#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i90 n HIS 4 N 0.00 2.17 -1.01 4.41 -0.00 -1.26 -4.93 115.22 114.60 1i90 n HIS 4 Ca 0.00 0.48 -0.31 0.00 -0.00 0.00 0.00 57.72 57.88 1i90 n HIS 4 Cb 0.00 -2.37 0.13 0.00 -0.00 0.00 0.00 29.99 27.74 1i90 n HIS 4 CO 0.00 0.00 0.00 1.67 -0.00 0.00 0.00 176.34 178.01 1i90 s TRP 5 N -1.23 2.04 0.00 1.57 1.48 -1.26 -4.94 118.94 116.60 1i90 s TRP 5 Ca 0.63 1.68 0.00 0.00 -1.06 0.00 0.00 56.10 57.36 1i90 s TRP 5 Cb -0.48 -3.24 0.00 0.00 -1.16 0.00 0.00 33.47 28.59 1i90 s TRP 5 CO 0.56 -2.38 0.00 0.41 -4.06 0.00 0.00 176.95 171.48 1i90 n GLY 6 N -0.32 2.93 0.01 3.67 0.00 -0.16 -5.03 105.19 106.29 1i90 n GLY 6 Ca 0.11 -0.63 0.01 0.00 0.00 0.00 0.00 46.02 45.50 1i90 n GLY 6 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1i90 n TYR 7 N 0.00 0.00 -2.09 1.61 4.01 -1.26 -3.60 117.16 115.83 1i90 n TYR 7 Ca 0.00 -0.48 -0.28 0.00 -0.16 0.00 0.00 57.90 56.98 1i90 n TYR 7 Cb 0.00 -0.05 0.14 0.00 -0.31 0.00 0.00 39.34 39.12 1i90 n TYR 7 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1i90 s GLY 8 N -1.03 1.74 0.29 2.72 0.00 -1.26 -4.62 107.32 105.15 1i90 s GLY 8 Ca 0.02 -1.18 0.01 0.00 0.00 0.00 0.00 44.72 43.58 1i90 s GLY 8 CO 0.00 -0.54 1.86 0.50 0.00 0.00 0.00 173.10 174.92 1i90 h LYS 9 N -1.20 0.97 0.00 2.90 1.79 -1.97 0.16 116.57 119.22 1i90 h LYS 9 Ca -0.43 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 57.98 1i90 h LYS 9 Cb 1.27 -0.22 0.00 0.00 -1.58 0.00 0.00 32.23 31.70 1i90 h LYS 9 CO 0.46 0.64 -0.58 0.72 -1.08 0.00 0.00 179.45 179.61 1i90 n HIS 10 N -4.57 0.03 -1.63 -1.35 8.25 -1.26 -4.37 115.22 110.32 1i90 n HIS 10 Ca 0.17 0.01 0.00 0.00 -0.26 0.00 0.00 57.72 57.64 1i90 n HIS 10 Cb 0.32 -0.25 0.00 0.00 1.12 0.00 0.00 29.99 31.18 1i90 n HIS 10 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1i90 n ASN 11 N -1.54 0.00 -2.63 0.41 6.94 -1.10 -4.97 115.26 112.36 1i90 n ASN 11 Ca 0.05 -1.55 -0.09 0.00 -0.02 0.00 0.00 54.58 52.97 1i90 n ASN 11 Cb 0.34 -0.11 0.06 0.00 -2.36 0.00 0.00 39.78 37.72 1i90 n ASN 11 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1i90 n GLY 12 N 0.00 -1.62 0.31 4.83 0.00 0.56 -0.99 105.19 108.29 1i90 n GLY 12 Ca 0.00 -1.62 0.14 0.00 0.00 0.00 0.00 46.02 44.54 1i90 n GLY 12 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1i90 h PRO 13 N 0.00 0.13 0.00 1.61 0.11 -1.85 0.18 132.00 132.17 1i90 h PRO 13 Ca -0.13 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.98 1i90 h PRO 13 Cb 0.36 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.44 1i90 h PRO 13 CO 0.09 0.08 0.00 -0.85 -0.21 0.00 0.00 178.00 177.11 1i90 n GLU 14 N -5.31 0.05 -0.00 1.05 0.00 -1.26 -2.07 120.64 113.10 1i90 n GLU 14 Ca 0.22 0.31 0.05 0.00 0.00 0.00 0.00 57.16 57.73 1i90 n GLU 14 Cb 0.72 -1.50 -0.07 0.00 0.00 0.00 0.00 31.44 30.59 1i90 n GLU 14 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 1i90 n HIS 15 N -1.39 0.00 -0.27 -1.84 8.25 0.61 -4.69 115.22 115.89 1i90 n HIS 15 Ca 0.02 0.00 0.18 0.00 -0.26 0.00 0.00 57.72 57.66 1i90 n HIS 15 Cb 0.06 -0.18 0.47 0.00 1.12 0.00 0.00 29.99 31.47 1i90 n HIS 15 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 1i90 h TRP 16 N 0.00 0.65 -0.58 4.41 6.55 -1.24 -2.23 115.95 123.52 1i90 h TRP 16 Ca 0.00 0.02 0.14 0.00 0.95 0.00 0.00 58.89 60.00 1i90 h TRP 16 Cb 0.40 -0.20 -0.03 0.00 -0.86 0.00 0.00 29.16 28.47 1i90 h TRP 16 CO 0.00 0.16 0.40 1.12 -1.05 0.00 0.00 178.44 179.07 1i90 h HIS 17 N 0.48 0.19 -0.86 0.49 2.07 -1.77 0.35 115.15 116.10 1i90 h HIS 17 Ca 0.50 0.01 0.03 0.00 -2.85 0.00 0.00 60.37 58.06 1i90 h HIS 17 Cb 1.14 -0.06 -0.05 0.00 2.57 0.00 0.00 27.41 31.00 1i90 h HIS 17 CO -0.00 0.08 0.55 0.87 -3.07 0.00 0.00 177.93 176.36 1i90 h LYS 18 N 0.17 1.05 0.00 5.12 1.57 -1.76 -2.20 116.57 120.52 1i90 h LYS 18 Ca 0.28 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.97 1i90 h LYS 18 Cb 0.86 -0.24 -0.00 0.00 0.08 0.00 0.00 32.23 32.93 1i90 h LYS 18 CO -0.04 0.69 -2.01 -0.25 -0.57 0.00 0.00 179.45 177.26 1i90 n ASP 19 N -4.55 0.05 -3.70 0.86 8.00 -0.89 -4.65 116.55 111.67 1i90 n ASP 19 Ca 0.11 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.33 1i90 n ASP 19 Cb 0.09 1.92 -0.11 0.00 -0.02 0.00 0.00 41.12 43.00 1i90 n ASP 19 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1i90 n PHE 20 N -2.28 1.74 0.30 1.24 3.72 0.06 -4.96 117.46 117.28 1i90 n PHE 20 Ca -0.06 -3.95 0.15 0.00 -0.05 0.00 0.00 57.45 53.54 1i90 n PHE 20 Cb 0.60 -0.31 0.78 0.00 -0.94 0.00 0.00 39.48 39.62 1i90 n PHE 20 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1i90 h PRO 21 N 5.43 0.00 0.00 -1.08 0.13 -1.63 -0.06 132.00 134.79 1i90 h PRO 21 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 1i90 h PRO 21 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 1i90 h PRO 21 CO 0.59 0.00 0.00 1.51 -0.23 0.00 0.00 178.00 179.87 1i90 n ILE 22 N -2.74 1.05 0.15 -3.56 0.13 -1.26 -2.67 119.36 110.47 1i90 n ILE 22 Ca -0.02 0.36 0.17 0.00 -1.10 0.00 0.00 62.75 62.16 1i90 n ILE 22 Cb 0.31 -1.27 0.76 0.00 -0.84 0.00 0.00 39.64 38.61 1i90 n ILE 22 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1i90 h ALA 23 N 2.25 2.04 -0.70 1.51 0.00 -1.32 0.17 119.26 123.21 1i90 h ALA 23 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1i90 h ALA 23 Cb 0.22 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1i90 h ALA 23 CO 0.00 -0.36 0.00 1.63 0.00 0.00 0.00 179.25 180.52 1i90 n LYS 24 N -4.08 3.31 -0.40 0.00 5.02 -1.09 -4.96 118.16 115.96 1i90 n LYS 24 Ca 0.03 -2.81 -0.21 0.00 -2.02 0.00 0.00 58.31 53.31 1i90 n LYS 24 Cb 0.38 -1.76 0.19 0.00 -0.02 0.00 0.00 35.03 33.82 1i90 n LYS 24 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1i90 n GLY 25 N 1.38 -3.35 0.07 0.72 0.00 0.58 -5.00 105.19 99.58 1i90 n GLY 25 Ca 0.26 -1.36 -0.07 0.00 0.00 0.00 0.00 46.02 44.84 1i90 n GLY 25 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1i90 h GLU 26 N 0.00 0.01 -2.16 1.61 4.39 -1.95 -3.37 114.58 113.12 1i90 h GLU 26 Ca -0.27 -0.02 -0.56 0.00 0.34 0.00 0.00 59.36 58.84 1i90 h GLU 26 Cb 0.89 0.01 -0.41 0.00 -0.10 0.00 0.00 28.75 29.13 1i90 h GLU 26 CO 0.17 0.98 -0.79 2.89 -1.16 0.00 0.00 179.01 181.10 1i90 n ARG 27 N -3.40 2.68 -3.21 2.33 1.85 -1.26 -4.63 116.66 111.03 1i90 n ARG 27 Ca -0.00 -4.47 -0.35 0.00 -1.00 0.00 0.00 57.85 52.03 1i90 n ARG 27 Cb 0.91 -2.10 -0.06 0.00 -1.05 0.00 0.00 32.46 30.17 1i90 n ARG 27 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 1i90 s GLN 28 N -3.23 4.08 0.25 2.89 -1.52 -1.26 -2.45 119.66 118.43 1i90 s GLN 28 Ca 0.46 0.67 0.11 0.00 -1.95 0.00 0.00 55.36 54.65 1i90 s GLN 28 Cb 0.31 -2.77 -0.05 0.00 -0.22 0.00 0.00 33.01 30.27 1i90 s GLN 28 CO -0.13 0.36 -0.19 -1.12 -0.25 0.00 0.00 175.29 173.96 1i90 s SER 29 N -1.87 3.30 0.95 5.90 0.01 -1.26 -4.67 113.70 116.06 1i90 s SER 29 Ca 0.44 -1.01 -0.11 0.00 1.31 0.00 0.00 55.95 56.58 1i90 s SER 29 Cb -0.14 -0.25 0.17 0.00 0.21 0.00 0.00 66.02 66.00 1i90 s SER 29 CO 0.20 -0.01 1.01 -0.81 0.41 0.00 0.00 173.24 174.04 1i90 n PRO 30 N -0.46 -0.86 -4.00 12.44 -0.04 -1.26 -4.47 135.00 136.35 1i90 n PRO 30 Ca -0.07 -1.71 -0.09 0.00 -0.04 0.00 0.00 63.50 61.60 1i90 n PRO 30 Cb 0.60 -1.00 -0.08 0.00 -0.04 0.00 0.00 33.50 32.98 1i90 n PRO 30 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1i90 s VAL 31 N -3.16 0.13 -0.03 0.52 -7.23 -1.26 0.53 120.40 109.90 1i90 s VAL 31 Ca 0.59 -1.52 -0.27 0.00 -1.81 0.00 0.00 61.98 58.96 1i90 s VAL 31 Cb -0.02 -1.66 -0.03 0.00 0.56 0.00 0.00 36.38 35.23 1i90 s VAL 31 CO 0.41 -0.59 0.85 -0.62 -0.31 0.00 0.00 175.10 174.84 1i90 s ASP 32 N -2.94 7.20 -0.49 4.85 2.15 -1.26 -3.46 116.67 122.71 1i90 s ASP 32 Ca 0.13 1.45 -0.18 0.00 0.43 0.00 0.00 52.55 54.37 1i90 s ASP 32 Cb 0.06 -2.50 0.06 0.00 -0.30 0.00 0.00 42.92 40.23 1i90 s ASP 32 CO -0.05 -0.19 0.57 -0.63 -0.17 0.00 0.00 175.17 174.69 1i90 s ILE 33 N 0.91 4.96 -0.63 4.11 1.01 0.12 -4.94 121.20 126.74 1i90 s ILE 33 Ca 0.46 -0.58 -0.25 0.00 0.00 0.00 0.00 60.65 60.28 1i90 s ILE 33 Cb -0.20 -4.25 0.05 0.00 0.01 0.00 0.00 42.46 38.07 1i90 s ILE 33 CO 0.24 -0.73 1.05 -0.62 0.00 0.00 0.00 174.94 174.87 1i90 s ASP 34 N 2.60 6.26 0.63 3.58 -1.08 -1.26 -0.71 116.67 126.70 1i90 s ASP 34 Ca 0.13 -0.51 0.35 0.00 -0.52 0.00 0.00 52.55 52.00 1i90 s ASP 34 Cb -0.20 -2.47 1.93 0.00 -1.46 0.00 0.00 42.92 40.72 1i90 s ASP 34 CO 0.11 -1.45 2.08 0.71 0.52 0.00 0.00 175.17 177.15 1i90 h THR 35 N 6.02 0.00 -0.01 1.71 1.35 -1.94 -0.71 112.91 119.33 1i90 h THR 35 Ca -0.27 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 1i90 h THR 35 Cb 1.07 0.79 0.00 0.00 -1.73 0.00 0.00 68.15 68.27 1i90 h THR 35 CO 1.17 0.00 -0.39 1.41 -0.25 0.00 0.00 175.52 177.46 1i90 n HIS 36 N -2.89 0.00 0.10 4.73 8.25 -1.26 -4.06 115.22 120.08 1i90 n HIS 36 Ca -0.02 