ca 0.32 -1.05 0.04 0.00 -1.41 0.00 0.00 60.65 58.56 2ost s ILE 76 Cb 0.06 -1.76 -0.03 0.00 0.13 0.00 0.00 42.46 40.86 2ost s ILE 76 CO 0.15 0.57 -0.12 0.68 -1.91 0.00 0.00 174.94 174.31 2ost s VAL 77 N -0.05 0.92 0.08 4.00 -7.23 -0.62 -5.01 120.40 112.48 2ost s VAL 77 Ca -0.07 -1.31 0.09 0.00 -1.81 0.00 0.00 61.98 58.88 2ost s VAL 77 Cb -0.15 -1.00 -0.03 0.00 0.56 0.00 0.00 36.38 35.76 2ost s VAL 77 CO 0.05 -0.34 -0.25 -0.13 -0.31 0.00 0.00 175.10 174.12 2ost s ARG 78 N -1.91 1.71 -0.33 4.82 0.52 -1.26 -1.93 118.95 120.57 2ost s ARG 78 Ca -0.03 -1.17 0.01 0.00 -0.52 0.00 0.00 55.73 54.02 2ost s ARG 78 Cb -0.09 -1.99 0.10 0.00 0.52 0.00 0.00 34.95 33.50 2ost s ARG 78 CO 0.01 0.49 0.10 -1.12 0.02 0.00 0.00 175.30 174.81 2ost s SER 79 N -1.58 4.17 0.84 0.23 0.01 -0.06 -4.97 113.70 112.33 2ost s SER 79 Ca 0.13 -1.88 -0.11 0.00 1.31 0.00 0.00 55.95 55.39 2ost s SER 79 Cb -0.10 -1.07 0.10 0.00 0.21 0.00 0.00 66.02 65.16 2ost s SER 79 CO 0.04 -0.39 1.09 -2.16 0.41 0.00 0.00 173.24 172.24 2ost s PRO 80 N 1.29 1.69 0.12 12.44 0.04 -1.26 -2.43 135.00 146.89 2ost s PRO 80 Ca 0.11 0.77 -0.29 0.00 0.04 0.00 0.00 61.00 61.63 2ost s PRO 80 Cb -0.19 -1.86 -0.06 0.00 0.04 0.00 0.00 34.50 32.43 2ost s PRO 80 CO -0.18 -1.93 0.91 0.71 0.04 0.00 0.00 177.00 176.55 2ost s TYR 81 N -3.03 3.83 0.79 0.56 1.51 -1.26 -4.96 117.35 114.80 2ost s TYR 81 Ca 0.62 1.75 -0.12 0.00 -1.01 0.00 0.00 57.07 58.31 2ost s TYR 81 Cb -0.16 -2.98 0.07 0.00 -0.11 0.00 0.00 41.96 38.77 2ost s TYR 81 CO 0.56 0.28 1.15 1.03 -1.11 0.00 0.00 175.55 177.45 2ost s ARG 82 N -0.27 2.11 0.33 -0.62 1.81 -1.26 -4.93 118.95 116.12 2ost s ARG 82 Ca 0.44 0.27 0.05 0.00 -1.72 0.00 0.00 55.73 54.77 2ost s ARG 82 Cb -0.23 -1.95 0.57 0.00 -0.45 0.00 0.00 34.95 32.89 2ost s ARG 82 CO 0.29 -1.52 1.82 0.78 -0.68 0.00 0.00 175.30 175.99 2ost h GLY 83 N -1.01 0.46 -0.59 -3.53 0.00 -1.96 -2.75 103.07 93.68 2ost h GLY 83 Ca -0.46 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 46.55 2ost h GLY 83 CO 0.64 0.29 0.00 1.16 0.00 0.00 0.00 176.54 178.63 2ost n ASN 84 N -4.21 1.53 0.23 0.19 6.94 -1.26 -4.19 115.26 114.49 2ost n ASN 84 Ca 0.00 -1.59 0.08 0.00 -0.02 0.00 0.00 54.58 53.05 2ost n ASN 84 Cb 0.32 -0.05 0.57 0.00 -2.36 0.00 0.00 39.78 38.25 2ost n ASN 84 CO 0.00 0.00 0.00 0.44 -1.03 0.00 0.00 177.26 176.67 2ost h ASP 85 N 2.20 0.00 -0.33 0.53 3.45 -1.87 -3.46 116.42 116.94 2ost h ASP 85 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 2ost h