#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d92 s TRP 5 N 0.00 2.47 0.00 -1.40 1.48 -1.26 -4.86 118.94 115.37 3d92 s TRP 5 Ca 0.00 1.49 0.00 0.00 -1.06 0.00 0.00 56.10 56.53 3d92 s TRP 5 Cb 0.00 -3.52 0.00 0.00 -1.16 0.00 0.00 33.47 28.79 3d92 s TRP 5 CO 0.00 -2.19 0.00 0.41 -4.06 0.00 0.00 176.95 171.11 3d92 n GLY 6 N 0.53 2.61 0.38 3.67 0.00 -0.38 -5.04 105.19 106.96 3d92 n GLY 6 Ca 0.12 -0.21 0.03 0.00 0.00 0.00 0.00 46.02 45.96 3d92 n GLY 6 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3d92 n TYR 7 N 0.00 0.00 -2.08 1.61 4.01 -1.26 -3.81 117.16 115.63 3d92 n TYR 7 Ca 0.00 -0.36 -0.04 0.00 -0.16 0.00 0.00 57.90 57.34 3d92 n TYR 7 Cb 0.00 -0.09 0.02 0.00 -0.31 0.00 0.00 39.34 38.96 3d92 n TYR 7 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3d92 n GLY 8 N -0.48 0.36 0.20 2.72 0.00 -1.26 -4.79 105.19 101.94 3d92 n GLY 8 Ca 0.06 -1.91 0.06 0.00 0.00 0.00 0.00 46.02 44.22 3d92 n GLY 8 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3d92 h LYS 9 N 0.00 0.00 0.00 1.61 1.57 -2.00 -3.09 116.57 114.66 3d92 h LYS 9 Ca -0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3d92 h LYS 9 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.51 3d92 h LYS 9 CO 0.06 0.33 0.00 0.72 -0.57 0.00 0.00 179.45 179.99 3d92 n HIS 10 N -3.77 0.00 -1.62 -1.35 8.25 -1.26 -4.75 115.22 110.71 3d92 n HIS 10 Ca -0.01 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.47 3d92 n HIS 10 Cb 0.42 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.56 3d92 n HIS 10 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 3d92 n ASN 11 N -0.02 0.50 -2.83 0.41 6.94 -1.24 -4.97 115.26 114.05 3d92 n ASN 11 Ca 0.00 -2.06 -0.12 0.00 -0.02 0.00 0.00 54.58 52.38 3d92 n ASN 11 Cb 0.05 -0.21 0.08 0.00 -2.36 0.00 0.00 39.78 37.35 3d92 n ASN 11 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3d92 n GLY 12 N -0.28 -1.14 0.44 4.83 0.00 -1.17 -1.24 105.19 106.63 3d92 n GLY 12 Ca 0.03 -1.71 0.26 0.00 0.00 0.00 0.00 46.02 44.60 3d92 n GLY 12 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3d92 h PRO 13 N 0.00 0.27 0.00 1.61 0.11 -1.90 0.13 132.00 132.22 3d92 h PRO 13 Ca -0.18 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.91 3d92 h PRO 13 Cb 0.51 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.56 3d92 h PRO 13 CO 0.13 0.18 0.00 -0.85 -0.21 0.00 0.00 178.00 177.25 3d92 n GLU 14 N -4.50 0.09 -0.00 1.05 0.00 -1.26 -2.67 120.64 113.34 3d92 n GLU 14 Ca 0.25 0.30 0.10 0.00 0.00 0.00 0.00 57.16 57.81 3d92 n GLU 14 Cb 0.97 -1.66 -0.14 0.00 0.00 0.00 0.00 31.44 30.61 3d92 n GLU 14 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 3d92 n HIS 15 N -1.82 0.00 0.19 -1.84 8.25 0.46 -4.62 115.22 115.84 3d92 n HIS 15 Ca 0.03 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.56 3d92 n HIS 15 Cb 0.22 -0.22 0.56 0.00 1.12 0.00 0.00 29.99 31.67 3d92 n HIS 15 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 3d92 h TRP 16 N 0.00 0.12 -0.04 4.41 6.55 -1.52 -2.47 115.95 122.99 3d92 h TRP 16 Ca 0.00 -0.00 0.01 0.00 0.95 0.00 0.00 58.89 59.85 3d92 h TRP 16 Cb 0.72 -0.04 -0.00 0.00 -0.86 0.00 0.00 29.16 28.98 3d92 h TRP 16 CO 0.00 0.11 0.05 1.12 -1.05 0.00 0.00 178.44 178.67 3d92 h HIS 17 N 0.12 0.00 -0.45 0.49 2.07 -1.79 -0.49 115.15 115.10 3d92 h HIS 17 Ca 0.03 0.00 -0.08 0.00 -2.85 0.00 0.00 60.37 57.47 3d92 h HIS 17 Cb 0.06 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.02 3d92 h HIS 17 CO 0.00 0.00 -0.06 0.87 -3.07 0.00 0.00 177.93 175.67 3d92 h LYS 18 N 0.00 0.79 0.00 5.12 1.57 -1.80 -2.91 116.57 119.34 3d92 h LYS 18 Ca 0.02 -0.24 -0.10 0.00 -1.87 0.00 0.00 60.65 58.46 3d92 h LYS 18 Cb 0.11 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 3d92 h LYS 18 CO -0.00 0.83 -1.77 -0.25 -0.57 0.00 0.00 179.45 177.69 3d92 n ASP 19 N -4.19 0.32 -3.61 0.86 8.00 -1.00 -4.74 116.55 112.20 3d92 n ASP 19 Ca 0.02 0.13 -0.27 0.00 0.71 0.00 0.00 54.79 55.38 3d92 n ASP 19 Cb 0.34 1.19 -0.11 0.00 -0.02 0.00 0.00 41.12 42.52 3d92 n ASP 19 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3d92 n PHE 20 N -2.54 1.44 0.27 1.24 3.72 -0.23 -5.00 117.46 116.36 3d92 n PHE 20 Ca -0.09 -3.86 0.18 0.00 -0.05 0.00 0.00 57.45 53.63 3d92 n PHE 20 Cb 0.72 -0.26 0.92 0.00 -0.94 0.00 0.00 39.48 39.92 3d92 n PHE 20 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3d92 h PRO 21 N 5.27 0.00 0.00 -1.08 0.13 -1.76 -0.21 132.00 134.35 3d92 h PRO 21 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 3d92 h PRO 21 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 3d92 h PRO 21 CO 0.58 0.00 0.00 1.51 -0.23 0.00 0.00 178.00 179.86 3d92 n ILE 22 N -3.42 1.07 -0.06 -3.56 0.13 -1.26 -2.03 119.36 110.22 3d92 n ILE 22 Ca -0.00 0.63 0.25 0.00 -1.10 0.00 0.00 62.75 62.52 3d92 n ILE 22 Cb 0.28 -1.61 0.71 0.00 -0.84 0.00 0.00 39.64 38.18 3d92 n ILE 22 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 3d92 h ALA 23 N 2.05 2.53 -0.57 1.51 0.00 -1.35 0.21 119.26 123.65 3d92 h ALA 23 Ca 0.00 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 3d92 h ALA 23 Cb 0.07 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 3d92 h ALA 23 CO 0.00 -0.97 0.09 1.63 0.00 0.00 0.00 179.25 180.00 3d92 n LYS 24 N -3.92 4.07 -0.76 0.00 5.02 -0.86 -4.97 118.16 116.74 3d92 n LYS 24 Ca 0.14 -3.09 -0.18 0.00 -2.02 0.00 0.00 58.31 53.16 3d92 n LYS 24 Cb 0.87 -2.17 0.14 0.00 -0.02 0.00 0.00 35.03 33.85 3d92 n LYS 24 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3d92 n GLY 25 N 0.10 -2.30 0.09 0.72 0.00 0.73 -4.99 105.19 99.53 3d92 n GLY 25 Ca 0.31 -1.53 0.12 0.00 0.00 0.00 0.00 46.02 44.92 3d92 n GLY 25 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3d92 h GLU 26 N 0.00 0.00 -1.01 1.61 4.39 -1.96 -3.38 114.58 114.22 3d92 h GLU 26 Ca -0.25 0.00 -0.38 0.00 0.34 0.00 0.00 59.36 59.07 3d92 h GLU 26 Cb 0.74 0.00 -0.40 0.00 -0.10 0.00 0.00 28.75 28.99 3d92 h GLU 26 CO 0.17 0.00 -1.13 0.54 -1.16 0.00 0.00 179.01 177.43 3d92 n ARG 27 N -2.29 1.50 -2.92 2.33 1.74 -1.26 -4.61 116.66 111.16 3d92 n ARG 27 Ca 0.03 -3.44 -0.31 0.00 -0.77 0.00 0.00 57.85 53.37 3d92 n ARG 27 Cb 0.46 -1.41 -0.04 0.00 -1.02 0.00 0.00 32.46 30.45 3d92 n ARG 27 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3d92 s GLN 28 N -3.23 3.84 0.15 5.56 -1.52 -1.26 -2.81 119.66 120.39 3d92 s GLN 28 Ca 0.30 0.53 0.07 0.00 -1.95 0.00 0.00 55.36 54.31 3d92 s GLN 28 Cb 0.44 -2.40 -0.04 0.00 -0.22 0.00 0.00 33.01 30.79 3d92 s GLN 28 CO 0.00 0.01 -0.16 -1.12 -0.25 0.00 0.00 175.29 173.78 3d92 s SER 29 N -2.92 2.38 1.06 5.90 0.01 -1.26 -4.66 113.70 114.22 3d92 s SER 29 Ca 0.52 -0.87 -0.16 0.00 1.31 0.00 0.00 55.95 56.75 3d92 s SER 29 Cb -0.10 -0.12 0.23 0.00 0.21 0.00 0.00 66.02 66.24 3d92 s SER 29 CO 0.28 -0.10 1.15 -0.81 0.41 0.00 0.00 173.24 174.17 3d92 n PRO 30 N 0.28 -1.70 -4.17 12.44 -0.04 -1.26 -4.57 135.00 135.99 3d92 n PRO 30 Ca -0.13 -1.80 -0.10 0.00 -0.04 0.00 0.00 63.50 61.42 3d92 n PRO 30 Cb 0.58 -1.32 -0.10 0.00 -0.04 0.00 0.00 33.50 32.61 3d92 n PRO 30 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3d92 s VAL 31 N -3.42 0.58 0.05 0.52 -7.23 -1.26 -0.50 120.40 109.14 3d92 s VAL 31 Ca 0.68 -1.92 -0.30 0.00 -1.81 0.00 0.00 61.98 58.63 3d92 s VAL 31 Cb -0.03 -1.74 -0.04 0.00 0.56 0.00 0.00 36.38 35.12 3d92 s VAL 31 CO 0.49 -0.81 0.98 -0.62 -0.31 0.00 0.00 175.10 174.82 3d92 s ASP 32 N -3.04 7.42 -0.46 4.85 2.15 -1.26 -3.15 116.67 123.17 3d92 s ASP 32 Ca 0.14 1.73 -0.17 0.00 0.43 0.00 0.00 52.55 54.67 3d92 s ASP 32 Cb 0.06 -2.58 0.05 0.00 -0.30 0.00 0.00 42.92 40.15 3d92 s ASP 32 CO -0.04 -0.18 0.49 -0.63 -0.17 0.00 0.00 175.17 174.65 3d92 s ILE 33 N 0.56 5.05 -0.48 4.11 1.01 0.37 -4.96 121.20 126.87 3d92 s ILE 33 Ca 0.50 -0.58 -0.23 0.00 0.00 0.00 0.00 60.65 60.34 3d92 s ILE 33 Cb -0.22 -4.15 0.03 0.00 0.01 0.00 0.00 42.46 38.13 3d92 s ILE 33 CO 0.29 -0.60 0.78 -0.62 0.00 0.00 0.00 174.94 174.79 3d92 s ASP 34 N 2.33 6.36 0.00 3.58 -1.08 -1.26 -0.56 116.67 126.03 3d92 s ASP 34 Ca 0.11 -0.28 0.17 0.00 -0.52 0.00 0.00 52.55 52.02 3d92 s ASP 34 Cb -0.20 -2.38 0.75 0.00 -1.46 0.00 0.00 42.92 39.64 3d92 s ASP 34 CO 0.11 -0.96 1.52 0.35 0.52 0.00 0.00 175.17 176.71 3d92 n THR 35 N 6.06 0.75 1.07 1.71 -2.24 -1.26 -1.56 114.28 118.81 3d92 n THR 35 Ca 0.01 0.19 0.12 0.00 -2.27 0.00 0.00 64.05 62.09 3d92 n THR 35 Cb 0.48 -0.91 0.16 0.00 -2.10 0.00 0.00 70.33 67.96 3d92 n THR 35 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3d92 n HIS 36 N -1.43 0.00 0.00 4.78 8.25 -1.26 -4.33 115.22 121.23 3d92 n HIS 36 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 3d92 n HIS 36 Cb 0.17 -0.11 0.00 0.00 1.12 0.00 0.00 29.99 31.17 3d92 n HIS 36 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 3d92 n THR 37 N -0.96 0.00 -2.00 1.59 -2.24 -0.91 -5.03 114.28 104.73 3d92 n THR 37 Ca 0.08 -0.27 -0.42 0.00 -2.27 0.00 0.00 64.05 61.17 3d92 n THR 37 Cb 0.36 0.79 -0.03 0.00 -2.10 0.00 0.00 70.33 69.35 3d92 n THR 37 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d92 s ALA 38 N -1.20 3.69 -0.10 6.98 0.00 -0.60 -4.91 121.76 125.62 3d92 s ALA 38 Ca 0.00 1.31 -0.01 0.00 0.00 0.00 0.00 51.96 53.26 3d92 s ALA 38 Cb 0.00 -3.58 -0.03 0.00 0.00 0.00 0.00 23.12 19.51 3d92 s ALA 38 CO 0.00 -0.74 -0.03 0.21 0.00 0.00 0.00 175.76 175.20 3d92 s LYS 39 N 0.59 3.11 0.21 0.00 2.20 -1.13 -4.81 119.74 119.91 3d92 s LYS 39 Ca 0.65 -0.49 -0.32 0.00 -0.36 0.00 0.00 55.97 55.45 3d92 s LYS 39 Cb -0.42 -2.76 -0.13 0.00 -1.51 0.00 0.00 37.83 33.01 3d92 s LYS 39 CO 0.35 0.56 1.60 0.98 -0.36 0.00 0.00 175.35 178.48 3d92 n TYR 40 N 2.57 2.50 -3.92 4.03 9.36 -1.26 -1.05 117.16 129.40 3d92 n TYR 40 Ca -0.18 0.22 -0.34 0.00 3.32 0.00 0.00 57.90 60.92 3d92 n TYR 40 Cb 0.53 -2.58 -0.14 0.00 -0.63 0.00 0.00 39.34 36.52 3d92 n TYR 40 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 3d92 s ASP 41 N 0.82 4.93 0.00 2.98 -1.08 -0.39 -4.86 116.67 119.07 3d92 s ASP 41 Ca 0.73 -1.91 0.11 0.00 -0.52 0.00 0.00 52.55 50.96 3d92 s ASP 41 Cb -0.59 -1.71 0.50 0.00 -1.46 0.00 0.00 42.92 39.66 3d92 s ASP 41 CO 0.40 -0.40 1.32 -0.81 0.52 0.00 0.00 175.17 176.19 3d92 n PRO 42 N 4.45 0.05 0.09 4.34 -0.04 -1.26 -2.08 135.00 140.55 3d92 n PRO 42 Ca -0.02 0.27 0.12 0.00 -0.04 0.00 0.00 63.50 63.83 3d92 n PRO 42 Cb 0.42 -1.50 0.28 0.00 -0.04 0.00 0.00 33.50 32.66 3d92 n PRO 42 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3d92 h SER 43 N 0.00 0.00 -3.32 3.54 4.64 -1.97 -3.45 113.55 113.00 3d92 h SER 43 Ca 0.00 -0.10 -0.54 0.00 -0.47 0.00 0.00 61.79 60.68 3d92 h SER 43 Cb 0.16 0.00 0.09 0.00 -0.31 0.00 0.00 62.40 62.34 3d92 h SER 43 CO 0.00 0.05 0.84 0.18 -0.87 0.00 0.00 176.83 177.03 3d92 n LEU 44 N -2.22 4.31 -4.92 5.97 4.77 -0.88 -5.01 117.00 119.01 3d92 n LEU 44 Ca 0.04 1.16 -0.27 0.00 -0.03 0.00 0.00 56.01 56.91 3d92 n LEU 44 Cb 0.44 -1.58 -0.03 0.00 -2.33 0.00 0.00 43.42 39.92 3d92 n LEU 44 CO 0.33 0.09 0.15 -0.54 -1.33 0.00 0.00 177.39 176.10 3d92 s LYS 45 N -0.73 3.56 0.54 3.23 1.02 -1.11 -4.98 119.74 121.28 3d92 s LYS 45 Ca 0.63 -0.18 -0.21 0.00 0.02 0.00 0.00 55.97 56.23 3d92 s LYS 45 Cb -0.51 -2.70 -0.06 0.00 -0.52 0.00 0.00 37.83 34.04 3d92 s LYS 45 CO 0.51 0.25 1.19 -2.30 -0.92 0.00 0.00 175.35 174.07 3d92 n PRO 46 N -1.09 1.42 -2.72 -1.68 -0.02 -1.26 -2.03 135.00 127.63 3d92 n PRO 46 Ca -0.03 0.52 -0.38 0.00 -2.02 0.00 0.00 63.50 61.59 3d92 n PRO 46 Cb 0.54 -2.37 -0.06 0.00 -0.02 0.00 0.00 33.50 31.60 3d92 n PRO 46 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3d92 s LEU 47 N -2.51 4.40 -0.26 2.45 2.96 -1.26 -1.60 118.68 122.85 3d92 s LEU 47 Ca 0.71 1.92 0.03 0.00 -0.22 0.00 0.00 54.13 56.57 3d92 s LEU 47 Cb -0.44 -3.92 0.06 0.00 0.50 0.00 0.00 46.19 42.39 3d92 s LEU 47 CO 0.50 -0.08 -0.11 -0.55 -1.32 0.00 0.00 176.35 174.79 3d92 s SER 48 N -1.46 4.46 -0.32 3.68 0.15 0.03 -4.86 113.70 115.38 3d92 s SER 48 Ca 0.49 -1.41 -0.09 0.00 0.70 0.00 0.00 55.95 55.64 3d92 s SER 48 Cb -0.22 -1.55 0.01 0.00 -1.71 0.00 0.00 66.02 62.55 3d92 s SER 48 CO 0.27 -0.19 0.14 -0.69 1.20 0.00 0.00 173.24 173.97 3d92 s VAL 49 N 1.10 4.35 -0.44 4.45 1.01 -1.26 -1.22 120.40 128.38 3d92 s VAL 49 Ca -0.09 -0.63 0.03 0.00 0.00 0.00 0.00 61.98 61.30 3d92 s VAL 49 Cb -0.20 -3.28 0.12 0.00 0.00 0.00 0.00 36.38 33.02 3d92 s VAL 49 CO -0.05 0.00 0.19 -0.55 0.00 0.00 0.00 175.10 174.69 3d92 s SER 50 N 1.56 4.26 0.00 3.32 0.15 -0.14 -4.92 113.70 117.92 3d92 s SER 50 Ca 0.03 -2.61 0.09 0.00 0.70 0.00 0.00 55.95 54.16 3d92 s SER 50 Cb -0.18 -1.45 0.25 0.00 -1.71 0.00 0.00 66.02 62.93 3d92 s SER 50 CO 0.05 -0.29 1.19 -1.22 1.20 0.00 0.00 173.24 174.17 3d92 n TYR 51 N 3.62 0.37 0.25 3.44 4.01 -1.26 -1.45 117.16 126.14 3d92 n TYR 51 Ca 0.05 -0.47 0.11 0.00 -0.16 0.00 0.00 57.90 57.43 3d92 n TYR 51 Cb 0.36 -0.03 0.64 0.00 -0.31 0.00 0.00 39.34 40.00 3d92 n TYR 51 CO 0.00 0.00 0.00 0.22 -0.46 0.00 0.00 176.86 176.62 3d92 h ASP 52 N 1.70 0.00 -0.47 7.72 3.58 -1.92 -2.47 116.42 124.55 3d92 h ASP 52 Ca 0.00 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.44 3d92 h ASP 52 Cb 0.68 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.72 3d92 h ASP 52 CO 0.00 0.16 0.01 0.00 -2.88 0.00 0.00 179.24 176.54 3d92 n GLN 53 N -3.62 4.14 -1.75 0.28 1.13 -1.21 -5.02 117.38 111.33 3d92 n GLN 53 Ca -0.01 -3.06 -0.41 0.00 -1.94 0.00 0.00 57.00 51.58 3d92 n GLN 53 Cb 0.29 -2.12 0.00 0.00 0.11 0.00 0.00 30.24 28.53 3d92 n GLN 53 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3d92 n ALA 54 N 0.17 1.93 -3.87 -1.58 0.00 -0.93 -4.61 120.51 111.61 3d92 n ALA 54 Ca 0.26 0.32 -0.30 0.00 0.00 0.00 0.00 53.44 53.72 3d92 n ALA 54 Cb 1.11 -2.36 -0.14 0.00 0.00 0.00 0.00 19.45 18.06 3d92 n ALA 54 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3d92 s THR 55 N -1.14 1.93 0.51 0.00 2.01 -1.26 -4.95 115.64 112.74 3d92 s THR 55 Ca 0.56 -2.59 -0.20 0.00 0.31 0.00 0.00 61.69 59.77 3d92 s THR 55 Cb -0.49 -2.38 -0.07 0.00 0.01 0.00 0.00 72.50 69.56 3d92 s THR 55 CO 0.62 -0.76 1.08 -0.94 -0.69 0.00 0.00 174.62 173.93 3d92 s SER 56 N 0.46 6.07 -0.00 3.53 1.04 -1.26 -0.88 113.70 122.66 3d92 s SER 56 Ca 0.15 2.05 -0.00 0.00 0.48 0.00 0.00 55.95 58.63 3d92 s SER 56 Cb -0.23 -2.57 -0.00 0.00 0.10 0.00 0.00 66.02 63.32 3d92 s SER 56 CO -0.05 -0.97 -0.00 0.18 0.98 0.00 0.00 173.24 173.37 3d92 n LEU 57 N -1.08 1.18 -3.48 2.42 4.77 0.72 -3.99 117.00 117.53 3d92 n LEU 57 Ca 0.10 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.95 3d92 n LEU 57 Cb 0.52 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.57 3d92 n LEU 57 CO 0.41 0.20 0.36 -0.60 -1.33 0.00 0.00 177.39 176.43 3d92 s ARG 58 N -2.00 1.19 -0.04 3.23 3.52 -1.23 -1.54 118.95 122.08 3d92 s ARG 58 Ca -0.00 -0.35 0.04 0.00 -0.13 0.00 0.00 55.73 55.29 3d92 s ARG 58 Cb 0.00 0.55 -0.00 0.00 -1.56 0.00 0.00 34.95 33.93 3d92 s ARG 58 CO 0.00 -0.48 -0.17 -1.50 -0.81 0.00 0.00 175.30 172.34 3d92 s ILE 59 N -3.17 1.41 -0.05 4.11 2.07 -0.47 -0.90 121.20 124.21 3d92 s ILE 59 Ca -0.02 -0.71 0.01 0.00 -1.41 0.00 0.00 60.65 58.52 3d92 s ILE 59 Cb -0.00 -1.21 0.02 0.00 0.13 0.00 0.00 42.46 41.40 3d92 s ILE 59 CO -0.08 0.41 -0.04 -0.22 -1.91 0.00 0.00 174.94 173.10 3d92 s LEU 60 N -0.01 1.29 -0.47 8.50 2.96 -0.52 -1.11 118.68 129.32 3d92 s LEU 60 Ca -0.03 -0.13 -0.26 0.00 -0.22 0.00 0.00 54.13 53.50 3d92 s LEU 60 Cb -0.11 -0.46 0.03 0.00 0.50 0.00 0.00 46.19 46.15 3d92 s LEU 60 CO 0.02 -0.06 0.94 0.21 -1.32 0.00 0.00 176.35 176.14 3d92 s ASN 61 N 0.98 6.50 0.00 3.68 3.84 -0.43 -1.01 114.94 128.50 3d92 s ASN 61 Ca -0.10 0.11 0.20 0.00 0.21 0.00 0.00 52.86 53.28 3d92 s ASN 61 Cb -0.14 -2.46 0.56 0.00 -0.55 0.00 0.00 41.25 38.66 3d92 s ASN 61 CO -0.00 -1.08 1.46 -0.46 -2.79 0.00 0.00 177.10 174.24 3d92 n ASN 62 N 7.24 3.36 0.00 -4.21 0.23 -0.80 -0.45 115.26 120.63 3d92 n ASN 62 Ca 0.06 -1.99 0.00 0.00 -0.53 0.00 0.00 54.58 52.12 3d92 n ASN 62 Cb 0.48 -0.40 0.00 0.00 -2.08 0.00 0.00 39.78 37.78 3d92 n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3d92 n GLY 63 N 1.50 1.22 0.00 4.83 0.00 -1.26 -4.79 105.19 106.69 3d92 n GLY 63 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 3d92 n GLY 63 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3d92 n HIS 64 N -2.00 0.00 -2.68 1.61 8.25 -1.26 -4.74 115.22 114.40 3d92 n HIS 64 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 3d92 n HIS 64 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 3d92 n HIS 64 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3d92 n ALA 65 N -1.78 0.00 -2.37 -1.41 0.00 -1.26 -4.88 120.51 108.81 3d92 n ALA 65 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 3d92 n ALA 65 Cb 0.32 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.62 3d92 n ALA 65 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 3d92 s PHE 66 N -6.77 2.14 -0.14 0.00 -0.71 -1.26 -1.91 117.98 109.33 3d92 s PHE 66 Ca 0.00 -0.40 -0.03 0.00 -1.04 0.00 0.00 56.93 55.46 3d92 s PHE 66 Cb 0.00 -1.33 -0.03 0.00 -1.21 0.00 0.00 43.02 40.45 3d92 s PHE 66 CO 0.00 0.03 -0.03 -0.80 -1.34 0.00 0.00 175.22 173.08 3d92 s ASN 67 N -0.84 4.86 -0.33 1.98 0.02 -0.18 -4.33 114.94 116.12 3d92 s ASN 67 Ca 0.10 -0.08 -0.18 0.00 -1.02 0.00 0.00 52.86 51.67 3d92 s ASN 67 Cb -0.09 -1.71 -0.01 0.00 0.02 0.00 0.00 41.25 39.46 3d92 s ASN 67 CO 0.00 0.21 0.50 -0.69 0.02 0.00 0.00 177.10 177.14 3d92 s VAL 68 N 0.14 5.04 -0.04 1.60 1.01 -0.18 -1.44 120.40 126.53 3d92 s VAL 68 Ca -0.01 0.43 -0.05 0.00 0.00 0.00 0.00 61.98 62.35 3d92 s VAL 68 Cb -0.14 -3.92 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 3d92 