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.46 1i90 n HIS 36 Cb 0.21 -0.12 -0.03 0.00 1.12 0.00 0.00 29.99 31.18 1i90 n HIS 36 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1i90 n THR 37 N -0.76 0.00 -2.06 1.59 -1.04 -0.36 -5.00 114.28 106.66 1i90 n THR 37 Ca 0.10 -0.26 -0.41 0.00 -2.04 0.00 0.00 64.05 61.44 1i90 n THR 37 Cb 0.36 0.72 -0.02 0.00 -1.82 0.00 0.00 70.33 69.57 1i90 n THR 37 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1i90 s ALA 38 N -1.80 3.61 -0.36 2.41 0.00 -0.69 -4.81 121.76 120.11 1i90 s ALA 38 Ca 0.00 1.28 -0.20 0.00 0.00 0.00 0.00 51.96 53.04 1i90 s ALA 38 Cb 0.03 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.61 1i90 s ALA 38 CO 0.17 -0.70 0.60 0.21 0.00 0.00 0.00 175.76 176.04 1i90 s LYS 39 N -0.31 3.65 0.18 0.00 2.47 0.17 -4.82 119.74 121.07 1i90 s LYS 39 Ca 0.59 -0.02 -0.32 0.00 -1.56 0.00 0.00 55.97 54.66 1i90 s LYS 39 Cb -0.41 -3.81 -0.10 0.00 -1.46 0.00 0.00 37.83 32.05 1i90 s LYS 39 CO 0.42 -0.72 1.59 -0.47 0.16 0.00 0.00 175.35 176.33 1i90 s TYR 40 N 2.62 3.03 -0.25 4.03 5.04 -1.26 -0.36 117.35 130.21 1i90 s TYR 40 Ca 0.23 0.60 0.01 0.00 -2.44 0.00 0.00 57.07 55.47 1i90 s TYR 40 Cb -0.15 -3.96 0.07 0.00 0.35 0.00 0.00 41.96 38.27 1i90 s TYR 40 CO 0.14 -3.53 -0.03 0.34 -1.34 0.00 0.00 175.55 171.13 1i90 s ASP 41 N 1.10 3.89 0.53 4.32 -1.08 0.42 -4.82 116.67 121.03 1i90 s ASP 41 Ca 0.70 -1.27 0.35 0.00 -0.52 0.00 0.00 52.55 51.81 1i90 s ASP 41 Cb -0.45 -1.16 1.70 0.00 -1.46 0.00 0.00 42.92 41.55 1i90 s ASP 41 CO 0.32 -0.26 2.05 -0.65 0.52 0.00 0.00 175.17 177.15 1i90 h PRO 42 N 7.95 0.00 -0.00 4.34 0.11 -1.93 -2.44 132.00 140.02 1i90 h PRO 42 Ca -0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.95 1i90 h PRO 42 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1i90 h PRO 42 CO 0.42 0.00 -0.05 -1.13 -0.21 0.00 0.00 178.00 177.03 1i90 n SER 43 N -2.85 0.16 -4.67 -2.05 3.41 -1.26 -4.80 113.62 101.55 1i90 n SER 43 Ca -0.01 -0.19 -0.43 0.00 -0.26 0.00 0.00 58.87 57.99 1i90 n SER 43 Cb 0.17 -0.23 -0.02 0.00 -0.26 0.00 0.00 64.21 63.87 1i90 n SER 43 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1i90 s LEU 44 N -2.62 4.19 0.67 1.04 1.43 -0.92 -5.03 118.68 117.44 1i90 s LEU 44 Ca 0.26 1.55 -0.11 0.00 -1.03 0.00 0.00 54.13 54.80 1i90 s LEU 44 Cb 0.20 -3.55 -0.01 0.00 0.03 0.00 0.00 46.19 42.87 1i90 s LEU 44 CO 0.49 -0.61 1.05 -0.54 0.23 0.00 0.00 176.35 176.97 1i90 s LYS 45 N 2.76 3.12 0.67 1.70 3.01 -1.24 -4.96 119.74 124.80 1i90 s LYS 45 Ca 0.49 0.89 -0.14 0.00 -1.01 0.00 0.00 55.97 56.21 1i90 s LYS 45 Cb -0.19 -2.02 0.00 0.00 -1.01 0.00 0.00 37.83 34.62 1i90 s LYS 45 CO 0.14 -0.95 1.08 -1.25 0.51 0.00 0.00 175.35 174.88 1i90 s PRO 46 N -5.09 2.87 0.44 -1.68 0.04 -1.26 -2.82 135.00 127.49 1i90 s PRO 46 Ca 0.57 1.21 -0.23 0.00 0.04 0.00 0.00 61.00 62.59 1i90 s PRO 46 Cb -0.13 -1.97 -0.08 0.00 0.04 0.00 0.00 34.50 32.36 1i90 s PRO 46 CO 0.55 -1.17 1.14 -0.51 0.04 0.00 0.00 177.00 177.04 1i90 s LEU 47 N -5.09 4.07 -0.35 -3.56 1.43 -1.26 -1.77 118.68 112.14 1i90 s LEU 47 Ca 0.63 2.24 0.03 0.00 -1.03 0.00 0.00 54.13 56.00 1i90 s LEU 47 Cb -0.17 -4.20 0.10 0.00 0.03 0.00 0.00 46.19 41.95 1i90 s LEU 47 CO 0.45 -0.78 0.08 -0.55 0.23 0.00 0.00 176.35 175.79 1i90 s SER 48 N -1.38 4.85 -0.44 2.29 0.15 0.81 -4.87 113.70 115.10 1i90 s SER 48 Ca 0.61 -2.15 -0.14 0.00 0.70 0.00 0.00 55.95 54.97 1i90 s SER 48 Cb -0.27 -1.66 0.06 0.00 -1.71 0.00 0.00 66.02 62.44 1i90 s SER 48 CO 0.33 -0.41 0.34 -0.69 1.20 0.00 0.00 173.24 174.02 1i90 s VAL 49 N 0.92 5.01 -0.87 4.45 1.01 -1.26 -1.20 120.40 128.46 1i90 s VAL 49 Ca 0.11 -1.04 -0.05 0.00 0.00 0.00 0.00 61.98 61.00 1i90 s VAL 49 Cb -0.20 -3.95 0.22 0.00 0.00 0.00 0.00 36.38 32.45 1i90 s VAL 49 CO -0.07 -0.49 0.76 -0.44 0.00 0.00 0.00 175.10 174.86 1i90 s SER 50 N 2.27 6.18 -0.20 3.32 0.01 -0.37 -4.85 113.70 120.05 1i90 s SER 50 Ca 0.04 -3.37 0.15 0.00 1.31 0.00 0.00 55.95 54.09 1i90 s SER 50 Cb -0.23 -1.99 0.68 0.00 0.21 0.00 0.00 66.02 64.69 1i90 s SER 50 CO 0.06 -0.30 1.59 -1.22 0.41 0.00 0.00 173.24 173.79 1i90 n TYR 51 N 2.88 1.51 0.15 2.43 4.01 -1.26 -1.63 117.16 125.26 1i90 n TYR 51 Ca 0.18 -0.78 0.01 0.00 -0.16 0.00 0.00 57.90 57.15 1i90 n TYR 51 Cb 0.39 -0.40 0.21 0.00 -0.31 0.00 0.00 39.34 39.23 1i90 n TYR 51 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 1i90 h ASP 52 N 2.99 0.00 -0.52 7.72 2.03 -1.89 -3.09 116.42 123.66 1i90 h ASP 52 Ca 0.00 0.00 -0.05 0.00 -0.73 0.00 0.00 57.03 56.25 1i90 h ASP 52 Cb 1.69 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 40.16 1i90 h ASP 52 CO 0.35 0.54 0.05 0.00 -1.03 0.00 0.00 179.24 179.15 1i90 n GLN 53 N -3.63 4.10 -1.88 4.15 1.13 -1.24 -5.00 117.38 115.00 1i90 n GLN 53 Ca -0.01 -3.08 -0.42 0.00 -1.94 0.00 0.00 57.00 51.56 1i90 n GLN 53 Cb 0.60 -2.14 -0.02 0.00 0.11 0.00 0.00 30.24 28.78 1i90 n GLN 53 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1i90 s ALA 54 N -2.85 3.75 -0.45 -1.58 0.00 -1.17 -4.48 121.76 114.99 1i90 s ALA 54 Ca 0.51 1.45 0.03 0.00 0.00 0.00 0.00 51.96 53.96 1i90 s ALA 54 Cb 0.40 -3.62 0.12 0.00 0.00 0.00 0.00 23.12 20.02 1i90 s ALA 54 CO 0.13 -0.85 0.19 0.99 0.00 0.00 0.00 175.76 176.22 1i90 s THR 55 N 0.49 2.64 0.29 0.00 2.01 -1.26 -4.86 115.64 114.95 1i90 s THR 55 Ca 0.66 -2.79 -0.29 0.00 0.31 0.00 0.00 61.69 59.58 1i90 s THR 55 Cb -0.45 -2.86 -0.09 0.00 0.01 0.00 0.00 72.50 69.10 1i90 s THR 55 CO 0.40 -0.72 1.07 -0.94 -0.69 0.00 0.00 174.62 173.74 1i90 s SER 56 N 0.47 7.26 -0.16 3.53 1.04 -1.26 -0.24 113.70 124.34 1i90 s SER 56 Ca 0.14 2.21 -0.09 0.00 0.48 0.00 0.00 55.95 58.68 1i90 s SER 56 Cb -0.22 -2.62 -0.07 0.00 0.10 0.00 0.00 66.02 63.21 1i90 s SER 56 CO -0.04 -0.14 -0.23 0.18 0.98 0.00 0.00 173.24 173.99 1i90 n LEU 57 N 1.10 1.30 -3.82 2.42 4.77 0.33 -3.96 117.00 119.13 1i90 n LEU 57 Ca -0.01 0.22 -0.06 0.00 -0.03 0.00 0.00 56.01 56.14 1i90 n LEU 57 Cb 0.45 -0.53 -0.01 0.00 -2.33 0.00 0.00 43.42 41.00 1i90 n LEU 57 CO 0.53 0.24 0.58 0.00 -1.33 0.00 0.00 177.39 177.40 1i90 s ARG 58 N -2.36 1.59 -0.04 3.23 1.70 -1.21 -1.73 118.95 120.12 1i90 s ARG 58 Ca -0.24 -0.90 0.06 0.00 -0.47 0.00 0.00 55.73 54.19 1i90 s ARG 58 Cb 0.08 0.53 -0.01 0.00 -0.57 0.00 0.00 34.95 34.98 1i90 s ARG 58 CO 0.30 -0.73 -0.24 -1.50 -1.08 0.00 0.00 175.30 172.06 1i90 s ILE 59 N -3.52 1.91 0.00 4.99 2.07 -0.16 -0.68 121.20 125.82 1i90 s ILE 59 Ca 0.12 -1.00 0.01 0.00 -1.41 0.00 0.00 60.65 58.37 1i90 s ILE 59 Cb -0.04 -1.61 -0.01 0.00 0.13 0.00 0.00 42.46 40.93 1i90 s ILE 59 CO 0.06 0.54 -0.03 -0.22 -1.91 0.00 0.00 174.94 173.37 1i90 s LEU 60 N -0.25 2.05 -0.31 8.50 2.96 -0.01 -0.54 118.68 131.08 1i90 s LEU 60 Ca 0.00 -0.14 -0.13 0.00 -0.22 0.00 0.00 54.13 53.65 1i90 s LEU 60 Cb -0.12 -0.12 -0.03 0.00 0.50 0.00 0.00 46.19 46.41 1i90 s LEU 60 CO 0.02 -0.02 0.26 0.21 -1.32 0.00 0.00 176.35 175.50 1i90 s ASN 61 N -0.34 6.09 -0.12 3.68 3.84 0.01 -0.27 114.94 127.82 1i90 s ASN 61 Ca -0.02 -0.13 0.17 0.00 0.21 0.00 0.00 52.86 53.09 1i90 s ASN 61 Cb -0.03 -2.15 0.65 0.00 -0.55 0.00 0.00 41.25 39.17 1i90 s ASN 61 CO -0.00 -0.17 1.56 -0.46 -2.79 0.00 0.00 177.10 175.25 1i90 n ASN 62 N 5.16 4.50 0.00 -4.21 0.23 -0.73 -0.75 115.26 119.46 1i90 n ASN 62 Ca -0.12 -2.53 0.00 0.00 -0.53 0.00 0.00 54.58 51.39 1i90 n ASN 62 Cb 0.51 -0.54 0.00 0.00 -2.08 0.00 0.00 39.78 37.67 1i90 n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1i90 n GLY 63 N 0.73 1.94 0.00 4.83 0.00 -1.26 -4.73 105.19 106.70 1i90 n GLY 63 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 1i90 n GLY 63 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1i90 n HIS 64 N -2.00 0.00 -3.90 1.61 8.25 -1.26 -4.70 115.22 113.22 1i90 n HIS 64 Ca 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.47 1i90 n HIS 64 Cb 0.00 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.12 1i90 n HIS 64 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1i90 n ALA 65 N -1.59 -2.28 -2.83 -1.41 0.00 -1.26 -4.87 120.51 106.27 1i90 n ALA 65 Ca 0.00 -0.59 -0.33 0.00 0.00 0.00 0.00 53.44 52.51 1i90 n ALA 65 Cb 0.30 0.19 -0.12 0.00 0.00 0.00 0.00 19.45 19.81 1i90 n ALA 65 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1i90 s PHE 66 N -2.65 2.92 -0.08 0.00 -0.71 -1.26 -1.77 117.98 114.43 1i90 s PHE 66 Ca 0.19 -0.26 0.01 0.00 -1.04 0.00 0.00 56.93 55.83 1i90 s PHE 66 Cb -0.01 -1.83 -0.03 0.00 -1.21 0.00 0.00 43.02 39.95 1i90 s PHE 66 CO 0.01 0.06 -0.10 -0.80 -1.34 0.00 0.00 175.22 173.05 1i90 s ASN 67 N -0.10 4.38 -0.25 1.98 0.02 0.62 -4.22 114.94 117.36 1i90 s ASN 67 Ca 0.01 -0.13 -0.08 0.00 -1.02 0.00 0.00 52.86 51.64 1i90 s ASN 67 Cb -0.13 -1.19 -0.03 0.00 0.02 0.00 0.00 41.25 39.92 1i90 s ASN 67 CO 0.03 0.31 0.10 -0.69 0.02 0.00 0.00 177.10 176.87 1i90 s VAL 68 N -0.51 4.59 0.08 1.60 1.01 -0.35 -0.83 120.40 125.98 1i90 s VAL 68 Ca 0.07 -0.08 -0.00 0.00 0.00 0.00 0.00 61.98 61.97 1i90 s VAL 68 Cb -0.12 -3.15 -0.04 0.00 0.00 0.00 0.00 36.38 33.07 1i90 s VAL 68 CO 0.02 0.32 0.23 -1.61 0.00 0.00 0.00 175.10 174.07 1i90 s GLU 69 N 1.59 3.45 0.16 2.72 2.02 0.14 -1.64 118.70 127.16 1i90 s GLU 69 Ca 0.06 -0.43 0.08 0.00 0.02 0.00 0.00 54.97 54.70 1i90 s GLU 69 Cb -0.15 -3.01 -0.04 0.00 0.10 0.00 0.00 34.13 31.02 1i90 s GLU 69 CO 0.05 0.58 -0.18 -0.06 0.02 0.00 0.00 175.26 175.68 1i90 s PHE 70 N -1.56 1.80 -0.42 1.61 0.40 0.18 -0.51 117.98 119.48 1i90 s PHE 70 Ca 0.35 -0.47 -0.29 0.00 -0.60 0.00 0.00 56.93 55.92 1i90 s PHE 70 Cb -0.13 -0.90 0.02 0.00 0.51 0.00 0.00 43.02 42.52 1i90 s PHE 70 CO 0.28 0.32 1.28 0.34 0.70 0.00 0.00 175.22 178.13 1i90 s ASP 71 N -2.64 6.52 -0.32 1.36 3.68 0.66 -4.78 116.67 121.14 1i90 s ASP 71 Ca 0.15 0.73 0.08 0.00 2.13 0.00 0.00 52.55 55.64 1i90 s ASP 71 Cb -0.06 -2.54 0.55 0.00 -1.45 0.00 0.00 42.92 39.41 1i90 s ASP 71 CO 0.06 -1.30 1.57 -0.90 0.13 0.00 0.00 175.17 174.73 1i90 n ASP 72 N 8.22 2.80 0.14 -0.34 5.75 -1.26 -4.61 116.55 127.25 1i90 n ASP 72 Ca 0.14 -3.72 0.13 0.00 -0.01 0.00 0.00 54.79 51.33 1i90 n ASP 72 Cb 0.48 -0.68 0.46 0.00 -1.03 0.00 0.00 41.12 40.36 1i90 n ASP 72 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 1i90 h SER 73 N 1.05 0.00 -5.46 -1.12 4.64 -1.95 -3.46 113.55 107.26 1i90 h SER 73 Ca 0.31 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.43 1i90 h SER 73 Cb 1.92 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.91 1i90 h SER 73 CO 0.54 0.00 -0.29 -1.10 -0.87 0.00 0.00 176.83 175.11 1i90 s GLN 74 N -3.27 1.59 -1.11 4.77 -0.21 -1.26 -5.06 119.66 115.11 1i90 s GLN 74 Ca 0.06 -1.55 -0.14 0.00 0.02 0.00 0.00 55.36 53.75 1i90 s GLN 74 Cb 0.10 0.40 -0.07 0.00 1.00 0.00 0.00 33.01 34.44 1i90 s GLN 74 CO 0.50 -0.63 2.21 -0.25 -2.12 0.00 0.00 175.29 175.00 1i90 n ASP 75 N -0.75 4.50 -0.06 5.90 8.00 -1.26 -4.57 116.55 128.31 1i90 n ASP 75 Ca 0.01 -2.60 -0.03 0.00 0.71 0.00 0.00 54.79 52.87 1i90 n ASP 75 Cb 0.63 -1.31 -0.02 0.00 -0.02 0.00 0.00 41.12 40.40 1i90 n ASP 75 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1i90 h LYS 76 N 6.55 0.00 -4.94 -1.24 1.79 -1.86 -3.45 116.57 113.42 1i90 h LYS 76 Ca 0.55 0.00 -0.66 0.00 -2.18 0.00 0.00 60.65 58.36 1i90 h LYS 76 Cb 0.46 0.00 -0.36 0.00 -1.58 0.00 0.00 32.23 30.75 1i90 h LYS 76 CO 1.78 0.10 -0.83 0.00 -1.08 0.00 0.00 179.45 179.41 1i90 s ALA 77 N -2.58 2.39 0.15 3.86 0.00 -1.26 -3.67 121.76 120.65 1i90 s ALA 77 Ca -0.07 -1.43 0.03 0.00 0.00 0.00 0.00 51.96 50.48 1i90 s ALA 77 Cb 0.01 -1.35 -0.05 0.00 0.00 0.00 0.00 23.12 21.73 1i90 s ALA 77 CO 0.14 -0.72 -0.04 0.14 0.00 0.00 0.00 175.76 175.27 1i90 s VAL 78 N 1.23 0.85 -0.08 0.00 -7.23 -0.64 -0.88 120.40 113.64 1i90 s VAL 78 Ca -0.01 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.19 1i90 s VAL 78 Cb -0.16 -1.96 0.01 0.00 0.56 0.00 0.00 36.38 34.83 1i90 s VAL 78 CO -0.09 -0.63 -0.17 -0.22 -0.31 0.00 0.00 175.10 173.67 1i90 s LEU 79 N -3.15 1.83 0.28 1.32 2.96 0.17 -1.24 118.68 120.85 1i90 s LEU 79 Ca 0.19 -0.41 0.02 0.00 -0.22 0.00 0.00 54.13 53.71 1i90 s LEU 79 Cb 0.05 -1.07 -0.03 0.00 0.50 0.00 0.00 46.19 45.64 1i90 s LEU 79 CO 0.01 0.08 0.27 -0.54 -1.32 0.00 0.00 176.35 174.86 1i90 s LYS 80 N 0.54 1.58 3.02 1.98 1.02 -0.34 -2.02 119.74 125.52 1i90 s LYS 80 Ca -0.16 -1.80 0.00 0.00 0.02 0.00 0.00 55.97 54.03 1i90 s LYS 80 Cb -0.17 0.33 0.00 0.00 -0.52 0.00 0.00 37.83 37.48 1i90 s LYS 80 CO 0.06 -0.58 0.00 0.41 -0.92 0.00 0.00 175.35 174.31 1i90 n GLY 81 N -0.48 -0.13 7.00 -3.33 0.00 -1.26 -0.14 105.19 106.85 1i90 n GLY 81 Ca 0.04 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.06 1i90 n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i90 n GLY 82 N 0.00 2.81 0.61 -0.02 0.00 -0.73 -1.46 105.19 106.40 1i90 n GLY 82 Ca 0.00 -0.38 0.06 0.00 0.00 0.00 0.00 46.02 45.70 1i90 n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1i90 n PRO 83 N 12.91 1.77 -3.38 1.61 -0.04 -1.26 -3.58 135.00 143.03 1i90 n PRO 83 Ca 0.00 -1.20 -0.34 0.00 -0.04 0.00 0.00 63.50 61.92 1i90 n PRO 83 Cb 0.00 -1.27 -0.06 0.00 -0.04 0.00 0.00 33.50 32.13 1i90 n PRO 83 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1i90 s LEU 84 N -1.04 4.28 -0.30 1.53 1.43 -0.53 -5.06 118.68 118.98 1i90 s LEU 84 Ca 0.23 1.02 -0.04 0.00 -1.03 0.00 0.00 54.13 54.31 1i90 s LEU 84 Cb 0.12 -3.41 0.03 0.00 0.03 0.00 0.00 46.19 42.96 1i90 s LEU 84 CO 0.16 0.04 0.04 -1.81 0.23 0.00 0.00 176.35 175.01 1i90 s ASP 85 N -1.94 4.96 0.00 2.29 1.01 -1.26 -4.36 116.67 117.37 1i90 s ASP 85 Ca 0.41 -1.03 0.00 0.00 0.71 0.00 0.00 52.55 52.64 1i90 s ASP 85 Cb -0.14 -1.79 0.00 0.00 1.01 0.00 0.00 42.92 42.01 1i90 s ASP 85 CO 0.20 -0.24 0.00 0.61 0.21 0.00 0.00 175.17 175.95 1i90 n GLY 86 N 4.74 -2.09 3.64 0.21 0.00 -1.26 -4.97 105.19 105.46 1i90 n GLY 86 Ca -0.14 -2.03 -0.35 0.00 0.00 0.00 0.00 46.02 43.51 1i90 n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1i90 s THR 87 N -0.15 4.55 -0.18 2.61 2.01 -1.26 -4.59 115.64 118.63 1i90 s THR 87 Ca 0.00 -0.13 0.00 0.00 0.31 0.00 0.00 61.69 61.87 1i90 s THR 87 Cb 0.00 -3.00 0.01 0.00 0.01 0.00 0.00 72.50 69.52 1i90 s THR 87 CO 0.00 0.52 -0.16 -0.31 -0.69 0.00 0.00 174.62 173.98 1i90 s TYR 88 N -0.07 2.80 0.05 4.92 1.51 -0.86 -0.93 117.35 124.77 1i90 s TYR 88 Ca 0.05 -1.32 -0.22 0.00 -1.01 0.00 0.00 57.07 54.58 1i90 s TYR 88 Cb -0.12 -1.94 -0.06 0.00 -0.11 0.00 0.00 41.96 39.73 1i90 s TYR 88 CO 0.01 -0.65 0.65 1.03 -1.11 0.00 0.00 175.55 175.48 1i90 s ARG 89 N 1.15 4.36 0.06 -0.62 0.52 0.24 -0.66 118.95 124.00 1i90 s ARG 89 Ca 0.01 0.86 -0.31 0.00 -0.52 0.00 0.00 55.73 55.77 1i90 s ARG 89 Cb -0.14 -3.31 -0.06 0.00 0.52 0.00 0.00 34.95 31.96 1i90 s ARG 89 CO -0.06 0.45 1.32 -1.17 0.02 0.00 0.00 175.30 175.85 1i90 s LEU 90 N -0.53 4.35 -0.07 2.53 2.96 -0.06 -1.44 118.68 126.41 1i90 s LEU 90 Ca 0.33 2.14 0.03 0.00 -0.22 0.00 0.00 54.13 56.40 1i90 s LEU 90 Cb -0.20 -3.58 -0.06 0.00 0.50 0.00 0.00 46.19 42.85 1i90 s LEU 90 CO 0.20 -0.60 -0.03 0.00 -1.32 0.00 0.00 176.35 174.60 1i90 n ILE 91 N 4.16 0.45 -3.66 6.68 3.06 -0.08 -4.50 119.36 125.46 1i90 n ILE 91 Ca 0.11 -0.22 -0.05 0.00 -2.50 0.00 0.00 62.75 60.09 1i90 n ILE 91 Cb 0.44 -0.81 -0.02 0.00 0.54 0.00 0.00 39.64 39.80 1i90 n ILE 91 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1i90 s GLN 92 N -2.16 1.04 0.02 9.51 1.03 -1.20 -0.64 119.66 127.26 1i90 s GLN 92 Ca -0.07 -0.52 -0.01 0.00 0.04 0.00 0.00 55.36 54.80 1i90 s GLN 92 Cb 0.02 0.39 -0.02 0.00 0.03 0.00 0.00 33.01 33.44 1i90 s GLN 92 CO 0.22 -0.47 -0.01 -0.59 -2.54 0.00 0.00 175.29 171.90 1i90 s PHE 93 N -3.20 0.24 0.35 9.60 -0.12 -0.65 -0.50 117.98 123.69 1i90 s PHE 93 Ca 0.10 -0.49 -0.06 0.00 -0.05 0.00 0.00 56.93 56.43 1i90 s PHE 93 Cb -0.01 -0.17 0.01 0.00 -0.63 0.00 0.00 43.02 42.22 1i90 s PHE 93 CO -0.02 -0.20 0.55 -3.38 -0.05 0.00 0.00 175.22 172.12 1i90 s HIS 94 N -1.45 0.83 0.20 3.49 -3.43 -0.34 -1.21 115.29 113.38 1i90 s HIS 94 Ca -0.16 -1.16 0.03 0.00 -0.80 0.00 0.00 55.06 52.97 1i90 s HIS 94 Cb -0.10 0.13 -0.05 0.00 -1.43 0.00 0.00 32.58 31.14 1i90 s HIS 94 CO -0.01 -1.23 -0.01 -0.06 -2.00 0.00 0.00 174.74 171.43 1i90 s PHE 95 N -2.92 1.40 -0.02 0.38 0.40 -1.26 -0.11 117.98 115.85 1i90 s PHE 95 Ca 0.27 -0.95 0.02 0.00 -0.60 0.00 0.00 56.93 55.67 1i90 s PHE 95 Cb -0.02 -0.80 0.00 0.00 0.51 0.00 0.00 43.02 42.72 1i90 s PHE 95 CO 0.18 -0.10 -0.09 -1.01 0.70 0.00 0.00 175.22 174.90 1i90 s HIS 96 N -3.51 0.91 0.22 0.36 3.76 -0.29 -4.74 115.29 112.00 1i90 s HIS 96 Ca 0.26 -0.22 -0.10 0.00 -0.15 0.00 0.00 55.06 54.85 1i90 s HIS 96 Cb 0.06 -0.64 -0.01 0.00 1.11 0.00 0.00 32.58 33.09 1i90 s HIS 96 CO 0.06 -0.08 0.37 1.67 -0.85 0.00 0.00 174.74 175.91 1i90 s TRP 97 N 0.13 0.49 0.44 1.40 -2.14 -1.22 -0.87 118.94 117.17 1i90 s TRP 97 Ca -0.02 -0.83 0.04 0.00 2.66 0.00 0.00 56.10 57.95 1i90 s TRP 97 Cb -0.08 0.01 0.04 0.00 -3.10 0.00 0.00 33.47 30.34 1i90 s TRP 97 CO 0.00 -0.86 0.30 0.41 -2.66 0.00 0.00 176.95 174.14 1i90 n GLY 98 N -0.32 2.89 0.15 3.67 0.00 -1.16 -0.73 105.19 109.69 1i90 n GLY 98 Ca -0.03 -2.28 0.12 0.00 0.00 0.00 0.00 46.02 43.83 1i90 n GLY 98 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1i90 h SER 99 N 0.58 0.00 -4.64 1.61 4.64 -1.89 -3.38 113.55 110.47 1i90 h SER 99 Ca -0.29 -0.02 -0.30 0.00 -0.47 0.00 0.00 61.79 60.71 1i90 h SER 99 Cb 1.04 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 62.92 1i90 h SER 99 CO 0.46 0.01 -0.74 -0.76 -0.87 0.00 0.00 176.83 174.93 1i90 s LEU 100 N -5.56 2.30 0.58 5.97 1.43 -1.26 -5.04 118.68 117.10 1i90 s LEU 100 Ca 0.03 -0.64 0.30 0.00 -1.03 0.00 0.00 54.13 52.79 1i90 s LEU 100 Cb 0.08 -0.24 1.64 0.00 0.03 0.00 0.00 46.19 47.70 1i90 s