ASP 85 Cb 0.47 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.24 2ost h ASP 85 CO 0.00 0.20 0.00 2.22 -1.57 0.00 0.00 179.24 180.09 2ost n PHE 86 N -3.91 -0.33 -0.00 4.55 -1.74 -1.26 -4.42 117.46 110.35 2ost n PHE 86 Ca -0.02 0.00 -0.00 0.00 -0.56 0.00 0.00 57.45 56.87 2ost n PHE 86 Cb 0.29 0.00 -0.00 0.00 1.52 0.00 0.00 39.48 41.29 2ost n PHE 86 CO 0.00 0.00 0.00 -0.25 -0.56 0.00 0.00 176.76 175.95 2ost n ASP 87 N -0.33 4.96 -3.87 5.98 8.00 -0.43 -4.85 116.55 126.00 2ost n ASP 87 Ca 0.00 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.40 2ost n ASP 87 Cb 0.00 0.51 -0.08 0.00 -0.02 0.00 0.00 41.12 41.53 2ost n ASP 87 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2ost s PHE 88 N -2.00 0.11 -0.12 1.24 0.40 -0.73 -3.34 117.98 113.53 2ost s PHE 88 Ca -0.00 -0.39 0.02 0.00 -0.60 0.00 0.00 56.93 55.96 2ost s PHE 88 Cb 0.00 -0.06 0.02 0.00 0.51 0.00 0.00 43.02 43.48 2ost s PHE 88 CO 0.01 -0.43 -0.16 0.00 0.70 0.00 0.00 175.22 175.33 2ost s ALA 89 N -2.81 1.81 -0.18 5.36 0.00 0.17 -0.93 121.76 125.18 2ost s ALA 89 Ca -0.03 -0.82 -0.03 0.00 0.00 0.00 0.00 51.96 51.07 2ost s ALA 89 Cb 0.00 -0.90 -0.02 0.00 0.00 0.00 0.00 23.12 22.20 2ost s ALA 89 CO -0.05 -0.14 -0.05 0.14 0.00 0.00 0.00 175.76 175.66 2ost s VAL 90 N 1.07 3.50 -0.17 0.00 -7.23 -0.20 0.03 120.40 117.40 2ost s VAL 90 Ca -0.04 -0.47 -0.08 0.00 -1.81 0.00 0.00 61.98 59.57 2ost s VAL 90 Cb -0.15 -2.55 -0.04 0.00 0.56 0.00 0.00 36.38 34.20 2ost s VAL 90 CO -0.04 0.46 0.11 0.00 -0.31 0.00 0.00 175.10 175.33 2ost s ALA 91 N 0.93 3.68 -0.14 1.32 0.00 -0.14 -1.86 121.76 125.54 2ost s ALA 91 Ca -0.01 -0.69 -0.02 0.00 0.00 0.00 0.00 51.96 51.24 2ost s ALA 91 Cb -0.15 -2.03 -0.02 0.00 0.00 0.00 0.00 23.12 20.93 2ost s ALA 91 CO 0.01 0.33 -0.08 -0.47 0.00 0.00 0.00 175.76 175.55 2ost s TYR 92 N -0.14 2.94 -0.21 0.00 5.04 -0.68 -1.51 117.35 122.79 2ost s TYR 92 Ca 0.10 -0.40 -0.08 0.00 -2.44 0.00 0.00 57.07 54.25 2ost s TYR 92 Cb -0.12 -1.89 -0.04 0.00 0.35 0.00 0.00 41.96 40.26 2ost s TYR 92 CO 0.00 -0.07 0.08 0.08 -1.34 0.00 0.00 175.55 174.30 2ost s VAL 93 N 0.25 4.73 -0.08 3.14 1.01 -0.30 -1.62 120.40 127.54 2ost s VAL 93 Ca -0.05 -0.05 -0.15 0.00 0.00 0.00 0.00 61.98 61.73 2ost s VAL 93 Cb -0.15 -3.16 -0.11 0.00 0.00 0.00 0.00 36.38 32.96 2ost s VAL 93 CO 0.04 0.41 0.53 -0.08 0.00 0.00 0.00 175.10 176.00 2ost h GLU 94 N 7.24 -0.16 -0.69 2.72 4.81 -1.87 -2.98 114.58 123.65 2ost h GLU 94 Ca -0.37 