#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dcs s TRP 5 N 0.00 3.06 0.00 1.57 1.48 -1.26 -4.86 118.94 118.93 3dcs s TRP 5 Ca 0.00 1.47 0.00 0.00 -1.06 0.00 0.00 56.10 56.51 3dcs s TRP 5 Cb 0.00 -2.94 0.00 0.00 -1.16 0.00 0.00 33.47 29.37 3dcs s TRP 5 CO 0.00 -1.14 0.00 0.41 -4.06 0.00 0.00 176.95 172.16 3dcs n GLY 6 N -1.46 2.42 0.00 3.67 0.00 -0.00 -5.03 105.19 104.78 3dcs n GLY 6 Ca 0.08 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.75 3dcs n GLY 6 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3dcs n TYR 7 N 0.00 0.00 -1.62 1.61 4.02 -1.26 -3.81 117.16 116.10 3dcs n TYR 7 Ca 0.00 -0.27 -0.30 0.00 -0.01 0.00 0.00 57.90 57.32 3dcs n TYR 7 Cb 0.00 -0.03 0.21 0.00 -0.02 0.00 0.00 39.34 39.51 3dcs n TYR 7 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 3dcs s GLY 8 N -0.54 1.72 0.35 2.72 0.00 -1.26 -4.66 107.32 105.65 3dcs s GLY 8 Ca 0.00 -1.16 0.05 0.00 0.00 0.00 0.00 44.72 43.62 3dcs s GLY 8 CO 0.00 -0.32 1.90 0.50 0.00 0.00 0.00 173.10 175.18 3dcs h LYS 9 N -2.04 0.49 -0.02 2.90 1.57 -1.98 -2.25 116.57 115.24 3dcs h LYS 9 Ca -0.44 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.24 3dcs h LYS 9 Cb 1.25 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.48 3dcs h LYS 9 CO 0.34 0.51 -0.30 0.72 -0.57 0.00 0.00 179.45 180.16 3dcs n HIS 10 N -4.30 0.00 -2.10 -1.35 8.25 -1.26 -4.41 115.22 110.05 3dcs n HIS 10 Ca 0.01 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.48 3dcs n HIS 10 Cb 0.23 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.31 3dcs n HIS 10 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 3dcs n ASN 11 N 0.04 0.18 -4.12 0.41 6.94 -1.18 -4.97 115.26 112.56 3dcs n ASN 11 Ca 0.12 -1.93 -0.29 0.00 -0.02 0.00 0.00 54.58 52.46 3dcs n ASN 11 Cb 0.45 -0.20 0.19 0.00 -2.36 0.00 0.00 39.78 37.86 3dcs n ASN 11 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 3dcs s GLY 12 N -1.13 1.80 0.52 4.83 0.00 -0.85 -0.82 107.32 111.67 3dcs s GLY 12 Ca 0.07 -1.37 0.36 0.00 0.00 0.00 0.00 44.72 43.77 3dcs s GLY 12 CO -0.03 -0.60 1.77 -2.55 0.00 0.00 0.00 173.10 171.69 3dcs h PRO 13 N -1.54 0.05 0.00 2.90 0.11 -1.87 0.47 132.00 132.12 3dcs h PRO 13 Ca -0.43 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3dcs h PRO 13 Cb 1.23 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3dcs h PRO 13 CO 0.35 0.03 0.00 -0.85 -0.21 0.00 0.00 178.00 177.32 3dcs n GLU 14 N -4.23 0.08 0.03 1.05 0.00 -1.26 -2.68 120.64 113.63 3dcs n GLU 14 Ca 0.28 0.03 0.11 0.00 0.00 0.00 0.00 57.16 57.58 3dcs n GLU 14 Cb 1.30 -1.50 -0.06 0.00 0.00 0.00 0.00 31.44 31.18 3dcs n GLU 14 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 3dcs n HIS 15 N -1.46 0.30 -0.03 -1.84 8.25 0.16 -4.56 115.22 116.05 3dcs n HIS 15 Ca 0.08 0.09 0.11 0.00 -0.26 0.00 0.00 57.72 57.73 3dcs n HIS 15 Cb 0.30 -0.53 0.51 0.00 1.12 0.00 0.00 29.99 31.39 3dcs n HIS 15 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 3dcs h TRP 16 N 0.00 0.38 0.00 4.41 6.55 -1.47 -1.79 115.95 124.03 3dcs h TRP 16 Ca 0.00 0.01 0.00 0.00 0.95 0.00 0.00 58.89 59.85 3dcs h TRP 16 Cb 0.86 -0.12 0.00 0.00 -0.86 0.00 0.00 29.16 29.03 3dcs h TRP 16 CO 0.00 0.20 0.00 1.12 -1.05 0.00 0.00 178.44 178.71 3dcs h HIS 17 N 0.37 0.00 -0.09 0.49 2.07 -1.79 -0.46 115.15 115.75 3dcs h HIS 17 Ca 0.23 0.00 -0.12 0.00 -2.85 0.00 0.00 60.37 57.63 3dcs h HIS 17 Cb 0.42 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.39 3dcs h HIS 17 CO -0.00 0.00 -0.48 0.87 -3.07 0.00 0.00 177.93 175.25 3dcs h LYS 18 N 0.00 0.22 0.00 5.12 1.57 -1.66 -3.00 116.57 118.81 3dcs h LYS 18 Ca 0.00 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 3dcs h LYS 18 Cb 0.26 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.58 3dcs h LYS 18 CO 0.00 0.66 -1.79 -0.25 -0.57 0.00 0.00 179.45 177.50 3dcs n ASP 19 N -3.97 0.32 -3.44 0.86 8.00 -0.57 -4.74 116.55 113.01 3dcs n ASP 19 Ca -0.02 -0.17 -0.27 0.00 0.71 0.00 0.00 54.79 55.05 3dcs n ASP 19 Cb 0.53 1.80 -0.10 0.00 -0.02 0.00 0.00 41.12 43.33 3dcs n ASP 19 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3dcs n PHE 20 N -2.10 0.04 0.33 1.24 3.72 -0.29 -4.99 117.46 115.41 3dcs n PHE 20 Ca -0.03 -3.55 0.20 0.00 -0.05 0.00 0.00 57.45 54.03 3dcs n PHE 20 Cb 0.51 -0.02 1.10 0.00 -0.94 0.00 0.00 39.48 40.13 3dcs n PHE 20 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 3dcs h PRO 21 N 5.25 0.00 0.00 -1.08 0.11 -1.77 0.27 132.00 134.78 3dcs h PRO 21 Ca 0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.32 3dcs h PRO 21 Cb 0.87 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.98 3dcs h PRO 21 CO 0.46 0.00 0.00 1.51 -0.21 0.00 0.00 178.00 179.76 3dcs n ILE 22 N -3.12 1.49 -0.08 4.15 3.06 -1.26 -1.84 119.36 121.76 3dcs n ILE 22 Ca -0.03 0.37 0.26 0.00 -2.50 0.00 0.00 62.75 60.85 3dcs n ILE 22 Cb 0.16 -1.25 0.71 0.00 0.54 0.00 0.00 39.64 39.80 3dcs n ILE 22 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3dcs h ALA 23 N 2.24 2.58 -0.63 1.51 0.00 -1.25 0.63 119.26 124.34 3dcs h ALA 23 Ca 0.00 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.72 3dcs h ALA 23 Cb 0.12 0.05 -0.10 0.00 0.00 0.00 0.00 17.79 17.86 3dcs h ALA 23 CO 0.00 -1.00 0.18 1.63 0.00 0.00 0.00 179.25 180.06 3dcs n LYS 24 N -3.96 3.62 -0.94 0.00 5.02 -0.77 -4.96 118.16 116.18 3dcs n LYS 24 Ca 0.15 -3.08 -0.30 0.00 -2.02 0.00 0.00 58.31 53.05 3dcs n LYS 24 Cb 0.89 -2.15 0.26 0.00 -0.02 0.00 0.00 35.03 34.00 3dcs n LYS 24 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3dcs s GLY 25 N -1.25 1.55 0.10 0.72 0.00 0.22 -4.98 107.32 103.68 3dcs s GLY 25 Ca 0.53 -1.00 0.26 0.00 0.00 0.00 0.00 44.72 44.51 3dcs s GLY 25 CO 0.12 -0.05 1.56 1.18 0.00 0.00 0.00 173.10 175.91 3dcs n GLU 26 N -5.00 0.18 -2.95 2.90 -0.58 -1.26 -4.30 120.64 109.63 3dcs n GLU 26 Ca 0.14 0.09 -0.14 0.00 -0.42 0.00 0.00 57.16 56.83 3dcs n GLU 26 Cb 0.60 -1.65 0.01 0.00 -0.57 0.00 0.00 31.44 29.83 3dcs n GLU 26 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 3dcs n ARG 27 N -1.92 1.04 -2.71 3.49 1.85 -1.26 -4.63 116.66 112.52 3dcs n ARG 27 Ca 0.05 -3.14 -0.31 0.00 -1.00 0.00 0.00 57.85 53.45 3dcs n ARG 27 Cb 0.40 -1.41 -0.03 0.00 -1.05 0.00 0.00 32.46 30.36 3dcs n ARG 27 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 3dcs s GLN 28 N -2.32 3.86 0.24 2.89 -1.52 -1.26 -2.85 119.66 118.70 3dcs s GLN 28 Ca 0.33 0.66 0.10 0.00 -1.95 0.00 0.00 55.36 54.50 3dcs s GLN 28 Cb 0.39 -2.30 -0.05 0.00 -0.22 0.00 0.00 33.01 30.83 3dcs s GLN 28 CO -0.04 -0.11 -0.16 -1.12 -0.25 0.00 0.00 175.29 173.61 3dcs s SER 29 N -3.06 3.05 0.94 5.90 0.01 -1.26 -4.66 113.70 114.61 3dcs s SER 29 Ca 0.54 -1.04 -0.12 0.00 1.31 0.00 0.00 55.95 56.65 3dcs s SER 29 Cb -0.10 -0.21 0.18 0.00 0.21 0.00 0.00 66.02 66.09 3dcs s SER 29 CO 0.30 -0.09 1.07 -0.81 0.41 0.00 0.00 173.24 174.12 3dcs n PRO 30 N -0.50 -0.90 -4.21 12.44 -0.04 -1.26 -4.65 135.00 135.88 3dcs n PRO 30 Ca -0.07 -1.83 -0.12 0.00 -0.04 0.00 0.00 63.50 61.44 3dcs n PRO 30 Cb 0.60 -1.05 -0.10 0.00 -0.04 0.00 0.00 33.50 32.92 3dcs n PRO 30 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3dcs s VAL 31 N -3.29 0.55 0.04 0.52 -7.23 -1.26 -0.80 120.40 108.93 3dcs s VAL 31 Ca 0.62 -1.96 -0.29 0.00 -1.81 0.00 0.00 61.98 58.54 3dcs s VAL 31 Cb -0.02 -2.06 -0.04 0.00 0.56 0.00 0.00 36.38 34.82 3dcs s VAL 31 CO 0.43 -0.52 0.93 -0.62 -0.31 0.00 0.00 175.10 175.01 3dcs s ASP 32 N -3.13 7.37 -0.47 4.85 2.15 -1.26 -3.15 116.67 123.03 3dcs s ASP 32 Ca 0.23 1.65 -0.18 0.00 0.43 0.00 0.00 52.55 54.68 3dcs s ASP 32 Cb 0.06 -2.55 0.05 0.00 -0.30 0.00 0.00 42.92 40.18 3dcs s ASP 32 CO 0.02 -0.14 0.52 -0.63 -0.17 0.00 0.00 175.17 174.78 3dcs s ILE 33 N 0.46 5.01 -0.55 4.11 1.01 0.72 -4.94 121.20 127.03 3dcs s ILE 33 Ca 0.47 -0.55 -0.28 0.00 0.00 0.00 0.00 60.65 60.30 3dcs s ILE 33 Cb -0.22 -4.18 0.03 0.00 0.01 0.00 0.00 42.46 38.11 3dcs s ILE 33 CO 0.27 -0.63 1.14 -0.62 0.00 0.00 0.00 174.94 175.11 3dcs s ASP 34 N 2.37 6.48 0.53 3.58 -1.08 -1.26 -1.00 116.67 126.29 3dcs s ASP 34 Ca 0.12 0.14 0.35 0.00 -0.52 0.00 0.00 52.55 52.64 3dcs s ASP 34 Cb -0.19 -2.54 1.58 0.00 -1.46 0.00 0.00 42.92 40.31 3dcs s ASP 34 CO 0.12 -1.39 2.03 0.71 0.52 0.00 0.00 175.17 177.16 3dcs h THR 35 N 6.16 0.00 0.00 1.71 1.35 -1.95 -1.36 112.91 118.83 3dcs h THR 35 Ca -0.25 -0.32 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 3dcs h THR 35 Cb 1.06 1.26 0.00 0.00 -1.73 0.00 0.00 68.15 68.73 3dcs h THR 35 CO 1.16 0.00 -0.60 1.41 -0.25 0.00 0.00 175.52 177.24 3dcs n HIS 36 N -2.93 0.21 0.28 4.73 8.25 -1.26 -3.83 115.22 120.67 3dcs n HIS 36 Ca -0.00 0.06 0.03 0.00 -0.26 0.00 0.00 57.72 57.55 3dcs n HIS 36 Cb 0.22 -0.40 -0.00 0.00 1.12 0.00 0.00 29.99 30.93 3dcs n HIS 36 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 