s VAL 68 CO 0.03 -0.14 0.19 -1.61 0.00 0.00 0.00 175.10 173.57 3d92 s GLU 69 N 2.35 3.47 0.24 2.72 2.02 -0.07 -1.44 118.70 127.99 3d92 s GLU 69 Ca 0.19 -0.21 0.11 0.00 0.02 0.00 0.00 54.97 55.08 3d92 s GLU 69 Cb -0.16 -3.12 -0.05 0.00 0.10 0.00 0.00 34.13 30.91 3d92 s GLU 69 CO 0.12 0.70 -0.20 -0.06 0.02 0.00 0.00 175.26 175.84 3d92 s PHE 70 N -1.23 2.34 -0.39 1.61 0.40 -0.56 -0.20 117.98 119.94 3d92 s PHE 70 Ca 0.24 -0.33 -0.29 0.00 -0.60 0.00 0.00 56.93 55.95 3d92 s PHE 70 Cb -0.13 -1.08 0.00 0.00 0.51 0.00 0.00 43.02 42.32 3d92 s PHE 70 CO 0.14 0.61 1.50 0.34 0.70 0.00 0.00 175.22 178.51 3d92 s ASP 71 N -3.12 6.24 -0.29 1.36 2.15 -0.06 -4.85 116.67 118.11 3d92 s ASP 71 Ca 0.26 0.96 0.10 0.00 0.43 0.00 0.00 52.55 54.29 3d92 s ASP 71 Cb -0.07 -2.54 0.54 0.00 -0.30 0.00 0.00 42.92 40.56 3d92 s ASP 71 CO 0.13 -1.49 1.53 -0.90 -0.17 0.00 0.00 175.17 174.27 3d92 n ASP 72 N 9.14 3.06 -0.78 -0.34 5.75 -1.26 -4.62 116.55 127.50 3d92 n ASP 72 Ca 0.18 -3.56 0.12 0.00 -0.01 0.00 0.00 54.79 51.52 3d92 n ASP 72 Cb 0.48 -0.65 0.31 0.00 -1.03 0.00 0.00 41.12 40.23 3d92 n ASP 72 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 3d92 n SER 73 N -0.94 2.36 -3.83 -1.12 3.41 -1.26 -4.88 113.62 107.35 3d92 n SER 73 Ca 0.34 -1.80 -0.09 0.00 -0.26 0.00 0.00 58.87 57.06 3d92 n SER 73 Cb 1.10 -0.11 -0.06 0.00 -0.26 0.00 0.00 64.21 64.87 3d92 n SER 73 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3d92 s GLN 74 N -1.77 1.02 -1.18 4.33 -0.21 -1.26 -5.08 119.66 115.51 3d92 s GLN 74 Ca 0.34 -0.96 -0.20 0.00 0.02 0.00 0.00 55.36 54.57 3d92 s GLN 74 Cb 0.20 0.39 -0.04 0.00 1.00 0.00 0.00 33.01 34.57 3d92 s GLN 74 CO 0.29 -0.37 1.93 -0.25 -2.12 0.00 0.00 175.29 174.77 3d92 n ASP 75 N -0.16 3.64 -0.08 5.90 8.00 -1.26 -4.66 116.55 127.92 3d92 n ASP 75 Ca -0.13 -2.78 -0.22 0.00 0.71 0.00 0.00 54.79 52.37 3d92 n ASP 75 Cb 0.63 -1.59 -0.12 0.00 -0.02 0.00 0.00 41.12 40.02 3d92 n ASP 75 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3d92 n LYS 76 N 7.64 0.67 -3.75 -1.24 5.02 -1.26 -4.87 118.16 120.35 3d92 n LYS 76 Ca 0.48 0.26 -0.29 0.00 -2.02 0.00 0.00 58.31 56.75 3d92 n LYS 76 Cb 0.44 -1.61 -0.16 0.00 -0.02 0.00 0.00 35.03 33.68 3d92 n LYS 76 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3d92 s ALA 77 N -2.51 1.29 0.09 7.82 0.00 -1.26 -3.29 121.76 123.90 3d92 s ALA 77 Ca -0.31 -1.13 0.04 0.00 0.00 0.00 0.00 51.96 50.57 3d92 s ALA 77 Cb 0.09 -1.37 -0.03 0.00 0.00 0.00 0.00 23.12 21.80 3d92 s ALA 77 CO 0.64 -1.36 -0.11 0.14 0.00 0.00 0.00 175.76 175.07 3d92 s VAL 78 N 1.72 0.97 -0.11 0.00 -7.23 -0.53 -1.13 120.40 114.09 3d92 s VAL 78 Ca 0.02 -1.49 0.01 0.00 -1.81 0.00 0.00 61.98 58.71 3d92 s VAL 78 Cb -0.17 -1.21 -0.02 0.00 0.56 0.00 0.00 36.38 35.55 3d92 s VAL 78 CO -0.15 -0.44 -0.14 -0.22 -0.31 0.00 0.00 175.10 173.85 3d92 s LEU 79 N -2.16 2.68 0.29 1.32 2.96 0.06 -0.97 118.68 122.87 3d92 s LEU 79 Ca 0.02 -0.32 -0.05 0.00 -0.22 0.00 0.00 54.13 53.57 3d92 s LEU 79 Cb -0.06 -1.59 -0.01 0.00 0.50 0.00 0.00 46.19 45.03 3d92 s LEU 79 CO 0.01 0.20 0.40 -1.59 -1.32 0.00 0.00 176.35 174.05 3d92 s LYS 80 N 0.15 1.66 2.64 1.98 -2.85 -0.36 -1.72 119.74 121.25 3d92 s LYS 80 Ca -0.07 -1.61 0.00 0.00 -1.00 0.00 0.00 55.97 53.29 3d92 s LYS 80 Cb -0.15 0.41 0.00 0.00 -2.06 0.00 0.00 37.83 36.03 3d92 s LYS 80 CO 0.05 -0.66 0.00 0.41 0.10 0.00 0.00 175.35 175.25 3d92 n GLY 81 N -0.46 -0.49 7.00 0.59 0.00 -1.26 -0.79 105.19 109.78 3d92 n GLY 81 Ca 0.01 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 44.93 3d92 n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d92 n GLY 82 N 0.00 2.98 0.09 -0.02 0.00 -0.63 -0.77 105.19 106.85 3d92 n GLY 82 Ca 0.00 -0.24 0.15 0.00 0.00 0.00 0.00 46.02 45.93 3d92 n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3d92 n PRO 83 N 13.66 0.72 -3.31 1.61 -0.04 -1.26 -2.74 135.00 143.64 3d92 n PRO 83 Ca 0.00 -0.19 -0.33 0.00 -0.04 0.00 0.00 63.50 62.94 3d92 n PRO 83 Cb 0.00 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 31.91 3d92 n PRO 83 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3d92 s LEU 84 N -2.41 4.21 -0.17 1.53 1.43 0.05 -5.07 118.68 118.26 3d92 s LEU 84 Ca 0.32 1.08 -0.06 0.00 -1.03 0.00 0.00 54.13 54.44 3d92 s LEU 84 Cb 0.20 -3.64 -0.04 0.00 0.03 0.00 0.00 46.19 42.75 3d92 s LEU 84 CO 0.45 -0.04 0.04 -1.81 0.23 0.00 0.00 176.35 175.22 3d92 s ASP 85 N -2.10 5.44 0.00 2.29 1.01 -1.26 -4.21 116.67 117.84 3d92 s ASP 85 Ca 0.46 0.04 0.00 0.00 0.71 0.00 0.00 52.55 53.76 3d92 s ASP 85 Cb -0.13 -1.91 0.00 0.00 1.01 0.00 0.00 42.92 41.90 3d92 s ASP 85 CO 0.20 0.19 0.00 0.61 0.21 0.00 0.00 175.17 176.37 3d92 n GLY 86 N 3.44 -1.85 3.22 0.21 0.00 -1.26 -4.92 105.19 104.03 3d92 n GLY 86 Ca -0.17 -1.72 -0.31 0.00 0.00 0.00 0.00 46.02 43.82 3d92 n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d92 s THR 87 N 0.00 1.98 -0.13 2.61 2.01 -1.26 -4.53 115.64 116.31 3d92 s THR 87 Ca 0.00 -0.99 0.03 0.00 0.31 0.00 0.00 61.69 61.03 3d92 s THR 87 Cb 0.00 -1.70 0.01 0.00 0.01 0.00 0.00 72.50 70.82 3d92 s THR 87 CO 0.00 0.55 -0.22 -0.31 -0.69 0.00 0.00 174.62 173.95 3d92 s TYR 88 N 0.17 2.62 -0.10 4.92 1.51 -0.70 -1.43 117.35 124.34 3d92 s TYR 88 Ca -0.13 -1.29 -0.15 0.00 -1.01 0.00 0.00 57.07 54.49 3d92 s TYR 88 Cb -0.16 -1.78 -0.05 0.00 -0.11 0.00 0.00 41.96 39.86 3d92 s TYR 88 CO 0.07 -0.58 0.37 1.03 -1.11 0.00 0.00 175.55 175.32 3d92 s ARG 89 N 0.77 4.14 0.04 -0.62 0.52 0.04 -0.76 118.95 123.08 3d92 s ARG 89 Ca -0.08 0.27 -0.30 0.00 -0.52 0.00 0.00 55.73 55.09 3d92 s ARG 89 Cb -0.16 -3.36 -0.07 0.00 0.52 0.00 0.00 34.95 31.88 3d92 s ARG 89 CO -0.01 0.37 1.58 -1.17 0.02 0.00 0.00 175.30 176.09 3d92 s LEU 90 N 0.01 4.35 -0.16 2.53 2.96 -0.28 -1.16 118.68 126.92 3d92 s LEU 90 Ca 0.21 2.36 0.02 0.00 -0.22 0.00 0.00 54.13 56.49 3d92 s LEU 90 Cb -0.15 -3.56 -0.11 0.00 0.50 0.00 0.00 46.19 42.88 3d92 s LEU 90 CO 0.08 -0.84 -0.13 0.00 -1.32 0.00 0.00 176.35 174.14 3d92 n ILE 91 N 4.77 0.92 -3.48 6.68 3.06 -0.41 -4.50 119.36 126.40 3d92 n ILE 91 Ca 0.15 -0.36 -0.10 0.00 -2.50 0.00 0.00 62.75 59.94 3d92 n ILE 91 Cb 0.42 -1.05 -0.02 0.00 0.54 0.00 0.00 39.64 39.53 3d92 n ILE 91 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3d92 s GLN 92 N -2.32 1.04 0.20 9.51 1.03 -1.23 -1.50 119.66 126.39 3d92 s GLN 92 Ca -0.21 -0.39 0.08 0.00 0.04 0.00 0.00 55.36 54.88 3d92 s GLN 92 Cb 0.05 0.47 -0.05 0.00 0.03 0.00 0.00 33.01 33.52 3d92 s GLN 92 CO 0.38 -0.46 -0.15 -0.59 -2.54 0.00 0.00 175.29 171.93 3d92 s PHE 93 N -3.41 1.76 0.31 9.60 -0.12 -0.52 -0.82 117.98 124.78 3d92 s PHE 93 Ca 0.03 -0.54 -0.15 0.00 -0.05 0.00 0.00 56.93 56.22 3d92 s PHE 93 Cb -0.01 -0.82 0.02 0.00 -0.63 0.00 0.00 43.02 41.58 3d92 s PHE 93 CO -0.10 0.37 0.66 -3.38 -0.05 0.00 0.00 175.22 172.71 3d92 s HIS 94 N -2.76 0.19 0.22 3.49 -3.43 -0.71 -1.02 115.29 111.28 3d92 s HIS 94 Ca 0.21 -0.66 0.07 0.00 -0.80 0.00 0.00 55.06 53.88 3d92 s HIS 94 Cb -0.02 0.53 -0.05 0.00 -1.43 0.00 0.00 32.58 31.61 3d92 s HIS 94 CO 0.07 -1.27 -0.11 -0.06 -2.00 0.00 0.00 174.74 171.37 3d92 s PHE 95 N -3.34 1.73 -0.02 0.38 0.40 -1.26 -0.76 117.98 115.10 3d92 s PHE 95 Ca 0.17 -0.65 0.06 0.00 -0.60 0.00 0.00 56.93 55.91 3d92 s PHE 95 Cb -0.04 -0.88 -0.01 0.00 0.51 0.00 0.00 43.02 42.60 3d92 s PHE 95 CO 0.10 0.28 -0.19 -1.01 0.70 0.00 0.00 175.22 175.10 3d92 s HIS 96 N -3.05 1.78 0.22 0.36 3.76 -0.27 -4.76 115.29 113.32 3d92 s HIS 96 Ca 0.24 -0.39 -0.12 0.00 -0.15 0.00 0.00 55.06 54.64 3d92 s HIS 96 Cb 0.01 -1.16 -0.00 0.00 1.11 0.00 0.00 32.58 32.54 3d92 s HIS 96 CO 0.08 -0.07 0.43 1.67 -0.85 0.00 0.00 174.74 176.00 3d92 s TRP 97 N -0.33 0.31 0.51 1.40 -2.14 -1.22 -1.14 118.94 116.32 3d92 s TRP 97 Ca 0.04 -0.66 0.08 0.00 2.66 0.00 0.00 56.10 58.22 3d92 s TRP 97 Cb -0.09 0.14 0.04 0.00 -3.10 0.00 0.00 33.47 30.47 3d92 s TRP 97 CO 0.00 -0.90 0.59 0.20 -2.66 0.00 0.00 176.95 174.18 3d92 s GLY 98 N -2.98 1.98 0.24 3.67 0.00 -1.15 -0.95 107.32 108.12 3d92 s GLY 98 Ca 0.19 -1.82 0.24 0.00 0.00 0.00 0.00 44.72 43.33 3d92 s GLY 98 CO 0.05 -1.70 1.54 1.48 0.00 0.00 0.00 173.10 174.47 3d92 h SER 99 N 0.55 0.00 -5.00 1.64 4.64 -1.89 -3.39 113.55 110.10 3d92 h SER 99 Ca -0.36 -0.05 -0.17 0.00 -0.47 0.00 0.00 61.79 60.74 3d92 h SER 99 Cb 1.29 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.18 3d92 h SER 99 CO 0.48 0.03 -0.70 -0.76 -0.87 0.00 0.00 176.83 175.01 3d92 s LEU 100 N -4.95 2.29 0.58 5.97 1.43 -1.26 -5.07 118.68 117.67 3d92 s LEU 100 Ca 0.07 -0.59 0.37 0.00 -1.03 0.00 0.00 54.13 52.95 3d92 s LEU 100 Cb 0.10 0.09 1.72 0.00 0.03 0.00 0.00 46.19 48.13 3d92 s LEU 100 CO 0.67 -0.34 2.11 0.44 0.23 0.00 0.00 176.35 179.45 3d92 h ASP 101 N 4.36 0.00 -0.09 2.29 3.32 -1.93 -2.77 116.42 121.61 3d92 h ASP 101 Ca -0.33 