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 58.91 2ost h GLU 94 Cb 1.17 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 30.55 2ost h GLU 94 CO 0.66 0.18 0.45 1.05 -0.73 0.00 0.00 179.01 180.61 2ost h GLU 95 N -0.98 0.78 -4.79 1.92 4.11 -1.98 -3.27 114.58 110.38 2ost h GLU 95 Ca -0.02 -0.05 -0.67 0.00 0.07 0.00 0.00 59.36 58.69 2ost h GLU 95 Cb 0.42 -0.18 -0.22 0.00 0.50 0.00 0.00 28.75 29.27 2ost h GLU 95 CO 0.03 0.52 -0.56 -0.51 0.07 0.00 0.00 179.01 178.56 2ost s LEU 96 N -9.72 4.10 -0.92 3.06 1.43 -1.26 -5.00 118.68 110.37 2ost s LEU 96 Ca -0.10 -0.49 -0.25 0.00 -1.03 0.00 0.00 54.13 52.26 2ost s LEU 96 Cb 0.19 -2.01 -0.18 0.00 0.03 0.00 0.00 46.19 44.21 2ost s LEU 96 CO 0.77 -0.18 1.93 -0.62 0.23 0.00 0.00 176.35 178.48 2ost n GLU 97 N 4.99 0.94 -4.18 1.70 1.02 -1.23 -4.39 120.64 119.49 2ost n GLU 97 Ca -0.14 -1.94 -0.18 0.00 -0.02 0.00 0.00 57.16 54.88 2ost n GLU 97 Cb 0.49 -3.47 -0.15 0.00 -0.02 0.00 0.00 31.44 28.29 2ost n GLU 97 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2ost s LEU 98 N 9.45 1.65 -0.08 -4.62 2.96 -1.12 -5.03 118.68 121.89 2ost s LEU 98 Ca 0.70 -0.11 0.04 0.00 -0.22 0.00 0.00 54.13 54.54 2ost s LEU 98 Cb 0.03 -0.37 0.00 0.00 0.50 0.00 0.00 46.19 46.35 2ost s LEU 98 CO 0.18 0.01 -0.20 -0.36 -1.32 0.00 0.00 176.35 174.65 2ost s PHE 99 N 0.40 2.17 -0.14 5.38 0.40 -1.26 -1.14 117.98 123.79 2ost s PHE 99 Ca -0.05 -0.81 -0.07 0.00 -0.60 0.00 0.00 56.93 55.39 2ost s PHE 99 Cb -0.09 -1.47 -0.04 0.00 0.51 0.00 0.00 43.02 41.93 2ost s PHE 99 CO -0.00 -0.33 0.13 0.71 0.70 0.00 0.00 175.22 176.43 2ost s TYR 100 N 0.31 3.54 -0.17 0.36 2.02 -0.57 -0.14 117.35 122.71 2ost s TYR 100 Ca -0.14 0.47 0.01 0.00 -0.37 0.00 0.00 57.07 57.04 2ost s TYR 100 Cb -0.16 -1.98 0.01 0.00 -0.40 0.00 0.00 41.96 39.43 2ost s TYR 100 CO 0.06 0.63 -0.19 0.14 -1.57 0.00 0.00 175.55 174.62 2ost s VAL 101 N -0.72 2.25 -0.02 0.71 -7.23 -0.91 -0.97 120.40 113.51 2ost s VAL 101 Ca 0.13 -0.89 0.04 0.00 -1.81 0.00 0.00 61.98 59.45 2ost s VAL 101 Cb -0.12 -1.94 -0.03 0.00 0.56 0.00 0.00 36.38 34.85 2ost s VAL 101 CO 0.03 0.53 -0.13 -0.36 -0.31 0.00 0.00 175.10 174.86 2ost s PHE 102 N 1.10 2.73 0.91 2.82 0.40 0.10 -4.65 117.98 121.40 2ost s PHE 102 Ca 0.00 -0.14 -0.11 0.00 -0.60 0.00 0.00 56.93 56.08 2ost s PHE 102 Cb -0.14 -1.59 0.14 0.00 0.51 0.00 0.00 43.02 41.93 2ost s PHE 102 CO -0.07 0.26 1.10 -2.14 0.70 0.00 0.00 175.22 175.06 2ost s PRO 103 N -1.06 1.14 0.11 0.24 0.02 -1.26 0.46 135.00 134.64 2ost