LEU 100 CO 0.73 -0.21 1.91 0.44 0.23 0.00 0.00 176.35 179.45 1i90 h ASP 101 N 4.19 0.00 -0.38 2.29 3.32 -1.91 -2.51 116.42 121.43 1i90 h ASP 101 Ca -0.37 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.68 1i90 h ASP 101 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 1i90 h ASP 101 CO 0.44 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.57 1i90 n GLY 102 N -1.20 1.77 3.47 2.75 0.00 -1.26 -3.44 105.19 107.28 1i90 n GLY 102 Ca -0.02 -0.51 -0.11 0.00 0.00 0.00 0.00 46.02 45.38 1i90 n GLY 102 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1i90 s GLN 103 N -1.76 1.33 0.00 1.61 -2.07 -0.94 -4.65 119.66 113.18 1i90 s GLN 103 Ca 0.31 -0.57 0.00 0.00 -1.82 0.00 0.00 55.36 53.27 1i90 s GLN 103 Cb 0.20 0.58 0.00 0.00 -1.09 0.00 0.00 33.01 32.70 1i90 s GLN 103 CO 0.14 -0.58 0.00 0.41 -1.32 0.00 0.00 175.29 173.94 1i90 n GLY 104 N -0.38 3.62 3.80 2.60 0.00 -0.97 -3.17 105.19 110.69 1i90 n GLY 104 Ca -0.15 -0.52 -0.32 0.00 0.00 0.00 0.00 46.02 45.02 1i90 n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1i90 s SER 105 N 0.00 5.54 -0.22 1.61 1.04 -0.51 -3.37 113.70 117.79 1i90 s SER 105 Ca 0.00 1.83 -0.17 0.00 0.48 0.00 0.00 55.95 58.09 1i90 s SER 105 Cb 0.00 -2.53 -0.18 0.00 0.10 0.00 0.00 66.02 63.41 1i90 s SER 105 CO 0.00 -1.33 0.08 -0.62 0.98 0.00 0.00 173.24 172.35 1i90 n GLU 106 N -2.31 0.60 -3.01 4.02 1.02 -1.26 -4.82 120.64 114.87 1i90 n GLU 106 Ca 0.09 0.45 -0.33 0.00 -0.02 0.00 0.00 57.16 57.35 1i90 n GLU 106 Cb 0.53 -1.68 -0.06 0.00 -0.02 0.00 0.00 31.44 30.21 1i90 n GLU 106 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1i90 s HIS 107 N -2.43 3.38 0.14 -0.32 3.76 -1.26 -4.34 115.29 114.22 1i90 s HIS 107 Ca -0.31 1.38 0.07 0.00 -0.15 0.00 0.00 55.06 56.06 1i90 s HIS 107 Cb 0.08 -2.66 -0.04 0.00 1.11 0.00 0.00 32.58 31.07 1i90 s HIS 107 CO 0.59 0.04 -0.16 0.95 -0.85 0.00 0.00 174.74 175.31 1i90 s THR 108 N -2.01 1.55 -0.28 1.30 -4.23 -1.22 -4.67 115.64 106.07 1i90 s THR 108 Ca 0.56 -1.81 -0.02 0.00 -1.18 0.00 0.00 61.69 59.24 1i90 s THR 108 Cb -0.10 -1.68 0.04 0.00 1.34 0.00 0.00 72.50 72.10 1i90 s THR 108 CO 0.16 -0.37 -0.02 -0.69 -0.54 0.00 0.00 174.62 173.16 1i90 s VAL 109 N -2.11 2.98 -1.40 2.29 1.01 -0.85 -0.70 120.40 121.63 1i90 s VAL 109 Ca 0.12 -1.24 -0.05 0.00 0.00 0.00 0.00 61.98 60.81 1i90 s VAL 109 Cb -0.05 -2.64 0.03 0.00 0.00 0.00 0.00 36.38 33.72 1i90 s VAL 109 CO 0.05 0.00 0.77 0.47 0.00 0.00 0.00 175.10 176.39 1i90 n ASP 110 N 4.65 -2.33 0.00 3.32 8.00 0.12 -0.87 116.55 129.43 1i90 n ASP 110 Ca -0.14 -0.83 0.00 0.00 0.71 0.00 0.00 54.79 54.53 1i90 n ASP 110 Cb 0.45 -3.89 0.00 0.00 -0.02 0.00 0.00 41.12 37.66 1i90 n ASP 110 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1i90 n LYS 111 N -4.43 0.00 -2.68 -1.24 4.76 -1.26 -4.98 118.16 108.33 1i90 n LYS 111 Ca -0.18 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 54.84 1i90 n LYS 111 Cb 0.63 -3.22 -0.03 0.00 -1.84 0.00 0.00 35.03 30.57 1i90 n LYS 111 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1i90 s LYS 112 N -0.35 4.48 -0.02 1.97 2.20 -0.05 -5.00 119.74 122.96 1i90 s LYS 112 Ca 0.00 1.43 -0.07 0.00 -0.36 0.00 0.00 55.97 56.97 1i90 s LYS 112 Cb 0.00 -3.50 -0.05 0.00 -1.51 0.00 0.00 37.83 32.77 1i90 s LYS 112 CO 0.00 -0.21 0.24 0.15 -0.36 0.00 0.00 175.35 175.17 1i90 s LYS 113 N 1.59 3.56 0.45 4.03 1.02 -1.26 -2.00 119.74 127.13 1i90 s LYS 113 Ca 0.50 -0.07 0.08 0.00 0.02 0.00 0.00 55.97 56.50 1i90 s LYS 113 Cb -0.20 -3.11 0.02 0.00 -0.52 0.00 0.00 37.83 34.02 1i90 s LYS 113 CO 0.22 0.68 0.60 0.71 -0.92 0.00 0.00 175.35 176.65 1i90 s TYR 114 N -1.23 2.54 0.34 3.18 2.02 -1.26 -4.63 117.35 118.31 1i90 s TYR 114 Ca 0.25 -0.47 0.09 0.00 -0.37 0.00 0.00 57.07 56.57 1i90 s TYR 114 Cb -0.13 -2.34 0.61 0.00 -0.40 0.00 0.00 41.96 39.70 1i90 s TYR 114 CO 0.14 -0.55 1.79 0.00 -1.57 0.00 0.00 175.55 175.36 1i90 h ALA 115 N 0.57 1.29 -2.94 3.71 0.00 -1.40 -1.25 119.26 119.23 1i90 h ALA 115 Ca -0.38 -0.34 0.04 0.00 0.00 0.00 0.00 54.91 54.24 1i90 h ALA 115 Cb 1.28 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 1i90 h ALA 115 CO 0.45 0.49 0.28 0.00 0.00 0.00 0.00 179.25 180.47 1i90 s ALA 116 N -4.32 -1.06 -0.13 0.00 0.00 -1.17 -3.00 121.76 112.08 1i90 s ALA 116 Ca -0.04 -0.47 -0.06 0.00 0.00 0.00 0.00 51.96 51.39 1i90 s ALA 116 Cb 0.14 0.76 0.06 0.00 0.00 0.00 0.00 23.12 24.08 1i90 s ALA 116 CO 0.75 -1.02 0.29 -2.00 0.00 0.00 0.00 175.76 173.78 1i90 s GLU 117 N -3.14 0.22 -0.09 0.00 2.12 -0.05 -1.23 118.70 116.53 1i90 s GLU 117 Ca 0.13 0.70 -0.16 0.00 0.36 0.00 0.00 54.97 56.00 1i90 s GLU 117 Cb -0.05 -0.03 -0.05 0.00 0.26 0.00 0.00 34.13 34.26 1i90 s GLU 117 CO 0.09 -0.22 0.41 -1.17 -0.54 0.00 0.00 175.26 173.83 1i90 s LEU 118 N 1.87 4.34 -0.17 2.70 2.96 0.16 -1.14 118.68 129.38 1i90 s LEU 118 Ca -0.04 0.80 0.01 0.00 -0.22 0.00 0.00 54.13 54.67 1i90 s LEU 118 Cb -0.11 -2.58 0.02 0.00 0.50 0.00 0.00 46.19 44.01 1i90 s LEU 118 CO -0.09 0.13 -0.20 -1.00 -1.32 0.00 0.00 176.35 173.87 1i90 s HIS 119 N 0.01 2.76 -0.39 5.38 3.76 0.85 -0.56 115.29 127.09 1i90 s HIS 119 Ca 0.23 -1.58 -0.10 0.00 -0.15 0.00 0.00 55.06 53.46 1i90 s HIS 119 Cb -0.15 -1.91 0.05 0.00 1.11 0.00 0.00 32.58 31.68 1i90 s HIS 119 CO 0.10 -0.77 0.22 -0.51 -0.85 0.00 0.00 174.74 172.93 1i90 s LEU 120 N 1.21 4.88 -0.12 0.89 1.43 -0.25 -1.20 118.68 125.52 1i90 s LEU 120 Ca 0.03 -1.24 -0.20 0.00 -1.03 0.00 0.00 54.13 51.69 1i90 s LEU 120 Cb -0.13 -1.99 -0.04 0.00 0.03 0.00 0.00 46.19 44.06 1i90 s LEU 120 CO -0.11 -0.45 0.58 -0.69 0.23 0.00 0.00 176.35 175.91 1i90 s VAL 121 N 1.48 5.11 0.05 -1.59 1.01 0.35 -1.03 120.40 125.78 1i90 s VAL 121 Ca 0.02 1.15 0.05 0.00 0.00 0.00 0.00 61.98 63.20 1i90 s VAL 121 Cb -0.21 -3.91 -0.02 0.00 0.00 0.00 0.00 36.38 32.23 1i90 s VAL 121 CO 0.04 0.26 -0.15 -1.00 0.00 0.00 0.00 175.10 174.25 1i90 s HIS 122 N 0.94 1.28 0.10 5.22 3.76 -0.17 -0.90 115.29 125.52 1i90 s HIS 122 Ca 0.30 -0.38 0.10 0.00 -0.15 0.00 0.00 55.06 54.92 1i90 s HIS 122 Cb -0.16 -0.75 -0.04 0.00 1.11 0.00 0.00 32.58 32.75 1i90 s HIS 122 CO 0.13 0.05 -0.25 1.67 -0.85 0.00 0.00 174.74 175.49 1i90 s TRP 123 N -0.97 2.17 -0.33 1.40 1.48 -0.52 -1.23 118.94 120.94 1i90 s TRP 123 Ca 0.01 -0.39 -0.29 0.00 -1.06 0.00 0.00 56.10 54.37 1i90 s TRP 123 Cb -0.09 -1.21 -0.01 0.00 -1.16 0.00 0.00 33.47 31.00 1i90 s TRP 123 CO 0.02 0.25 1.69 1.21 -4.06 0.00 0.00 176.95 176.05 1i90 s ASN 124 N -1.78 6.06 0.56 -2.66 3.84 0.75 -0.59 114.94 121.12 1i90 s ASN 124 Ca 0.11 1.26 0.26 0.00 0.21 0.00 0.00 52.86 54.70 1i90 s ASN 124 Cb -0.10 -2.53 1.53 0.00 -0.55 0.00 0.00 41.25 39.60 1i90 s ASN 124 CO 0.04 -1.58 2.08 0.71 -2.79 0.00 0.00 177.10 175.56 1i90 h THR 125 N 6.64 0.62 -0.68 -5.21 1.35 -1.38 -1.85 112.91 112.40 1i90 h THR 125 Ca -0.32 0.00 0.20 0.00 -0.55 0.00 0.00 66.41 65.73 1i90 h THR 125 Cb 1.15 0.84 -0.03 0.00 -1.73 0.00 0.00 68.15 68.38 1i90 h THR 125 CO 1.04 0.00 0.56 0.50 -0.25 0.00 0.00 175.52 177.37 1i90 h LYS 127 N 0.00 0.00 -0.05 4.72 3.64 -1.91 0.04 116.57 123.00 1i90 h LYS 127 Ca 0.11 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 1i90 h LYS 127 Cb 0.55 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.37 1i90 h LYS 127 CO -0.00 0.00 0.00 0.66 -2.27 0.00 0.00 179.45 177.84 1i90 n TYR 128 N -4.05 0.06 0.00 1.91 4.01 -0.70 -4.97 117.16 113.42 1i90 n TYR 128 Ca 0.14 -0.03 0.00 0.00 -0.16 0.00 0.00 57.90 57.85 1i90 n TYR 128 Cb 0.81 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.84 1i90 n TYR 128 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1i90 n GLY 129 N 1.11 1.85 3.17 2.72 0.00 -0.00 -4.60 105.19 109.44 1i90 n GLY 129 Ca 0.19 -0.19 -0.09 0.00 0.00 0.00 0.00 46.02 45.92 1i90 n GLY 129 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1i90 s ASP 130 N 0.00 0.15 0.30 1.61 1.47 -1.26 -5.03 116.67 113.91 1i90 s ASP 130 Ca 0.00 -0.59 0.05 0.00 1.18 0.00 0.00 52.55 53.19 1i90 s ASP 130 Cb 0.00 0.29 0.76 0.00 -0.34 0.00 0.00 42.92 43.63 1i90 s ASP 130 CO 0.00 -0.63 1.71 0.15 0.68 0.00 0.00 175.17 177.08 1i90 h PHE 131 N 3.16 0.78 -0.90 2.11 3.57 -1.93 -0.91 116.94 122.82 1i90 h PHE 131 Ca -0.33 0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.24 1i90 h PHE 131 Cb 1.19 -0.20 -0.05 0.00 2.79 0.00 0.00 35.95 39.68 1i90 h PHE 131 CO 0.48 0.00 0.59 0.78 -2.23 0.00 0.00 178.31 177.94 1i90 h GLY 132 N 0.47 1.30 1.20 2.40 0.00 -1.96 -2.34 103.07 104.14 1i90 h GLY 132 Ca 0.58 -0.44 -0.25 0.00 0.00 0.00 0.00 47.33 47.22 1i90 h GLY 132 CO -0.50 0.38 -0.93 0.50 0.00 0.00 0.00 176.54 175.98 1i90 h LYS 133 N 1.12 0.74 -0.76 4.80 1.79 -1.46 -3.26 116.57 119.54 1i90 h LYS 133 Ca 0.36 -0.71 0.13 0.00 -2.18 0.00 0.00 60.65 58.25 1i90 h LYS 133 Cb 0.04 0.18 -0.09 0.00 -1.58 0.00 0.00 32.23 30.78 1i90 h LYS 133 CO -0.11 1.30 0.34 0.00 -1.08 0.00 0.00 179.45 179.89 1i90 h ALA 134 N 0.47 1.08 0.00 3.86 0.00 -0.92 -0.19 119.26 123.56 1i90 h ALA 134 Ca -0.10 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1i90 h ALA 134 Cb 1.58 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.40 1i90 h ALA 134 CO 0.19 -0.15 0.00 1.33 0.00 0.00 0.00 179.25 180.62 1i90 n VAL 135 N -4.94 0.12 -0.19 0.00 0.24 -0.93 -1.06 118.33 111.58 1i90 n VAL 135 Ca 0.14 0.03 0.08 0.00 -2.04 0.00 0.00 64.34 62.55 1i90 n VAL 135 Cb 0.38 -0.77 0.21 0.00 -1.47 0.00 0.00 33.84 32.19 1i90 n VAL 135 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1i90 n GLN 136 N -1.06 2.70 -4.98 7.34 6.02 -0.08 -4.92 117.38 122.39 1i90 n GLN 136 Ca 0.11 -2.25 -0.30 0.00 -0.01 0.00 0.00 57.00 54.55 1i90 n GLN 136 Cb 0.07 -1.39 -0.15 0.00 1.02 0.00 0.00 30.24 29.79 1i90 n GLN 136 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1i90 s GLN 137 N -1.03 1.86 -1.53 -1.09 -1.52 -0.22 -5.04 119.66 111.09 1i90 s GLN 137 Ca 0.33 -1.08 -0.11 0.00 -1.95 0.00 0.00 55.36 52.55 1i90 s GLN 137 Cb 0.17 -1.99 -0.02 0.00 -0.22 0.00 0.00 33.01 30.96 1i90 s GLN 137 CO 0.23 0.52 2.59 -0.35 -0.25 0.00 0.00 175.29 178.03 1i90 n PRO 138 N 1.89 3.40 0.00 2.91 -0.04 -1.26 -1.47 135.00 140.43 1i90 n PRO 138 Ca -0.17 -2.48 0.00 0.00 -0.04 0.00 0.00 63.50 60.81 1i90 n PRO 138 Cb 0.52 -3.00 0.00 0.00 -0.04 0.00 0.00 33.50 30.98 1i90 n PRO 138 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1i90 n ASP 139 N 4.54 0.00 0.10 3.54 5.75 -1.26 -5.06 116.55 124.16 1i90 n ASP 139 Ca 0.65 0.00 -0.05 0.00 -0.01 0.00 0.00 54.79 55.38 1i90 n ASP 139 Cb 0.30 0.00 0.04 0.00 -1.03 0.00 0.00 41.12 40.43 1i90 n ASP 139 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1i90 h GLY 140 N 0.00 0.10 -3.18 6.12 0.00 -1.03 -3.43 103.07 101.65 1i90 h GLY 140 Ca 0.00 -0.16 -0.56 0.00 0.00 0.00 0.00 47.33 46.61 1i90 h GLY 140 CO 0.00 0.14 -0.79 1.08 0.00 0.00 0.00 176.54 176.97 1i90 s LEU 141 N -7.36 2.45 -0.05 3.11 1.43 0.13 -0.18 118.68 118.21 1i90 s LEU 141 Ca -0.01 -0.88 -0.02 0.00 -1.03 0.00 0.00 54.13 52.19 1i90 s LEU 141 Cb 0.11 -0.93 0.03 0.00 0.03 0.00 0.00 46.19 45.43 1i90 s LEU 141 CO 0.80 0.01 0.06 0.00 0.23 0.00 0.00 176.35 177.45 1i90 s ALA 142 N -2.00 0.28 -0.14 4.21 0.00 -0.36 -1.10 121.76 122.64 1i90 s ALA 142 Ca 0.18 0.15 0.01 0.00 0.00 0.00 0.00 51.96 52.30 1i90 s ALA 142 Cb -0.06 -0.64 -0.00 0.00 0.00 0.00 0.00 23.12 22.41 1i90 s ALA 142 CO 0.08 -0.50 -0.16 0.08 0.00 0.00 0.00 175.76 175.25 1i90 s VAL 143 N 2.15 2.62 -0.34 0.00 1.01 -1.05 -1.00 120.40 123.79 1i90 s VAL 143 Ca 0.05 -0.79 -0.18 0.00 0.00 0.00 0.00 61.98 61.06 1i90 s VAL 143 Cb -0.12 -2.09 -0.01 0.00 0.00 0.00 0.00 36.38 34.16 1i90 s VAL 143 CO -0.03 0.52 0.50 -0.22 0.00 0.00 0.00 175.10 175.88 1i90 s LEU 144 N 0.66 4.30 -0.15 3.92 2.96 -0.20 -1.63 118.68 128.55 1i90 s LEU 144 Ca -0.08 0.04 -0.06 0.00 -0.22 0.00 0.00 54.13 53.81 1i90 s LEU 144 Cb -0.16 -2.58 -0.04 0.00 0.50 0.00 0.00 46.19 43.91 1i90 s LEU 144 CO 0.02 -0.44 0.07 -0.83 -1.32 0.00 0.00 176.35 173.85 1i90 s GLY 145 N 1.73 1.97 -0.06 7.98 0.00 0.95 -1.09 107.32 118.81 1i90 s GLY 145 Ca 0.19 -0.73 0.02 0.00 0.00 0.00 0.00 44.72 44.20 1i90 s GLY 145 CO 0.13 -0.19 -0.12 -0.42 0.00 0.00 0.00 173.10 172.50 1i90 s ILE 146 N -0.27 1.10 0.32 0.90 1.01 0.27 -1.25 121.20 123.27 1i90 s ILE 146 Ca 0.09 -0.46 -0.16 0.00 0.00 0.00 0.00 60.65 60.12 1i90 s ILE 146 Cb -0.12 -1.01 -0.09 0.00 0.01 0.00 0.00 42.46 41.25 1i90 s ILE 146 CO 0.01 0.35 0.75 -0.36 0.00 0.00 0.00 174.94 175.69 1i90 s PHE 147 N 0.65 3.40 -0.10 3.97 0.08 -1.26 0.36 117.98 125.09 1i90 s PHE 147 Ca -0.14 1.26 0.04 0.00 0.12 0.00 0.00 56.93 58.21 1i90 s PHE 147 Cb -0.16 -2.57 -0.00 0.00 -0.57 0.00 0.00 43.02 39.72 1i90 s PHE 147 CO 0.03 0.11 -0.23 -0.51 -0.10 0.00 0.00 175.22 174.52 1i90 s LEU 148 N -2.88 2.17 0.03 -0.37 1.02 -0.37 -0.73 118.68 117.55 1i90 s LEU 148 Ca 0.53 -0.52 0.08 0.00 0.02 0.00 0.00 54.13 54.25 1i90 s LEU 148 Cb -0.11 -1.43 -0.03 0.00 0.02 0.00 0.00 46.19 44.64 1i90 s LEU 148 CO 0.17 0.18 -0.23 -1.59 0.02 0.00 0.00 176.35 174.90 1i90 s LYS 149 N 0.23 1.97 -0.19 1.70 -2.85 0.02 -1.91 119.74 118.71 1i90 s LYS 149 Ca -0.15 -1.02 -0.29 0.00 -1.00 0.00 0.00 55.97 53.51 1i90 s LYS 149 Cb -0.17 -2.07 -0.02 0.00 -2.06 0.00 0.00 37.83 33.51 1i90 s LYS 149 CO 0.08 0.53 1.37 0.08 0.10 0.00 0.00 175.35 177.51 1i90 s VAL 150 N -0.80 4.07 0.00 1.79 1.01 -1.26 -1.42 120.40 123.79 1i90 s VAL 150 Ca 0.12 1.26 0.00 0.00 0.00 0.00 0.00 61.98 63.37 1i90 s VAL 150 Cb -0.10 -3.93 0.00 0.00 0.00 0.00 0.00 36.38 32.35 1i90 s VAL 150 CO 0.02 -0.24 0.00 0.61 0.00 0.00 0.00 175.10 175.50 1i90 n GLY 151 N 4.01 2.38 3.88 4.51 0.00 0.05 -4.90 105.19 115.13 1i90 n GLY 151 Ca 0.15 0.19 -0.30 0.00 0.00 0.00 0.00 46.02 46.07 1i90 n GLY 151 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1i90 s SER 152 N 2.00 5.95 0.49 1.61 1.04 -1.26 -3.84 113.70 119.69 1i90 s SER 152 Ca 0.00 1.18 -0.22 0.00 0.48 0.00 0.00 55.95 57.39 1i90 s SER 152 Cb 0.00 -2.20 -0.07 0.00 0.10 0.00 0.00 66.02 63.85 1i90 s SER 152 CO 0.00 -0.97 1.19 0.00 0.98 0.00 0.00 173.24 174.43 1i90 s ALA 153 N -3.14 2.90 -0.44 5.32 0.00 -1.26 -2.42 121.76 122.71 1i90 s ALA 153 Ca 0.55 0.97 -0.12 0.00 0.00 0.00 0.00 51.96 53.36 1i90 s ALA 153 Cb -0.11 -3.41 0.08 0.00 0.00 0.00 0.00 23.12 19.68 1i90 s ALA 153 CO 0.51 -0.79 0.32 0.21 0.00 0.00 0.00 175.76 176.02 1i90 s LYS 154 N -2.83 2.77 0.30 0.00 2.47 -1.23 -4.81 119.74 116.40 1i90 s LYS 154 Ca 0.66 -1.42 0.03 0.00 -1.56 0.00 0.00 55.97 53.69 1i90 s LYS 154 Cb -0.30 -3.94 0.63 0.00 -1.46 0.00 0.00 37.83 32.76 1i90 s LYS 154 CO 0.35 -0.99 1.84 -1.35 0.16 0.00 0.00 175.35 175.36 1i90 h PRO 155 N 8.56 0.88 0.00 4.03 0.11 -1.92 -0.76 132.00 142.92 1i90 h PRO 155 Ca -0.25 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1i90 h PRO 155 Cb 1.09 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.01 1i90 h PRO 155 CO 0.82 0.58 0.00 0.78 -0.21 0.00 0.00 178.00 179.97 1i90 h GLY 156 N 0.91 0.00 1.11 -0.55 0.00 -1.94 -2.00 103.07 100.59 1i90 h GLY 156 Ca 0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.82 1i90 h GLY 156 CO -0.26 0.00 -0.83 -2.00 0.00 0.00 0.00 176.54 173.45 1i90 h LEU 157 N 0.00 0.00 -0.75 3.11 5.85 -1.37 -3.39 115.31 118.77 1i90 h LEU 157 Ca 0.00 -0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.71 1i90 h LEU 157 Cb 0.27 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.24 1i90 h LEU 157 CO 0.00 0.03 0.44 -0.61 -0.34 0.00 0.00 178.44 177.97 1i90 h GLN 158 N 0.00 0.79 -0.72 1.25 5.75 -1.26 -1.48 115.11 119.44 1i90 h GLN 158 Ca 0.00 -0.05 0.11 0.00 -0.15 0.00 0.00 58.65 58.56 1i90 h GLN 158 Cb 0.92 -0.18 -0.05 0.00 1.07 0.00 0.00 27.48 29.25 1i90 h GLN 158 CO 0.00 0.52 0.48 0.87 -2.65 0.00 0.00 178.83 178.05 1i90 h LYS 159 N 0.82 0.54 -0.11 1.69 1.57 -1.76 0.70 116.57 120.02 1i90 h LYS 159 Ca 0.33 -0.03 -0.07 0.00 -1.87 0.00 0.00 60.65 59.00 1i90 h LYS 159 Cb 0.16 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.35 1i90 h LYS 159 CO -0.17 0.36 -0.21 0.28 -0.57 0.00 0.00 179.45 179.14 1i90 h VAL 160 N 0.55 1.39 -0.83 0.50 2.07 -1.57 -3.12 116.25 115.24 1i90 h VAL 160 Ca 0.34 -1.49 0.01 0.00 0.82 0.00 0.00 66.70 66.38 1i90 h VAL 160 Cb 0.57 2.09 -0.04 0.00 -1.52 0.00 0.00 31.29 32.39 1i90 h VAL 160 CO -0.12 0.43 0.55 0.58 0.02 0.00 0.00 177.57 179.04 1i90 h VAL 161 N -0.10 1.21 0.00 2.57 2.07 -0.45 -2.67 116.25 118.88 1i90 h VAL 161 Ca 0.00 -0.39 -0.04 0.00 0.82 0.00 0.00 66.70 67.10 1i90 h VAL 161 Cb 0.80 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 1i90 h VAL 161 CO 0.05 0.21 -0.20 0.44 0.02 0.00 0.00 177.57 178.08 1i90 h ASP 162 N 1.13 0.00 0.47 0.57 3.32 -0.94 -2.95 116.42 118.02 1i90 h ASP 162 Ca 0.30 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.35 1i90 h ASP 162 Cb -0.13 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.42 1i90 h ASP 162 CO -0.07 0.20 -0.72 0.55 -1.72 0.00 0.00 179.24 177.49 1i90 n VAL 163 N -3.51 0.09 -0.10 -1.35 3.14 -1.02 -4.43 118.33 111.16 1i90 n VAL 163 Ca -0.01 -0.10 0.22 0.00 -2.96 0.00 0.00 64.34 61.49 1i90 n VAL 163 Cb 0.36 0.28 0.66 0.00 -1.06 0.00 0.00 33.84 34.08 1i90 n VAL 163 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 1i90 h LEU 164 N 0.00 0.09 -1.71 6.55 3.38 -1.41 -0.88 115.31 121.34 1i90 h LEU 164 Ca 0.00 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1i90 h LEU 164 Cb 0.59 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1i90 h LEU 164 CO 0.00 0.04 -0.01 0.44 0.09 0.00 0.00 178.44 179.00 1i90 h ASP 165 N 0.10 0.15 1.12 -0.43 3.32 -1.80 -2.15 116.42 116.72 1i90 h ASP 165 Ca 0.34 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.38 1i90 h ASP 165 Cb 1.22 