3dcs n THR 37 N -1.75 0.00 -1.64 1.59 -2.24 -0.73 -4.98 114.28 104.54 3dcs n THR 37 Ca 0.04 -0.43 -0.36 0.00 -2.27 0.00 0.00 64.05 61.04 3dcs n THR 37 Cb 0.38 1.07 0.08 0.00 -2.10 0.00 0.00 70.33 69.76 3dcs n THR 37 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dcs s ALA 38 N -1.08 2.28 -0.24 6.98 0.00 -0.59 -4.82 121.76 124.29 3dcs s ALA 38 Ca 0.05 1.08 -0.06 0.00 0.00 0.00 0.00 51.96 53.03 3dcs s ALA 38 Cb 0.05 -3.52 -0.02 0.00 0.00 0.00 0.00 23.12 19.63 3dcs s ALA 38 CO 0.17 -1.69 0.03 0.21 0.00 0.00 0.00 175.76 174.48 3dcs s LYS 39 N -3.57 3.56 0.23 0.00 2.47 -0.23 -4.88 119.74 117.32 3dcs s LYS 39 Ca 0.79 -0.53 -0.31 0.00 -1.56 0.00 0.00 55.97 54.37 3dcs s LYS 39 Cb -0.34 -3.20 -0.11 0.00 -1.46 0.00 0.00 37.83 32.72 3dcs s LYS 39 CO 0.41 -0.18 1.56 -0.47 0.16 0.00 0.00 175.35 176.84 3dcs s TYR 40 N 1.52 2.95 -0.41 4.03 5.04 -1.26 -0.17 117.35 129.05 3dcs s TYR 40 Ca 0.06 0.74 0.02 0.00 -2.44 0.00 0.00 57.07 55.45 3dcs s TYR 40 Cb -0.15 -3.96 0.13 0.00 0.35 0.00 0.00 41.96 38.32 3dcs s TYR 40 CO 0.01 -3.38 0.20 0.34 -1.34 0.00 0.00 175.55 171.38 3dcs s ASP 41 N 0.75 3.82 0.00 4.32 -1.08 -0.17 -4.85 116.67 119.47 3dcs s ASP 41 Ca 0.66 -2.39 0.16 0.00 -0.52 0.00 0.00 52.55 50.46 3dcs s ASP 41 Cb -0.45 -1.05 0.92 0.00 -1.46 0.00 0.00 42.92 40.88 3dcs s ASP 41 CO 0.39 -0.30 1.40 -0.81 0.52 0.00 0.00 175.17 176.37 3dcs n PRO 42 N 3.86 0.43 0.00 4.34 -0.04 -1.26 -0.69 135.00 141.63 3dcs n PRO 42 Ca 0.06 0.04 0.14 0.00 -0.04 0.00 0.00 63.50 63.70 3dcs n PRO 42 Cb 0.36 -1.50 0.54 0.00 -0.04 0.00 0.00 33.50 32.86 3dcs n PRO 42 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3dcs n SER 43 N -1.09 0.23 -4.72 3.54 3.41 -1.26 -4.83 113.62 108.92 3dcs n SER 43 Ca 0.11 0.01 -0.42 0.00 -0.26 0.00 0.00 58.87 58.31 3dcs n SER 43 Cb 0.08 -0.20 -0.03 0.00 -0.26 0.00 0.00 64.21 63.80 3dcs n SER 43 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3dcs s LEU 44 N -2.84 4.38 0.52 1.04 1.43 0.13 -5.01 118.68 118.34 3dcs s LEU 44 Ca 0.18 2.14 -0.06 0.00 -1.03 0.00 0.00 54.13 55.36 3dcs s LEU 44 Cb 0.19 -3.59 -0.03 0.00 0.03 0.00 0.00 46.19 42.80 3dcs s LEU 44 CO 0.55 -0.51 0.84 -0.54 0.23 0.00 0.00 176.35 176.92 3dcs s LYS 45 N 0.87 3.40 0.60 1.70 -0.14 -1.22 -4.99 119.74 119.95 3dcs s LYS 45 Ca 0.60 0.21 -0.19 0.00 -1.36 0.00 0.00 55.97 55.22 3dcs s LYS 45 Cb -0.32 -2.32 -0.03 0.00 -1.68 0.00 0.00 37.83 33.48 3dcs s LYS 45 CO 0.31 -0.36 1.27 -2.14 -0.76 0.00 0.00 175.35 173.66 3dcs s PRO 46 N -4.85 2.89 0.46 -1.68 0.02 -1.26 -2.88 135.00 127.69 3dcs s PRO 46 Ca 0.50 1.99 -0.23 0.00 0.02 0.00 0.00 61.00 63.27 3dcs s PRO 46 Cb -0.10 -1.98 -0.07 0.00 0.02 0.00 0.00 34.50 32.36 3dcs s PRO 46 CO 0.46 -1.31 1.18 -0.51 -0.33 0.00 0.00 177.00 176.48 3dcs s LEU 47 N -4.03 4.03 -0.29 -5.54 1.43 -1.26 -1.64 118.68 111.38 3dcs s LEU 47 Ca 0.78 2.34 0.01 0.00 -1.03 0.00 0.00 54.13 56.23 3dcs s LEU 47 Cb -0.35 -4.21 0.07 0.00 0.03 0.00 0.00 46.19 41.73 3dcs s LEU 47 CO 0.38 -0.92 -0.03 -0.55 0.23 0.00 0.00 176.35 175.46 3dcs s SER 48 N -1.30 4.70 -0.30 2.29 0.15 0.69 -4.85 113.70 115.08 3dcs s SER 48 Ca 0.63 -1.50 -0.09 0.00 0.70 0.00 0.00 55.95 55.69 3dcs s SER 48 Cb -0.30 -1.63 -0.01 0.00 -1.71 0.00 0.00 66.02 62.37 3dcs s SER 48 CO 0.36 -0.26 0.14 -0.69 1.20 0.00 0.00 173.24 173.99 3dcs s VAL 49 N 1.13 4.58 -0.42 4.45 1.01 -1.26 -1.08 120.40 128.81 3dcs s VAL 49 Ca -0.04 -0.38 0.01 0.00 0.00 0.00 0.00 61.98 61.57 3dcs s VAL 49 Cb -0.20 -3.31 0.11 0.00 0.00 0.00 0.00 36.38 32.99 3dcs s VAL 49 CO -0.04 0.10 0.18 -0.55 0.00 0.00 0.00 175.10 174.80 3dcs s SER 50 N 1.62 4.96 -0.03 3.32 0.15 0.02 -4.89 113.70 118.84 3dcs s SER 50 Ca 0.05 -2.30 0.06 0.00 0.70 0.00 0.00 55.95 54.46 3dcs s SER 50 Cb -0.17 -1.74 0.13 0.00 -1.71 0.00 0.00 66.02 62.54 3dcs s SER 50 CO 0.06 -0.42 1.09 -1.22 1.20 0.00 0.00 173.24 173.95 3dcs n TYR 51 N 4.15 0.13 0.24 3.44 4.01 -1.26 -0.73 117.16 127.14 3dcs n TYR 51 Ca 0.02 -0.60 0.12 0.00 -0.16 0.00 0.00 57.90 57.28 3dcs n TYR 51 Cb 0.40 -0.07 0.58 0.00 -0.31 0.00 0.00 39.34 39.93 3dcs n TYR 51 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 3dcs h ASP 52 N 0.46 0.00 -0.51 7.72 2.03 -1.90 -2.56 116.42 121.65 3dcs h ASP 52 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3dcs h ASP 52 Cb 0.67 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.17 3dcs h ASP 52 CO 0.01 0.16 0.00 0.00 -1.03 0.00 0.00 179.24 178.38 3dcs n GLN 53 N -3.38 3.55 -1.70 4.15 1.13 -1.24 -5.02 117.38 114.86 3dcs n GLN 53 Ca -0.00 -2.77 -0.42 0.00 -1.94 0.00 0.00 57.00 51.86 3dcs n GLN 53 Cb 0.36 -1.82 0.00 0.00 0.11 0.00 0.00 30.24 28.89 3dcs n GLN 53 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3dcs n ALA 54 N 0.62 1.35 -3.94 -1.58 0.00 -0.97 -4.59 120.51 111.40 3dcs n ALA 54 Ca 0.23 0.32 -0.31 0.00 0.00 0.00 0.00 53.44 53.68 3dcs n ALA 54 Cb 0.85 -2.27 -0.15 0.00 0.00 0.00 0.00 19.45 17.88 3dcs n ALA 54 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3dcs s THR 55 N -1.14 1.79 0.46 0.00 2.01 -1.26 -4.95 115.64 112.55 3dcs s THR 55 Ca 0.58 -1.85 -0.20 0.00 0.31 0.00 0.00 61.69 60.53 3dcs s THR 55 Cb -0.54 -2.24 -0.10 0.00 0.01 0.00 0.00 72.50 69.64 3dcs s THR 55 CO 0.61 -0.47 0.99 -0.94 -0.69 0.00 0.00 174.62 174.11 3dcs s SER 56 N 1.18 6.65 -0.05 3.53 1.04 -1.26 -1.08 113.70 123.72 3dcs s SER 56 Ca 0.06 1.77 -0.02 0.00 0.48 0.00 0.00 55.95 58.24 3dcs s SER 56 Cb -0.19 -2.54 -0.02 0.00 0.10 0.00 0.00 66.02 63.37 3dcs s SER 56 CO -0.12 -0.57 -0.06 0.18 0.98 0.00 0.00 173.24 173.66 3dcs n LEU 57 N -0.89 1.04 -3.53 2.42 4.77 0.61 -4.09 117.00 117.32 3dcs n LEU 57 Ca 0.08 0.04 -0.16 0.00 -0.03 0.00 0.00 56.01 55.94 3dcs n LEU 57 Cb 0.53 -0.15 -0.05 0.00 -2.33 0.00 0.00 43.42 41.43 3dcs n LEU 57 CO 0.39 0.23 0.37 -0.60 -1.33 0.00 0.00 177.39 176.44 3dcs s ARG 58 N -2.09 1.07 -0.03 3.23 3.52 -1.23 -1.01 118.95 122.41 3dcs s ARG 58 Ca -0.07 -0.03 0.07 0.00 -0.13 0.00 0.00 55.73 55.57 3dcs s ARG 58 Cb 0.02 0.50 -0.02 0.00 -1.56 0.00 0.00 34.95 33.90 3dcs s ARG 58 CO 0.09 -0.37 -0.24 -1.50 -0.81 0.00 0.00 175.30 172.47 3dcs s ILE 59 N -1.99 1.90 -0.01 4.11 2.07 -0.13 -0.62 121.20 126.52 3dcs s ILE 59 Ca -0.07 -1.01 0.02 0.00 -1.41 0.00 0.00 60.65 58.17 3dcs s ILE 59 Cb -0.01 -1.59 0.00 0.00 0.13 0.00 0.00 42.46 41.00 3dcs s ILE 59 CO 0.02 0.53 -0.06 -0.22 -1.91 0.00 0.00 174.94 173.31 3dcs s LEU 60 N -0.42 1.87 -0.46 8.50 2.96 0.09 -1.46 118.68 129.76 3dcs s LEU 60 Ca 0.05 -0.11 -0.25 0.00 -0.22 0.00 0.00 54.13 53.60 3dcs s LEU 60 Cb -0.11 -0.35 0.03 0.00 0.50 0.00 0.00 46.19 46.27 3dcs s LEU 60 CO 0.00 0.05 0.90 0.21 -1.32 0.00 0.00 176.35 176.19 3dcs s ASN 61 N 0.06 6.47 0.00 3.68 3.84 -0.10 -0.57 114.94 128.33 3dcs s ASN 61 Ca -0.00 0.04 0.18 0.00 0.21 0.00 0.00 52.86 53.29 3dcs s ASN 61 Cb -0.05 -2.44 0.51 0.00 -0.55 0.00 0.00 41.25 38.73 3dcs s ASN 61 CO -0.00 -1.03 1.43 -0.46 -2.79 0.00 0.00 177.10 174.24 3dcs n ASN 62 N 7.09 3.03 0.00 -4.21 0.23 -0.48 -0.55 115.26 120.37 3dcs n ASN 62 Ca 0.05 -1.98 0.00 0.00 -0.53 0.00 0.00 54.58 52.12 3dcs n ASN 62 Cb 0.48 -0.36 0.00 0.00 -2.08 0.00 0.00 39.78 37.82 3dcs n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3dcs n GLY 63 N 1.41 1.69 0.00 4.83 0.00 -1.26 -4.71 105.19 107.14 3dcs n GLY 63 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 3dcs n GLY 63 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3dcs n HIS 64 N -2.00 0.00 -3.46 1.61 1.44 -1.26 -4.69 115.22 106.87 3dcs n HIS 64 Ca 0.00 0.00 -0.02 0.00 -2.01 0.00 0.00 57.72 55.69 3dcs n HIS 64 Cb 0.00 0.00 -0.00 0.00 0.12 0.00 0.00 29.99 30.11 3dcs n HIS 64 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 3dcs n SER 65 N -1.25 -0.30 -4.33 4.39 2.88 -1.26 -4.86 113.62 108.88 3dcs n SER 65 Ca 0.00 -1.32 -0.28 0.00 -1.33 0.00 0.00 58.87 55.95 3dcs n SER 65 Cb 0.15 0.54 -0.14 0.00 -0.75 0.00 0.00 64.21 64.01 3dcs n SER 65 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 3dcs s PHE 66 N -5.87 2.14 0.02 0.66 -0.12 -1.26 -1.38 117.98 112.17 3dcs s PHE 66 Ca 0.04 -0.40 0.03 0.00 -0.05 0.00 0.00 56.93 56.55 3dcs s PHE 66 Cb -0.00 -1.22 -0.02 0.00 -0.63 0.00 0.00 43.02 41.15 3dcs s PHE 66 CO 0.03 0.21 -0.09 1.14 -0.05 0.00 0.00 175.22 176.46 3dcs s GLN 67 N -1.62 0.61 -0.20 1.99 -2.07 0.27 -3.95 119.66 114.69 3dcs s GLN 67 Ca 0.11 -0.55 -0.07 0.00 -1.82 0.00 0.00 55.36 53.03 3dcs s GLN 67 Cb -0.10 -0.51 -0.04 0.00 -1.09 0.00 0.00 33.01 31.27 3dcs s GLN 67 CO 0.04 0.12 0.06 0.08 -1.32 0.00 0.00 175.29 174.27 3dcs s VAL 68 N -0.77 4.59 0.01 3.63 1.01 0.10 -0.73 120.40 128.23 3dcs s VAL 68 Ca -0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 61.98 61.84 3dcs s VAL 68 Cb -0.06 