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.72 3d92 h ASP 101 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.75 3d92 h ASP 101 CO 0.45 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.58 3d92 n GLY 102 N -0.35 -0.52 3.41 2.75 0.00 -1.26 -3.54 105.19 105.68 3d92 n GLY 102 Ca -0.01 -0.16 -0.10 0.00 0.00 0.00 0.00 46.02 45.76 3d92 n GLY 102 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3d92 s GLN 103 N -1.88 1.23 0.00 1.61 -2.07 -1.05 -4.69 119.66 112.82 3d92 s GLN 103 Ca 0.16 -0.95 0.00 0.00 -1.82 0.00 0.00 55.36 52.75 3d92 s GLN 103 Cb 0.08 0.46 0.00 0.00 -1.09 0.00 0.00 33.01 32.46 3d92 s GLN 103 CO 0.12 -0.49 0.00 0.41 -1.32 0.00 0.00 175.29 174.01 3d92 n GLY 104 N -0.27 1.89 3.80 2.60 0.00 -1.05 -3.29 105.19 108.87 3d92 n GLY 104 Ca -0.10 -0.10 -0.31 0.00 0.00 0.00 0.00 46.02 45.51 3d92 n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3d92 s SER 105 N 0.00 5.18 -0.13 1.61 1.04 -0.50 -3.42 113.70 117.48 3d92 s SER 105 Ca 0.00 1.70 -0.11 0.00 0.48 0.00 0.00 55.95 58.02 3d92 s SER 105 Cb 0.00 -2.51 -0.04 0.00 0.10 0.00 0.00 66.02 63.58 3d92 s SER 105 CO 0.00 -1.58 -0.21 -0.62 0.98 0.00 0.00 173.24 171.81 3d92 n GLU 106 N -3.11 0.40 -1.59 4.02 1.02 -1.26 -4.85 120.64 115.27 3d92 n GLU 106 Ca 0.08 0.33 -0.34 0.00 -0.02 0.00 0.00 57.16 57.21 3d92 n GLU 106 Cb 0.53 -1.40 0.07 0.00 -0.02 0.00 0.00 31.44 30.63 3d92 n GLU 106 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 3d92 s HIS 107 N -2.27 2.21 0.19 -0.32 3.76 -1.26 -4.21 115.29 113.39 3d92 s HIS 107 Ca -0.18 1.58 0.06 0.00 -0.15 0.00 0.00 55.06 56.38 3d92 s HIS 107 Cb 0.02 -3.42 -0.05 0.00 1.11 0.00 0.00 32.58 30.25 3d92 s HIS 107 CO 0.26 -2.37 -0.12 0.95 -0.85 0.00 0.00 174.74 172.61 3d92 s THR 108 N -1.99 1.52 -0.24 1.30 -4.23 -1.19 -4.69 115.64 106.12 3d92 s THR 108 Ca 0.73 -2.15 0.00 0.00 -1.18 0.00 0.00 61.69 59.10 3d92 s THR 108 Cb -0.28 -2.01 0.06 0.00 1.34 0.00 0.00 72.50 71.61 3d92 s THR 108 CO 0.43 -0.62 -0.04 -0.69 -0.54 0.00 0.00 174.62 173.16 3d92 s VAL 109 N -3.11 1.44 -1.57 2.29 1.01 -0.85 -0.47 120.40 119.14 3d92 s VAL 109 Ca 0.21 -1.21 -0.14 0.00 0.00 0.00 0.00 61.98 60.84 3d92 s VAL 109 Cb 0.01 -1.75 0.10 0.00 0.00 0.00 0.00 36.38 34.73 3d92 s VAL 109 CO 0.05 -0.15 0.91 0.47 0.00 0.00 0.00 175.10 176.38 3d92 n ASP 110 N 4.70 -4.17 0.00 3.32 8.00 0.27 -1.19 116.55 127.48 3d92 n ASP 110 Ca -0.11 -0.85 0.00 0.00 0.71 0.00 0.00 54.79 54.55 3d92 n ASP 110 Cb 0.44 -3.59 0.00 0.00 -0.02 0.00 0.00 41.12 37.95 3d92 n ASP 110 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3d92 n LYS 111 N -4.59 0.00 -2.28 -1.24 4.76 -1.26 -5.00 118.16 108.54 3d92 n LYS 111 Ca 0.03 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 55.05 3d92 n LYS 111 Cb 0.53 -3.06 -0.03 0.00 -1.84 0.00 0.00 35.03 30.63 3d92 n LYS 111 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 3d92 s LYS 112 N -0.29 4.36 -0.15 1.97 2.20 -0.33 -4.99 119.74 122.50 3d92 s LYS 112 Ca 0.00 1.93 -0.12 0.00 -0.36 0.00 0.00 55.97 57.42 3d92 s LYS 112 Cb 0.00 -3.36 -0.05 0.00 -1.51 0.00 0.00 37.83 32.92 3d92 s LYS 112 CO 0.00 -0.40 0.25 0.15 -0.36 0.00 0.00 175.35 174.99 3d92 s LYS 113 N 1.37 4.09 0.58 4.03 1.02 -1.26 -2.01 119.74 127.54 3d92 s LYS 113 Ca 0.62 0.03 -0.02 0.00 0.02 0.00 0.00 55.97 56.62 3d92 s LYS 113 Cb -0.33 -3.37 0.03 0.00 -0.52 0.00 0.00 37.83 33.64 3d92 s LYS 113 CO 0.29 0.38 0.84 0.71 -0.92 0.00 0.00 175.35 176.64 3d92 s TYR 114 N 0.07 3.01 0.27 3.18 2.02 -1.26 -4.61 117.35 120.03 3d92 s TYR 114 Ca 0.15 0.26 0.20 0.00 -0.37 0.00 0.00 57.07 57.31 3d92 s TYR 114 Cb -0.13 -2.78 0.90 0.00 -0.40 0.00 0.00 41.96 39.56 3d92 s TYR 114 CO 0.04 -0.90 1.85 0.00 -1.57 0.00 0.00 175.55 174.96 3d92 h ALA 115 N -0.07 1.16 -2.56 3.71 0.00 -1.44 -1.27 119.26 118.79 3d92 h ALA 115 Ca -0.44 -0.27 0.14 0.00 0.00 0.00 0.00 54.91 54.34 3d92 h ALA 115 Cb 1.29 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.97 3d92 h ALA 115 CO 0.57 0.37 0.42 0.00 0.00 0.00 0.00 179.25 180.61 3d92 s ALA 116 N -3.89 -1.48 -0.11 0.00 0.00 -1.12 -2.95 121.76 112.21 3d92 s ALA 116 Ca -0.01 -0.09 -0.06 0.00 0.00 0.00 0.00 51.96 51.79 3d92 s ALA 116 Cb 0.12 0.70 0.05 0.00 0.00 0.00 0.00 23.12 23.99 3d92 s ALA 116 CO 0.66 -1.04 0.27 -2.00 0.00 0.00 0.00 175.76 173.66 3d92 s GLU 117 N -3.23 0.25 -0.13 0.00 2.12 -0.29 -1.35 118.70 116.06 3d92 s GLU 117 Ca 0.13 0.55 -0.13 0.00 0.36 0.00 0.00 54.97 55.88 3d92 s GLU 117 Cb -0.03 -0.07 -0.05 0.00 0.26 0.00 0.00 34.13 34.24 3d92 s GLU 117 CO 0.04 -0.15 0.28 -1.17 -0.54 0.00 0.00 175.26 173.73 3d92 s LEU 118 N 1.14 4.29 -0.21 2.70 2.96 0.24 -1.12 118.68 128.68 3d92 s LEU 118 Ca -0.08 0.55 0.02 0.00 -0.22 0.00 0.00 54.13 54.40 3d92 s LEU 118 Cb -0.09 -2.35 0.04 0.00 0.50 0.00 0.00 46.19 44.29 3d92 s LEU 118 CO -0.08 0.18 -0.16 -1.00 -1.32 0.00 0.00 176.35 173.96 3d92 s HIS 119 N 0.05 2.97 -0.40 5.38 3.76 0.06 -1.13 115.29 125.98 3d92 s HIS 119 Ca 0.17 -1.92 -0.15 0.00 -0.15 0.00 0.00 55.06 53.00 3d92 s HIS 119 Cb -0.13 -1.92 0.01 0.00 1.11 0.00 0.00 32.58 31.65 3d92 s HIS 119 CO 0.05 -0.84 0.34 -0.51 -0.85 0.00 0.00 174.74 172.93 3d92 s LEU 120 N 1.21 4.93 -0.22 0.89 1.02 -0.23 -1.74 118.68 124.56 3d92 s LEU 120 Ca -0.01 -0.74 -0.11 0.00 0.02 0.00 0.00 54.13 53.29 3d92 s LEU 120 Cb -0.16 -2.24 -0.05 0.00 0.02 0.00 0.00 46.19 43.76 3d92 s LEU 120 CO -0.10 -0.46 0.18 -0.69 0.02 0.00 0.00 176.35 175.30 3d92 s VAL 121 N 1.84 5.36 0.05 -1.59 1.01 -0.00 -1.40 120.40 125.67 3d92 s VAL 121 Ca 0.08 0.26 0.06 0.00 0.00 0.00 0.00 61.98 62.37 3d92 s VAL 121 Cb -0.18 -3.52 -0.02 0.00 0.00 0.00 0.00 36.38 32.66 3d92 s VAL 121 CO 0.11 0.38 -0.17 -1.00 0.00 0.00 0.00 175.10 174.42 3d92 s HIS 122 N 0.78 1.48 0.09 5.22 3.76 -0.42 -1.28 115.29 124.92 3d92 s HIS 122 Ca 0.09 -0.37 0.10 0.00 -0.15 0.00 0.00 55.06 54.73 3d92 s HIS 122 Cb -0.13 -0.87 -0.03 0.00 1.11 0.00 0.00 32.58 32.66 3d92 s HIS 122 CO 0.02 0.07 -0.26 1.67 -0.85 0.00 0.00 174.74 175.39 3d92 s TRP 123 N -0.88 2.26 -0.21 1.40 1.48 -0.31 -0.96 118.94 121.71 3d92 s TRP 123 Ca 0.04 -0.39 -0.29 0.00 -1.06 0.00 0.00 56.10 54.39 3d92 s TRP 123 Cb -0.08 -1.28 -0.02 0.00 -1.16 0.00 0.00 33.47 30.93 3d92 s TRP 123 CO 0.02 0.24 1.44 1.21 -4.06 0.00 0.00 176.95 175.80 3d92 s ASN 124 N -1.69 6.63 0.38 -2.66 3.84 0.34 -0.78 114.94 120.99 3d92 s ASN 124 Ca 0.12 1.58 0.27 0.00 0.21 0.00 0.00 52.86 55.04 3d92 s ASN 124 Cb -0.10 -2.54 1.29 0.00 -0.55 0.00 0.00 41.25 39.36 3d92 s ASN 124 CO 0.04 -1.06 1.83 0.71 -2.79 0.00 0.00 177.10 175.83 3d92 h THR 125 N 5.88 0.00 0.00 -5.21 1.35 -1.59 -1.92 112.91 111.42 3d92 h THR 125 Ca -0.30 -0.18 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 3d92 h THR 125 Cb 1.13 0.91 0.00 0.00 -1.73 0.00 0.00 68.15 68.46 3d92 h THR 125 CO 1.00 0.00 0.00 0.07 -0.25 0.00 0.00 175.52 176.34 3d92 h LYS 127 N 0.00 0.00 -0.18 4.72 2.10 -1.91 -2.42 116.57 118.88 3d92 h LYS 127 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3d92 h LYS 127 Cb 0.23 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.56 3d92 h LYS 127 CO 0.00 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 178.11 3d92 n TYR 128 N -2.54 0.20 0.00 0.07 4.01 -0.72 -5.01 117.16 113.17 3d92 n TYR 128 Ca -0.00 -0.10 0.00 0.00 -0.16 0.00 0.00 57.90 57.63 3d92 n TYR 128 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.17 3d92 n TYR 128 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3d92 n GLY 129 N 1.41 1.33 3.41 2.72 0.00 -0.91 -4.52 105.19 108.64 3d92 n GLY 129 Ca 0.16 -0.11 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 3d92 n GLY 129 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3d92 s ASP 130 N 0.00 -0.07 0.16 1.61 1.47 -1.26 -5.07 116.67 113.51 3d92 s ASP 130 Ca 0.00 -0.74 -0.13 0.00 1.18 0.00 0.00 52.55 52.86 3d92 s ASP 130 Cb 0.00 0.49 0.05 0.00 -0.34 0.00 0.00 42.92 43.12 3d92 s ASP 130 CO 0.00 -0.96 1.73 0.15 0.68 0.00 0.00 175.17 176.77 3d92 h PHE 131 N 2.41 0.78 -0.09 2.11 3.57 -1.95 -1.33 116.94 122.44 3d92 h PHE 131 Ca -0.30 -0.05 -0.06 0.00 3.53 0.00 0.00 57.97 61.09 3d92 h PHE 131 Cb 1.24 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 39.73 3d92 h PHE 131 CO 0.38 0.63 -0.20 0.78 -2.23 0.00 0.00 178.31 177.67 3d92 h GLY 132 N 0.71 0.17 1.38 2.40 0.00 -1.97 -1.33 103.07 104.43 3d92 h GLY 132 Ca 0.18 -0.11 -0.24 0.00 0.00 0.00 0.00 47.33 47.16 3d92 h GLY 132 CO -0.02 0.10 -0.95 0.50 0.00 0.00 0.00 176.54 176.18 3d92 h LYS 133 N 0.14 0.56 -0.82 4.80 6.56 -1.77 -3.33 116.57 122.71 3d92 h LYS 133 Ca 0.03 -0.58 -0.02 0.00 -1.06 0.00 0.00 60.65 59.02 3d92 h LYS 133 Cb 0.45 0.16 -0.04 0.00 -0.57 0.00 0.00 32.23 32.23 3d92 h LYS 133 CO 0.03 1.20 0.43 0.00 -2.06 0.00 0.00 179.45 179.04 3d92 h ALA 134 N 0.61 1.20 