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.74 1i90 h ASP 165 CO -0.04 0.19 0.00 -1.20 -1.72 0.00 0.00 179.24 176.48 1i90 n SER 166 N -4.42 0.73 -2.44 6.45 7.64 -0.33 -3.58 113.62 117.66 1i90 n SER 166 Ca -0.01 0.62 -0.12 0.00 1.01 0.00 0.00 58.87 60.36 1i90 n SER 166 Cb 0.16 -0.79 0.03 0.00 -1.01 0.00 0.00 64.21 62.60 1i90 n SER 166 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 1i90 n ILE 167 N -2.24 1.88 -0.25 0.44 -5.35 -0.82 -4.63 119.36 108.40 1i90 n ILE 167 Ca 0.04 -3.58 0.06 0.00 -0.27 0.00 0.00 62.75 59.00 1i90 n ILE 167 Cb 0.34 0.08 0.30 0.00 -1.74 0.00 0.00 39.64 38.62 1i90 n ILE 167 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1i90 h LYS 168 N 2.42 0.86 -6.08 6.28 3.64 -1.58 -3.42 116.57 118.68 1i90 h LYS 168 Ca 0.11 -0.05 -0.57 0.00 -1.27 0.00 0.00 60.65 58.87 1i90 h LYS 168 Cb 1.39 -0.19 -0.10 0.00 -0.41 0.00 0.00 32.23 32.91 1i90 h LYS 168 CO 0.48 0.57 -0.61 0.95 -2.27 0.00 0.00 179.45 178.56 1i90 s THR 169 N -5.79 2.86 0.20 1.00 -4.23 -1.26 -0.05 115.64 108.37 1i90 s THR 169 Ca -0.11 -1.92 -0.33 0.00 -1.18 0.00 0.00 61.69 58.16 1i90 s THR 169 Cb 0.20 -2.82 -0.14 0.00 1.34 0.00 0.00 72.50 71.08 1i90 s THR 169 CO 0.79 -0.24 1.47 1.17 -0.54 0.00 0.00 174.62 177.26 1i90 n LYS 170 N -0.97 2.02 0.00 3.99 4.81 -0.53 -2.27 118.16 125.21 1i90 n LYS 170 Ca -0.04 0.72 0.00 0.00 -0.87 0.00 0.00 58.31 58.12 1i90 n LYS 170 Cb 0.61 -2.42 0.00 0.00 0.02 0.00 0.00 35.03 33.24 1i90 n LYS 170 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1i90 n GLY 171 N 2.66 3.28 3.77 3.14 0.00 0.07 -4.44 105.19 113.67 1i90 n GLY 171 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 1i90 n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i90 s LYS 172 N -0.60 4.30 0.05 1.61 1.02 -0.96 -4.84 119.74 120.31 1i90 s LYS 172 Ca 0.00 1.69 -0.02 0.00 0.02 0.00 0.00 55.97 57.66 1i90 s LYS 172 Cb 0.00 -2.79 -0.04 0.00 -0.52 0.00 0.00 37.83 34.48 1i90 s LYS 172 CO 0.00 -0.06 -0.01 -1.54 -0.92 0.00 0.00 175.35 172.82 1i90 s SER 173 N -1.23 0.45 -0.04 2.83 1.04 -1.26 -0.81 113.70 114.67 1i90 s SER 173 Ca 0.53 -0.95 -0.08 0.00 0.48 0.00 0.00 55.95 55.94 1i90 s SER 173 Cb -0.27 0.21 0.01 0.00 0.10 0.00 0.00 66.02 66.07 1i90 s SER 173 CO 0.35 -0.60 0.18 0.00 0.98 0.00 0.00 173.24 174.14 1i90 s ALA 174 N -3.84 -0.45 0.36 5.32 0.00 0.29 -4.91 121.76 118.54 1i90 s ALA 174 Ca 0.06 0.29 -0.28 0.00 0.00 0.00 0.00 51.96 52.03 1i90 s ALA 174 Cb 0.07 -0.14 -0.11 0.00 0.00 0.00 0.00 23.12 22.94 1i90 s ALA 174 CO -0.10 -0.15 1.47 -0.25 0.00 0.00 0.00 175.76 176.74 1i90 n ASP 175 N 2.32 3.67 -3.00 0.00 8.00 -1.26 -0.99 116.55 125.29 1i90 n ASP 175 Ca -0.17 1.22 -0.16 0.00 0.71 0.00 0.00 54.79 56.39 1i90 n ASP 175 Cb 0.57 -1.60 -0.02 0.00 -0.02 0.00 0.00 41.12 40.05 1i90 n ASP 175 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1i90 n PHE 176 N 0.60 -2.07 -3.15 1.24 7.35 -0.70 -4.70 117.46 116.02 1i90 n PHE 176 Ca 0.02 -2.53 -0.21 0.00 -0.76 0.00 0.00 57.45 53.97 1i90 n PHE 176 Cb 0.38 0.72 0.01 0.00 0.35 0.00 0.00 39.48 40.93 1i90 n PHE 176 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1i90 s THR 177 N 0.00 3.95 -1.51 -2.13 -4.23 -1.26 -3.26 115.64 107.21 1i90 s THR 177 Ca 0.33 -0.70 -0.03 0.00 -1.18 0.00 0.00 61.69 60.11 1i90 s THR 177 Cb 0.14 -3.42 0.01 0.00 1.34 0.00 0.00 72.50 70.57 1i90 s THR 177 CO -0.16 -0.25 0.29 0.59 -0.54 0.00 0.00 174.62 174.55 1i90 n ASN 178 N -1.92 -5.34 -4.77 3.99 4.13 -1.25 -4.94 115.26 105.15 1i90 n ASN 178 Ca 0.01 -0.12 -0.38 0.00 1.68 0.00 0.00 54.58 55.77 1i90 n ASN 178 Cb 0.58 -4.40 -0.06 0.00 -1.54 0.00 0.00 39.78 34.36 1i90 n ASN 178 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1i90 s PHE 179 N -3.00 3.62 -0.43 3.10 5.36 -1.26 -5.01 117.98 120.35 1i90 s PHE 179 Ca 0.16 1.00 -0.13 0.00 -0.96 0.00 0.00 56.93 57.00 1i90 s PHE 179 Cb -0.08 -2.49 0.06 0.00 -0.34 0.00 0.00 43.02 40.18 1i90 s PHE 179 CO 0.20 0.36 0.31 0.34 -1.46 0.00 0.00 175.22 174.98 1i90 s ASP 180 N -0.11 5.95 0.35 6.13 2.15 -1.26 -4.44 116.67 125.45 1i90 s ASP 180 Ca 0.26 -1.24 0.26 0.00 0.43 0.00 0.00 52.55 52.26 1i90 s ASP 180 Cb -0.16 -2.11 1.23 0.00 -0.30 0.00 0.00 42.92 41.58 1i90 s ASP 180 CO 0.13 -0.54 1.77 1.55 -0.17 0.00 0.00 175.17 177.91 1i90 h PRO 181 N 8.60 0.00 0.00 4.34 0.13 -1.95 -2.54 132.00 140.58 1i90 h PRO 181 Ca -0.26 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.86 1i90 h PRO 181 Cb 1.10 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.23 1i90 h PRO 181 CO 0.79 0.00 -0.03 0.00 -0.23 0.00 0.00 178.00 178.53 1i90 h ARG 182 N 0.00 0.00 0.00 0.86 3.08 -1.92 -1.17 114.38 115.23 1i90 h ARG 182 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1i90 h ARG 182 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.23 1i90 h ARG 182 CO 0.00 0.03 0.00 0.41 -1.07 0.00 0.00 179.97 179.34 1i90 n GLY 183 N -1.21 -0.65 0.48 0.04 0.00 -0.96 -1.94 105.19 100.95 1i90 n GLY 183 Ca -0.03 -0.10 0.08 0.00 0.00 0.00 0.00 46.02 45.97 1i90 n GLY 183 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1i90 n LEU 184 N -1.09 1.91 -4.78 0.99 4.77 -0.44 -4.15 117.00 114.21 1i90 n LEU 184 Ca 0.12 -0.85 -0.38 0.00 -0.03 0.00 0.00 56.01 54.86 1i90 n LEU 184 Cb 0.09 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.11 1i90 n LEU 184 CO 0.11 0.35 0.54 -0.76 -1.33 0.00 0.00 177.39 176.31 1i90 s LEU 185 N -1.80 4.51 0.00 2.23 1.43 -0.82 -4.94 118.68 119.30 1i90 s LEU 185 Ca 0.16 1.71 -0.14 0.00 -1.03 0.00 0.00 54.13 54.83 1i90 s LEU 185 Cb 0.13 -3.58 0.20 0.00 0.03 0.00 0.00 46.19 42.98 1i90 s LEU 185 CO 0.33 0.11 0.93 -0.81 0.23 0.00 0.00 176.35 177.14 1i90 n PRO 186 N 1.18 -1.82 -0.07 1.29 -0.04 -1.26 -4.98 135.00 129.30 1i90 n PRO 186 Ca -0.03 -1.46 -0.14 0.00 -0.04 0.00 0.00 63.50 61.84 1i90 n PRO 186 Cb 0.49 -1.15 -0.06 0.00 -0.04 0.00 0.00 33.50 32.74 1i90 n PRO 186 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1i90 h GLU 187 N 0.00 0.54 -5.82 0.54 5.08 -1.91 -3.45 114.58 109.56 1i90 h GLU 187 Ca -0.32 -0.31 -0.65 0.00 -1.00 0.00 0.00 59.36 57.08 1i90 h GLU 187 Cb 0.94 0.03 -0.06 0.00 0.50 0.00 0.00 28.75 30.15 1i90 h GLU 187 CO 0.22 0.91 -0.51 0.45 -1.00 0.00 0.00 179.01 179.08 1i90 s SER 188 N -6.42 6.23 -0.24 1.42 0.15 -1.26 -5.01 113.70 108.57 1i90 s SER 188 Ca -0.13 0.33 0.14 0.00 0.70 0.00 0.00 55.95 56.98 1i90 s SER 188 Cb 0.07 -1.94 0.73 0.00 -1.71 0.00 0.00 66.02 63.17 1i90 s SER 188 CO 0.80 0.29 1.68 0.18 1.20 0.00 0.00 173.24 177.39 1i90 n LEU 189 N 1.15 5.34 -4.76 3.45 4.77 -1.26 -4.71 117.00 120.98 1i90 n LEU 189 Ca -0.13 -3.04 -0.37 0.00 -0.03 0.00 0.00 56.01 52.44 1i90 n LEU 189 Cb 0.53 -0.66 0.03 0.00 -2.33 0.00 0.00 43.42 40.98 1i90 n LEU 189 CO 0.41 0.69 0.88 -1.81 -1.33 0.00 0.00 177.39 176.23 1i90 s ASP 190 N -1.17 5.41 0.27 -1.43 1.01 -1.26 -4.70 116.67 114.80 1i90 s ASP 190 Ca 0.52 2.48 -0.18 0.00 0.71 0.00 0.00 52.55 56.08 1i90 s ASP 190 Cb 0.40 -2.61 0.01 0.00 1.01 0.00 0.00 42.92 41.74 1i90 s ASP 190 CO 0.13 -1.45 0.63 -0.72 0.21 0.00 0.00 175.17 173.97 1i90 s TYR 191 N -1.49 0.04 0.09 4.23 -0.85 -1.26 -0.99 117.35 117.12 1i90 s TYR 191 Ca 0.73 -0.47 0.08 0.00 -0.52 0.00 0.00 57.07 56.89 1i90 s TYR 191 Cb -0.33 0.50 -0.04 0.00 0.38 0.00 0.00 41.96 42.48 1i90 s TYR 191 CO 0.38 -1.15 -0.18 -1.58 -1.52 0.00 0.00 175.55 171.49 1i90 s TRP 192 N -3.91 2.54 -0.02 -3.49 0.51 0.03 -1.20 118.94 113.40 1i90 s TRP 192 Ca 0.16 -0.26 -0.04 0.00 -2.12 0.00 0.00 56.10 53.83 1i90 s TRP 192 Cb -0.04 -1.39 0.00 0.00 -0.81 0.00 0.00 33.47 31.24 1i90 s TRP 192 CO 0.08 0.33 0.10 -0.08 -0.51 0.00 0.00 176.95 176.87 1i90 s THR 193 N -1.06 0.05 0.05 2.01 -1.32 -0.10 -0.85 115.64 114.42 1i90 s THR 193 Ca 0.17 -0.39 -0.27 0.00 -1.21 0.00 0.00 61.69 59.99 1i90 s THR 193 Cb -0.11 -0.27 0.08 0.00 -1.51 0.00 0.00 72.50 70.69 1i90 s THR 193 CO 0.08 -0.21 0.68 -0.72 -2.21 0.00 0.00 174.62 172.24 1i90 s TYR 194 N -0.68 -0.55 0.03 9.09 1.13 -1.03 -1.05 117.35 124.28 1i90 s TYR 194 Ca -0.08 0.63 -0.30 0.00 -1.41 0.00 0.00 57.07 55.92 1i90 s TYR 194 Cb -0.05 0.50 -0.04 0.00 -1.10 0.00 0.00 41.96 41.27 1i90 s TYR 194 CO 0.00 -0.70 0.97 -1.25 -2.51 0.00 0.00 175.55 172.07 1i90 s PRO 195 N -2.57 4.59 0.00 -3.49 0.04 -1.26 -1.06 135.00 131.24 1i90 s PRO 195 Ca -0.03 1.42 0.00 0.00 0.04 0.00 0.00 61.00 62.43 1i90 s PRO 195 Cb -0.01 -3.44 0.00 0.00 0.04 0.00 0.00 34.50 31.09 1i90 s PRO 195 CO -0.03 0.01 0.00 0.41 0.04 0.00 0.00 177.00 177.43 1i90 n GLY 196 N 2.75 4.73 3.36 0.56 0.00 0.82 -4.82 105.19 112.58 1i90 n GLY 196 Ca 0.05 -0.73 -0.16 0.00 0.00 0.00 0.00 46.02 45.18 1i90 n GLY 196 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1i90 n SER 197 N 0.00 -1.17 -4.77 1.61 3.41 -1.02 -2.70 113.62 108.97 1i90 n SER 197 Ca 0.00 -3.02 -0.36 0.00 -0.26 0.00 0.00 58.87 55.23 1i90 n SER 