s PRO 103 Ca 0.14 1.08 -0.25 0.00 0.02 0.00 0.00 61.00 61.99 2ost s PRO 103 Cb -0.11 -1.78 -0.09 0.00 0.02 0.00 0.00 34.50 32.54 2ost s PRO 103 CO 0.03 -2.39 1.68 0.28 -0.33 0.00 0.00 177.00 176.27 2ost h VAL 104 N -1.67 0.65 -0.27 3.83 2.07 -1.88 -1.51 116.25 117.47 2ost h VAL 104 Ca -0.48 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.07 2ost h VAL 104 Cb 1.27 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 2ost h VAL 104 CO 0.50 0.00 0.07 0.44 0.02 0.00 0.00 177.57 178.60 2ost h ASP 105 N -0.28 0.05 0.00 0.57 3.32 -1.91 0.32 116.42 118.49 2ost h ASP 105 Ca 0.03 0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.11 2ost h ASP 105 Cb 0.31 0.04 -0.00 0.00 0.22 0.00 0.00 39.33 39.90 2ost h ASP 105 CO -0.10 0.06 -0.01 0.58 -1.72 0.00 0.00 179.24 178.06 2ost h VAL 106 N 0.18 1.01 0.03 -1.35 2.07 -1.91 0.11 116.25 116.38 2ost h VAL 106 Ca 0.12 -0.03 -0.04 0.00 0.82 0.00 0.00 66.70 67.57 2ost h VAL 106 Cb 0.11 1.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.89 2ost h VAL 106 CO -0.15 0.01 -0.18 0.15 0.02 0.00 0.00 177.57 177.43 2ost h PHE 107 N 0.01 0.12 0.00 1.57 3.57 0.03 -3.33 116.94 118.90 2ost h PHE 107 Ca 0.00 -0.09 -0.03 0.00 3.53 0.00 0.00 57.97 61.38 2ost h PHE 107 Cb 0.02 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 38.74 2ost h PHE 107 CO 0.00 1.06 -0.16 0.97 -2.23 0.00 0.00 178.31 177.95 2ost h ILE 108 N -0.85 0.40 0.00 1.41 6.09 -0.31 -3.12 117.51 121.12 2ost h ILE 108 Ca -0.03 -0.97 -0.00 0.00 -1.37 0.00 0.00 64.86 62.49 2ost h ILE 108 Cb 1.13 1.71 -0.00 0.00 0.47 0.00 0.00 36.82 40.14 2ost h ILE 108 CO 0.03 0.16 -0.01 0.77 -3.07 0.00 0.00 178.15 176.04 2ost h SER 109 N 0.00 0.00 -4.30 2.19 4.64 -0.89 -3.43 113.55 111.76 2ost h SER 109 Ca -0.00 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.80 2ost h SER 109 Cb 0.70 0.00 0.13 0.00 -0.31 0.00 0.00 62.40 62.92 2ost h SER 109 CO 0.02 0.01 0.32 -0.31 -0.87 0.00 0.00 176.83 176.00 2ost s TYR 110 N -4.04 2.60 -0.12 4.77 2.02 -1.18 -5.02 117.35 116.38 2ost s TYR 110 Ca -0.03 1.55 -0.10 0.00 -0.37 0.00 0.00 57.07 58.12 2ost s TYR 110 Cb 0.12 -3.05 -0.09 0.00 -0.40 0.00 0.00 41.96 38.54 2ost s TYR 110 CO 0.46 -1.77 0.24 0.78 -1.57 0.00 0.00 175.55 173.69 2ost h GLY 111 N -1.01 0.00 0.00 0.71 0.00 -1.90 -3.49 103.07 97.37 2ost h GLY 111 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.89 2ost h GLY 111 CO 0.52 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.92 2ost n SER 112 N -4.71 0.00 -4.62 0.19 3.41 -1.26 -4.98 113.62 101.66 2ost n SER 112 Ca -0.04 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.18 2ost n SER 112 Cb 0.17 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.16 2ost n SER 112 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2ost n GLU 113 N 0.00 1.17 -3.73 4.33 1.02 -1.26 -3.30 120.64 118.87 2ost n GLU 113 Ca 0.00 0.43 -0.28 0.00 -0.02 0.00 0.00 57.16 57.30 2ost n GLU 113 Cb 0.00 -2.12 -0.16 0.00 -0.02 0.00 0.00 31.44 29.13 2ost n GLU 113 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 2ost s ILE 114 N -1.40 0.51 0.20 -3.67 2.07 0.47 -4.96 121.20 114.42 2ost s ILE 114 Ca 0.69 -0.57 -0.21 0.00 -1.41 0.00 0.00 60.65 59.14 2ost s ILE 114 Cb -0.48 -1.04 -0.08 0.00 0.13 0.00 0.00 42.46 40.99 2ost s ILE 114 CO 0.52 -0.23 0.73 -1.00 -1.91 0.00 0.00 174.94 173.06 2ost s HIS 115 N 1.86 3.73 -0.14 3.50 3.76 -1.26 -2.40 115.29 124.35 2ost s HIS 115 Ca -0.01 1.46 0.02 0.00 -0.15 0.00 0.00 55.06 56.39 2ost s HIS 115 Cb -0.17 -2.66 0.01 0.00 1.11 0.00 0.00 32.58 30.87 2ost s HIS 115 CO -0.09 0.40 -0.21 -0.51 -0.85 0.00 0.00 174.74 173.48 2ost s LEU 116 N -1.68 2.07 -0.13 0.89 1.43 0.65 -4.75 118.68 117.16 2ost s LEU 116 Ca 0.40 -0.59 -0.03 0.00 -1.03 0.00 0.00 54.13 52.89 2ost s LEU 116 Cb -0.19 -1.41 -0.03 0.00 0.03 0.00 0.00 46.19 44.60 2ost s LEU 116 CO 0.22 0.07 -0.04 0.68 0.23 0.00 0.00 176.35 177.51 2ost s VAL 117 N 0.85 3.88 0.00 -1.59 -7.23 -1.26 -2.32 120.40 112.72 2ost s VAL 117 Ca -0.07 -0.38 0.00 0.00 -1.81 0.00 0.00 61.98 59.73 2ost s VAL 117 Cb -0.15 -2.67 0.00 0.00 0.56 0.00 0.00 36.38 34.12 2ost s VAL 117 CO -0.02 0.52 0.38 1.21 -0.31 0.00 0.00 175.10 176.88 2ost n GLU 118 N 3.17 0.71 -2.17 4.82 4.07 -1.26 -4.99 120.64 124.99 2ost n GLU 118 Ca -0.18 -0.38 -0.34 0.00 -0.06 0.00 0.00 57.16 56.20 2ost n GLU 118 Cb 0.53 -0.88 0.01 0.00 -0.06 0.00 0.00 31.44 31.04 2ost n GLU 118 CO 0.00 0.00 0.00 0.99 -0.06 0.00 0.00 177.13 178.06 2ost s THR 119 N -0.21 3.27 0.37 6.31 2.01 -1.26 -4.94 115.64 121.19 2ost s THR 119 Ca 0.00 0.74 0.12 0.00 0.31 0.00 0.00 61.69 62.86 2ost s THR 119 Cb 0.00 -3.27 0.34 0.00 0.01 0.00 0.00 72.50 69.59 2ost s THR 119 CO 0.00 -0.22 1.84 0.44 -0.69 0.00 0.00 174.62 175.98 2ost h ASP 120 N 0.94 0.58 0.00 3.53 5.19 -2.02 -3.44 116.42 121.21 2ost h ASP 120 Ca -0.49 0.06 0.00 0.00 -0.62 0.00 0.00 57.03 55.98 2ost h ASP 120 Cb 1.25 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.71 2ost h ASP 120 CO 0.56 0.24 