0.00 3.86 0.00 -0.48 -2.31 119.26 122.14 3d92 h ALA 134 Ca -0.09 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3d92 h ALA 134 Cb 1.58 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 19.05 3d92 h ALA 134 CO 0.18 0.63 0.00 1.33 0.00 0.00 0.00 179.25 181.38 3d92 n VAL 135 N -4.33 1.13 1.11 0.00 0.24 -0.57 -1.72 118.33 114.19 3d92 n VAL 135 Ca 0.08 0.32 0.09 0.00 -2.04 0.00 0.00 64.34 62.79 3d92 n VAL 135 Cb 0.12 -1.17 0.29 0.00 -1.47 0.00 0.00 33.84 31.61 3d92 n VAL 135 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3d92 n GLN 136 N -1.72 1.74 -4.94 7.34 6.02 -0.87 -4.69 117.38 120.27 3d92 n GLN 136 Ca 0.02 -1.13 -0.29 0.00 -0.01 0.00 0.00 57.00 55.59 3d92 n GLN 136 Cb 0.15 -1.34 -0.15 0.00 1.02 0.00 0.00 30.24 29.91 3d92 n GLN 136 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 3d92 s GLN 137 N -1.69 1.75 0.50 -1.09 -1.52 -0.70 -5.04 119.66 111.86 3d92 s GLN 137 Ca 0.29 -0.97 0.20 0.00 -1.95 0.00 0.00 55.36 52.92 3d92 s GLN 137 Cb 0.15 -1.82 1.28 0.00 -0.22 0.00 0.00 33.01 32.40 3d92 s GLN 137 CO 0.22 0.48 2.09 -1.35 -0.25 0.00 0.00 175.29 176.48 3d92 h PRO 138 N 5.09 0.00 -0.63 2.91 0.11 -1.86 -2.25 132.00 135.37 3d92 h PRO 138 Ca -0.44 0.00 -0.39 0.00 0.11 0.00 0.00 66.00 65.28 3d92 h PRO 138 Cb 1.14 0.00 -0.23 0.00 0.11 0.00 0.00 31.00 32.02 3d92 h PRO 138 CO 0.45 0.10 0.04 -0.40 -0.21 0.00 0.00 178.00 177.98 3d92 n ASP 139 N -4.18 4.08 0.09 -2.05 5.75 -1.26 -3.97 116.55 115.00 3d92 n ASP 139 Ca -0.03 -3.77 -0.12 0.00 -0.01 0.00 0.00 54.79 50.87 3d92 n ASP 139 Cb 0.18 -0.67 -0.13 0.00 -1.03 0.00 0.00 41.12 39.47 3d92 n ASP 139 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 3d92 h GLY 140 N 1.42 0.18 -3.34 6.12 0.00 -1.20 -3.43 103.07 102.81 3d92 h GLY 140 Ca 0.38 -0.46 -0.60 0.00 0.00 0.00 0.00 47.33 46.64 3d92 h GLY 140 CO 0.78 0.40 -0.81 1.08 0.00 0.00 0.00 176.54 177.99 3d92 s LEU 141 N -6.97 2.42 -0.10 3.11 1.43 0.06 -0.51 118.68 118.12 3d92 s LEU 141 Ca -0.02 -0.84 0.00 0.00 -1.03 0.00 0.00 54.13 52.24 3d92 s LEU 141 Cb 0.08 -1.03 0.02 0.00 0.03 0.00 0.00 46.19 45.29 3d92 s LEU 141 CO 0.86 0.07 -0.09 0.00 0.23 0.00 0.00 176.35 177.41 3d92 s ALA 142 N -1.72 1.34 -0.19 4.21 0.00 -0.14 -1.02 121.76 124.24 3d92 s ALA 142 Ca 0.17 -0.53 -0.02 0.00 0.00 0.00 0.00 51.96 51.59 3d92 s ALA 142 Cb -0.07 -0.82 -0.00 0.00 0.00 0.00 0.00 23.12 22.23 3d92 s ALA 142 CO 0.08 -0.25 -0.11 0.08 0.00 0.00 0.00 175.76 175.56 3d92 s VAL 143 N 1.38 2.90 -0.32 0.00 1.01 -0.90 -1.30 120.40 123.17 3d92 s VAL 143 Ca -0.01 -0.67 -0.20 0.00 0.00 0.00 0.00 61.98 61.10 3d92 s VAL 143 Cb -0.14 -2.27 -0.01 0.00 0.00 0.00 0.00 36.38 33.97 3d92 s VAL 143 CO -0.05 0.48 0.64 -0.22 0.00 0.00 0.00 175.10 175.95 3d92 s LEU 144 N 1.19 4.17 -0.13 3.92 2.96 -0.49 -1.32 118.68 128.97 3d92 s LEU 144 Ca 0.02 0.36 -0.04 0.00 -0.22 0.00 0.00 54.13 54.25 3d92 s LEU 144 Cb -0.14 -2.82 -0.03 0.00 0.50 0.00 0.00 46.19 43.70 3d92 s LEU 144 CO -0.04 -0.51 -0.00 -0.83 -1.32 0.00 0.00 176.35 173.64 3d92 s GLY 145 N 1.68 1.81 -0.08 7.98 0.00 0.14 -1.06 107.32 117.79 3d92 s GLY 145 Ca 0.25 -0.80 0.00 0.00 0.00 0.00 0.00 44.72 44.17 3d92 s GLY 145 CO 0.13 -0.26 -0.05 -0.42 0.00 0.00 0.00 173.10 172.50 3d92 s ILE 146 N -0.17 0.70 0.42 0.90 1.01 -0.28 -0.93 121.20 122.85 3d92 s ILE 146 Ca 0.05 -0.14 -0.22 0.00 0.00 0.00 0.00 60.65 60.34 3d92 s ILE 146 Cb -0.13 -0.75 -0.10 0.00 0.01 0.00 0.00 42.46 41.50 3d92 s ILE 146 CO 0.02 0.29 0.99 -0.36 0.00 0.00 0.00 174.94 175.88 3d92 s PHE 147 N 1.45 3.29 -0.10 3.97 0.08 -1.26 -0.59 117.98 124.81 3d92 s PHE 147 Ca -0.02 1.64 0.03 0.00 0.12 0.00 0.00 56.93 58.70 3d92 s PHE 147 Cb -0.13 -2.97 -0.01 0.00 -0.57 0.00 0.00 43.02 39.33 3d92 s PHE 147 CO -0.04 -0.34 -0.19 -0.51 -0.10 0.00 0.00 175.22 174.05 3d92 s LEU 148 N -2.96 2.41 0.21 -0.37 1.02 -0.46 -0.99 118.68 117.55 3d92 s LEU 148 Ca 0.60 -0.42 0.10 0.00 0.02 0.00 0.00 54.13 54.44 3d92 s LEU 148 Cb -0.15 -1.50 -0.04 0.00 0.02 0.00 0.00 46.19 44.52 3d92 s LEU 148 CO 0.19 0.20 -0.15 -1.59 0.02 0.00 0.00 176.35 175.02 3d92 s LYS 149 N 0.15 1.86 -0.20 1.70 -2.85 -0.43 -1.95 119.74 118.02 3d92 s LYS 149 Ca -0.10 -1.44 -0.21 0.00 -1.00 0.00 0.00 55.97 53.22 3d92 s LYS 149 Cb -0.16 -2.01 -0.02 0.00 -2.06 0.00 0.00 37.83 33.58 3d92 s LYS 149 CO 0.06 0.40 0.65 0.08 0.10 0.00 0.00 175.35 176.64 3d92 s VAL 150 N -1.88 5.00 0.00 1.79 1.01 -1.26 -1.18 120.40 123.88 3d92 s VAL 150 Ca 0.25 1.23 0.00 0.00 0.00 0.00 0.00 61.98 63.46 3d92 s VAL 150 Cb -0.08 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.34 3d92 s VAL 150 CO 0.14 0.09 0.00 0.61 0.00 0.00 0.00 175.10 175.94 3d92 n GLY 151 N 3.82 1.09 3.81 4.51 0.00 0.39 -4.91 105.19 113.89 3d92 n GLY 151 Ca -0.01 0.41 -0.32 0.00 0.00 0.00 0.00 46.02 46.10 3d92 n GLY 151 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3d92 s SER 152 N 2.00 5.74 0.64 1.61 1.04 -1.26 -4.03 113.70 119.44 3d92 s SER 152 Ca 0.00 1.79 -0.18 0.00 0.48 0.00 0.00 55.95 58.04 3d92 s SER 152 Cb 0.00 -2.53 -0.01 0.00 0.10 0.00 0.00 66.02 63.58 3d92 s SER 152 CO 0.00 -1.19 1.27 0.00 0.98 0.00 0.00 173.24 174.30 3d92 s ALA 153 N -2.53 2.39 -0.53 5.32 0.00 -1.26 -2.53 121.76 122.63 3d92 s ALA 153 Ca 0.63 1.15 -0.15 0.00 0.00 0.00 0.00 51.96 53.59 3d92 s ALA 153 Cb -0.16 -3.53 0.12 0.00 0.00 0.00 0.00 23.12 19.56 3d92 s ALA 153 CO 0.39 -1.53 0.47 0.21 0.00 0.00 0.00 175.76 175.30 3d92 s LYS 154 N -3.41 2.92 0.30 0.00 2.47 -1.20 -4.80 119.74 116.02 3d92 s LYS 154 Ca 0.81 -1.69 0.03 0.00 -1.56 0.00 0.00 55.97 53.56 3d92 s LYS 154 Cb -0.35 -4.23 0.62 0.00 -1.46 0.00 0.00 37.83 32.40 3d92 s LYS 154 CO 0.39 -1.29 1.84 -1.35 0.16 0.00 0.00 175.35 175.10 3d92 h PRO 155 N 8.82 0.90 0.00 4.03 0.11 -1.91 -1.77 132.00 142.18 3d92 h PRO 155 Ca -0.29 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.77 3d92 h PRO 155 Cb 1.10 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.00 3d92 h PRO 155 CO 1.00 0.59 0.00 0.41 -0.21 0.00 0.00 178.00 179.80 3d92 n GLY 156 N -1.36 -0.87 0.07 -0.55 0.00 -1.26 -2.25 105.19 98.97 3d92 n GLY 156 Ca 0.19 -0.04 0.11 0.00 0.00 0.00 0.00 46.02 46.28 3d92 n GLY 156 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3d92 n LEU 157 N -1.50 0.63 -0.03 0.99 7.94 -0.67 -4.55 117.00 119.82 3d92 n LEU 157 Ca 0.03 0.19 -0.02 0.00 -1.11 0.00 0.00 56.01 55.10 3d92 n LEU 157 Cb 0.13 -0.07 0.25 0.00 0.53 0.00 0.00 43.42 44.26 3d92 n LEU 157 CO 0.10 -0.10 0.90 -0.61 -1.11 0.00 0.00 177.39 176.57 3d92 h GLN 158 N 0.00 0.59 -0.29 1.96 5.75 -1.49 -1.34 115.11 120.29 3d92 h GLN 158 Ca 0.00 -0.14 -0.02 0.00 -0.15 0.00 0.00 58.65 58.34 3d92 h GLN 158 Cb 0.92 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 29.38 3d92 h GLN 158 CO 0.00 0.63 0.09 0.87 -2.65 0.00 0.00 178.83 177.77 3d92 h LYS 159 N 0.56 0.41 0.13 1.69 1.57 -1.80 -1.07 116.57 118.06 3d92 h LYS 159 Ca 0.11 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.83 3d92 h LYS 159 Cb 0.40 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.63 3d92 h LYS 159 CO 0.02 0.37 -0.06 0.28 -0.57 0.00 0.00 179.45 179.48 3d92 h VAL 160 N 0.41 0.98 -0.82 0.50 2.07 -1.57 -3.15 116.25 114.67 3d92 h VAL 160 Ca 0.10 -0.48 0.15 0.00 0.82 0.00 0.00 66.70 67.29 3d92 h VAL 160 Cb 0.13 1.28 -0.10 0.00 -1.52 0.00 0.00 31.29 31.09 3d92 h VAL 160 CO -0.01 0.12 0.39 0.58 0.02 0.00 0.00 177.57 178.67 3d92 h VAL 161 N -0.41 0.69 0.00 2.57 2.07 -0.87 -2.33 116.25 117.97 3d92 h VAL 161 Ca -0.02 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.31 3d92 h VAL 161 Cb 0.33 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 3d92 h VAL 161 CO 0.03 0.10 0.00 0.47 0.02 0.00 0.00 177.57 178.19 3d92 n ASP 162 N -4.93 0.76 0.00 0.57 8.00 -0.46 -2.52 116.55 117.98 3d92 n ASP 162 Ca 0.16 0.62 0.11 0.00 0.71 0.00 0.00 54.79 56.40 3d92 n ASP 162 Cb 0.44 -0.81 0.12 0.00 -0.02 0.00 0.00 41.12 40.85 3d92 n ASP 162 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 3d92 n VAL 163 N -2.26 0.00 0.16 2.53 3.14 -0.88 -4.49 118.33 116.52 3d92 n VAL 163 Ca 0.04 -0.00 0.05 0.00 -2.96 0.00 0.00 64.34 61.46 3d92 n VAL 163 Cb 0.34 0.52 0.49 0.00 -1.06 0.00 0.00 33.84 34.12 3d92 n VAL 163 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 3d92 h LEU 164 N 0.00 0.15 -2.38 6.55 3.38 -1.43 -1.57 115.31 120.01 3d92 h LEU 164 Ca 0.00 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 57.97 3d92 h LEU 164 Cb 0.50 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 3d92 h LEU 164 CO 0.00 0.23 0.06 0.44 0.09 0.00 0.00 178.44 179.26 3d92 h ASP 165 N 0.17 0.00 0.77 -0.43 5.19 -1.79 -1.97 116.42 118.35 3d92 h ASP 165 Ca 0.04 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.45 3d92 h ASP 165 Cb 0.19 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.70 