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.19 3dcs s VAL 68 CO 0.00 0.43 0.15 -1.61 0.00 0.00 0.00 175.10 174.07 3dcs s GLU 69 N 0.72 3.29 0.21 2.72 2.02 0.20 -1.70 118.70 126.17 3dcs s GLU 69 Ca 0.03 -0.41 0.11 0.00 0.02 0.00 0.00 54.97 54.72 3dcs s GLU 69 Cb -0.13 -2.99 -0.05 0.00 0.10 0.00 0.00 34.13 31.06 3dcs s GLU 69 CO 0.02 0.65 -0.23 -0.06 0.02 0.00 0.00 175.26 175.66 3dcs s PHE 70 N -1.32 2.28 -0.23 1.61 0.40 -0.33 -0.29 117.98 120.11 3dcs s PHE 70 Ca 0.27 -0.36 -0.29 0.00 -0.60 0.00 0.00 56.93 55.95 3dcs s PHE 70 Cb -0.12 -1.10 -0.01 0.00 0.51 0.00 0.00 43.02 42.29 3dcs s PHE 70 CO 0.19 0.54 1.40 0.34 0.70 0.00 0.00 175.22 178.39 3dcs s ASP 71 N -2.86 6.66 -0.25 1.36 2.15 -0.24 -4.82 116.67 118.67 3dcs s ASP 71 Ca 0.23 1.50 0.10 0.00 0.43 0.00 0.00 52.55 54.81 3dcs s ASP 71 Cb -0.07 -2.54 0.46 0.00 -0.30 0.00 0.00 42.92 40.47 3dcs s ASP 71 CO 0.11 -1.04 1.35 -0.90 -0.17 0.00 0.00 175.17 174.52 3dcs n ASP 72 N 7.57 2.20 0.10 -0.34 5.75 -1.26 -4.64 116.55 125.93 3dcs n ASP 72 Ca 0.16 -3.77 0.13 0.00 -0.01 0.00 0.00 54.79 51.29 3dcs n ASP 72 Cb 0.46 -0.58 0.34 0.00 -1.03 0.00 0.00 41.12 40.30 3dcs n ASP 72 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 3dcs n SER 73 N -1.12 0.81 -3.87 -1.12 3.41 -1.26 -4.85 113.62 105.62 3dcs n SER 73 Ca 0.26 0.46 -0.12 0.00 -0.26 0.00 0.00 58.87 59.21 3dcs n SER 73 Cb 0.87 -0.55 -0.07 0.00 -0.26 0.00 0.00 64.21 64.21 3dcs n SER 73 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3dcs s GLN 74 N -3.12 1.52 -1.15 4.33 -0.21 -1.26 -5.07 119.66 114.69 3dcs s GLN 74 Ca 0.09 -1.54 -0.22 0.00 0.02 0.00 0.00 55.36 53.71 3dcs s GLN 74 Cb 0.12 0.39 -0.08 0.00 1.00 0.00 0.00 33.01 34.44 3dcs s GLN 74 CO 0.63 -0.59 1.92 -0.25 -2.12 0.00 0.00 175.29 174.88 3dcs n ASP 75 N -0.63 3.17 -0.14 5.90 8.00 -1.26 -4.63 116.55 126.96 3dcs n ASP 75 Ca 0.01 -2.72 -0.29 0.00 0.71 0.00 0.00 54.79 52.50 3dcs n ASP 75 Cb 0.63 -1.66 -0.10 0.00 -0.02 0.00 0.00 41.12 39.97 3dcs n ASP 75 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3dcs n LYS 76 N 8.11 0.59 -3.89 -1.24 5.02 -1.26 -4.89 118.16 120.60 3dcs n LYS 76 Ca 0.46 0.27 -0.30 0.00 -2.02 0.00 0.00 58.31 56.72 3dcs n LYS 76 Cb 0.46 -1.50 -0.15 0.00 -0.02 0.00 0.00 35.03 33.81 3dcs n LYS 76 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3dcs s ALA 77 N -2.52 1.97 0.13 7.82 0.00 -1.26 -3.62 121.76 124.29 3dcs s ALA 77 Ca -0.38 -1.63 0.05 0.00 0.00 0.00 0.00 51.96 50.00 3dcs s ALA 77 Cb 0.14 -1.57 -0.04 0.00 0.00 0.00 0.00 23.12 21.65 3dcs s ALA 77 CO 0.49 -1.42 -0.12 0.14 0.00 0.00 0.00 175.76 174.85 3dcs s VAL 78 N 1.39 1.28 -0.11 0.00 -7.23 0.09 -1.50 120.40 114.31 3dcs s VAL 78 Ca 0.02 -1.86 0.01 0.00 -1.81 0.00 0.00 61.98 58.34 3dcs s VAL 78 Cb -0.18 -1.65 -0.01 0.00 0.56 0.00 0.00 36.38 35.09 3dcs s VAL 78 CO -0.12 -0.55 -0.15 -0.22 -0.31 0.00 0.00 175.10 173.75 3dcs s LEU 79 N -2.75 2.60 0.29 1.32 2.96 -0.37 -0.80 118.68 121.92 3dcs s LEU 79 Ca 0.12 -0.35 -0.03 0.00 -0.22 0.00 0.00 54.13 53.66 3dcs s LEU 79 Cb -0.02 -1.56 -0.01 0.00 0.50 0.00 0.00 46.19 45.10 3dcs s LEU 79 CO 0.02 0.20 0.36 -0.54 -1.32 0.00 0.00 176.35 175.08 3dcs s LYS 80 N 0.12 1.64 2.46 1.98 1.02 -0.24 -1.31 119.74 125.42 3dcs s LYS 80 Ca -0.08 -1.67 0.00 0.00 0.02 0.00 0.00 55.97 54.24 3dcs s LYS 80 Cb -0.15 0.39 0.00 0.00 -0.52 0.00 0.00 37.83 37.55 3dcs s LYS 80 CO 0.05 -0.64 0.00 0.41 -0.92 0.00 0.00 175.35 174.25 3dcs n GLY 81 N -0.47 -1.00 7.00 -3.33 0.00 -1.26 -0.22 105.19 105.91 3dcs n GLY 81 Ca 0.02 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.82 3dcs n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dcs n GLY 82 N 0.00 2.82 0.64 -0.02 0.00 -0.65 -1.50 105.19 106.48 3dcs n GLY 82 Ca 0.00 -0.31 0.07 0.00 0.00 0.00 0.00 46.02 45.79 3dcs n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3dcs n PRO 83 N 14.00 1.81 -3.30 1.61 -0.04 -1.26 -3.43 135.00 144.38 3dcs n PRO 83 Ca 0.00 -1.24 -0.36 0.00 -0.04 0.00 0.00 63.50 61.86 3dcs n PRO 83 Cb 0.00 -1.31 -0.06 0.00 -0.04 0.00 0.00 33.50 32.09 3dcs n PRO 83 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3dcs s LEU 84 N -1.16 4.38 -0.13 1.53 1.43 -0.56 -5.08 118.68 119.08 3dcs s LEU 84 Ca 0.27 1.17 0.00 0.00 -1.03 0.00 0.00 54.13 54.54 3dcs s LEU 84 Cb 0.14 -3.23 -0.01 0.00 0.03 0.00 0.00 46.19 43.11 3dcs s LEU 84 CO 0.19 0.13 -0.14 -1.81 0.23 0.00 0.00 176.35 174.95 3dcs s ASP 85 N -1.58 3.87 0.00 2.29 1.01 -1.26 -4.46 116.67 116.54 3dcs s ASP 85 Ca 0.37 -0.37 0.00 0.00 0.71 0.00 0.00 52.55 53.26 3dcs s ASP 85 Cb -0.16 -1.58 0.00 0.00 1.01 0.00 0.00 42.92 42.18 3dcs s ASP 85 CO 0.19 0.15 0.00 0.61 0.21 0.00 0.00 175.17 176.34 3dcs n GLY 86 N 3.61 -3.44 3.27 0.21 0.00 -1.26 -4.96 105.19 102.61 3dcs n GLY 86 Ca -0.18 -2.13 -0.28 0.00 0.00 0.00 0.00 46.02 43.43 3dcs n GLY 86 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dcs s THR 87 N -0.78 1.84 -0.14 2.61 -4.23 -1.26 -4.69 115.64 108.98 3dcs s THR 87 Ca 0.00 -1.11 0.02 0.00 -1.18 0.00 0.00 61.69 59.42 3dcs s THR 87 Cb 0.00 -1.55 0.00 0.00 1.34 0.00 0.00 72.50 72.29 3dcs s THR 87 CO 0.00 0.41 -0.20 -0.31 -0.54 0.00 0.00 174.62 173.98 3dcs s TYR 88 N -0.65 2.69 -0.02 3.99 1.51 -0.43 -1.45 117.35 123.00 3dcs s TYR 88 Ca 0.09 -1.20 -0.15 0.00 -1.01 0.00 0.00 57.07 54.80 3dcs s TYR 88 Cb -0.09 -1.82 -0.06 0.00 -0.11 0.00 0.00 41.96 39.88 3dcs s TYR 88 CO 0.00 -0.54 0.42 1.03 -1.11 0.00 0.00 175.55 175.36 3dcs s ARG 89 N 0.74 4.01 0.10 -0.62 0.52 0.08 -1.24 118.95 122.55 3dcs s ARG 89 Ca -0.08 0.43 -0.31 0.00 -0.52 0.00 0.00 55.73 55.25 3dcs s ARG 89 Cb -0.16 -3.26 -0.07 0.00 0.52 0.00 0.00 34.95 31.98 3dcs s ARG 89 CO 0.00 0.60 1.35 -1.17 0.02 0.00 0.00 175.30 176.10 3dcs s LEU 90 N -0.78 4.37 -0.05 2.53 2.96 -0.56 -0.89 118.68 126.26 3dcs s LEU 90 Ca 0.24 2.25 0.02 0.00 -0.22 0.00 0.00 54.13 56.42 3dcs s LEU 90 Cb -0.17 -3.58 -0.04 0.00 0.50 0.00 0.00 46.19 42.90 3dcs s LEU 90 CO 0.13 -0.62 -0.02 0.00 -1.32 0.00 0.00 176.35 174.52 3dcs n ILE 91 N 3.96 0.30 -3.60 6.68 3.06 -0.62 -4.51 119.36 124.64 3dcs n ILE 91 Ca 0.11 -0.14 -0.08 0.00 -2.50 0.00 0.00 62.75 60.14 3dcs n ILE 91 Cb 0.43 -0.77 -0.02 0.00 0.54 0.00 0.00 39.64 39.82 3dcs n ILE 91 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3dcs s GLN 92 N -2.11 1.20 0.13 9.51 -2.07 -1.23 -1.19 119.66 123.91 3dcs s GLN 92 Ca -0.05 -0.55 0.05 0.00 -1.82 0.00 0.00 55.36 52.99 3dcs s GLN 92 Cb 0.02 0.48 -0.04 0.00 -1.09 0.00 0.00 33.01 32.38 3dcs s GLN 92 CO 0.14 -0.54 -0.13 -0.59 -1.32 0.00 0.00 175.29 172.86 3dcs s PHE 93 N -3.47 1.35 0.29 9.60 -0.12 -0.69 -0.93 117.98 124.01 3dcs s PHE 93 Ca 0.07 -0.62 -0.11 0.00 -0.05 0.00 0.00 56.93 56.22 3dcs s PHE 93 Cb -0.02 -0.70 0.00 0.00 -0.63 0.00 0.00 43.02 41.68 3dcs s PHE 93 CO -0.05 0.13 0.52 -3.38 -0.05 0.00 0.00 175.22 172.39 3dcs s HIS 94 N -2.55 0.48 0.21 3.49 -3.43 -0.62 -0.72 115.29 112.15 3dcs s HIS 94 Ca 0.12 -0.85 0.08 0.00 -0.80 0.00 0.00 55.06 53.61 3dcs s HIS 94 Cb -0.02 0.22 -0.05 0.00 -1.43 0.00 0.00 32.58 31.30 3dcs s HIS 94 CO 0.02 -1.10 -0.15 -0.06 -2.00 0.00 0.00 174.74 171.45 3dcs s PHE 95 N -3.61 1.77 -0.04 0.38 0.40 -1.25 -0.68 117.98 114.95 3dcs s PHE 95 Ca 0.23 -0.54 0.05 0.00 -0.60 0.00 0.00 56.93 56.07 3dcs s PHE 95 Cb -0.01 -0.82 -0.01 0.00 0.51 0.00 0.00 43.02 42.69 3dcs s PHE 95 CO 0.12 0.40 -0.18 -1.01 0.70 0.00 0.00 175.22 175.24 3dcs s HIS 96 N -2.89 1.78 0.27 0.36 3.76 -0.37 -4.69 115.29 113.52 3dcs s HIS 96 Ca 0.23 -0.48 -0.06 0.00 -0.15 0.00 0.00 55.06 54.60 3dcs s HIS 96 Cb -0.01 -1.19 -0.01 0.00 1.11 0.00 0.00 32.58 32.48 3dcs s HIS 96 CO 0.08 -0.15 0.38 1.67 -0.85 0.00 0.00 174.74 175.87 3dcs s TRP 97 N -0.07 0.84 0.55 1.40 -2.14 -1.22 -0.58 118.94 117.72 3dcs s TRP 97 Ca -0.02 -1.11 0.05 0.00 2.66 0.00 0.00 56.10 57.68 3dcs s TRP 97 Cb -0.11 -0.12 0.04 0.00 -3.10 0.00 0.00 33.47 30.18 3dcs s TRP 97 CO 0.02 -0.95 0.36 0.20 -2.66 0.00 0.00 176.95 173.93 3dcs s GLY 98 N -3.14 2.46 0.34 3.67 0.00 -1.16 -1.33 107.32 108.17 3dcs s GLY 98 Ca 0.30 -1.10 0.23 0.00 0.00 0.00 0.00 44.72 44.16 3dcs s GLY 98 CO 0.14 -1.98 1.51 1.48 0.00 0.00 0.00 173.10 174.25 3dcs h SER 99 N 0.79 0.00 -4.71 1.64 4.64 -1.89 -3.39 113.55 110.63 3dcs h SER 99 Ca -0.37 -0.01 -0.29 0.00 -0.47 0.00 0.00 61.79 60.64 3dcs h SER 99 Cb 1.31 0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 63.19 3dcs h SER 99 CO 0.59 0.01 -0.74 -0.76 -0.87 0.00 0.00 176.83 175.06 3dcs s LEU 100 N -5.69 2.27 0.59 5.97 1.43 -1.26 -5.06 118.68 116.93 3dcs s LEU 100 Ca 0.06 -0.59 0.36 0.00 -1.03 0.00 0.00 54.13 52.93 3dcs s LEU 100 Cb 0.07 -0.21 1.84 0.00 0.03 0.00 0.00 46.19 47.93 3dcs s LEU 100 CO 0.68 -0.20 2.18 0.44 0.23 0.00 0.00 176.35 179.69 3dcs h ASP 101 N 4.38 0.00 -0.14 