0.00 2.29 -3.12 0.00 0.00 179.24 179.21 2ost n LYS 121 N -4.59 0.00 0.00 3.56 0.00 -1.26 -4.56 118.16 111.31 2ost n LYS 121 Ca 0.20 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.51 2ost n LYS 121 Cb 0.61 -0.38 0.00 0.00 -0.00 0.00 0.00 35.03 35.26 2ost n LYS 121 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 2ost n ARG 122 N 0.00 0.00 -1.07 -1.58 -4.01 -1.26 -4.94 116.66 103.79 2ost n ARG 122 Ca 0.00 0.00 -0.29 0.00 -1.04 0.00 0.00 57.85 56.52 2ost n ARG 122 Cb 0.00 -3.37 0.20 0.00 -3.04 0.00 0.00 32.46 26.25 2ost n ARG 122 CO 0.00 0.00 0.00 -1.14 -3.04 0.00 0.00 177.63 173.45 2ost s GLN 123 N 0.00 -0.13 0.00 2.89 2.00 -1.26 -4.96 119.66 118.20 2ost s GLN 123 Ca 0.00 0.42 0.24 0.00 -2.00 0.00 0.00 55.36 54.02 2ost s GLN 123 Cb 0.00 -1.68 1.33 0.00 0.80 0.00 0.00 33.01 33.46 2ost s GLN 123 CO 0.00 -3.08 1.87 2.89 -0.50 0.00 0.00 175.29 176.47 2ost n ARG 124 N -4.41 1.16 -1.34 1.67 -4.01 -1.26 -5.03 116.66 103.45 2ost n ARG 124 Ca 0.06 -0.24 0.00 0.00 -1.04 0.00 0.00 57.85 56.63 2ost n ARG 124 Cb 0.57 -1.39 0.00 0.00 -3.04 0.00 0.00 32.46 28.60 2ost n ARG 124 CO 0.00 0.00 0.00 0.36 -3.04 0.00 0.00 177.63 174.95 2ost n LYS 125 N -0.62 -3.83 -1.33 2.89 -0.00 -1.26 -4.98 118.16 109.02 2ost n LYS 125 Ca 0.18 2.85 -0.29 0.00 -0.00 0.00 0.00 58.31 61.05 2ost n LYS 125 Cb 0.14 -3.20 0.20 0.00 -0.00 0.00 0.00 35.03 32.17 2ost n LYS 125 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2ost s PRO 126 N -4.02 -0.13 0.22 -1.58 0.04 -1.26 -4.90 135.00 123.37 2ost s PRO 126 Ca 0.00 0.06 0.19 0.00 0.04 0.00 0.00 61.00 61.28 2ost s PRO 126 Cb 0.00 -1.71 0.88 0.00 0.04 0.00 0.00 34.50 33.71 2ost s PRO 126 CO 0.00 -3.01 1.57 2.89 0.04 0.00 0.00 177.00 178.49 2ost n ARG 127 N -4.28 0.13 -0.22 4.56 1.85 -1.26 -2.43 116.66 115.00 2ost n ARG 127 Ca 0.11 0.50 -0.04 0.00 -1.00 0.00 0.00 57.85 57.42 2ost n ARG 127 Cb 0.59 -1.81 0.14 0.00 -1.05 0.00 0.00 32.46 30.33 2ost n ARG 127 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 2ost h SER 128 N 0.00 0.94 -0.85 2.89 4.64 -1.90 -3.22 113.55 116.05 2ost h SER 128 Ca 0.00 -0.14 0.20 0.00 -0.47 0.00 0.00 61.79 61.38 2ost h SER 128 Cb 0.16 -0.24 -0.06 0.00 -0.31 0.00 0.00 62.40 61.95 2ost h SER 128 CO 0.00 0.84 0.58 0.15 -0.87 0.00 0.00 176.83 177.53 2ost h PHE 129 N 1.00 0.41 0.00 4.77 3.04 -1.82 -1.93 116.94 122.41 2ost h PHE 129 Ca 0.23 0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.19 2ost h PHE 129 Cb 0.20 -0.12 0.00 0.00 2.56 0.00 