3d92 h ASP 165 CO 0.01 0.00 -0.34 -1.54 -3.12 0.00 0.00 179.24 174.25 3d92 n SER 166 N -3.86 0.40 -2.37 6.45 3.41 -0.59 -3.95 113.62 113.11 3d92 n SER 166 Ca -0.02 0.09 -0.18 0.00 -0.26 0.00 0.00 58.87 58.50 3d92 n SER 166 Cb 0.16 -0.06 0.02 0.00 -0.26 0.00 0.00 64.21 64.07 3d92 n SER 166 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 3d92 n ILE 167 N -1.64 2.06 -0.24 -1.33 -5.35 -0.75 -4.75 119.36 107.35 3d92 n ILE 167 Ca 0.06 -3.97 -0.03 0.00 -0.27 0.00 0.00 62.75 58.54 3d92 n ILE 167 Cb 0.36 -0.45 0.16 0.00 -1.74 0.00 0.00 39.64 37.97 3d92 n ILE 167 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 3d92 h LYS 168 N 2.45 1.06 -6.29 6.28 3.64 -1.66 -3.43 116.57 118.63 3d92 h LYS 168 Ca 0.19 -0.14 -0.59 0.00 -1.27 0.00 0.00 60.65 58.84 3d92 h LYS 168 Cb 1.31 -0.20 -0.12 0.00 -0.41 0.00 0.00 32.23 32.81 3d92 h LYS 168 CO 0.63 0.81 -0.69 0.95 -2.27 0.00 0.00 179.45 178.87 3d92 s THR 169 N -5.63 3.17 0.14 1.00 -4.23 -1.26 -0.72 115.64 108.12 3d92 s THR 169 Ca -0.11 -1.93 -0.35 0.00 -1.18 0.00 0.00 61.69 58.12 3d92 s THR 169 Cb 0.17 -2.65 -0.15 0.00 1.34 0.00 0.00 72.50 71.21 3d92 s THR 169 CO 0.81 -0.29 1.45 1.17 -0.54 0.00 0.00 174.62 177.22 3d92 n LYS 170 N -0.53 1.72 0.00 3.99 4.81 -0.33 -2.05 118.16 125.77 3d92 n LYS 170 Ca -0.08 0.62 0.00 0.00 -0.87 0.00 0.00 58.31 57.98 3d92 n LYS 170 Cb 0.58 -2.32 0.00 0.00 0.02 0.00 0.00 35.03 33.31 3d92 n LYS 170 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3d92 n GLY 171 N 2.89 1.41 3.75 3.14 0.00 0.41 -4.56 105.19 112.22 3d92 n GLY 171 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 3d92 n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d92 s LYS 172 N -0.68 4.83 0.21 1.61 1.02 -0.87 -4.91 119.74 120.96 3d92 s LYS 172 Ca 0.00 1.47 0.04 0.00 0.02 0.00 0.00 55.97 57.50 3d92 s LYS 172 Cb 0.00 -3.29 -0.05 0.00 -0.52 0.00 0.00 37.83 33.97 3d92 s LYS 172 CO 0.00 0.49 -0.03 -1.54 -0.92 0.00 0.00 175.35 173.35 3d92 s SER 173 N -1.06 1.83 -0.00 2.83 1.04 -1.26 -1.31 113.70 115.76 3d92 s SER 173 Ca 0.41 -1.16 -0.09 0.00 0.48 0.00 0.00 55.95 55.59 3d92 s SER 173 Cb -0.26 0.00 0.01 0.00 0.10 0.00 0.00 66.02 65.87 3d92 s SER 173 CO 0.31 -0.46 0.18 0.00 0.98 0.00 0.00 173.24 174.25 3d92 s ALA 174 N -3.39 -0.44 0.45 5.32 0.00 -0.26 -4.92 121.76 118.52 3d92 s ALA 174 Ca 0.25 -0.01 -0.25 0.00 0.00 0.00 0.00 51.96 51.95 3d92 s ALA 174 Cb 0.05 0.09 -0.09 0.00 0.00 0.00 0.00 23.12 23.17 3d92 s ALA 174 CO 0.07 -0.22 1.38 -0.25 0.00 0.00 0.00 175.76 176.74 3d92 n ASP 175 N 1.46 3.05 -2.91 0.00 8.00 -1.26 -1.37 116.55 123.52 3d92 n ASP 175 Ca -0.22 1.11 -0.14 0.00 0.71 0.00 0.00 54.79 56.25 3d92 n ASP 175 Cb 0.56 -1.57 0.02 0.00 -0.02 0.00 0.00 41.12 40.10 3d92 n ASP 175 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 3d92 n PHE 176 N -0.25 -2.06 -3.07 1.24 7.35 -0.59 -4.71 117.46 115.36 3d92 n PHE 176 Ca 0.06 -2.54 -0.25 0.00 -0.76 0.00 0.00 57.45 53.95 3d92 n PHE 176 Cb 0.41 0.84 -0.01 0.00 0.35 0.00 0.00 39.48 41.08 3d92 n PHE 176 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 3d92 s THR 177 N -0.25 4.99 -1.72 -2.13 -4.23 -1.26 -3.26 115.64 107.78 3d92 s THR 177 Ca 0.32 -0.21 -0.01 0.00 -1.18 0.00 0.00 61.69 60.61 3d92 s THR 177 Cb 0.24 -3.85 0.00 0.00 1.34 0.00 0.00 72.50 70.23 3d92 s THR 177 CO -0.15 -0.67 0.19 0.59 -0.54 0.00 0.00 174.62 174.04 3d92 n ASN 178 N -1.98 -6.02 -4.73 3.99 4.13 -1.26 -4.97 115.26 104.43 3d92 n ASN 178 Ca -0.02 -0.10 -0.39 0.00 1.68 0.00 0.00 54.58 55.75 3d92 n ASN 178 Cb 0.56 -4.96 -0.06 0.00 -1.54 0.00 0.00 39.78 33.78 3d92 n ASN 178 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 3d92 s PHE 179 N -3.09 3.57 -0.49 3.10 5.36 -1.26 -5.02 117.98 120.14 3d92 s PHE 179 Ca 0.10 1.04 -0.16 0.00 -0.96 0.00 0.00 56.93 56.95 3d92 s PHE 179 Cb -0.04 -2.62 0.09 0.00 -0.34 0.00 0.00 43.02 40.11 3d92 s PHE 179 CO 0.12 0.20 0.43 0.34 -1.46 0.00 0.00 175.22 174.85 3d92 s ASP 180 N 0.46 6.16 0.12 6.13 -1.08 -1.26 -4.47 116.67 122.74 3d92 s ASP 180 Ca 0.30 -1.43 0.18 0.00 -0.52 0.00 0.00 52.55 51.08 3d92 s ASP 180 Cb -0.16 -2.20 0.77 0.00 -1.46 0.00 0.00 42.92 39.87 3d92 s ASP 180 CO 0.14 -0.72 1.56 -0.81 0.52 0.00 0.00 175.17 175.86 3d92 n PRO 181 N 5.26 0.09 0.30 4.34 -0.04 -1.26 -2.22 135.00 141.47 3d92 n PRO 181 Ca -0.13 0.35 0.16 0.00 -0.04 0.00 0.00 63.50 63.84 3d92 n PRO 181 Cb 0.43 -1.68 0.96 0.00 -0.04 0.00 0.00 33.50 33.17 3d92 n PRO 181 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3d92 h ARG 182 N 0.00 0.00 0.00 0.54 3.08 -1.93 -1.58 114.38 114.50 3d92 h ARG 182 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3d92 h ARG 182 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.34 3d92 h ARG 182 CO 0.00 0.01 0.00 0.41 -1.07 0.00 0.00 179.97 179.32 3d92 n GLY 183 N -1.24 -0.78 0.73 0.04 0.00 -0.94 -2.75 105.19 100.25 3d92 n GLY 183 Ca -0.03 -0.13 0.10 0.00 0.00 0.00 0.00 46.02 45.96 3d92 n GLY 183 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3d92 n LEU 184 N -0.92 2.50 -4.84 0.99 4.77 -0.59 -4.12 117.00 114.79 3d92 n LEU 184 Ca 0.16 -0.97 -0.35 0.00 -0.03 0.00 0.00 56.01 54.81 3d92 n LEU 184 Cb 0.07 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.10 3d92 n LEU 184 CO 0.12 0.44 0.27 -0.76 -1.33 0.00 0.00 177.39 176.13 3d92 s LEU 185 N -1.66 4.32 1.06 2.23 1.43 -1.11 -4.93 118.68 120.01 3d92 s LEU 185 Ca 0.22 1.14 -0.18 0.00 -1.03 0.00 0.00 54.13 54.28 3d92 s LEU 185 Cb 0.16 -3.38 0.24 0.00 0.03 0.00 0.00 46.19 43.24 3d92 s LEU 185 CO 0.26 0.07 1.27 -2.16 0.23 0.00 0.00 176.35 176.03 3d92 s PRO 186 N -2.04 -0.12 0.04 1.29 0.04 -1.26 -5.01 135.00 127.94 3d92 s PRO 186 Ca 0.40 -0.38 -0.23 0.00 0.04 0.00 0.00 61.00 60.82 3d92 s PRO 186 Cb -0.15 -1.76 -0.16 0.00 0.04 0.00 0.00 34.50 32.48 3d92 s PRO 186 CO 0.20 -2.92 1.47 1.49 0.04 0.00 0.00 177.00 177.27 3d92 h GLU 187 N -2.01 0.11 -6.22 4.56 4.81 -1.92 -3.44 114.58 110.46 3d92 h GLU 187 Ca -0.44 -0.03 -0.57 0.00 -0.13 0.00 0.00 59.36 58.18 3d92 h GLU 187 Cb 1.24 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 30.57 3d92 h GLU 187 CO 0.33 0.37 -0.13 0.45 -0.73 0.00 0.00 179.01 179.30 3d92 s SER 188 N -5.60 6.82 -0.12 1.04 0.15 -1.26 -5.00 113.70 109.73 3d92 s SER 188 Ca -0.14 1.03 0.16 0.00 0.70 0.00 0.00 55.95 57.70 3d92 s SER 188 Cb 0.04 -2.27 0.61 0.00 -1.71 0.00 0.00 66.02 62.69 3d92 s SER 188 CO 0.69 0.17 1.52 0.18 1.20 0.00 0.00 173.24 177.00 3d92 n LEU 189 N 1.09 4.30 -4.68 3.45 4.77 -1.26 -4.72 117.00 119.94 3d92 n LEU 189 Ca -0.08 -2.53 -0.44 0.00 -0.03 0.00 0.00 56.01 52.94 3d92 n LEU 189 Cb 0.52 -0.51 -0.02 0.00 -2.33 0.00 0.00 43.42 41.08 3d92 n LEU 189 CO 0.41 0.76 0.98 0.47 -1.33 0.00 0.00 177.39 178.68 3d92 n ASP 190 N 0.61 2.81 -3.92 -1.43 8.00 -1.26 -4.87 116.55 116.49 3d92 n ASP 190 Ca 0.22 1.17 -0.09 0.00 0.71 0.00 0.00 54.79 56.80 3d92 n ASP 190 Cb 0.83 -1.46 -0.07 0.00 -0.02 0.00 0.00 41.12 40.40 3d92 n ASP 190 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3d92 s TYR 191 N -0.44 0.31 0.09 1.24 -0.85 -1.26 -1.40 117.35 115.04 3d92 s TYR 191 Ca 0.63 -0.68 0.05 0.00 -0.52 0.00 0.00 57.07 56.55 3d92 s TYR 191 Cb -0.61 -0.01 -0.04 0.00 0.38 0.00 0.00 41.96 41.68 3d92 s TYR 191 CO 0.54 -0.72 0.00 -1.58 -1.52 0.00 0.00 175.55 172.27 3d92 s TRP 192 N -3.95 3.00 0.01 -3.49 0.51 -0.11 -0.96 118.94 113.96 3d92 s TRP 192 Ca 0.15 -0.02 -0.00 0.00 -2.12 0.00 0.00 56.10 54.11 3d92 s TRP 192 Cb 0.03 -1.54 -0.01 0.00 -0.81 0.00 0.00 33.47 31.13 3d92 s TRP 192 CO -0.02 0.48 -0.01 -0.08 -0.51 0.00 0.00 176.95 176.81 3d92 s THR 193 N -1.31 0.08 0.16 2.01 -1.32 0.05 -0.82 115.64 114.49 3d92 s THR 193 Ca 0.26 -0.63 -0.23 0.00 -1.21 0.00 0.00 61.69 59.88 3d92 s THR 193 Cb -0.12 -0.19 0.07 0.00 -1.51 0.00 0.00 72.50 70.75 3d92 s THR 193 CO 0.18 -0.35 0.63 -0.72 -2.21 0.00 0.00 174.62 172.16 3d92 s TYR 194 N -1.02 -0.50 -0.02 9.09 1.13 -1.09 -1.51 117.35 123.43 3d92 s TYR 194 Ca -0.11 0.28 -0.24 0.00 -1.41 0.00 0.00 57.07 55.58 3d92 s TYR 194 Cb -0.07 0.57 -0.04 0.00 -1.10 0.00 0.00 41.96 41.32 3d92 s TYR 194 CO -0.01 -0.85 0.74 -1.25 -2.51 0.00 0.00 175.55 171.67 3d92 s PRO 195 N -3.71 4.46 0.00 -3.49 0.04 -1.26 -1.45 135.00 129.58 3d92 s PRO 195 Ca 0.02 0.98 0.00 0.00 0.04 0.00 0.00 61.00 62.04 3d92 s PRO 195 Cb -0.01 -3.42 0.00 0.00 0.04 0.00 0.00 34.50 31.11 3d92 s PRO 195 CO -0.11 0.13 0.00 0.41 0.04 0.00 0.00 177.00 177.47 3d92 n GLY 196 N 2.84 4.16 3.24 0.56 0.00 0.48 -4.85 105.19 111.63 3d92 n GLY 196 Ca -0.01 -0.39 -0.14 0.00 0.00 0.00 0.00 46.02 45.48 3d92 n GLY 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3d92 s SER 197 N 1.75 0.83 0.59 1.61 1.04 -1.12 -2.10 113.70 116.31 3d92 s SER 197 Ca 0.00 -1.30 -0.20 0.00 0.48 0.00 0.00 55.95 54.93 3d92 s SER 197 Cb 0.00 