2.29 3.32 -1.93 -2.42 116.42 121.91 3dcs h ASP 101 Ca -0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.69 3dcs h ASP 101 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.75 3dcs h ASP 101 CO 0.42 0.04 0.00 0.61 -1.72 0.00 0.00 179.24 178.59 3dcs n GLY 102 N -0.72 0.06 3.50 2.75 0.00 -1.26 -3.72 105.19 105.80 3dcs n GLY 102 Ca -0.02 -0.17 -0.09 0.00 0.00 0.00 0.00 46.02 45.74 3dcs n GLY 102 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3dcs s GLN 103 N -1.72 1.35 0.00 1.61 -2.07 -0.91 -4.68 119.66 113.23 3dcs s GLN 103 Ca 0.10 -0.94 0.00 0.00 -1.82 0.00 0.00 55.36 52.70 3dcs s GLN 103 Cb 0.06 0.49 0.00 0.00 -1.09 0.00 0.00 33.01 32.47 3dcs s GLN 103 CO 0.06 -0.56 0.00 0.41 -1.32 0.00 0.00 175.29 173.88 3dcs n GLY 104 N -0.32 2.58 3.82 2.60 0.00 -1.10 -3.17 105.19 109.60 3dcs n GLY 104 Ca -0.09 -0.29 -0.32 0.00 0.00 0.00 0.00 46.02 45.32 3dcs n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dcs s SER 105 N -0.05 5.61 -0.18 1.61 1.04 -0.57 -3.43 113.70 117.73 3dcs s SER 105 Ca 0.00 1.67 -0.15 0.00 0.48 0.00 0.00 55.95 57.96 3dcs s SER 105 Cb 0.00 -2.51 -0.09 0.00 0.10 0.00 0.00 66.02 63.52 3dcs s SER 105 CO 0.00 -1.29 -0.09 -0.62 0.98 0.00 0.00 173.24 172.22 3dcs n GLU 106 N -2.67 0.51 -1.98 4.02 1.02 -1.26 -4.84 120.64 115.43 3dcs n GLU 106 Ca 0.08 0.48 -0.33 0.00 -0.02 0.00 0.00 57.16 57.37 3dcs n GLU 106 Cb 0.53 -1.66 0.02 0.00 -0.02 0.00 0.00 31.44 30.31 3dcs n GLU 106 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 3dcs s HIS 107 N -2.38 2.83 0.16 -0.32 3.76 -1.26 -4.43 115.29 113.65 3dcs s HIS 107 Ca -0.23 1.53 0.06 0.00 -0.15 0.00 0.00 55.06 56.27 3dcs s HIS 107 Cb 0.05 -3.09 -0.04 0.00 1.11 0.00 0.00 32.58 30.60 3dcs s HIS 107 CO 0.39 -1.35 -0.13 0.95 -0.85 0.00 0.00 174.74 173.75 3dcs s THR 108 N -2.33 1.43 -0.19 1.30 -4.23 -1.19 -4.71 115.64 105.72 3dcs s THR 108 Ca 0.66 -1.98 0.01 0.00 -1.18 0.00 0.00 61.69 59.20 3dcs s THR 108 Cb -0.18 -1.80 0.03 0.00 1.34 0.00 0.00 72.50 71.89 3dcs s THR 108 CO 0.37 -0.57 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.05 3dcs s VAL 109 N -2.75 1.81 -1.49 2.29 1.01 -0.81 -0.20 120.40 120.26 3dcs s VAL 109 Ca 0.16 -0.96 -0.03 0.00 0.00 0.00 0.00 61.98 61.15 3dcs s VAL 109 Cb -0.01 -1.76 0.02 0.00 0.00 0.00 0.00 36.38 34.63 3dcs s VAL 109 CO 0.04 0.33 0.35 0.47 0.00 0.00 0.00 175.10 176.28 3dcs n ASP 110 N 4.66 -0.32 0.00 3.32 8.00 -0.17 -0.47 116.55 131.57 3dcs n ASP 110 Ca -0.17 -1.09 0.00 0.00 0.71 0.00 0.00 54.79 54.24 3dcs n ASP 110 Cb 0.48 -2.60 0.00 0.00 -0.02 0.00 0.00 41.12 38.98 3dcs n ASP 110 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3dcs n LYS 111 N -4.44 -0.37 -2.41 -1.24 4.76 -1.26 -4.98 118.16 108.22 3dcs n LYS 111 Ca -0.26 0.09 -0.42 0.00 -2.87 0.00 0.00 58.31 54.85 3dcs n LYS 111 Cb 0.66 -4.29 -0.03 0.00 -1.84 0.00 0.00 35.03 29.53 3dcs n LYS 111 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 3dcs s LYS 112 N -1.02 4.47 0.07 1.97 2.20 0.38 -5.01 119.74 122.79 3dcs s LYS 112 Ca 0.00 1.80 -0.01 0.00 -0.36 0.00 0.00 55.97 57.40 3dcs s LYS 112 Cb 0.00 -3.30 -0.04 0.00 -1.51 0.00 0.00 37.83 32.97 3dcs s LYS 112 CO 0.00 -0.17 0.24 0.15 -0.36 0.00 0.00 175.35 175.21 3dcs s LYS 113 N 0.51 3.48 0.42 4.03 1.02 -1.26 -1.92 119.74 126.02 3dcs s LYS 113 Ca 0.56 -0.36 0.08 0.00 0.02 0.00 0.00 55.97 56.27 3dcs s LYS 113 Cb -0.31 -3.00 -0.02 0.00 -0.52 0.00 0.00 37.83 33.99 3dcs s LYS 113 CO 0.32 0.58 0.40 0.71 -0.92 0.00 0.00 175.35 176.44 3dcs s TYR 114 N -1.53 2.66 0.26 3.18 2.02 -1.26 -4.74 117.35 117.93 3dcs s TYR 114 Ca 0.36 -0.50 0.12 0.00 -0.37 0.00 0.00 57.07 56.67 3dcs s TYR 114 Cb -0.13 -2.18 0.40 0.00 -0.40 0.00 0.00 41.96 39.65 3dcs s TYR 114 CO 0.27 -0.17 1.63 0.00 -1.57 0.00 0.00 175.55 175.71 3dcs h ALA 115 N 0.98 0.98 -2.98 3.71 0.00 -1.41 -1.47 119.26 119.08 3dcs h ALA 115 Ca -0.41 -0.53 0.05 0.00 0.00 0.00 0.00 54.91 54.02 3dcs h ALA 115 Cb 1.27 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.91 3dcs h ALA 115 CO 0.56 0.73 0.19 0.00 0.00 0.00 0.00 179.25 180.74 3dcs s ALA 116 N -3.60 -1.07 -0.03 0.00 0.00 -1.16 -2.98 121.76 112.91 3dcs s ALA 116 Ca -0.01 -0.41 -0.01 0.00 0.00 0.00 0.00 51.96 51.53 3dcs s ALA 116 Cb 0.12 0.86 0.03 0.00 0.00 0.00 0.00 23.12 24.14 3dcs s ALA 116 CO 0.75 -1.02 0.06 -2.00 0.00 0.00 0.00 175.76 173.56 3dcs s GLU 117 N -3.83 -0.02 -0.17 0.00 2.12 0.25 -1.69 118.70 115.36 3dcs s GLU 117 Ca 0.13 0.27 -0.15 0.00 0.36 0.00 0.00 54.97 55.57 3dcs s GLU 117 Cb -0.05 -0.29 -0.04 0.00 0.26 0.00 0.00 34.13 34.01 3dcs s GLU 117 CO 0.08 -0.20 0.35 -1.17 -0.54 0.00 0.00 175.26 173.77 3dcs s LEU 118 N 1.34 4.21 -0.23 2.70 2.96 0.51 -1.24 118.68 128.93 3dcs s LEU 118 Ca -0.06 0.53 -0.04 0.00 -0.22 0.00 0.00 54.13 54.35 3dcs s LEU 118 Cb -0.13 -2.46 -0.00 0.00 0.50 0.00 0.00 46.19 44.11 3dcs s LEU 118 CO -0.04 0.02 -0.04 -1.00 -1.32 0.00 0.00 176.35 173.98 3dcs s HIS 119 N 0.82 2.99 -0.41 5.38 3.76 0.14 -0.72 115.29 127.25 3dcs s HIS 119 Ca 0.18 -1.04 -0.14 0.00 -0.15 0.00 0.00 55.06 53.91 3dcs s HIS 119 Cb -0.14 -2.11 0.03 0.00 1.11 0.00 0.00 32.58 31.47 3dcs s HIS 119 CO 0.06 -0.58 0.29 -0.51 -0.85 0.00 0.00 174.74 173.15 3dcs s LEU 120 N 1.46 5.08 -0.16 0.89 1.43 -0.29 -1.60 118.68 125.49 3dcs s LEU 120 Ca 0.05 -0.99 -0.16 0.00 -1.03 0.00 0.00 54.13 51.99 3dcs s LEU 120 Cb -0.15 -2.13 -0.04 0.00 0.03 0.00 0.00 46.19 43.90 3dcs s LEU 120 CO -0.03 -0.46 0.40 -0.69 0.23 0.00 0.00 176.35 175.79 3dcs s VAL 121 N 1.64 5.22 0.07 -1.59 1.01 -0.11 -0.89 120.40 125.75 3dcs s VAL 121 Ca 0.04 0.75 0.06 0.00 0.00 0.00 0.00 61.98 62.83 3dcs s VAL 121 Cb -0.20 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.42 3dcs s VAL 121 CO 0.09 0.31 -0.15 -1.00 0.00 0.00 0.00 175.10 174.35 3dcs s HIS 122 N 0.85 1.31 0.13 5.22 3.76 -0.38 -1.58 115.29 124.60 3dcs s HIS 122 Ca 0.21 -0.43 0.09 0.00 -0.15 0.00 0.00 55.06 54.77 3dcs s HIS 122 Cb -0.14 -0.74 -0.04 0.00 1.11 0.00 0.00 32.58 32.77 3dcs s HIS 122 CO 0.07 0.08 -0.21 1.67 -0.85 0.00 0.00 174.74 175.50 3dcs s TRP 123 N -1.18 1.88 -0.31 1.40 1.48 -0.06 -1.18 118.94 120.97 3dcs s TRP 123 Ca -0.00 -0.42 -0.29 0.00 -1.06 0.00 0.00 56.10 54.32 3dcs s TRP 123 Cb -0.10 -1.00 0.01 0.00 -1.16 0.00 0.00 33.47 31.23 3dcs s TRP 123 CO 0.02 0.27 1.14 1.21 -4.06 0.00 0.00 176.95 175.54 3dcs s ASN 124 N -2.17 6.86 0.17 -2.66 3.84 -0.08 -0.74 114.94 120.17 3dcs s ASN 124 Ca 0.11 1.12 0.18 0.00 0.21 0.00 0.00 52.86 54.47 3dcs s ASN 124 Cb -0.09 -2.54 0.81 0.00 -0.55 0.00 0.00 41.25 38.88 3dcs s ASN 124 CO 0.05 -0.93 1.56 0.35 -2.79 0.00 0.00 177.10 175.34 3dcs n THR 125 N 5.95 1.04 0.40 -5.21 -2.24 -0.53 -1.77 114.28 111.92 3dcs n THR 125 Ca 0.13 0.36 0.08 0.00 -2.27 0.00 0.00 64.05 62.35 3dcs n THR 125 Cb 0.47 -1.26 0.36 0.00 -2.10 0.00 0.00 70.33 67.80 3dcs n THR 125 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 3dcs n LYS 127 N -1.97 0.07 -0.05 -0.78 2.85 -1.26 -1.81 118.16 115.21 3dcs n LYS 127 Ca 0.02 0.35 0.12 0.00 -1.05 0.00 0.00 58.31 57.75 3dcs n LYS 127 Cb 0.15 -1.65 0.26 0.00 -0.65 0.00 0.00 35.03 33.14 3dcs n LYS 127 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 3dcs n TYR 128 N -1.79 0.14 0.00 5.58 4.01 -0.73 -4.98 117.16 119.39 3dcs n TYR 128 Ca 0.02 -0.07 0.00 0.00 -0.16 0.00 0.00 57.90 57.69 3dcs n TYR 128 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.20 3dcs n TYR 128 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3dcs n GLY 129 N 1.32 1.21 3.49 2.72 0.00 -0.75 -4.60 105.19 108.58 3dcs n GLY 129 Ca 0.17 -0.04 -0.10 0.00 0.00 0.00 0.00 46.02 46.05 3dcs n GLY 129 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3dcs s ASP 130 N 0.00 -0.05 0.15 1.61 1.47 -1.26 -5.06 116.67 113.52 3dcs s ASP 130 Ca 0.00 -0.94 -0.14 0.00 1.18 0.00 0.00 52.55 52.66 3dcs s ASP 130 Cb 0.00 0.54 0.02 0.00 -0.34 0.00 0.00 42.92 43.14 3dcs s ASP 130 CO 0.00 -1.06 1.65 0.15 0.68 0.00 0.00 175.17 176.59 3dcs h PHE 131 N 2.34 0.81 -0.30 2.11 3.57 -1.95 -2.27 116.94 121.25 3dcs h PHE 131 Ca -0.28 -0.10 0.04 0.00 3.53 0.00 0.00 57.97 61.15 3dcs h PHE 131 Cb 1.25 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 39.74 3dcs h PHE 131 CO 0.39 0.74 0.20 0.78 -2.23 0.00 0.00 178.31 178.19 3dcs h GLY 132 N 0.65 0.29 1.14 2.40 0.00 -1.97 -1.93 103.07 103.65 3dcs h GLY 132 Ca 0.15 -0.10 -0.25 0.00 0.00 0.00 0.00 47.33 47.14 3dcs h GLY 132 CO 0.00 0.09 -0.95 0.50 0.00 0.00 0.00 176.54 176.18 3dcs h LYS 133 N 0.25 0.67 -0.92 4.80 1.79 -1.78 -3.33 116.57 118.05 3dcs h LYS 133 Ca 0.13 -0.70 0.01 0.00 -2.18 0.00 0.00 60.65 57.91 3dcs h LYS 133 Cb 0.19 0.19 -0.05 0.00 -1.58 0.00 0.00 32.23 30.99 3dcs h LYS 133 CO -0.02 1.29 0.61 0.00 -1.08 0.00 0.00 179.45 180.24 3dcs h ALA 