0.00 35.95 38.59 2ost h PHE 129 CO 0.02 0.12 0.00 0.41 -2.02 0.00 0.00 178.31 176.83 2ost n GLY 130 N -1.56 -0.23 0.00 2.40 0.00 -1.22 -2.49 105.19 102.09 2ost n GLY 130 Ca 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 -0.51 0.00 -1.68 1.61 4.02 -0.72 -4.94 117.16 114.93 2ost n TYR 131 Ca 0.00 -0.16 -0.49 0.00 -0.01 0.00 0.00 57.90 57.24 2ost n TYR 131 Cb 0.00 -0.02 -0.05 0.00 -0.02 0.00 0.00 39.34 39.26 2ost n TYR 131 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2ost n ARG 132 N -0.16 2.02 -4.12 -0.72 1.74 -1.04 -1.80 116.66 112.59 2ost n ARG 132 Ca 0.00 0.74 -0.31 0.00 -0.77 0.00 0.00 57.85 57.51 2ost n ARG 132 Cb 0.21 -2.56 -0.03 0.00 -1.02 0.00 0.00 32.46 29.06 2ost n ARG 132 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2ost n GLU 133 N 6.12 -2.92 -0.25 5.56 4.71 0.81 -4.82 120.64 129.86 2ost n GLU 133 Ca 0.23 0.35 0.00 0.00 -0.01 0.00 0.00 57.16 57.72 2ost n GLU 133 Cb 0.27 -4.65 0.00 0.00 -1.01 0.00 0.00 31.44 26.06 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 -4.41 3.06 0.33 0.62 0.00 -0.75 -4.45 120.51 114.92 2ost n ALA 134 Ca -0.15 0.00 0.22 0.00 0.00 0.00 0.00 53.44 53.50 2ost n ALA 134 Cb 0.61 -1.10 1.15 0.00 0.00 0.00 0.00 19.45 20.10 2ost n ALA 134 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 2ost h TRP 135 N 1.05 0.00 -0.35 0.00 4.06 -1.88 -0.14 115.95 118.68 2ost h TRP 135 Ca 0.00 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 60.88 2ost h TRP 135 Cb 0.83 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.97 2ost h TRP 135 CO 0.16 0.00 -0.06 1.12 -3.56 0.00 0.00 178.44 176.11 2ost h HIS 136 N 0.00 0.62 -0.66 0.49 2.07 -1.99 -2.64 115.15 113.03 2ost h HIS 136 Ca 0.00 -0.08 -0.00 0.00 -2.85 0.00 0.00 60.37 57.43 2ost h HIS 136 Cb 0.05 -0.17 -0.03 0.00 2.57 0.00 0.00 27.41 29.83 2ost h HIS 136 CO 0.00 0.63 0.39 -0.07 -3.07 0.00 0.00 177.93 175.82 2ost h LEU 137 N 0.54 0.79 -0.19 6.12 3.38 -1.39 0.45 115.31 125.01 2ost h LEU 137 Ca 0.11 -0.04 -0.22 0.00 0.09 0.00 0.00 57.88 57.81 2ost h LEU 137 Cb 0.44 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2ost h LEU 137 CO 0.02 0.61 -0.91 -0.29 0.09 0.00 0.00 178.44 177.95 2ost h ILE 138 N 0.91 1.38 -0.63 1.22 6.09 -1.66 -2.50 117.51 122.31 2ost h ILE 138 Ca 0.24 -2.35 -0.07 0.00 -1.37 0.00 0.00 64.86 61.31 2ost h ILE 138 Cb -0.03 2.34 -0.03 0.00 0.47 0.00 0.00 36.82 39.57 2ost h ILE 138 CO -0.04 0.71 0.14 0.25 -3.07 0.00 0.00 178.15 176.13 2ost h LEU 139 N 0.28 0.97 -0.56 