0.22 -0.03 0.00 0.10 0.00 0.00 66.02 66.31 3d92 s SER 197 CO 0.00 -0.71 1.34 0.18 0.98 0.00 0.00 173.24 175.03 3d92 n LEU 198 N -0.30 5.81 -1.05 2.42 4.77 -0.45 -4.52 117.00 123.68 3d92 n LEU 198 Ca -0.02 0.91 0.12 0.00 -0.03 0.00 0.00 56.01 56.99 3d92 n LEU 198 Cb 0.65 -1.57 0.15 0.00 -2.33 0.00 0.00 43.42 40.32 3d92 n LEU 198 CO 0.34 -0.75 0.66 0.35 -1.33 0.00 0.00 177.39 176.66 3d92 n THR 199 N -1.44 0.21 -4.34 -5.08 -2.24 -1.26 -4.44 114.28 95.70 3d92 n THR 199 Ca 0.13 -0.61 -0.23 0.00 -2.27 0.00 0.00 64.05 61.07 3d92 n THR 199 Cb 0.46 1.28 -0.12 0.00 -2.10 0.00 0.00 70.33 69.86 3d92 n THR 199 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3d92 s THR 200 N -1.79 1.90 0.18 4.28 -4.23 -1.26 -4.72 115.64 110.00 3d92 s THR 200 Ca 0.33 -1.86 -0.32 0.00 -1.18 0.00 0.00 61.69 58.65 3d92 s THR 200 Cb 0.21 -1.84 -0.16 0.00 1.34 0.00 0.00 72.50 72.06 3d92 s THR 200 CO 0.31 -0.22 1.06 -2.65 -0.54 0.00 0.00 174.62 172.58 3d92 n PRO 201 N 0.45 0.96 -0.12 3.99 -0.02 -1.26 -0.68 135.00 138.33 3d92 n PRO 201 Ca -0.14 0.34 0.04 0.00 -2.02 0.00 0.00 63.50 61.72 3d92 n PRO 201 Cb 0.56 -1.77 0.12 0.00 -0.02 0.00 0.00 33.50 32.39 3d92 n PRO 201 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3d92 n PRO 202 N 1.52 1.54 -2.15 0.52 -0.04 -1.26 -5.02 135.00 130.11 3d92 n PRO 202 Ca 0.15 -0.84 -0.16 0.00 -0.04 0.00 0.00 63.50 62.61 3d92 n PRO 202 Cb 0.24 -1.19 -0.02 0.00 -0.04 0.00 0.00 33.50 32.49 3d92 n PRO 202 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3d92 n LEU 203 N 0.18 -1.63 -4.77 1.53 4.77 0.15 -4.90 117.00 112.33 3d92 n LEU 203 Ca 0.08 0.06 -0.39 0.00 -0.03 0.00 0.00 56.01 55.73 3d92 n LEU 203 Cb 0.20 -2.36 -0.01 0.00 -2.33 0.00 0.00 43.42 38.92 3d92 n LEU 203 CO 0.06 -0.29 0.92 -0.76 -1.33 0.00 0.00 177.39 175.98 3d92 s LEU 204 N -4.43 4.20 -1.21 2.23 1.43 -1.26 -4.47 118.68 115.17 3d92 s LEU 204 Ca 0.00 2.54 -0.09 0.00 -1.03 0.00 0.00 54.13 55.55 3d92 s LEU 204 Cb 0.00 -3.95 0.21 0.00 0.03 0.00 0.00 46.19 42.48 3d92 s LEU 204 CO 0.00 -0.79 1.66 -0.62 0.23 0.00 0.00 176.35 176.82 3d92 n GLU 205 N 0.10 3.80 -0.02 1.70 1.02 -1.26 -1.35 120.64 124.63 3d92 n GLU 205 Ca 0.04 -3.90 0.00 0.00 -0.02 0.00 0.00 57.16 53.28 3d92 n GLU 205 Cb 0.45 -2.81 0.00 0.00 -0.02 0.00 0.00 31.44 29.06 3d92 n GLU 205 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3d92 s VAL 207 N -0.53 2.95 -0.42 0.00 1.01 -0.89 -0.76 120.40 121.75 3d92 s VAL 207 Ca 0.01 -0.70 -0.22 0.00 0.00 0.00 0.00 61.98 61.07 3d92 s VAL 207 Cb 0.01 -2.22 0.02 0.00 0.00 0.00 0.00 36.38 34.19 3d92 s VAL 207 CO 0.00 0.53 0.71 -0.89 0.00 0.00 0.00 175.10 175.45 3d92 s THR 208 N 0.31 4.76 0.08 3.92 2.01 -0.19 -0.39 115.64 126.14 3d92 s THR 208 Ca -0.11 0.36 -0.26 0.00 0.31 0.00 0.00 61.69 61.99 3d92 s THR 208 Cb -0.16 -4.23 -0.06 0.00 0.01 0.00 0.00 72.50 68.06 3d92 s THR 208 CO 0.06 -0.59 0.81 0.26 -0.69 0.00 0.00 174.62 174.47 3d92 s TRP 209 N 3.00 3.78 -0.28 4.92 0.52 -0.53 -2.11 118.94 128.25 3d92 s TRP 209 Ca 0.26 1.58 -0.00 0.00 0.02 0.00 0.00 56.10 57.96 3d92 s TRP 209 Cb -0.13 -2.86 0.08 0.00 -1.15 0.00 0.00 33.47 29.41 3d92 s TRP 209 CO 0.20 0.30 0.05 0.42 0.02 0.00 0.00 176.95 177.93 3d92 s ILE 210 N -0.23 1.15 -0.26 2.03 1.01 -0.43 -2.66 121.20 121.81 3d92 s ILE 210 Ca 0.40 -1.34 -0.06 0.00 0.00 0.00 0.00 60.65 59.64 3d92 s ILE 210 Cb -0.22 -1.72 -0.01 0.00 0.01 0.00 0.00 42.46 40.52 3d92 s ILE 210 CO 0.25 -0.46 0.05 -0.69 0.00 0.00 0.00 174.94 174.09 3d92 s VAL 211 N 1.51 4.00 0.32 2.92 1.01 -0.00 -0.68 120.40 129.48 3d92 s VAL 211 Ca 0.05 -0.39 -0.29 0.00 0.00 0.00 0.00 61.98 61.35 3d92 s VAL 211 Cb -0.18 -2.92 -0.10 0.00 0.00 0.00 0.00 36.38 33.19 3d92 s VAL 211 CO -0.16 0.28 1.18 -0.76 0.00 0.00 0.00 175.10 175.64 3d92 s LEU 212 N 1.55 4.46 0.17 3.92 1.43 -0.11 -0.94 118.68 129.17 3d92 s LEU 212 Ca 0.05 2.42 -0.08 0.00 -1.03 0.00 0.00 54.13 55.49 3d92 s LEU 212 Cb -0.15 -3.70 0.05 0.00 0.03 0.00 0.00 46.19 42.42 3d92 s LEU 212 CO 0.02 -0.35 1.55 0.50 0.23 0.00 0.00 176.35 178.30 3d92 h LYS 213 N 3.49 0.90 -5.68 1.70 3.64 -1.57 -3.43 116.57 115.61 3d92 h LYS 213 Ca -0.48 -0.41 -0.60 0.00 -1.27 0.00 0.00 60.65 57.90 3d92 h LYS 213 Cb 1.22 -0.02 -0.10 0.00 -0.41 0.00 0.00 32.23 32.93 3d92 h LYS 213 CO 0.66 1.06 0.29 -2.00 -2.27 0.00 0.00 179.45 177.18 3d92 s GLU 214 N -4.54 4.17 0.73 1.90 2.12 -1.26 -5.02 118.70 116.80 3d92 s GLU 214 Ca -0.10 0.75 -0.11 0.00 0.36 0.00 0.00 54.97 55.86 3d92 s GLU 214 Cb 0.12 -3.63 0.03 0.00 0.26 0.00 0.00 34.13 30.91 3d92 s GLU 214 CO 0.86 -0.41 1.07 -1.25 -0.54 0.00 0.00 175.26 174.99 3d92 s PRO 215 N 2.48 2.65 0.21 4.30 0.04 -1.26 -4.67 135.00 138.75 3d92 s PRO 215 Ca 0.31 0.83 0.00 0.00 0.04 0.00 0.00 61.00 62.19 3d92 s PRO 215 Cb -0.16 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.38 3d92 s PRO 215 CO 0.09 -1.27 0.38 0.96 0.04 0.00 0.00 177.00 177.20 3d92 s ILE 216 N -3.09 5.22 -0.00 0.56 -4.36 -0.16 -4.86 121.20 114.51 3d92 s ILE 216 Ca 0.59 -0.49 0.03 0.00 -0.26 0.00 0.00 60.65 60.52 3d92 s ILE 216 Cb -0.14 -3.76 -0.03 0.00 1.25 0.00 0.00 42.46 39.78 3d92 s ILE 216 CO 0.55 -0.21 -0.06 -0.94 0.24 0.00 0.00 174.94 174.51 3d92 s SER 217 N -3.33 4.65 0.18 4.36 1.04 -1.26 -1.31 113.70 118.03 3d92 s SER 217 Ca 0.37 -0.13 0.08 0.00 0.48 0.00 0.00 55.95 56.76 3d92 s SER 217 Cb -0.11 -1.10 -0.04 0.00 0.10 0.00 0.00 66.02 64.87 3d92 s SER 217 CO 0.30 0.29 -0.16 0.68 0.98 0.00 0.00 173.24 175.33 3d92 s VAL 218 N -0.98 1.75 0.56 5.02 -7.23 -0.33 -3.27 120.40 115.91 3d92 s VAL 218 Ca 0.17 -2.06 -0.07 0.00 -1.81 0.00 0.00 61.98 58.21 3d92 s VAL 218 Cb -0.11 -1.93 -0.02 0.00 0.56 0.00 0.00 36.38 34.88 3d92 s VAL 218 CO 0.07 -0.47 0.89 -0.94 -0.31 0.00 0.00 175.10 174.34 3d92 s SER 219 N -3.00 5.99 0.35 4.85 1.04 -1.19 -0.46 113.70 121.28 3d92 s SER 219 Ca 0.19 0.96 0.05 0.00 0.48 0.00 0.00 55.95 57.63 3d92 s SER 219 Cb -0.03 -2.10 0.70 0.00 0.10 0.00 0.00 66.02 64.69 3d92 s SER 219 CO 0.07 -0.83 1.94 0.77 0.98 0.00 0.00 173.24 176.16 3d92 h SER 220 N -0.06 0.72 -0.47 7.02 4.64 -1.93 -1.80 113.55 121.67 3d92 h SER 220 Ca -0.46 0.01 -0.11 0.00 -0.47 0.00 0.00 61.79 60.76 3d92 h SER 220 Cb 1.22 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 63.15 3d92 h SER 220 CO 0.62 0.45 -0.12 -0.33 -0.87 0.00 0.00 176.83 176.58 3d92 h GLU 221 N 0.81 0.95 -0.16 4.77 3.07 -1.95 -0.83 114.58 121.24 3d92 h GLU 221 Ca 0.35 -0.35 -0.01 0.00 -0.50 0.00 0.00 59.36 58.85 3d92 h GLU 221 Cb 0.30 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.14 3d92 h GLU 221 CO -0.13 1.01 0.06 1.96 -1.40 0.00 0.00 179.01 180.52 3d92 h GLN 222 N 0.85 0.24 -0.03 2.33 4.20 -1.77 -2.77 115.11 118.17 3d92 h GLN 222 Ca 0.13 -0.05 -0.11 0.00 0.06 0.00 0.00 58.65 58.68 3d92 h GLN 222 Cb 0.67 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.40 3d92 h GLN 222 CO 0.05 0.34 -0.50 -0.24 -0.67 0.00 0.00 178.83 177.81 3d92 h VAL 223 N 0.09 1.36 -0.63 -0.54 3.04 -1.22 -2.58 116.25 115.76 3d92 h VAL 223 Ca 0.05 -1.72 0.04 0.00 -1.01 0.00 0.00 66.70 64.06 3d92 h VAL 223 Cb 0.19 1.89 -0.04 0.00 -2.01 0.00 0.00 31.29 31.33 3d92 h VAL 223 CO -0.00 0.50 0.42 -0.07 -1.01 0.00 0.00 177.57 177.40 3d92 h LEU 224 N 0.06 0.63 -0.58 3.16 3.38 -1.07 -1.99 115.31 118.90 3d92 h LEU 224 Ca -0.00 -0.01 -0.15 0.00 0.09 0.00 0.00 57.88 57.81 3d92 h LEU 224 Cb 0.90 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 3d92 h LEU 224 CO 0.07 0.43 -0.49 0.11 0.09 0.00 0.00 178.44 178.65 3d92 h LYS 225 N 0.73 0.56 -0.85 1.13 1.57 -1.17 -2.58 116.57 115.95 3d92 h LYS 225 Ca 0.26 -0.33 0.11 0.00 -1.87 0.00 0.00 60.65 58.82 3d92 h LYS 225 Cb 0.12 0.03 -0.08 0.00 0.08 0.00 0.00 32.23 32.38 3d92 h LYS 225 CO -0.07 0.93 0.49 0.74 -0.57 0.00 0.00 179.45 180.96 3d92 h PHE 226 N 0.45 0.88 0.00 -1.35 -1.00 -1.17 -2.48 116.94 112.25 3d92 h PHE 226 Ca 0.02 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.83 3d92 h PHE 226 Cb 1.02 -0.26 0.00 0.00 3.61 0.00 0.00 35.95 40.31 3d92 h PHE 226 CO 0.04 0.33 0.00 0.54 -1.61 0.00 0.00 178.31 177.61 3d92 n ARG 227 N -4.75 0.52 0.00 1.51 1.74 -0.82 -2.32 116.66 112.54 3d92 n ARG 227 Ca 0.15 0.04 0.12 0.00 -0.77 0.00 0.00 57.85 57.39 3d92 n ARG 227 Cb 0.32 -1.50 0.20 0.00 -1.02 0.00 0.00 32.46 30.46 3d92 n ARG 227 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3d92 n LYS 228 N -1.16 0.03 -0.76 5.56 5.02 -0.93 -4.53 118.16 121.38 3d92 n LYS 228 Ca 0.14 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 56.14 3d92 n LYS 228 Cb 0.14 -1.52 0.18 0.00 -0.02 0.00 0.00 35.03 33.82 3d92 n LYS 228 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3d92 s LEU 229 N -3.12 2.16 -0.01 -0.35 1.43 -0.98 -4.86 118.68 112.95 3d92 s LEU 229 Ca 0.10 1.86 0.07 0.00 -1.03 0.00 0.00 54.13 55.13 