134 N 0.40 1.36 0.00 3.86 0.00 -0.80 -2.03 119.26 122.06 3dcs h ALA 134 Ca -0.11 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3dcs h ALA 134 Cb 1.61 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3dcs h ALA 134 CO 0.19 0.58 0.00 1.33 0.00 0.00 0.00 179.25 181.35 3dcs n VAL 135 N -4.41 1.03 1.02 0.00 0.24 -0.80 -1.55 118.33 113.87 3dcs n VAL 135 Ca 0.11 0.31 0.10 0.00 -2.04 0.00 0.00 64.34 62.82 3dcs n VAL 135 Cb 0.04 -1.18 0.31 0.00 -1.47 0.00 0.00 33.84 31.54 3dcs n VAL 135 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3dcs n GLN 136 N -1.86 1.85 -4.79 7.34 6.02 -0.76 -4.65 117.38 120.53 3dcs n GLN 136 Ca 0.02 -1.29 -0.30 0.00 -0.01 0.00 0.00 57.00 55.42 3dcs n GLN 136 Cb 0.17 -1.39 -0.14 0.00 1.02 0.00 0.00 30.24 29.90 3dcs n GLN 136 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 3dcs s GLN 137 N -1.69 1.89 0.58 -1.09 -1.52 -0.60 -5.01 119.66 112.22 3dcs s GLN 137 Ca 0.32 -1.07 0.33 0.00 -1.95 0.00 0.00 55.36 52.99 3dcs s GLN 137 Cb 0.17 -2.06 1.77 0.00 -0.22 0.00 0.00 33.01 32.67 3dcs s GLN 137 CO 0.25 0.52 2.17 -1.00 -0.25 0.00 0.00 175.29 176.98 3dcs h PRO 138 N 4.65 0.00 -0.42 2.91 0.13 -1.86 -1.83 132.00 135.59 3dcs h PRO 138 Ca -0.47 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.38 3dcs h PRO 138 Cb 1.15 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.09 3dcs h PRO 138 CO 0.45 0.05 -0.35 -0.40 -0.23 0.00 0.00 178.00 177.52 3dcs n ASP 139 N -3.46 3.34 0.04 1.44 5.75 -1.26 -4.21 116.55 118.18 3dcs n ASP 139 Ca -0.02 -3.82 -0.17 0.00 -0.01 0.00 0.00 54.79 50.78 3dcs n ASP 139 Cb 0.17 -0.55 -0.07 0.00 -1.03 0.00 0.00 41.12 39.65 3dcs n ASP 139 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 3dcs h GLY 140 N 1.42 0.68 -3.01 6.12 0.00 -1.21 -3.44 103.07 103.63 3dcs h GLY 140 Ca 0.23 -1.11 -0.57 0.00 0.00 0.00 0.00 47.33 45.88 3dcs h GLY 140 CO 0.48 0.99 -0.78 1.08 0.00 0.00 0.00 176.54 178.30 3dcs s LEU 141 N -8.05 2.47 -0.08 3.11 1.43 -0.10 -0.90 118.68 116.56 3dcs s LEU 141 Ca -0.08 -0.91 -0.01 0.00 -1.03 0.00 0.00 54.13 52.10 3dcs s LEU 141 Cb 0.08 -0.95 0.03 0.00 0.03 0.00 0.00 46.19 45.38 3dcs s LEU 141 CO 0.89 0.01 -0.02 0.00 0.23 0.00 0.00 176.35 177.46 3dcs s ALA 142 N -2.11 0.86 -0.16 4.21 0.00 -0.33 -1.29 121.76 122.94 3dcs s ALA 142 Ca 0.20 -0.23 -0.02 0.00 0.00 0.00 0.00 51.96 51.91 3dcs s ALA 142 Cb -0.06 -0.79 -0.02 0.00 0.00 0.00 0.00 23.12 22.26 3dcs s ALA 142 CO 0.09 -0.45 -0.08 0.08 0.00 0.00 0.00 175.76 175.40 3dcs s VAL 143 N 1.90 3.37 -0.25 0.00 1.01 -0.88 -1.24 120.40 124.32 3dcs s VAL 143 Ca 0.05 -0.53 -0.21 0.00 0.00 0.00 0.00 61.98 61.29 3dcs s VAL 143 Cb -0.12 -2.47 -0.02 0.00 0.00 0.00 0.00 36.38 33.77 3dcs s VAL 143 CO -0.06 0.49 0.66 -0.22 0.00 0.00 0.00 175.10 175.97 3dcs s LEU 144 N 0.67 4.07 -0.18 3.92 2.96 -0.07 -1.50 118.68 128.55 3dcs s LEU 144 Ca -0.04 0.77 -0.05 0.00 -0.22 0.00 0.00 54.13 54.58 3dcs s LEU 144 Cb -0.15 -2.91 -0.03 0.00 0.50 0.00 0.00 46.19 43.60 3dcs s LEU 144 CO 0.02 -0.38 0.01 -0.83 -1.32 0.00 0.00 176.35 173.86 3dcs s GLY 145 N 1.42 1.79 -0.07 7.98 0.00 0.49 -1.14 107.32 117.80 3dcs s GLY 145 Ca 0.28 -0.84 0.02 0.00 0.00 0.00 0.00 44.72 44.18 3dcs s GLY 145 CO 0.08 0.06 -0.12 -0.42 0.00 0.00 0.00 173.10 172.70 3dcs s ILE 146 N 0.53 1.14 0.33 0.90 1.01 0.10 -1.21 121.20 124.01 3dcs s ILE 146 Ca -0.00 -0.47 -0.26 0.00 0.00 0.00 0.00 60.65 59.92 3dcs s ILE 146 Cb -0.14 -1.05 -0.10 0.00 0.01 0.00 0.00 42.46 41.18 3dcs s ILE 146 CO 0.02 0.36 0.94 -0.36 0.00 0.00 0.00 174.94 175.90 3dcs s PHE 147 N 0.74 3.66 -0.14 3.97 0.08 -1.26 -0.36 117.98 124.67 3dcs s PHE 147 Ca -0.13 1.77 -0.01 0.00 0.12 0.00 0.00 56.93 58.68 3dcs s PHE 147 Cb -0.16 -2.92 -0.02 0.00 -0.57 0.00 0.00 43.02 39.36 3dcs s PHE 147 CO 0.03 0.18 -0.11 -0.51 -0.10 0.00 0.00 175.22 174.71 3dcs s LEU 148 N -2.15 2.83 0.12 -0.37 1.02 -0.68 -0.61 118.68 118.84 3dcs s LEU 148 Ca 0.51 -0.29 0.10 0.00 0.02 0.00 0.00 54.13 54.47 3dcs s LEU 148 Cb -0.18 -1.65 -0.04 0.00 0.02 0.00 0.00 46.19 44.34 3dcs s LEU 148 CO 0.23 0.16 -0.21 -1.59 0.02 0.00 0.00 176.35 174.96 3dcs s LYS 149 N 0.40 1.68 0.03 1.70 -2.85 -0.23 -1.69 119.74 118.78 3dcs s LYS 149 Ca -0.09 -1.22 -0.30 0.00 -1.00 0.00 0.00 55.97 53.36 3dcs s LYS 149 Cb -0.15 -2.05 -0.04 0.00 -2.06 0.00 0.00 37.83 33.52 3dcs s LYS 149 CO 0.05 0.47 1.03 0.08 0.10 0.00 0.00 175.35 177.08 3dcs s VAL 150 N -1.11 4.63 0.00 1.79 1.01 -1.26 -1.62 120.40 123.83 3dcs s VAL 150 Ca 0.17 1.92 0.00 0.00 0.00 0.00 0.00 61.98 64.07 3dcs s VAL 150 Cb -0.10 -4.23 0.00 0.00 0.00 0.00 0.00 36.38 32.04 3dcs s VAL 150 CO 0.09 0.17 0.00 0.61 0.00 0.00 0.00 175.10 175.97 3dcs n GLY 151 N 2.87 0.24 3.83 4.51 0.00 0.75 -4.90 105.19 112.49 3dcs n GLY 151 Ca 0.06 0.52 -0.31 0.00 0.00 0.00 0.00 46.02 46.29 3dcs n GLY 151 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dcs s SER 152 N 2.00 5.89 0.54 1.61 1.04 -1.26 -3.99 113.70 119.53 3dcs s SER 152 Ca 0.00 1.59 -0.19 0.00 0.48 0.00 0.00 55.95 57.83 3dcs s SER 152 Cb 0.00 -2.50 -0.06 0.00 0.10 0.00 0.00 66.02 63.56 3dcs s SER 152 CO 0.00 -1.10 1.12 0.00 0.98 0.00 0.00 173.24 174.24 3dcs s ALA 153 N -2.90 2.72 -0.37 5.32 0.00 -1.26 -2.27 121.76 122.99 3dcs s ALA 153 Ca 0.58 0.80 -0.11 0.00 0.00 0.00 0.00 51.96 53.23 3dcs s ALA 153 Cb -0.13 -3.35 0.03 0.00 0.00 0.00 0.00 23.12 19.67 3dcs s ALA 153 CO 0.47 -0.72 0.21 0.21 0.00 0.00 0.00 175.76 175.93 3dcs s LYS 154 N -3.29 2.85 0.23 0.00 2.47 -1.23 -4.80 119.74 115.97 3dcs s LYS 154 Ca 0.72 -1.06 -0.07 0.00 -1.56 0.00 0.00 55.97 54.00 3dcs s LYS 154 Cb -0.23 -3.73 0.29 0.00 -1.46 0.00 0.00 37.83 32.70 3dcs s LYS 154 CO 0.26 -0.69 1.84 -1.35 0.16 0.00 0.00 175.35 175.57 3dcs h PRO 155 N 8.44 0.83 0.00 4.03 0.11 -1.92 -1.37 132.00 142.13 3dcs h PRO 155 Ca -0.26 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.80 3dcs h PRO 155 Cb 1.11 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.03 3dcs h PRO 155 CO 0.67 0.55 0.00 0.41 -0.21 0.00 0.00 178.00 179.42 3dcs n GLY 156 N -1.31 -0.76 0.03 -0.55 0.00 -1.26 -1.76 105.19 99.59 3dcs n GLY 156 Ca 0.11 -0.03 0.11 0.00 0.00 0.00 0.00 46.02 46.20 3dcs n GLY 156 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3dcs n LEU 157 N -1.46 0.54 -0.08 0.99 7.94 -0.52 -4.52 117.00 119.90 3dcs n LEU 157 Ca 0.03 -0.04 0.00 0.00 -1.11 0.00 0.00 56.01 54.89 3dcs n LEU 157 Cb 0.10 -0.06 0.29 0.00 0.53 0.00 0.00 43.42 44.27 3dcs n LEU 157 CO 0.08 0.04 1.06 -0.61 -1.11 0.00 0.00 177.39 176.84 3dcs h GLN 158 N 0.00 0.70 -0.42 1.96 5.75 -1.38 -1.37 115.11 120.35 3dcs h GLN 158 Ca 0.00 -0.10 -0.01 0.00 -0.15 0.00 0.00 58.65 58.39 3dcs h GLN 158 Cb 0.79 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 29.19 3dcs h GLN 158 CO 0.00 0.58 0.24 0.87 -2.65 0.00 0.00 178.83 177.87 3dcs h LYS 159 N 0.70 0.57 -0.02 1.69 1.57 -1.79 0.21 116.57 119.50 3dcs h LYS 159 Ca 0.17 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.90 3dcs h LYS 159 Cb 0.14 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 3dcs h LYS 159 CO -0.02 0.42 -0.01 0.28 -0.57 0.00 0.00 179.45 179.56 3dcs h VAL 160 N 0.58 1.32 -0.74 0.50 2.07 -1.57 -3.15 116.25 115.26 3dcs h VAL 160 Ca 0.15 -0.96 0.03 0.00 0.82 0.00 0.00 66.70 66.74 3dcs h VAL 160 Cb 0.00 1.94 -0.04 0.00 -1.52 0.00 0.00 31.29 31.67 3dcs h VAL 160 CO -0.03 0.25 0.49 0.58 0.02 0.00 0.00 177.57 178.89 3dcs h VAL 161 N -0.36 1.14 0.00 2.57 2.07 -0.71 -2.17 116.25 118.79 3dcs h VAL 161 Ca 0.00 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.20 3dcs h VAL 161 Cb 0.41 0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 30.30 3dcs h VAL 161 CO 0.00 0.17 -0.03 0.44 0.02 0.00 0.00 177.57 178.18 3dcs h ASP 162 N 0.94 0.00 -0.39 0.57 3.32 -0.58 -2.88 116.42 117.41 3dcs h ASP 162 Ca 0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.34 3dcs h ASP 162 Cb -0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3dcs h ASP 162 CO -0.08 0.03 0.00 1.33 -1.72 0.00 0.00 179.24 178.80 3dcs n VAL 163 N -3.14 0.51 0.16 -1.35 0.24 -0.82 -4.47 118.33 109.46 3dcs n VAL 163 Ca 0.00 -0.76 0.03 0.00 -2.04 0.00 0.00 64.34 61.58 3dcs n VAL 163 Cb 0.29 0.98 0.43 0.00 -1.47 0.00 0.00 33.84 34.07 3dcs n VAL 163 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 3dcs h LEU 164 N 4.38 0.14 -2.22 1.34 3.38 -1.50 -1.56 115.31 119.28 3dcs h LEU 164 Ca 0.00 -0.03 0.01 0.00 0.09 0.00 0.00 57.88 57.96 3dcs h LEU 164 Cb 0.97 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 3dcs h LEU 164 CO 0.00 0.31 0.04 0.44 0.09 0.00 0.00 178.44 179.31 3dcs h ASP 165 N 0.15 0.00 0.80 -0.43 3.32 -1.81 -1.19 116.42 117.25 3dcs h ASP 165 Ca 0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 3dcs h ASP 165 Cb 0.35 