2.19 5.85 -0.99 -2.61 115.31 120.44 2ost h LEU 139 Ca -0.08 -0.24 -0.12 0.00 0.84 0.00 0.00 57.88 58.28 2ost h LEU 139 Cb 1.54 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 42.30 2ost h LEU 139 CO 0.16 0.96 -0.14 1.56 -0.34 0.00 0.00 178.44 180.64 2ost h GLN 140 N 0.94 1.01 0.00 1.25 4.20 -0.17 -2.33 115.11 120.01 2ost h GLN 140 Ca 0.20 -0.39 -0.03 0.00 0.06 0.00 0.00 58.65 58.49 2ost h GLN 140 Cb 0.38 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.10 2ost h GLN 140 CO 0.00 1.07 -0.15 -0.22 -0.67 0.00 0.00 178.83 178.87 2ost h LYS 141 N 0.89 0.00 0.10 1.46 3.11 -1.41 -2.03 116.57 118.68 2ost h LYS 141 Ca 0.13 0.00 -0.00 0.00 -2.81 0.00 0.00 60.65 57.97 2ost h LYS 141 Cb 0.71 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.94 2ost h LYS 141 CO 0.05 0.15 -0.05 0.78 -2.81 0.00 0.00 179.45 177.57 2ost h GLY 142 N 0.88 -0.14 2.00 5.01 0.00 -1.02 -3.00 103.07 106.80 2ost h GLY 142 Ca -0.00 0.05 -0.05 0.00 0.00 0.00 0.00 47.33 47.33 2ost h GLY 142 CO 0.02 -0.05 -0.23 0.00 0.00 0.00 0.00 176.54 176.28 2ost h ALA 143 N 0.52 1.00 -0.04 3.60 0.00 -1.36 -2.66 119.26 120.33 2ost h ALA 143 Ca -0.01 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 2ost h ALA 143 Cb 0.30 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2ost h ALA 143 CO 0.02 0.29 -0.23 0.00 0.00 0.00 0.00 179.25 179.34 2ost h ALA 144 N 1.77 1.54 0.00 0.00 0.00 -1.27 -2.70 119.26 118.61 2ost h ALA 144 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2ost h ALA 144 Cb 0.78 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2ost h ALA 144 CO 0.03 0.34 -1.30 1.04 0.00 0.00 0.00 179.25 179.36 2ost n GLN 145 N -4.24 0.47 -0.06 0.00 3.00 -1.14 -4.62 117.38 110.79 2ost n GLN 145 Ca -0.02 -0.03 -0.07 0.00 -0.01 0.00 0.00 57.00 56.87 2ost n GLN 145 Cb 0.30 -1.63 -0.02 0.00 0.00 0.00 0.00 30.24 28.89 2ost n GLN 145 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.06 176.84 2ost h LYS 146 N 0.00 0.01 -7.25 -1.09 1.63 -1.12 -3.42 116.57 105.32 2ost h LYS 146 Ca 0.00 -0.00 -0.52 0.00 -0.85 0.00 0.00 60.65 59.28 2ost h LYS 146 Cb 0.87 -0.00 0.14 0.00 -0.60 0.00 0.00 32.23 32.64 2ost h LYS 146 CO 0.00 0.01 0.32 -1.83 -3.45 0.00 0.00 179.45 174.50 2ost s GLU 147 N -6.21 2.08 0.00 1.90 1.03 -1.25 -5.11 118.70 111.14 2ost s GLU 147 Ca -0.13 1.42 0.00 0.00 0.03 0.00 0.00 54.97 56.29 2ost s GLU 147 Cb 0.11 -1.86 0.00 0.00 -0.80 0.00 0.00 34.13 31.58 2ost s GLU 147 CO 0.69 -1.81 0.00 -2.37 -1.33 0.00 0.00 175.26 170.44