3d92 s LEU 229 Cb 0.17 -4.13 -0.02 0.00 0.03 0.00 0.00 46.19 42.25 3d92 s LEU 229 CO 0.72 -3.30 -0.23 0.20 0.23 0.00 0.00 176.35 173.98 3d92 s ASN 230 N -2.79 2.65 0.22 2.29 0.02 0.10 -0.50 114.94 116.93 3d92 s ASN 230 Ca 0.66 -0.41 0.03 0.00 -1.02 0.00 0.00 52.86 52.12 3d92 s ASN 230 Cb -0.22 -0.29 0.18 0.00 0.02 0.00 0.00 41.25 40.94 3d92 s ASN 230 CO 0.60 0.27 1.52 -0.26 0.02 0.00 0.00 177.10 179.25 3d92 h PHE 231 N 5.54 0.37 -4.37 2.20 0.04 -1.36 -3.36 116.94 116.01 3d92 h PHE 231 Ca -0.41 -0.15 -0.49 0.00 2.80 0.00 0.00 57.97 59.72 3d92 h PHE 231 Cb 1.13 -0.06 0.10 0.00 2.20 0.00 0.00 35.95 39.32 3d92 h PHE 231 CO 0.40 0.85 0.37 0.54 -0.60 0.00 0.00 178.31 179.87 3d92 s ASN 232 N -6.91 4.85 0.70 2.17 4.22 -1.26 -4.37 114.94 114.34 3d92 s ASN 232 Ca -0.04 1.23 -0.11 0.00 -2.14 0.00 0.00 52.86 51.79 3d92 s ASN 232 Cb 0.11 -1.98 0.02 0.00 1.28 0.00 0.00 41.25 40.68 3d92 s ASN 232 CO 0.81 -1.73 1.09 -0.83 -2.04 0.00 0.00 177.10 174.40 3d92 s GLY 233 N -4.09 1.63 0.26 0.45 0.00 -1.26 -1.18 107.32 103.12 3d92 s GLY 233 Ca 0.60 -0.38 -0.31 0.00 0.00 0.00 0.00 44.72 44.63 3d92 s GLY 233 CO 0.53 -0.01 1.48 -2.21 0.00 0.00 0.00 173.10 172.89 3d92 n GLU 234 N -3.00 2.30 -0.87 2.90 2.13 -1.26 -2.11 120.64 120.73 3d92 n GLU 234 Ca 0.07 0.82 0.00 0.00 0.66 0.00 0.00 57.16 58.70 3d92 n GLU 234 Cb 0.57 -2.52 0.00 0.00 0.27 0.00 0.00 31.44 29.76 3d92 n GLU 234 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3d92 n GLY 235 N 2.11 0.93 3.96 8.31 0.00 -1.26 -5.03 105.19 114.21 3d92 n GLY 235 Ca 0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 3d92 n GLY 235 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3d92 s GLU 236 N -0.13 3.46 0.29 1.61 2.02 -0.90 -5.07 118.70 119.98 3d92 s GLU 236 Ca 0.00 -0.59 -0.30 0.00 0.02 0.00 0.00 54.97 54.11 3d92 s GLU 236 Cb 0.00 -2.79 -0.13 0.00 0.10 0.00 0.00 34.13 31.31 3d92 s GLU 236 CO 0.00 0.31 1.37 -2.30 0.02 0.00 0.00 175.26 174.66 3d92 n PRO 237 N -1.57 2.15 -2.33 0.39 -0.02 -1.26 -4.89 135.00 127.47 3d92 n PRO 237 Ca -0.07 0.76 -0.42 0.00 -2.02 0.00 0.00 63.50 61.75 3d92 n PRO 237 Cb 0.57 -2.39 -0.03 0.00 -0.02 0.00 0.00 33.50 31.62 3d92 n PRO 237 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 3d92 s GLU 238 N -1.09 4.39 -0.24 -0.52 2.12 -1.26 -4.78 118.70 117.32 3d92 s GLU 238 Ca 0.62 1.88 -0.00 0.00 0.36 0.00 0.00 54.97 57.83 3d92 s GLU 238 Cb -0.60 -3.31 0.07 0.00 0.26 0.00 0.00 34.13 30.55 3d92 s GLU 238 CO 0.55 -0.32 0.01 -1.21 -0.54 0.00 0.00 175.26 173.75 3d92 s GLU 239 N 1.09 1.14 0.32 4.30 2.02 -1.26 -5.06 118.70 121.24 3d92 s GLU 239 Ca 0.61 -0.88 -0.29 0.00 0.02 0.00 0.00 54.97 54.43 3d92 s GLU 239 Cb -0.32 -2.36 -0.11 0.00 0.10 0.00 0.00 34.13 31.44 3d92 s GLU 239 CO 0.30 -0.70 1.46 -0.51 0.02 0.00 0.00 175.26 175.82 3d92 s LEU 240 N 1.55 4.36 -1.01 1.80 1.43 -1.26 -1.09 118.68 124.47 3d92 s LEU 240 Ca -0.00 2.86 -0.23 0.00 -1.03 0.00 0.00 54.13 55.72 3d92 s LEU 240 Cb -0.18 -3.65 0.05 0.00 0.03 0.00 0.00 46.19 42.45 3d92 s LEU 240 CO -0.10 -0.77 1.43 -0.32 0.23 0.00 0.00 176.35 176.82 3d92 s MET 241 N -1.23 3.57 0.04 1.70 -2.45 0.35 -4.60 119.30 116.69 3d92 s MET 241 Ca 0.56 -1.11 -0.01 0.00 -1.25 0.00 0.00 55.69 53.88 3d92 s MET 241 Cb -0.44 -5.30 -0.03 0.00 1.25 0.00 0.00 34.83 30.31 3d92 s MET 241 CO 0.53 -2.19 -0.03 0.14 1.05 0.00 0.00 175.02 174.52 3d92 s VAL 242 N 4.92 0.19 -1.33 10.11 -7.23 -1.26 -4.53 120.40 121.28 3d92 s VAL 242 Ca 0.45 -1.54 -0.06 0.00 -1.81 0.00 0.00 61.98 59.01 3d92 s VAL 242 Cb -0.00 -1.16 0.01 0.00 0.56 0.00 0.00 36.38 35.79 3d92 s VAL 242 CO -0.09 -0.85 1.10 0.47 -0.31 0.00 0.00 175.10 175.41 3d92 n ASP 243 N 0.53 -4.79 -2.48 4.85 8.00 -0.12 -4.86 116.55 117.68 3d92 n ASP 243 Ca -0.17 -0.59 -0.30 0.00 0.71 0.00 0.00 54.79 54.44 3d92 n ASP 243 Cb 0.59 -4.93 0.00 0.00 -0.02 0.00 0.00 41.12 36.76 3d92 n ASP 243 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 3d92 n ASN 244 N -3.04 6.90 -4.32 -2.24 6.94 -1.09 -4.90 115.26 113.52 3d92 n ASN 244 Ca -0.09 -3.42 -0.29 0.00 -0.02 0.00 0.00 54.58 50.77 3d92 n ASN 244 Cb 0.59 -1.13 -0.14 0.00 -2.36 0.00 0.00 39.78 36.74 3d92 n ASN 244 CO 0.00 0.00 0.00 -1.66 -1.03 0.00 0.00 177.26 174.57 3d92 s TRP 245 N -2.61 2.17 -0.03 -2.53 1.48 -1.26 -4.59 118.94 111.57 3d92 s TRP 245 Ca 0.53 -0.40 -0.17 0.00 -1.06 0.00 0.00 56.10 55.00 3d92 s TRP 245 Cb 0.39 -1.29 -0.05 0.00 -1.16 0.00 0.00 33.47 31.36 3d92 s TRP 245 CO -0.21 0.13 0.47 0.50 -4.06 0.00 0.00 176.95 173.78 3d92 s ARG 246 N -1.27 4.13 0.91 3.25 3.52 -1.26 -4.96 118.95 123.27 3d92 s ARG 246 Ca 0.11 0.49 -0.12 0.00 -0.13 0.00 0.00 55.73 56.08 3d92 s ARG 246 Cb -0.10 -3.30 0.14 0.00 -1.56 0.00 0.00 34.95 30.13 3d92 s ARG 246 CO 0.02 0.48 1.13 -1.25 -0.81 0.00 0.00 175.30 174.88 3d92 s PRO 247 N -0.46 1.14 0.35 5.12 0.04 -1.26 -4.58 135.00 135.35 3d92 s PRO 247 Ca 0.26 0.32 -0.29 0.00 0.04 0.00 0.00 61.00 61.33 3d92 s PRO 247 Cb -0.17 -1.84 -0.12 0.00 0.04 0.00 0.00 34.50 32.42 3d92 s PRO 247 CO 0.13 -2.20 1.47 0.00 0.04 0.00 0.00 177.00 176.44 3d92 n ALA 248 N -3.77 2.15 -2.72 8.56 0.00 -1.26 -4.35 120.51 119.13 3d92 n ALA 248 Ca 0.06 0.35 -0.22 0.00 0.00 0.00 0.00 53.44 53.64 3d92 n ALA 248 Cb 0.59 -2.39 -0.05 0.00 0.00 0.00 0.00 19.45 17.59 3d92 n ALA 248 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3d92 s GLN 249 N -1.66 2.66 0.31 0.00 -1.52 0.34 -4.94 119.66 114.84 3d92 s GLN 249 Ca 0.56 -1.23 -0.30 0.00 -1.95 0.00 0.00 55.36 52.45 3d92 s GLN 249 Cb -0.50 -2.39 -0.11 0.00 -0.22 0.00 0.00 33.01 29.78 3d92 s GLN 249 CO 0.60 0.35 1.59 -2.30 -0.25 0.00 0.00 175.29 175.28 3d92 n PRO 250 N -1.10 2.74 0.00 2.91 -0.02 -1.26 -4.58 135.00 133.69 3d92 n PRO 250 Ca -0.07 0.97 -0.05 0.00 -2.02 0.00 0.00 63.50 62.34 3d92 n PRO 250 Cb 0.59 -2.76 0.16 0.00 -0.02 0.00 0.00 33.50 31.47 3d92 n PRO 250 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3d92 h LEU 251 N 4.60 0.53 0.00 2.45 5.85 -1.95 -3.43 115.31 123.36 3d92 h LEU 251 Ca -0.48 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.04 3d92 h LEU 251 Cb 1.22 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.11 3d92 h LEU 251 CO 0.78 0.82 0.00 0.29 -0.34 0.00 0.00 178.44 179.98 3d92 n LYS 252 N -4.08 0.00 -2.05 1.25 5.02 -1.26 -3.30 118.16 113.74 3d92 n LYS 252 Ca -0.01 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 55.88 3d92 n LYS 252 Cb 0.45 0.00 -0.00 0.00 -0.02 0.00 0.00 35.03 35.46 3d92 n LYS 252 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 3d92 n ASN 253 N 0.48 7.98 -4.21 4.39 5.15 -1.26 -4.89 115.26 122.90 3d92 n ASN 253 Ca 0.00 -3.20 -0.16 0.00 -0.60 0.00 0.00 54.58 50.62 3d92 n ASN 253 Cb 0.00 -1.34 -0.11 0.00 -0.53 0.00 0.00 39.78 37.80 3d92 n ASN 253 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 3d92 s ARG 254 N -1.48 0.93 -0.04 1.20 0.52 -1.21 -5.12 118.95 113.76 3d92 s ARG 254 Ca 0.53 -1.19 0.06 0.00 -0.52 0.00 0.00 55.73 54.61 3d92 s ARG 254 Cb 0.19 -0.72 -0.01 0.00 0.52 0.00 0.00 34.95 34.92 3d92 s ARG 254 CO -0.10 0.13 -0.23 -0.65 0.02 0.00 0.00 175.30 174.47 3d92 s GLN 255 N -2.71 2.13 -0.16 3.54 -0.21 -1.26 -5.05 119.66 115.95 3d92 s GLN 255 Ca 0.07 -0.83 -0.16 0.00 0.02 0.00 0.00 55.36 54.46 3d92 s GLN 255 Cb -0.04 -1.92 -0.04 0.00 1.00 0.00 0.00 33.01 32.01 3d92 s GLN 255 CO 0.02 0.42 0.39 0.42 -2.12 0.00 0.00 175.29 174.42 3d92 s ILE 256 N -0.32 5.23 -0.01 1.08 1.01 -1.26 -4.66 121.20 122.27 3d92 s ILE 256 Ca 0.02 0.75 0.03 0.00 0.00 0.00 0.00 60.65 61.46 3d92 s ILE 256 Cb -0.11 -3.73 -0.03 0.00 0.01 0.00 0.00 42.46 38.59 3d92 s ILE 256 CO 0.01 0.32 -0.08 -0.54 0.00 0.00 0.00 174.94 174.66 3d92 s LYS 257 N 0.77 2.56 -0.07 2.79 1.02 -0.57 -2.82 119.74 123.41 3d92 s LYS 257 Ca 0.21 -0.70 -0.02 0.00 0.02 0.00 0.00 55.97 55.48 3d92 s LYS 257 Cb -0.14 -2.50 -0.03 0.00 -0.52 0.00 0.00 37.83 34.64 3d92 s LYS 257 CO 0.07 0.61 0.01 0.00 -0.92 0.00 0.00 175.35 175.13 3d92 s ALA 258 N -0.95 3.33 -1.41 5.17 0.00 -0.21 -0.77 121.76 126.92 3d92 s ALA 258 Ca 0.16 -0.81 0.29 0.00 0.00 0.00 0.00 51.96 51.60 3d92 s ALA 258 Cb -0.11 -1.50 1.30 0.00 0.00 0.00 0.00 23.12 22.81 3d92 s ALA 258 CO 0.06 0.60 1.92 -1.13 0.00 0.00 0.00 175.76 177.21 3d92 n SER 259 N 2.00 0.21 -4.13 0.00 3.41 -0.13 -1.26 113.62 113.71 3d92 n SER 259 Ca -0.18 -0.21 -0.15 0.00 -0.26 0.00 0.00 58.87 58.08 3d92 n SER 259 Cb 0.54 -0.20 -0.11 0.00 -0.26 0.00 0.00 64.21 64.17 3d92 n SER 259 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 3d92 s PHE 260 N -2.63 0.94 -2.31 7.33 -0.71 -1.26 -4.90 117.98 114.43 3d92 s PHE 260 Ca 0.25 -0.57 0.18 0.00 -1.04 0.00 0.00 56.93 55.76 3d92 s PHE 260 Cb 0.20 -0.54 0.15 0.00 -1.21 0.00 0.00 43.02 41.62 3d92 s PHE 260 CO 0.49 -0.03 1.09 1.63 -1.34 0.00 0.00 175.22 177.06