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.90 3dcs h ASP 165 CO 0.02 0.00 -0.17 -1.54 -1.72 0.00 0.00 179.24 175.83 3dcs n SER 166 N -4.18 0.19 -2.46 6.45 3.41 -0.59 -3.93 113.62 112.52 3dcs n SER 166 Ca -0.02 0.19 -0.18 0.00 -0.26 0.00 0.00 58.87 58.60 3dcs n SER 166 Cb 0.13 -0.22 0.02 0.00 -0.26 0.00 0.00 64.21 63.88 3dcs n SER 166 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 3dcs n ILE 167 N -1.47 1.93 -0.04 -1.33 -5.35 -0.46 -4.75 119.36 107.90 3dcs n ILE 167 Ca 0.07 -4.02 -0.02 0.00 -0.27 0.00 0.00 62.75 58.52 3dcs n ILE 167 Cb 0.33 -0.40 0.24 0.00 -1.74 0.00 0.00 39.64 38.08 3dcs n ILE 167 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 3dcs h LYS 168 N 2.57 0.61 -6.11 6.28 3.64 -1.66 -3.41 116.57 118.49 3dcs h LYS 168 Ca 0.16 -0.15 -0.58 0.00 -1.27 0.00 0.00 60.65 58.81 3dcs h LYS 168 Cb 1.19 -0.08 -0.11 0.00 -0.41 0.00 0.00 32.23 32.83 3dcs h LYS 168 CO 0.64 0.65 -0.65 0.95 -2.27 0.00 0.00 179.45 178.77 3dcs s THR 169 N -4.94 2.85 0.18 1.00 -4.23 -1.26 -0.86 115.64 108.38 3dcs s THR 169 Ca -0.08 -2.02 -0.33 0.00 -1.18 0.00 0.00 61.69 58.07 3dcs s THR 169 Cb 0.15 -2.73 -0.14 0.00 1.34 0.00 0.00 72.50 71.12 3dcs s THR 169 CO 0.78 -0.29 1.48 1.17 -0.54 0.00 0.00 174.62 177.23 3dcs n LYS 170 N -0.88 1.98 -0.25 3.99 4.81 -0.23 -2.26 118.16 125.32 3dcs n LYS 170 Ca -0.05 0.71 0.00 0.00 -0.87 0.00 0.00 58.31 58.10 3dcs n LYS 170 Cb 0.61 -2.42 0.00 0.00 0.02 0.00 0.00 35.03 33.24 3dcs n LYS 170 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3dcs n GLY 171 N 2.83 1.56 3.76 3.14 0.00 0.28 -4.56 105.19 112.21 3dcs n GLY 171 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 3dcs n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dcs s LYS 172 N -0.33 4.63 0.05 1.61 -0.14 -0.96 -4.88 119.74 119.71 3dcs s LYS 172 Ca 0.00 1.56 -0.00 0.00 -1.36 0.00 0.00 55.97 56.17 3dcs s LYS 172 Cb 0.00 -3.04 -0.03 0.00 -1.68 0.00 0.00 37.83 33.07 3dcs s LYS 172 CO 0.00 0.27 -0.04 -1.54 -0.76 0.00 0.00 175.35 173.29 3dcs s SER 173 N -1.23 0.51 -0.03 2.83 1.04 -1.26 -0.92 113.70 114.64 3dcs s SER 173 Ca 0.47 -0.86 -0.08 0.00 0.48 0.00 0.00 55.95 55.96 3dcs s SER 173 Cb -0.26 0.16 0.01 0.00 0.10 0.00 0.00 66.02 66.03 3dcs s SER 173 CO 0.33 -0.50 0.17 0.00 0.98 0.00 0.00 173.24 174.22 3dcs s ALA 174 N -3.19 -0.41 0.19 5.32 0.00 -0.54 -4.96 121.76 118.17 3dcs s ALA 174 Ca 0.01 0.15 -0.33 0.00 0.00 0.00 0.00 51.96 51.80 3dcs s ALA 174 Cb 0.03 -0.05 -0.14 0.00 0.00 0.00 0.00 23.12 22.95 3dcs s ALA 174 CO -0.07 -0.17 1.40 -0.25 0.00 0.00 0.00 175.76 176.68 3dcs n ASP 175 N 2.01 2.47 -3.14 0.00 8.00 -1.26 -0.95 116.55 123.68 3dcs n ASP 175 Ca -0.19 1.12 -0.20 0.00 0.71 0.00 0.00 54.79 56.23 3dcs n ASP 175 Cb 0.57 -1.36 -0.05 0.00 -0.02 0.00 0.00 41.12 40.25 3dcs n ASP 175 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 3dcs n PHE 176 N 2.31 -1.38 -3.11 1.24 7.35 -0.18 -4.72 117.46 118.97 3dcs n PHE 176 Ca 0.14 -2.97 -0.22 0.00 -0.76 0.00 0.00 57.45 53.65 3dcs n PHE 176 Cb 0.28 0.33 0.01 0.00 0.35 0.00 0.00 39.48 40.45 3dcs n PHE 176 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 3dcs s THR 177 N -0.28 3.95 -1.88 -2.13 -4.23 -1.26 -3.19 115.64 106.62 3dcs s THR 177 Ca 0.33 -0.66 0.00 0.00 -1.18 0.00 0.00 61.69 60.18 3dcs s THR 177 Cb 0.12 -3.43 0.00 0.00 1.34 0.00 0.00 72.50 70.53 3dcs s THR 177 CO -0.15 -0.26 0.00 0.59 -0.54 0.00 0.00 174.62 174.26 3dcs n ASN 178 N -1.96 -5.68 -4.72 3.99 4.13 -1.26 -4.96 115.26 104.81 3dcs n ASN 178 Ca 0.01 0.15 -0.41 0.00 1.68 0.00 0.00 54.58 56.02 3dcs n ASN 178 Cb 0.58 -4.82 -0.04 0.00 -1.54 0.00 0.00 39.78 33.96 3dcs n ASN 178 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 3dcs s PHE 179 N -2.93 3.62 -0.36 3.10 5.36 -1.26 -5.01 117.98 120.50 3dcs s PHE 179 Ca 0.00 1.44 -0.12 0.00 -0.96 0.00 0.00 56.93 57.29 3dcs s PHE 179 Cb 0.00 -2.93 0.01 0.00 -0.34 0.00 0.00 43.02 39.77 3dcs s PHE 179 CO 0.00 0.07 0.22 0.34 -1.46 0.00 0.00 175.22 174.38 3dcs s ASP 180 N 0.81 5.79 0.00 6.13 -1.08 -1.26 -4.46 116.67 122.61 3dcs s ASP 180 Ca 0.43 -0.83 0.16 0.00 -0.52 0.00 0.00 52.55 51.79 3dcs s ASP 180 Cb -0.19 -2.05 0.69 0.00 -1.46 0.00 0.00 42.92 39.90 3dcs s ASP 180 CO 0.22 -0.34 1.50 -0.81 0.52 0.00 0.00 175.17 176.26 3dcs n PRO 181 N 5.03 0.03 0.29 4.34 -0.04 -1.26 -2.86 135.00 140.54 3dcs n PRO 181 Ca -0.12 0.22 0.15 0.00 -0.04 0.00 0.00 63.50 63.71 3dcs n PRO 181 Cb 0.47 -1.50 0.90 0.00 -0.04 0.00 0.00 33.50 33.34 3dcs n PRO 181 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3dcs h ARG 182 N 0.00 0.00 0.00 0.54 3.08 -1.93 -1.56 114.38 114.51 3dcs h ARG 182 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3dcs h ARG 182 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.30 3dcs h ARG 182 CO 0.00 0.02 0.00 0.41 -1.07 0.00 0.00 179.97 179.33 3dcs n GLY 183 N -1.18 -0.77 0.65 0.04 0.00 -1.13 -2.64 105.19 100.16 3dcs n GLY 183 Ca -0.03 -0.13 0.09 0.00 0.00 0.00 0.00 46.02 45.96 3dcs n GLY 183 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3dcs n LEU 184 N -1.08 2.33 -4.84 0.99 4.77 -0.59 -4.32 117.00 114.26 3dcs n LEU 184 Ca 0.14 -0.95 -0.35 0.00 -0.03 0.00 0.00 56.01 54.83 3dcs n LEU 184 Cb 0.10 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.13 3dcs n LEU 184 CO 0.13 0.41 0.30 -0.76 -1.33 0.00 0.00 177.39 176.15 3dcs s LEU 185 N -1.66 4.28 1.05 2.23 1.43 -1.08 -4.96 118.68 119.98 3dcs s LEU 185 Ca 0.20 1.17 -0.15 0.00 -1.03 0.00 0.00 54.13 54.32 3dcs s LEU 185 Cb 0.15 -3.51 0.22 0.00 0.03 0.00 0.00 46.19 43.07 3dcs s LEU 185 CO 0.28 0.02 1.14 -2.16 0.23 0.00 0.00 176.35 175.85 3dcs s PRO 186 N -2.21 -0.03 0.13 1.29 0.04 -1.26 -4.96 135.00 127.99 3dcs s PRO 186 Ca 0.43 0.13 -0.12 0.00 0.04 0.00 0.00 61.00 61.48 3dcs s PRO 186 Cb -0.14 -1.72 -0.09 0.00 0.04 0.00 0.00 34.50 32.59 3dcs s PRO 186 CO 0.20 -2.96 1.40 1.49 0.04 0.00 0.00 177.00 177.17 3dcs h GLU 187 N -2.04 0.88 -5.83 4.56 4.81 -1.93 -3.44 114.58 111.59 3dcs h GLU 187 Ca -0.49 -0.57 -0.65 0.00 -0.13 0.00 0.00 59.36 57.52 3dcs h GLU 187 Cb 1.31 0.07 -0.07 0.00 0.63 0.00 0.00 28.75 30.69 3dcs h GLU 187 CO 0.48 1.20 -0.51 0.45 -0.73 0.00 0.00 179.01 179.90 3dcs s SER 188 N -6.97 6.19 -0.25 1.04 0.15 -1.26 -5.00 113.70 107.59 3dcs s SER 188 Ca -0.11 0.32 0.13 0.00 0.70 0.00 0.00 55.95 56.99 3dcs s SER 188 Cb 0.10 -1.92 0.69 0.00 -1.71 0.00 0.00 66.02 63.19 3dcs s SER 188 CO 0.89 0.29 1.66 0.18 1.20 0.00 0.00 173.24 177.46 3dcs n LEU 189 N 1.19 5.22 -4.75 3.45 4.77 -1.26 -4.71 117.00 120.90 3dcs n LEU 189 Ca -0.13 -3.12 -0.36 0.00 -0.03 0.00 0.00 56.01 52.36 3dcs n LEU 189 Cb 0.53 -0.66 0.04 0.00 -2.33 0.00 0.00 43.42 40.99 3dcs n LEU 189 CO 0.40 0.75 0.86 -1.81 -1.33 0.00 0.00 177.39 176.26 3dcs s ASP 190 N -1.34 5.20 0.17 -1.43 1.01 -1.26 -4.74 116.67 114.28 3dcs s ASP 190 Ca 0.51 2.45 -0.14 0.00 0.71 0.00 0.00 52.55 56.07 3dcs s ASP 190 Cb 0.40 -2.60 0.02 0.00 1.01 0.00 0.00 42.92 41.74 3dcs s ASP 190 CO 0.12 -1.59 0.42 -0.72 0.21 0.00 0.00 175.17 173.61 3dcs s TYR 191 N -1.54 0.05 0.14 4.23 -0.85 -1.26 -1.82 117.35 116.30 3dcs s TYR 191 Ca 0.77 -0.40 0.06 0.00 -0.52 0.00 0.00 57.07 56.97 3dcs s TYR 191 Cb -0.32 0.22 -0.04 0.00 0.38 0.00 0.00 41.96 42.20 3dcs s TYR 191 CO 0.35 -0.82 0.02 -1.58 -1.52 0.00 0.00 175.55 172.01 3dcs s TRP 192 N -3.90 2.95 -0.04 -3.49 0.51 0.19 -1.27 118.94 113.89 3dcs s TRP 192 Ca 0.11 -0.08 -0.10 0.00 -2.12 0.00 0.00 56.10 53.92 3dcs s TRP 192 Cb 0.01 -1.46 0.02 0.00 -0.81 0.00 0.00 33.47 31.23 3dcs s TRP 192 CO -0.03 0.50 0.22 -0.08 -0.51 0.00 0.00 176.95 177.06 3dcs s THR 193 N -1.58 0.04 0.05 2.01 -1.32 0.03 -0.85 115.64 114.02 3dcs s THR 193 Ca 0.27 -0.36 -0.24 0.00 -1.21 0.00 0.00 61.69 60.16 3dcs s THR 193 Cb -0.10 -0.44 0.06 0.00 -1.51 0.00 0.00 72.50 70.50 3dcs s THR 193 CO 0.19 -0.20 0.57 -0.72 -2.21 0.00 0.00 174.62 172.25 3dcs s TYR 194 N -0.76 -0.49 0.05 9.09 1.13 -1.06 -1.41 117.35 123.90 3dcs s TYR 194 Ca -0.09 0.57 -0.29 0.00 -1.41 0.00 0.00 57.07 55.85 3dcs s TYR 194 Cb -0.05 0.40 -0.04 0.00 -1.10 0.00 0.00 41.96 41.17 3dcs s TYR 194 CO 0.02 -0.68 0.94 -1.25 -2.51 0.00 0.00 175.55 172.07 3dcs s PRO 195 N -2.47 4.61 0.00 -3.49 0.04 -1.26 -1.34 135.00 131.09 3dcs s PRO 195 Ca -0.05 1.38 0.00 0.00 0.04 0.00 0.00 61.00 62.37 3dcs s PRO 195 Cb -0.01 -3.42 0.00 0.00 0.04 0.00 0.00 34.50 31.12 3dcs s PRO 195 CO -0.02 0.09 0.00 0.41 0.04 0.00 0.00 177.00 177.52 3dcs n GLY 196 N 2.60 4.41 3.27 0.56 0.00 0.22 -4.86 105.19 111.38 3dcs n GLY 196 Ca 0.04 -0.55 -0.15 0.00 0.00 0.00 0.00 46.02 45.36 3dcs n GLY 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dcs s SER 197 N 1.60 0.86 0.57 1.61 1.04 -1.13 -2.56 113.70 115.69 3dcs s SER 197 Ca 0.00 -1.46 -0.19 0.00 0.48 0.00 0.00 55.95 