197 Cb 0.00 2.30 -0.01 0.00 -0.26 0.00 0.00 64.21 66.24 1i90 n SER 197 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1i90 s LEU 198 N 0.00 3.94 0.00 1.04 1.43 -0.75 -4.45 118.68 119.88 1i90 s LEU 198 Ca 0.33 2.26 0.26 0.00 -1.03 0.00 0.00 54.13 55.95 1i90 s LEU 198 Cb -0.00 -4.34 0.96 0.00 0.03 0.00 0.00 46.19 42.83 1i90 s LEU 198 CO 0.23 -0.99 1.69 0.35 0.23 0.00 0.00 176.35 177.86 1i90 n THR 199 N -0.71 0.06 -4.25 5.49 -2.24 -1.26 -4.50 114.28 106.86 1i90 n THR 199 Ca 0.08 -0.28 -0.17 0.00 -2.27 0.00 0.00 64.05 61.41 1i90 n THR 199 Cb 0.49 0.48 -0.11 0.00 -2.10 0.00 0.00 70.33 69.10 1i90 n THR 199 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1i90 s THR 200 N -1.94 1.32 0.67 4.28 -4.23 -1.26 -4.67 115.64 109.81 1i90 s THR 200 Ca 0.36 -1.80 -0.17 0.00 -1.18 0.00 0.00 61.69 58.90 1i90 s THR 200 Cb 0.20 -1.61 -0.04 0.00 1.34 0.00 0.00 72.50 72.39 1i90 s THR 200 CO 0.32 -0.49 0.75 -2.65 -0.54 0.00 0.00 174.62 172.01 1i90 n PRO 201 N 0.35 0.53 0.00 3.99 -0.02 -1.26 -0.08 135.00 138.50 1i90 n PRO 201 Ca -0.14 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.56 1i90 n PRO 201 Cb 0.58 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 1i90 n PRO 201 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1i90 n PRO 202 N -1.01 0.59 -2.67 0.52 -0.04 -1.26 -4.95 135.00 126.18 1i90 n PRO 202 Ca 0.12 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.41 1i90 n PRO 202 Cb 0.49 -1.01 -0.00 0.00 -0.04 0.00 0.00 33.50 32.94 1i90 n PRO 202 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1i90 n LEU 203 N -0.49 -1.57 -4.71 1.53 4.77 0.88 -4.88 117.00 112.54 1i90 n LEU 203 Ca 0.00 -0.01 -0.43 0.00 -0.03 0.00 0.00 56.01 55.54 1i90 n LEU 203 Cb 0.00 -2.40 -0.01 0.00 -2.33 0.00 0.00 43.42 38.68 1i90 n LEU 203 CO 0.00 -0.05 1.03 0.18 -1.33 0.00 0.00 177.39 177.22 1i90 n LEU 204 N -3.17 3.72 -3.58 2.23 4.77 -1.26 -4.43 117.00 115.27 1i90 n LEU 204 Ca -0.14 1.18 -0.41 0.00 -0.03 0.00 0.00 56.01 56.61 1i90 n LEU 204 Cb 0.61 -1.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.20 1i90 n LEU 204 CO 0.29 -0.28 2.15 -0.62 -1.33 0.00 0.00 177.39 177.60 1i90 n GLU 205 N 1.31 4.56 -2.90 3.23 1.02 -1.26 -1.81 120.64 124.79 1i90 n GLU 205 Ca 0.07 -3.69 -0.13 0.00 -0.02 0.00 0.00 57.16 53.40 1i90 n GLU 205 Cb 0.35 -2.65 0.03 0.00 -0.02 0.00 0.00 31.44 29.16 1i90 n GLU 205 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1i90 s VAL 207 N -0.51 2.02 -0.38 0.00 1.01 -1.10 -0.69 120.40 120.74 1i90 s VAL 207 Ca 0.30 -1.02 -0.15 0.00 0.00 0.00 0.00 61.98 61.11 1i90 s VAL 207 Cb 0.28 -1.73 0.01 0.00 0.00 0.00 0.00 36.38 34.94 1i90 s VAL 207 CO -0.10 0.56 0.31 -0.89 0.00 0.00 0.00 175.10 174.97 1i90 s THR 208 N 0.12 5.23 0.07 3.92 2.01 -0.26 -0.13 115.64 126.60 1i90 s THR 208 Ca -0.12 -0.41 -0.26 0.00 0.31 0.00 0.00 61.69 61.21 1i90 s THR 208 Cb -0.16 -3.87 -0.06 0.00 0.01 0.00 0.00 72.50 68.42 1i90 s THR 208 CO 0.06 -0.22 0.79 0.26 -0.69 0.00 0.00 174.62 174.83 1i90 s TRP 209 N 1.79 3.77 -0.29 4.92 0.52 -0.23 -2.54 118.94 126.88 1i90 s TRP 209 Ca 0.07 1.53 0.01 0.00 0.02 0.00 0.00 56.10 57.73 1i90 s TRP 209 Cb -0.18 -2.84 0.09 0.00 -1.15 0.00 0.00 33.47 29.39 1i90 s TRP 209 CO 0.11 0.30 0.04 0.42 0.02 0.00 0.00 176.95 177.83 1i90 s ILE 210 N -0.20 1.45 -0.25 2.03 1.01 -0.64 -2.46 121.20 122.13 1i90 s ILE 210 Ca 0.39 -1.57 -0.08 0.00 0.00 0.00 0.00 60.65 59.39 1i90 s ILE 210 Cb -0.21 -1.96 -0.04 0.00 0.01 0.00 0.00 42.46 40.26 1i90 s ILE 210 CO 0.24 -0.46 0.10 -0.69 0.00 0.00 0.00 174.94 174.13 1i90 s VAL 211 N 1.36 4.63 0.39 2.92 1.01 -0.03 -0.03 120.40 130.65 1i90 s VAL 211 Ca 0.05 -0.07 -0.25 0.00 0.00 0.00 0.00 61.98 61.71 1i90 s VAL 211 Cb -0.18 -3.16 -0.09 0.00 0.00 0.00 0.00 36.38 32.95 1i90 s VAL 211 CO -0.14 0.33 1.13 -0.76 0.00 0.00 0.00 175.10 175.67 1i90 s LEU 212 N 1.47 4.22 0.02 3.92 1.43 -0.38 -0.79 118.68 128.57 1i90 s LEU 212 Ca 0.06 2.27 -0.22 0.00 -1.03 0.00 0.00 54.13 55.21 1i90 s LEU 212 Cb -0.15 -4.02 -0.16 0.00 0.03 0.00 0.00 46.19 41.89 1i90 s LEU 212 CO 0.05 -0.57 1.30 0.50 0.23 0.00 0.00 176.35 177.86 1i90 h LYS 213 N 2.73 0.28 -5.88 1.70 3.64 -1.39 -3.44 116.57 114.22 1i90 h LYS 213 Ca -0.48 -0.16 -0.59 0.00 -1.27 0.00 0.00 60.65 58.15 1i90 h LYS 213 Cb 1.23 0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 32.98 1i90 h LYS 213 CO 0.63 0.72 0.52 -2.00 -2.27 0.00 0.00 179.45 177.05 1i90 s GLU 214 N -4.18 4.22 0.71 1.90 2.12 -1.26 -5.01 118.70 117.20 1i90 s GLU 214 Ca -0.15 1.04 -0.11 0.00 0.36 0.00 0.00 54.97 56.11 1i90 s GLU 214 Cb 0.04 -3.63 0.02 0.00 0.26 0.00 0.00 34.13 30.82 1i90 s GLU 214 CO 0.74 -0.51 1.10 -1.25 -0.54 0.00 0.00 175.26 174.80 1i90 s PRO 215 N 2.79 2.81 0.16 4.30 0.04 -1.26 -4.69 135.00 139.14 1i90 s PRO 215 Ca 0.37 0.46 0.04 0.00 0.04 0.00 0.00 61.00 61.91 1i90 s PRO 215 Cb -0.15 -2.02 -0.04 0.00 0.04 0.00 0.00 34.50 32.33 1i90 s PRO 215 CO 0.08 -1.07 0.19 0.96 0.04 0.00 0.00 177.00 177.20 1i90 s ILE 216 N -3.36 4.79 -0.09 0.56 -4.36 0.09 -4.88 121.20 113.95 1i90 s ILE 216 Ca 0.58 -0.93 -0.06 0.00 -0.26 0.00 0.00 60.65 59.98 1i90 s ILE 216 Cb -0.11 -3.46 -0.04 0.00 1.25 0.00 0.00 42.46 40.10 1i90 s ILE 216 CO 0.52 -0.10 0.14 -0.44 0.24 0.00 0.00 174.94 175.30 1i90 s SER 217 N -3.15 6.33 0.03 4.36 0.01 -1.26 -0.80 113.70 119.23 1i90 s SER 217 Ca 0.32 0.43 0.01 0.00 1.31 0.00 0.00 55.95 58.02 1i90 s SER 217 Cb -0.10 -2.03 -0.02 0.00 0.21 0.00 0.00 66.02 64.08 1i90 s SER 217 CO 0.25 0.37 -0.05 0.68 0.41 0.00 0.00 173.24 174.91 1i90 s VAL 218 N -1.10 0.29 0.75 3.43 -7.23 -0.51 -3.58 120.40 112.46 1i90 s VAL 218 Ca 0.18 -0.89 -0.11 0.00 -1.81 0.00 0.00 61.98 59.35 1i90 s VAL 218 Cb -0.12 -0.39 0.04 0.00 0.56 0.00 0.00 36.38 36.47 1i90 s VAL 218 CO 0.08 -0.39 1.08 -0.94 -0.31 0.00 0.00 175.10 174.61 1i90 s SER 219 N -1.36 4.92 0.41 4.85 1.04 -1.13 -0.77 113.70 121.66 1i90 s SER 219 Ca -0.12 1.45 0.11 0.00 0.48 0.00 0.00 55.95 57.87 1i90 s SER 219 Cb -0.09 -2.25 0.85 0.00 0.10 0.00 0.00 66.02 64.63 1i90 s SER 219 CO -0.00 -1.71 1.95 0.77 0.98 0.00 0.00 173.24 175.22 1i90 h SER 220 N -0.91 0.18 -0.52 7.02 4.64 -1.93 -1.45 113.55 120.58 1i90 h SER 220 Ca -0.45 -0.03 -0.09 0.00 -0.47 0.00 0.00 61.79 60.75 1i90 h SER 220 Cb 1.24 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 63.26 1i90 h SER 220 CO 0.58 0.32 0.01 -0.33 -0.87 0.00 0.00 176.83 176.54 1i90 h GLU 221 N 0.18 0.96 -0.15 4.77 3.07 -1.95 0.24 114.58 121.70 1i90 h GLU 221 Ca 0.04 -0.28 -0.03 0.00 -0.50 0.00 0.00 59.36 58.59 1i90 h GLU 221 Cb 0.33 -0.10 -0.00 0.00 -0.84 0.00 0.00 28.75 28.14 1i90 h GLU 221 CO 0.02 0.94 -0.02 1.96 -1.40 0.00 0.00 179.01 180.51 1i90 h GLN 222 N 0.88 0.27 -0.06 2.33 4.20 -1.65 -2.67 115.11 118.41 1i90 h GLN 222 Ca 0.16 -0.09 -0.10 0.00 0.06 0.00 0.00 58.65 58.68 1i90 h GLN 222 Cb 0.51 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 1i90 h GLN 222 CO 0.02 0.53 -0.40 -0.39 -0.67 0.00 0.00 178.83 177.92 1i90 h VAL 223 N -0.01 1.30 -0.96 -0.54 -1.51 -1.22 -2.84 116.25 110.47 1i90 h VAL 223 Ca 0.04 -1.45 0.05 0.00 -1.23 0.00 0.00 66.70 64.11 1i90 h VAL 223 Cb 0.41 1.70 -0.06 0.00 -2.13 0.00 0.00 31.29 31.22 1i90 h VAL 223 CO 0.01 0.43 0.62 -0.07 -1.23 0.00 0.00 177.57 177.33 1i90 h LEU 224 N 0.12 1.00 -1.50 4.19 3.38 -0.41 -0.99 115.31 121.10 1i90 h LEU 224 Ca 0.01 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 1i90 h LEU 224 Cb 0.76 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1i90 h LEU 224 CO 0.06 0.66 -0.07 0.11 0.09 0.00 0.00 178.44 179.29 1i90 h LYS 225 N 1.15 0.24 -0.33 1.13 6.56 -1.22 -2.56 116.57 121.53 1i90 h LYS 225 Ca 0.40 -0.04 -0.01 0.00 -1.06 0.00 0.00 60.65 59.94 1i90 h LYS 225 Cb 0.11 -0.04 -0.02 0.00 -0.57 0.00 0.00 32.23 31.72 1i90 h LYS 225 CO -0.14 0.32 0.18 0.74 -2.06 0.00 0.00 179.45 178.49 1i90 h PHE 226 N 0.23 0.46 0.00 -1.35 -1.00 -1.20 -2.87 116.94 111.22 1i90 h PHE 226 Ca 0.05 -0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.82 1i90 h PHE 226 Cb 0.27 -0.15 0.00 0.00 3.61 0.00 0.00 35.95 39.69 1i90 h PHE 226 CO 0.00 0.38 0.00 0.54 -1.61 0.00 0.00 178.31 177.62 1i90 n ARG 227 N -4.78 0.06 0.00 1.51 1.74 -0.97 -2.25 116.66 111.97 1i90 n ARG 227 Ca -0.01 0.27 0.12 0.00 -0.77 0.00 0.00 57.85 57.47 1i90 n ARG 227 Cb 0.09 -1.50 0.17 0.00 -1.02 0.00 0.00 32.46 30.20 1i90 n ARG 227 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1i90 n LYS 228 N -1.33 2.11 -1.57 5.56 5.02 -1.08 -4.36 118.16 122.51 1i90 n LYS 228 Ca 0.02 -1.67 -0.29 0.00 -2.02 0.00 0.00 58.31 54.35 1i90 n LYS 228 Cb 0.04 -1.47 0.11 0.00 -0.02 0.00 0.00 35.03 33.70 1i90 n LYS 228 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1i90 s LEU 229 N -2.04 2.30 0.02 -0.35 1.43 -0.95 -4.87 118.68 114.22 1i90 s LEU 229 Ca 0.29 1.10 0.07 0.00 -1.03 