54.77 3dcs s SER 197 Cb 0.00 0.35 -0.04 0.00 0.10 0.00 0.00 66.02 66.42 3dcs s SER 197 CO 0.00 -0.85 1.19 -0.76 0.98 0.00 0.00 173.24 173.80 3dcs s LEU 198 N -3.27 3.72 0.00 2.42 1.43 -0.54 -4.53 118.68 117.91 3dcs s LEU 198 Ca 0.38 2.34 0.16 0.00 -1.03 0.00 0.00 54.13 55.98 3dcs s LEU 198 Cb 0.06 -4.56 0.26 0.00 0.03 0.00 0.00 46.19 41.98 3dcs s LEU 198 CO 0.15 -1.45 1.16 0.35 0.23 0.00 0.00 176.35 176.79 3dcs n THR 199 N -1.42 0.42 -4.43 5.49 -2.24 -1.26 -4.42 114.28 106.42 3dcs n THR 199 Ca 0.13 -0.71 -0.22 0.00 -2.27 0.00 0.00 64.05 60.97 3dcs n THR 199 Cb 0.50 0.98 -0.10 0.00 -2.10 0.00 0.00 70.33 69.61 3dcs n THR 199 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3dcs s THR 200 N -1.19 2.22 0.33 4.28 -4.23 -1.26 -4.72 115.64 111.07 3dcs s THR 200 Ca 0.25 -2.33 -0.27 0.00 -1.18 0.00 0.00 61.69 58.16 3dcs s THR 200 Cb 0.15 -2.23 -0.13 0.00 1.34 0.00 0.00 72.50 71.63 3dcs s THR 200 CO 0.21 -0.45 0.99 -2.65 -0.54 0.00 0.00 174.62 172.17 3dcs n PRO 201 N -0.55 1.33 -0.02 3.99 -0.02 -1.26 -0.87 135.00 137.60 3dcs n PRO 201 Ca -0.06 0.47 0.04 0.00 -2.02 0.00 0.00 63.50 61.93 3dcs n PRO 201 Cb 0.60 -1.89 0.19 0.00 -0.02 0.00 0.00 33.50 32.39 3dcs n PRO 201 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3dcs n PRO 202 N 0.56 1.12 -2.10 0.52 -0.04 -1.26 -5.01 135.00 128.79 3dcs n PRO 202 Ca 0.09 -0.19 -0.18 0.00 -0.04 0.00 0.00 63.50 63.18 3dcs n PRO 202 Cb 0.35 -1.13 -0.03 0.00 -0.04 0.00 0.00 33.50 32.64 3dcs n PRO 202 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3dcs n LEU 203 N -0.43 -1.68 -4.78 1.53 4.77 -0.05 -4.92 117.00 111.45 3dcs n LEU 203 Ca 0.06 0.12 -0.41 0.00 -0.03 0.00 0.00 56.01 55.75 3dcs n LEU 203 Cb 0.07 -2.60 -0.00 0.00 -2.33 0.00 0.00 43.42 38.55 3dcs n LEU 203 CO 0.04 -0.41 1.11 -0.76 -1.33 0.00 0.00 177.39 176.04 3dcs s LEU 204 N -4.90 4.32 -1.25 2.23 1.43 -1.26 -4.41 118.68 114.84 3dcs s LEU 204 Ca 0.00 2.99 -0.09 0.00 -1.03 0.00 0.00 54.13 56.01 3dcs s LEU 204 Cb 0.00 -3.68 0.19 0.00 0.03 0.00 0.00 46.19 42.73 3dcs s LEU 204 CO 0.00 -0.84 1.78 -0.62 0.23 0.00 0.00 176.35 176.90 3dcs n GLU 205 N 0.47 3.72 -0.10 1.70 1.02 -1.26 -1.47 120.64 124.73 3dcs n GLU 205 Ca 0.01 -3.70 0.04 0.00 -0.02 0.00 0.00 57.16 53.49 3dcs n GLU 205 Cb 0.40 -2.87 0.06 0.00 -0.02 0.00 0.00 31.44 29.00 3dcs n GLU 205 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3dcs s VAL 207 N -1.49 2.65 -0.48 0.00 1.01 -1.06 -0.92 120.40 120.11 3dcs s VAL 207 Ca 0.13 -0.82 -0.22 0.00 0.00 0.00 0.00 61.98 61.07 3dcs s VAL 207 Cb 0.11 -2.07 0.03 0.00 0.00 0.00 0.00 36.38 34.46 3dcs s VAL 207 CO 0.01 0.55 0.75 -0.89 0.00 0.00 0.00 175.10 175.52 3dcs s THR 208 N 0.20 4.68 0.01 3.92 2.01 -0.41 0.70 115.64 126.74 3dcs s THR 208 Ca -0.11 0.15 -0.26 0.00 0.31 0.00 0.00 61.69 61.78 3dcs s THR 208 Cb -0.16 -4.34 -0.04 0.00 0.01 0.00 0.00 72.50 67.97 3dcs s THR 208 CO 0.06 -0.79 0.81 0.26 -0.69 0.00 0.00 174.62 174.27 3dcs s TRP 209 N 3.20 3.68 -0.29 4.92 0.52 -0.45 -2.06 118.94 128.45 3dcs s TRP 209 Ca 0.25 1.48 0.02 0.00 0.02 0.00 0.00 56.10 57.87 3dcs s TRP 209 Cb -0.14 -2.90 0.08 0.00 -1.15 0.00 0.00 33.47 29.37 3dcs s TRP 209 CO 0.19 0.15 0.00 0.42 0.02 0.00 0.00 176.95 177.74 3dcs s ILE 210 N 0.42 1.75 -0.22 2.03 1.01 -0.56 -2.55 121.20 123.08 3dcs s ILE 210 Ca 0.42 -1.70 -0.04 0.00 0.00 0.00 0.00 60.65 59.32 3dcs s ILE 210 Cb -0.20 -2.15 -0.01 0.00 0.01 0.00 0.00 42.46 40.11 3dcs s ILE 210 CO 0.23 -0.38 -0.02 -0.69 0.00 0.00 0.00 174.94 174.08 3dcs s VAL 211 N 1.23 3.59 0.21 2.92 1.01 -0.03 -0.38 120.40 128.96 3dcs s VAL 211 Ca 0.03 -0.42 -0.30 0.00 0.00 0.00 0.00 61.98 61.29 3dcs s VAL 211 Cb -0.19 -2.64 -0.08 0.00 0.00 0.00 0.00 36.38 33.47 3dcs s VAL 211 CO -0.10 0.41 1.01 -0.76 0.00 0.00 0.00 175.10 175.67 3dcs s LEU 212 N 1.39 4.57 0.20 3.92 1.43 -0.35 -0.64 118.68 129.20 3dcs s LEU 212 Ca 0.05 2.02 -0.06 0.00 -1.03 0.00 0.00 54.13 55.11 3dcs s LEU 212 Cb -0.14 -3.61 0.14 0.00 0.03 0.00 0.00 46.19 42.61 3dcs s LEU 212 CO -0.01 -0.03 1.64 0.50 0.23 0.00 0.00 176.35 178.68 3dcs h LYS 213 N 4.53 0.92 -5.47 1.70 3.64 -1.70 -3.43 116.57 116.76 3dcs h LYS 213 Ca -0.45 -0.33 -0.61 0.00 -1.27 0.00 0.00 60.65 57.99 3dcs h LYS 213 Cb 1.21 -0.07 -0.12 0.00 -0.41 0.00 0.00 32.23 32.84 3dcs h LYS 213 CO 0.69 0.98 0.12 -2.00 -2.27 0.00 0.00 179.45 176.97 3dcs s GLU 214 N -4.81 4.08 0.76 1.90 2.12 -1.26 -5.02 118.70 116.46 3dcs s GLU 214 Ca -0.10 0.46 -0.11 0.00 0.36 0.00 0.00 54.97 55.58 3dcs s GLU 214 Cb 0.13 -3.66 0.05 0.00 0.26 0.00 0.00 34.13 30.91 3dcs s GLU 214 CO 0.85 -0.41 1.08 -2.14 -0.54 0.00 0.00 175.26 174.09 3dcs s PRO 215 N 2.47 2.39 0.16 4.30 0.02 -1.26 -4.66 135.00 138.41 3dcs s PRO 215 Ca 0.25 0.84 0.04 0.00 0.02 0.00 0.00 61.00 62.15 3dcs s PRO 215 Cb -0.15 -1.94 -0.04 0.00 0.02 0.00 0.00 34.50 32.39 3dcs s PRO 215 CO 0.09 -1.46 0.18 0.96 -0.33 0.00 0.00 177.00 176.44 3dcs s ILE 216 N -3.06 4.75 -0.08 2.83 -4.36 0.21 -4.90 121.20 116.58 3dcs s ILE 216 Ca 0.60 -0.95 -0.01 0.00 -0.26 0.00 0.00 60.65 60.03 3dcs s ILE 216 Cb -0.15 -3.43 -0.03 0.00 1.25 0.00 0.00 42.46 40.10 3dcs s ILE 216 CO 0.55 -0.10 -0.04 -0.94 0.24 0.00 0.00 174.94 174.65 3dcs s SER 217 N -3.13 4.91 0.27 4.36 1.04 -1.26 -1.07 113.70 118.83 3dcs s SER 217 Ca 0.32 0.04 0.07 0.00 0.48 0.00 0.00 55.95 56.86 3dcs s SER 217 Cb -0.10 -1.34 -0.06 0.00 0.10 0.00 0.00 66.02 64.62 3dcs s SER 217 CO 0.25 0.35 -0.07 0.68 0.98 0.00 0.00 173.24 175.43 3dcs s VAL 218 N -0.75 1.71 0.54 5.02 -7.23 -0.64 -3.56 120.40 115.49 3dcs s VAL 218 Ca 0.11 -2.15 -0.04 0.00 -1.81 0.00 0.00 61.98 58.10 3dcs s VAL 218 Cb -0.11 -2.41 0.00 0.00 0.56 0.00 0.00 36.38 34.43 3dcs s VAL 218 CO 0.02 -0.33 0.82 -0.94 -0.31 0.00 0.00 175.10 174.35 3dcs s SER 219 N -3.44 5.67 0.29 4.85 1.04 -1.05 -0.18 113.70 120.88 3dcs s SER 219 Ca 0.29 0.55 -0.02 0.00 0.48 0.00 0.00 55.95 57.24 3dcs s SER 219 Cb 0.03 -1.63 0.42 0.00 0.10 0.00 0.00 66.02 64.94 3dcs s SER 219 CO 0.12 -0.94 1.95 0.77 0.98 0.00 0.00 173.24 176.12 3dcs h SER 220 N 0.03 0.99 -0.85 7.02 4.64 -1.92 -2.09 113.55 121.36 3dcs h SER 220 Ca -0.46 -0.02 -0.03 0.00 -0.47 0.00 0.00 61.79 60.82 3dcs h SER 220 Cb 1.26 -0.24 -0.04 0.00 -0.31 0.00 0.00 62.40 63.07 3dcs h SER 220 CO 0.59 0.70 0.43 -0.33 -0.87 0.00 0.00 176.83 177.36 3dcs h GLU 221 N 1.16 1.21 0.35 4.77 3.07 -1.95 0.54 114.58 123.73 3dcs h GLU 221 Ca 0.33 -0.16 -0.02 0.00 -0.50 0.00 0.00 59.36 59.01 3dcs h GLU 221 Cb -0.08 -0.23 0.00 0.00 -0.84 0.00 0.00 28.75 27.61 3dcs h GLU 221 CO -0.08 0.91 -0.17 1.96 -1.40 0.00 0.00 179.01 180.23 3dcs h GLN 222 N 1.21 -0.46 -0.03 2.33 4.20 -1.77 -2.93 115.11 117.66 3dcs h GLN 222 Ca 0.30 0.03 -0.05 0.00 0.06 0.00 0.00 58.65 58.99 3dcs h GLN 222 Cb 0.08 0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.96 3dcs h GLN 222 CO -0.04 -0.24 -0.22 0.28 -0.67 0.00 0.00 178.83 177.94 3dcs h VAL 223 N -0.57 1.17 -0.97 -0.54 2.07 -1.27 -2.27 116.25 113.87 3dcs h VAL 223 Ca -0.05 -0.82 0.10 0.00 0.82 0.00 0.00 66.70 66.76 3dcs h VAL 223 Cb 0.42 1.40 -0.07 0.00 -1.52 0.00 0.00 31.29 31.52 3dcs h VAL 223 CO 0.08 0.24 0.62 -0.07 0.02 0.00 0.00 177.57 178.46 3dcs h LEU 224 N 0.04 0.92 -1.32 2.57 -0.00 -0.72 -1.37 115.31 115.43 3dcs h LEU 224 Ca 0.01 0.03 -0.02 0.00 -0.00 0.00 0.00 57.88 57.90 3dcs h LEU 224 Cb 0.42 -0.16 -0.03 0.00 -0.00 0.00 0.00 40.66 40.89 3dcs h LEU 224 CO 0.03 0.53 0.25 0.11 -0.00 0.00 0.00 178.44 179.36 3dcs h LYS 225 N 1.01 0.71 -0.78 1.13 1.79 -1.24 -1.83 116.57 117.36 3dcs h LYS 225 Ca 0.46 -0.08 0.03 0.00 -2.18 0.00 0.00 60.65 58.88 3dcs h LYS 225 Cb 0.39 -0.14 -0.05 0.00 -1.58 0.00 0.00 32.23 30.85 3dcs h LYS 225 CO -0.21 0.55 0.49 0.74 -1.08 0.00 0.00 179.45 179.94 3dcs h PHE 226 N 0.72 0.92 0.00 -1.35 -1.00 -1.27 -2.19 116.94 112.77 3dcs h PHE 226 Ca 0.18 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.99 3dcs h PHE 226 Cb 0.07 -0.30 0.00 0.00 3.61 0.00 0.00 35.95 39.32 3dcs h PHE 226 CO 0.01 0.52 0.00 0.54 -1.61 0.00 0.00 178.31 177.77 3dcs n ARG 227 N -4.61 0.39 0.00 1.51 1.74 -0.70 -2.30 116.66 112.69 3dcs n ARG 227 Ca 0.09 0.07 0.12 0.00 -0.77 0.00 0.00 57.85 57.36 3dcs n ARG 227 Cb 0.10 -1.50 0.15 0.00 -1.02 0.00 0.00 32.46 30.18 3dcs n ARG 227 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3dcs n LYS 228 N -1.17 1.26 -1.29 5.56 5.02 -0.82 -4.49 118.16 122.23 3dcs n LYS 228 Ca 0.11 -0.96 -0.29 0.00 -2.02 0.00 0.00 58.31 55.15 3dcs n LYS 228 Cb 0.11 -1.48 0.16 0.00 -0.02 0.00 0.00 35.03 33.80 3dcs n LYS 228 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3dcs s LEU 229 N -2.40 1.80 -0.02 -0.35 1.43 -0.97 -4.87 118.68 113.30 3dcs s LEU 229 Ca 0.22 1.16 0.05 0.00 -1.03 0.00 0.00 54.13 54.53 3dcs s LEU 229 Cb 0.19 -3.41 -0.01 0.00 0.03 0.00 0.00 46.19 42.98 3dcs s LEU 229 CO 0.51 -2.89 -0.16 0.20 0.23 0.00 0.00 176.35 174.24 3dcs s ASN 230 N -3.63 1.94 0.24 2.29 0.02 -0.04 -0.11 114.94 115.64 3dcs s ASN 230 Ca 0.65 -0.30 0.09 0.00 -1.02 0.00 0.00 52.86 52.28 3dcs s ASN 230 Cb -0.17 -0.30 0.23 0.00 0.02 0.00 0.00 41.25 41.03 3dcs s ASN 230 CO 0.56 0.18 1.54 -0.26 0.02 0.00 0.00 177.10 179.15 3dcs h PHE 231 N 5.88 0.02 -4.31 2.20 0.04 -1.39 -3.36 116.94 116.02 3dcs h PHE 231 Ca -0.35 -0.01 -0.51 0.00 2.80 0.00 0.00 57.97 59.90 3dcs h PHE 231 Cb 1.16 -0.00 0.06 0.00 2.20 0.00 0.00 35.95 39.36 3dcs h PHE 231 CO 0.41 0.71 0.40 0.54 -0.60 0.00 0.00 178.31 179.76 3dcs s ASN 232 N -6.82 6.19 0.72 2.17 4.22 -1.26 -4.40 114.94 115.76 3dcs s ASN 232 Ca -0.01 1.37 -0.09 0.00 -2.14 0.00 0.00 52.86 51.99 3dcs s ASN 232 Cb 0.12 -2.42 0.05 0.00 1.28 0.00 0.00 41.25 40.28 3dcs s ASN 232 CO 0.78 -0.88 1.07 -0.83 -2.04 0.00 0.00 177.10 175.20 3dcs s GLY 233 N -4.19 1.63 0.35 0.45 0.00 -1.26 -1.06 107.32 103.23 3dcs s GLY 233 Ca 0.55 -0.67 -0.28 0.00 0.00 0.00 0.00 44.72 44.31 3dcs s GLY 233 CO 0.53 -0.27 1.37 -2.21 0.00 0.00 0.00 173.10 172.52 3dcs n GLU 234 N -3.02 2.31 -0.21 2.90 2.13 -1.26 -2.03 120.64 121.47 3dcs n GLU 234 Ca 0.07 0.81 0.00 0.00 0.66 0.00 0.00 57.16 58.70 3dcs n GLU 234 Cb 0.59 -2.45 0.00 0.00 0.27 0.00 0.00 31.44 29.85 3dcs n GLU 234 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3dcs n GLY 235 N 0.80 2.10 3.93 8.31 0.00 -1.26 -5.01 105.19 114.06 3dcs n GLY 235 Ca 0.04 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.81 3dcs n GLY 235 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dcs s GLU 236 N -0.17 3.39 0.27 1.61 2.02 -0.86 -5.05 118.70 119.91 3dcs s GLU 236 Ca 0.00 -0.19 -0.31 0.00 0.02 0.00 0.00 54.97 54.49 3dcs s GLU 236 Cb 0.00 -2.54 -0.12 0.00 0.10 0.00 0.00 34.13 31.58 3dcs s GLU 236 CO 0.00 -0.08 1.63 -2.30 0.02 0.00 0.00 175.26 174.52 3dcs n PRO 237 N -2.03 2.71 -2.19 0.39 -0.02 -1.26 -4.91 135.00 127.70 3dcs n PRO 237 Ca -0.01 0.97 -0.42 0.00 -2.02 0.00 0.00 63.50 62.01 3dcs n PRO 237 Cb 0.56 -2.77 -0.03 0.00 -0.02 0.00 0.00 33.50 31.25 3dcs n PRO 237 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 3dcs s GLU 238 N -0.09 4.28 -0.16 -0.52 2.12 -1.26 -4.76 118.70 118.31 3dcs s GLU 238 Ca 0.67 2.01 -0.02 0.00 0.36 0.00 0.00 54.97 57.99 3dcs s GLU 238 Cb -0.50 -3.54 0.05 0.00 0.26 0.00 0.00 34.13 30.40 3dcs s GLU 238 CO 0.44 -0.57 -0.00 -1.21 -0.54 0.00 0.00 175.26 173.38 3dcs s GLU 239 N 2.28 0.94 0.34 4.30 0.41 -1.26 -5.06 118.70 120.64 3dcs s GLU 239 Ca 0.65 -0.37 -0.28 0.00 -0.41 0.00 0.00 54.97 54.55 3dcs s GLU 239 Cb -0.33 -1.87 -0.10 0.00 -1.78 0.00 0.00 34.13 30.06 3dcs s GLU 239 CO 0.27 -0.50 1.28 -0.51 -0.49 0.00 0.00 175.26 175.31 3dcs s LEU 240 N 1.79 4.41 -0.89 1.80 1.43 -1.26 -1.14 118.68 124.81 3dcs s LEU 240 Ca 0.01 2.63 -0.25 0.00 -1.03 0.00 0.00 54.13 55.48 3dcs s LEU 240 Cb -0.16 -3.69 0.04 0.00 0.03 0.00 0.00 46.19 42.42 3dcs s LEU 240 CO -0.07 -0.53 1.37 -0.32 0.23 0.00 0.00 176.35 177.03 3dcs s MET 241 N -1.82 3.41 0.05 1.70 -2.45 0.84 -4.64 119.30 116.39 3dcs s MET 241 Ca 0.49 -0.74 -0.03 0.00 -1.25 0.00 0.00 55.69 54.16 3dcs s MET 241 Cb -0.38 -4.83 -0.02 0.00 1.25 0.00 0.00 34.83 30.84 3dcs s MET 241 CO 0.51 -2.18 0.03 0.14 1.05 0.00 0.00 175.02 174.57 3dcs s VAL 242 N 5.27 0.17 -1.33 10.11 -7.23 -1.26 -4.50 120.40 121.63 3dcs s VAL 242 Ca 0.41 -1.39 -0.03 0.00 -1.81 0.00 0.00 61.98 59.16 3dcs s VAL 242 Cb -0.04 -1.12 0.02 0.00 0.56 0.00 0.00 36.38 35.80 3dcs s VAL 242 CO 0.01 -0.77 0.87 0.47 -0.31 0.00 0.00 175.10 175.37 3dcs n ASP 243 N 0.51 -2.56 -2.95 4.85 8.00 -0.44 -4.86 116.55 119.11 3dcs n ASP 243 Ca -0.17 -0.74 -0.35 0.00 0.71 0.00 0.00 54.79 54.25 3dcs n ASP 243 Cb 0.60 -4.38 -0.01 0.00 -0.02 0.00 0.00 41.12 37.30 3dcs n ASP 243 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 3dcs n ASN 244 N -3.03 7.17 -4.26 -2.24 6.94 -1.13 -4.91 115.26 113.80 3dcs n ASN 244 Ca -0.21 -3.41 -0.25 0.00 -0.02 0.00 0.00 54.58 50.69 3dcs n ASN 244 Cb 0.64 -1.21 -0.14 0.00 -2.36 0.00 0.00 39.78 36.71 3dcs n ASN 244 CO 0.00 0.00 0.00 -1.66 -1.03 0.00 0.00 177.26 174.57 3dcs s TRP 245 N -2.52 1.84 -0.06 -2.53 1.48 -1.26 -4.63 118.94 111.27 3dcs s TRP 245 Ca 0.54 -0.38 -0.13 0.00 -1.06 0.00 0.00 56.10 55.06 3dcs s TRP 245 Cb 0.33 -1.08 -0.05 0.00 -1.16 0.00 0.00 33.47 31.51 3dcs s TRP 245 CO -0.23 0.12 0.34 0.50 -4.06 0.00 0.00 176.95 173.62 3dcs s ARG 246 N -1.34 3.90 0.77 3.25 3.52 -1.26 -4.98 118.95 122.80 3dcs s ARG 246 Ca 0.08 0.26 -0.12 0.00 -0.13 0.00 0.00 55.73 55.81 3dcs s ARG 246 Cb -0.09 -3.26 0.06 0.00 -1.56 0.00 0.00 34.95 30.10 3dcs s ARG 246 CO 0.02 0.61 1.11 -2.14 -0.81 0.00 0.00 175.30 174.10 3dcs s PRO 247 N -0.74 2.16 0.31 5.12 0.02 -1.26 -4.68 135.00 135.93 3dcs s PRO 247 Ca 0.21 1.33 -0.29 0.00 0.02 0.00 0.00 61.00 62.27 3dcs s PRO 247 Cb -0.15 -1.88 -0.13 0.00 0.02 0.00 0.00 34.50 32.37 3dcs s PRO 247 CO 0.10 -1.74 1.31 0.00 -0.33 0.00 0.00 177.00 176.34 3dcs n ALA 248 N -3.34 1.15 -2.73 -1.55 0.00 -1.26 -4.38 120.51 108.40 3dcs n ALA 248 Ca 0.10 0.38 -0.25 0.00 0.00 0.00 0.00 53.44 53.67 3dcs n ALA 248 Cb 0.52 -2.25 -0.06 0.00 0.00 0.00 0.00 19.45 17.67 3dcs n ALA 248 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3dcs s GLN 249 N -1.40 2.64 0.31 0.00 -1.52 0.02 -4.96 119.66 114.76 3dcs s GLN 249 Ca 0.60 -1.08 -0.30 0.00 -1.95 0.00 0.00 55.36 52.63 3dcs s GLN 249 Cb -0.60 -2.45 -0.11 0.00 -0.22 0.00 0.00 33.01 29.62 3dcs s GLN 249 CO 0.58 0.43 1.58 -2.30 -0.25 0.00 0.00 175.29 175.34 3dcs n PRO 250 N -0.56 2.72 0.05 2.91 -0.02 -1.26 -4.57 135.00 134.26 3dcs n PRO 250 Ca -0.08 0.96 -0.06 0.00 -2.02 0.00 0.00 63.50 62.30 3dcs n PRO 250 Cb 0.56 -2.74 0.13 0.00 -0.02 0.00 0.00 33.50 31.43 3dcs n PRO 250 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3dcs h LEU 251 N 4.47 0.41 0.00 2.45 5.85 -1.95 -3.44 115.31 123.10 3dcs h LEU 251 Ca -0.48 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.04 3dcs h LEU 251 Cb 1.23 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.14 3dcs h LEU 251 CO 0.77 0.85 0.00 0.29 -0.34 0.00 0.00 178.44 180.00 3dcs n LYS 252 N -3.96 0.00 -0.67 1.25 5.02 -1.26 -3.14 118.16 115.40 3dcs n LYS 252 Ca -0.02 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.20 3dcs n LYS 252 Cb 0.56 0.00 -0.09 0.00 -0.02 0.00 0.00 35.03 35.48 3dcs n LYS 252 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 3dcs n ASN 253 N -0.45 4.31 -4.26 4.39 2.85 -1.26 -4.83 115.26 116.01 3dcs n ASN 253 Ca 0.00 -2.25 -0.22 0.00 -0.11 0.00 0.00 54.58 52.00 3dcs n ASN 253 Cb 0.00 -1.08 -0.12 0.00 1.24 0.00 0.00 39.78 39.82 3dcs n ASN 253 CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 3dcs s ARG 254 N 1.02 1.06 -0.08 1.20 0.52 -1.19 -5.13 118.95 116.36 3dcs s ARG 254 Ca 0.36 -1.14 0.03 0.00 -0.52 0.00 0.00 55.73 54.46 3dcs s ARG 254 Cb 0.17 -1.24 -0.02 0.00 0.52 0.00 0.00 34.95 34.38 3dcs s ARG 254 CO 0.00 0.28 -0.17 -1.14 0.02 0.00 0.00 175.30 174.29 3dcs s GLN 255 N -1.96 2.81 -0.10 3.54 2.00 -1.26 -5.04 119.66 119.65 3dcs s GLN 255 Ca 0.05 -0.76 -0.17 0.00 -2.00 0.00 0.00 55.36 52.48 3dcs s GLN 255 Cb -0.09 -2.39 -0.05 0.00 0.80 0.00 0.00 33.01 31.28 3dcs s GLN 255 CO 0.04 0.41 0.45 0.42 -0.50 0.00 0.00 175.29 176.11 3dcs s ILE 256 N -0.19 5.17 0.07 -2.34 1.01 -1.26 -4.71 121.20 118.95 3dcs s ILE 256 Ca -0.01 0.90 0.04 0.00 0.00 0.00 0.00 60.65 61.58 3dcs s ILE 256 Cb -0.13 -3.79 -0.04 0.00 0.01 0.00 0.00 42.46 38.51 3dcs s ILE 256 CO 0.03 0.37 0.01 -0.54 0.00 0.00 0.00 174.94 174.82 3dcs s LYS 257 N 0.33 2.66 0.01 2.79 1.02 -0.50 -1.06 119.74 124.99 3dcs s LYS 257 Ca 0.25 -0.76 0.06 0.00 0.02 0.00 0.00 55.97 55.54 3dcs s LYS 257 Cb -0.15 -2.60 -0.03 0.00 -0.52 0.00 0.00 37.83 34.52 3dcs s LYS 257 CO 0.10 0.56 -0.17 0.00 -0.92 0.00 0.00 175.35 174.92 3dcs s ALA 258 N -1.27 2.60 -2.17 5.17 0.00 0.76 -0.79 121.76 126.05 3dcs s ALA 258 Ca 0.25 -1.12 0.28 0.00 0.00 0.00 0.00 51.96 51.37 3dcs s ALA 258 Cb -0.12 -0.80 0.99 0.00 0.00 0.00 0.00 23.12 23.19 3dcs s ALA 258 CO 0.17 0.57 1.71 -1.13 0.00 0.00 0.00 175.76 177.08 3dcs n SER 259 N 1.83 1.21 -4.02 0.00 3.41 -0.39 -0.99 113.62 114.67 3dcs n SER 259 Ca -0.16 -1.21 -0.10 0.00 -0.26 0.00 0.00 58.87 57.13 3dcs n SER 259 Cb 0.52 0.04 -0.11 0.00 -0.26 0.00 0.00 64.21 64.40 3dcs n SER 259 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 3dcs s PHE 260 N -2.20 0.44 -0.96 7.33 -0.71 -1.26 -4.89 117.98 115.72 3dcs s PHE 260 Ca 0.33 -0.59 0.08 0.00 -1.04 0.00 0.00 56.93 55.71 3dcs s PHE 260 Cb 0.20 -0.29 0.06 0.00 -1.21 0.00 0.00 43.02 41.79 3dcs s PHE 260 CO 0.41 -0.18 0.74 1.17 -1.34 0.00 0.00 175.22 176.03