0.00 0.00 54.13 54.57 1i90 s LEU 229 Cb 0.20 -3.57 -0.02 0.00 0.03 0.00 0.00 46.19 42.83 1i90 s LEU 229 CO 0.33 -2.25 -0.22 0.20 0.23 0.00 0.00 176.35 174.64 1i90 s ASN 230 N -4.01 2.60 0.07 2.29 0.02 0.92 -0.01 114.94 116.82 1i90 s ASN 230 Ca 0.62 -0.49 -0.15 0.00 -1.02 0.00 0.00 52.86 51.83 1i90 s ASN 230 Cb -0.14 -0.24 -0.23 0.00 0.02 0.00 0.00 41.25 40.65 1i90 s ASN 230 CO 0.53 0.21 1.19 -0.26 0.02 0.00 0.00 177.10 178.79 1i90 h PHE 231 N 5.09 1.01 -4.16 2.20 0.04 -1.34 -3.35 116.94 116.44 1i90 h PHE 231 Ca -0.42 -0.54 -0.50 0.00 2.80 0.00 0.00 57.97 59.30 1i90 h PHE 231 Cb 1.15 -0.12 0.09 0.00 2.20 0.00 0.00 35.95 39.27 1i90 h PHE 231 CO 0.46 1.38 0.40 0.54 -0.60 0.00 0.00 178.31 180.49 1i90 s ASN 232 N -7.23 5.37 0.77 2.17 4.22 -1.26 -4.30 114.94 114.69 1i90 s ASN 232 Ca -0.10 2.06 -0.10 0.00 -2.14 0.00 0.00 52.86 52.58 1i90 s ASN 232 Cb 0.07 -2.56 0.08 0.00 1.28 0.00 0.00 41.25 40.11 1i90 s ASN 232 CO 0.91 -1.45 1.12 -0.83 -2.04 0.00 0.00 177.10 174.80 1i90 s GLY 233 N -2.28 1.65 0.52 0.45 0.00 -1.26 -1.45 107.32 104.95 1i90 s GLY 233 Ca 0.69 -0.82 -0.23 0.00 0.00 0.00 0.00 44.72 44.36 1i90 s GLY 233 CO 0.36 -0.35 1.38 1.85 0.00 0.00 0.00 173.10 176.34 1i90 s GLU 234 N -5.45 3.28 0.00 2.90 2.12 -1.26 -2.43 118.70 117.85 1i90 s GLU 234 Ca 0.62 2.30 0.00 0.00 0.36 0.00 0.00 54.97 58.25 1i90 s GLU 234 Cb -0.10 -2.37 0.00 0.00 0.26 0.00 0.00 34.13 31.92 1i90 s GLU 234 CO 0.47 -1.10 0.00 0.41 -0.54 0.00 0.00 175.26 174.50 1i90 n GLY 235 N 0.69 3.05 3.96 -1.50 0.00 -1.26 -5.01 105.19 105.12 1i90 n GLY 235 Ca 0.09 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 1i90 n GLY 235 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1i90 s GLU 236 N -0.28 2.95 0.33 1.61 2.02 -1.02 -5.04 118.70 119.27 1i90 s GLU 236 Ca 0.00 -0.53 -0.29 0.00 0.02 0.00 0.00 54.97 54.17 1i90 s GLU 236 Cb 0.00 -2.53 -0.11 0.00 0.10 0.00 0.00 34.13 31.59 1i90 s GLU 236 CO 0.00 -0.38 1.56 -2.14 0.02 0.00 0.00 175.26 174.31 1i90 s PRO 237 N -4.62 4.11 0.01 0.39 0.02 -1.26 -4.90 135.00 128.75 1i90 s PRO 237 Ca 0.50 2.58 -0.30 0.00 0.02 0.00 0.00 61.00 63.80 1i90 s PRO 237 Cb -0.10 -3.00 -0.06 0.00 0.02 0.00 0.00 34.50 31.36 1i90 s PRO 237 CO 0.38 -0.60 1.50 -2.00 -0.33 0.00 0.00 177.00 175.95 1i90 s GLU 238 N -1.11 4.24 -0.24 5.54 2.12 -1.26 -4.71 118.70 123.28 1i90 s GLU 238 Ca 0.59 2.08 0.00 0.00 0.36 0.00 0.00 54.97 58.01 1i90 s GLU 238 Cb -0.47 -3.64 0.06 0.00 0.26 0.00 0.00 34.13 30.34 1i90 s GLU 238 CO 0.54 -0.66 -0.02 -1.21 -0.54 0.00 0.00 175.26 173.37 1i90 s GLU 239 N 2.71 1.41 0.26 4.30 2.02 -1.26 -5.04 118.70 123.09 1i90 s GLU 239 Ca 0.67 -0.96 -0.31 0.00 0.02 0.00 0.00 54.97 54.40 1i90 s GLU 239 Cb -0.34 -2.51 -0.12 0.00 0.10 0.00 0.00 34.13 31.27 1i90 s GLU 239 CO 0.28 -0.65 1.61 1.28 0.02 0.00 0.00 175.26 177.81 1i90 n LEU 240 N 4.72 4.12 -4.53 1.80 4.77 -1.26 -1.00 117.00 125.62 1i90 n LEU 240 Ca -0.10 1.12 -0.41 0.00 -0.03 0.00 0.00 56.01 56.59 1i90 n LEU 240 Cb 0.44 -1.57 -0.03 0.00 -2.33 0.00 0.00 43.42 39.93 1i90 n LEU 240 CO 0.17 0.09 1.17 -0.32 -1.33 0.00 0.00 177.39 177.17 1i90 s MET 241 N -0.01 3.30 0.07 3.23 -2.45 0.99 -4.66 119.30 119.76 1i90 s MET 241 Ca 0.68 -0.63 -0.09 0.00 -1.25 0.00 0.00 55.69 54.40 1i90 s MET 241 Cb -0.52 -4.52 -0.00 0.00 1.25 0.00 0.00 34.83 31.04 1i90 s MET 241 CO 0.44 -2.09 0.18 0.14 1.05 0.00 0.00 175.02 174.74 1i90 s VAL 242 N 5.12 0.13 -1.44 10.11 -7.23 -1.26 -4.33 120.40 121.50 1i90 s VAL 242 Ca 0.36 -1.07 -0.10 0.00 -1.81 0.00 0.00 61.98 59.36 1i90 s VAL 242 Cb -0.07 -1.15 0.05 0.00 0.56 0.00 0.00 36.38 35.77 1i90 s VAL 242 CO 0.07 -0.59 0.97 0.47 -0.31 0.00 0.00 175.10 175.70 1i90 n ASP 243 N 0.28 -4.28 -2.80 4.85 8.00 0.09 -4.85 116.55 117.85 1i90 n ASP 243 Ca -0.17 -0.73 -0.31 0.00 0.71 0.00 0.00 54.79 54.29 1i90 n ASP 243 Cb 0.61 -4.20 -0.04 0.00 -0.02 0.00 0.00 41.12 37.47 1i90 n ASP 243 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1i90 n ASN 244 N -2.93 6.95 -4.26 -2.24 6.94 -1.07 -4.91 115.26 113.76 1i90 n ASN 244 Ca -0.05 -3.19 -0.20 0.00 -0.02 0.00 0.00 54.58 51.13 1i90 n ASN 244 Cb 0.57 -1.27 -0.12 0.00 -2.36 0.00 0.00 39.78 36.60 1i90 n ASN 244 CO 0.00 0.00 0.00 -1.66 -1.03 0.00 0.00 177.26 174.57 1i90 s TRP 245 N -1.55 1.55 -0.16 -2.53 1.48 -1.26 -4.63 118.94 111.84 1i90 s TRP 245 Ca 0.57 -0.49 -0.09 0.00 -1.06 0.00 0.00 56.10 55.04 1i90 s TRP 245 Cb 0.32 -0.82 -0.05 0.00 -1.16 0.00 0.00 33.47 31.76 1i90 s TRP 245 CO -0.18 0.18 0.15 0.50 -4.06 0.00 0.00 176.95 173.54 1i90 s ARG 246 N -2.33 3.92 0.93 3.25 3.52 -1.26 -4.96 118.95 122.03 1i90 s ARG 246 Ca 0.08 -0.15 -0.11 0.00 -0.13 0.00 0.00 55.73 55.41 1i90 s ARG 246 Cb -0.07 -3.33 0.15 0.00 -1.56 0.00 0.00 34.95 30.13 1i90 s ARG 246 CO 0.04 0.47 1.09 -1.25 -0.81 0.00 0.00 175.30 174.85 1i90 s PRO 247 N -0.16 0.93 0.33 5.12 0.04 -1.26 -4.64 135.00 135.35 1i90 s PRO 247 Ca 0.11 1.07 -0.29 0.00 0.04 0.00 0.00 61.00 61.93 1i90 s PRO 247 Cb -0.12 -1.75 -0.12 0.00 0.04 0.00 0.00 34.50 32.56 1i90 s PRO 247 CO 0.01 -2.54 1.51 0.00 0.04 0.00 0.00 177.00 176.02 1i90 n ALA 248 N -4.12 2.27 -2.93 8.56 0.00 -1.26 -4.35 120.51 118.68 1i90 n ALA 248 Ca 0.08 0.36 -0.22 0.00 0.00 0.00 0.00 53.44 53.66 1i90 n ALA 248 Cb 0.54 -2.41 -0.03 0.00 0.00 0.00 0.00 19.45 17.55 1i90 n ALA 248 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1i90 s GLN 249 N -1.27 3.33 0.18 0.00 -1.52 0.19 -4.93 119.66 115.64 1i90 s GLN 249 Ca 0.59 -0.78 -0.31 0.00 -1.95 0.00 0.00 55.36 52.91 1i90 s GLN 249 Cb -0.50 -2.84 -0.09 0.00 -0.22 0.00 0.00 33.01 29.35 1i90 s GLN 249 CO 0.56 0.45 1.42 -1.25 -0.25 0.00 0.00 175.29 176.22 1i90 s PRO 250 N -3.77 4.30 0.43 2.91 0.04 -1.26 -4.49 135.00 133.16 1i90 s PRO 250 Ca 0.34 2.20 0.09 0.00 0.04 0.00 0.00 61.00 63.67 1i90 s PRO 250 Cb -0.09 -3.17 0.95 0.00 0.04 0.00 0.00 34.50 32.22 1i90 s PRO 250 CO 0.28 -0.43 2.07 1.25 0.04 0.00 0.00 177.00 180.22 1i90 h LEU 251 N 5.95 0.37 0.00 -3.56 5.85 -1.94 -3.44 115.31 118.54 1i90 h LEU 251 Ca -0.44 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.27 1i90 h LEU 251 Cb 1.21 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.15 1i90 h LEU 251 CO 0.83 0.27 0.00 0.29 -0.34 0.00 0.00 178.44 179.49 1i90 n LYS 252 N -4.49 0.00 -1.58 1.25 5.02 -1.26 -3.27 118.16 113.83 1i90 n LYS 252 Ca 0.02 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 55.99 1i90 n LYS 252 Cb 0.08 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 35.04 1i90 n LYS 252 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1i90 n ASN 253 N 2.98 7.36 -4.10 4.39 4.13 -1.26 -4.90 115.26 123.86 1i90 n ASN 253 Ca 0.00 -2.95 -0.09 0.00 1.68 0.00 0.00 54.58 53.22 1i90 n ASN 253 Cb 0.00 -1.37 -0.10 0.00 -1.54 0.00 0.00 39.78 36.77 1i90 n ASN 253 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1i90 s ARG 254 N -0.36 0.64 -0.02 3.52 0.52 -1.20 -5.11 118.95 116.93 1i90 s ARG 254 Ca 0.60 -1.15 0.04 0.00 -0.52 0.00 0.00 55.73 54.70 1i90 s ARG 254 Cb 0.26 0.04 -0.01 0.00 0.52 0.00 0.00 34.95 35.76 1i90 s ARG 254 CO -0.11 -0.06 -0.12 -1.14 0.02 0.00 0.00 175.30 173.88 1i90 s GLN 255 N -3.44 1.07 -0.26 3.54 2.00 -1.26 -5.03 119.66 116.28 1i90 s GLN 255 Ca 0.05 -0.43 -0.19 0.00 -2.00 0.00 0.00 55.36 52.78 1i90 s GLN 255 Cb 0.04 -1.01 -0.02 0.00 0.80 0.00 0.00 33.01 32.81 1i90 s GLN 255 CO -0.07 0.24 0.57 0.42 -0.50 0.00 0.00 175.29 175.95 1i90 s ILE 256 N -0.17 5.02 0.19 -2.34 1.01 -1.26 -4.69 121.20 118.96 1i90 s ILE 256 Ca 0.02 1.00 -0.06 0.00 0.00 0.00 0.00 60.65 61.62 1i90 s ILE 256 Cb -0.06 -3.88 -0.06 0.00 0.01 0.00 0.00 42.46 38.47 1i90 s ILE 256 CO -0.00 0.05 0.44 -0.54 0.00 0.00 0.00 174.94 174.89 1i90 s LYS 257 N 2.41 3.66 0.04 2.79 1.02 -0.21 -0.66 119.74 128.79 1i90 s LYS 257 Ca 0.24 0.00 0.09 0.00 0.02 0.00 0.00 55.97 56.32 1i90 s LYS 257 Cb -0.16 -2.77 -0.03 0.00 -0.52 0.00 0.00 37.83 34.36 1i90 s LYS 257 CO 0.09 0.40 -0.25 0.00 -0.92 0.00 0.00 175.35 174.67 1i90 s ALA 258 N -1.76 2.09 -2.54 5.17 0.00 0.52 -0.92 121.76 124.31 1i90 s ALA 258 Ca 0.43 -1.19 0.24 0.00 0.00 0.00 0.00 51.96 51.44 1i90 s ALA 258 Cb -0.12 -0.44 0.64 0.00 0.00 0.00 0.00 23.12 23.20 1i90 s ALA 258 CO 0.24 0.49 1.51 -1.13 0.00 0.00 0.00 175.76 176.87 1i90 n SER 259 N 1.87 2.29 -4.09 0.00 3.41 -0.34 -0.44 113.62 116.32 1i90 n SER 259 Ca -0.17 -1.78 -0.10 0.00 -0.26 0.00 0.00 58.87 56.57 1i90 n SER 259 Cb 0.52 -0.08 -0.10 0.00 -0.26 0.00 0.00 64.21 64.29 1i90 n SER 259 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1i90 s PHE 260 N -1.84 0.61 -2.30 7.33 -0.71 -1.26 -4.88 117.98 114.93 1i90 s PHE 260 Ca 0.34 -0.82 0.30 0.00 -1.04 0.00 0.00 56.93 55.71 1i90 s PHE 260 Cb 0.20 -0.39 1.39 0.00 -1.21 0.00 0.00 43.02 43.01 1i90 s PHE 260 CO 0.30 -0.22 1.94 1.17 -1.34 0.00 0.00 175.22 177.07