#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ft6 n ASP 2 N 0.00 0.00 -4.83 0.00 -0.08 -1.26 -5.12 116.55 105.26 1ft6 n ASP 2 Ca 0.00 0.00 -0.31 0.00 -1.51 0.00 0.00 54.79 52.97 1ft6 n ASP 2 Cb 0.00 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.40 1ft6 n ASP 2 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1ft6 s ALA 3 N -2.00 3.72 0.49 -1.67 0.00 -1.26 -5.09 121.76 115.96 1ft6 s ALA 3 Ca 0.00 -0.94 -0.09 0.00 0.00 0.00 0.00 51.96 50.92 1ft6 s ALA 3 Cb 0.00 -1.58 -0.05 0.00 0.00 0.00 0.00 23.12 21.49 1ft6 s ALA 3 CO 0.00 0.78 0.86 -1.25 0.00 0.00 0.00 175.76 176.14 1ft6 s PRO 4 N -2.40 3.67 0.56 0.00 0.04 -1.26 -4.73 135.00 130.87 1ft6 s PRO 4 Ca 0.31 0.48 -0.16 0.00 0.04 0.00 0.00 61.00 61.66 1ft6 s PRO 4 Cb -0.12 -2.29 -0.06 0.00 0.04 0.00 0.00 34.50 32.07 1ft6 s PRO 4 CO 0.24 -0.24 1.03 -0.06 0.04 0.00 0.00 177.00 178.00 1ft6 s PHE 5 N -2.72 3.16 0.00 0.56 0.08 -0.51 -2.89 117.98 115.67 1ft6 s PHE 5 Ca 0.51 1.50 0.00 0.00 0.12 0.00 0.00 56.93 59.06 1ft6 s PHE 5 Cb -0.10 -2.93 0.00 0.00 -0.57 0.00 0.00 43.02 39.41 1ft6 s PHE 5 CO 0.42 -0.82 0.00 0.39 -0.10 0.00 0.00 175.22 175.11 1ft6 n GLU 6 N -1.79 3.54 0.00 0.44 1.02 -1.26 -4.53 120.64 118.05 1ft6 n GLU 6 Ca 0.08 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.22 1ft6 n GLU 6 Cb 0.53 -0.66 0.00 0.00 -0.02 0.00 0.00 31.44 31.29 1ft6 n GLU 6 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ft6 n GLY 7 N 0.89 1.41 0.14 0.62 0.00 -1.26 -4.82 105.19 102.17 1ft6 n GLY 7 Ca 0.00 -2.20 0.13 0.00 0.00 0.00 0.00 46.02 43.95 1ft6 n GLY 7 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1ft6 h ARG 8 N 0.00 0.00 -0.06 1.61 3.08 -1.69 -3.41 114.38 113.91 1ft6 h ARG 8 Ca 0.00 0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.08 1ft6 h ARG 8 Cb 0.00 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 29.99 1ft6 h ARG 8 CO 0.00 0.00 -0.47 -0.22 -1.07 0.00 0.00 179.97 178.21 1ft6 h LYS 9 N 0.00 -0.56 -0.64 0.04 3.64 -1.88 0.13 116.57 117.31 1ft6 h LYS 9 Ca 0.00 0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.39 1ft6 h LYS 9 Cb 0.82 0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.74 1ft6 h LYS 9 CO 0.00 -0.37 0.27 0.87 -2.27 0.00 0.00 179.45 177.95 1ft6 h LYS 10 N -0.58 0.94 -0.49 1.90 1.79 -1.96 -1.53 116.57 116.65 1ft6 h LYS 10 Ca 0.05 -0.16 -0.01 0.00 -2.18 0.00 0.00 60.65 58.35 1ft6 h LYS 10 Cb 0.67 -0.16 -0.02 0.00 -1.58 0.00 0.00 32.23 31.14 1ft6 h LYS 10 CO -0.37 0.78 0.28 0.00 -1.08 0.00 0.00 179.45 179.06 1ft6 h SER 12 N 0.65 0.06 -0.08 0.00 0.02 -0.68 -0.39 113.55 113.12 1ft6 h SER 12 Ca 0.17 -0.02 -0.13 0.00 -0.84 0.00 0.00 61.79 60.98 1ft6 h SER 12 Cb 0.02 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1ft6 h SER 12 CO -0.03 0.32 -0.36 0.77 -1.14 0.00 0.00 176.83 176.39 1ft6 h SER 13 N 0.06 0.61 0.64 3.07 4.64 -0.98 -3.01 113.55 118.59 1ft6 h SER 13 Ca 0.01 -0.26 -0.17 0.00 -0.47 0.00 0.00 61.79 60.90 1ft6 h SER 13 Cb 0.48 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 62.37 1ft6 h SER 13 CO 0.03 0.92 -1.48 0.00 -0.87 0.00 0.00 176.83 175.43 1ft6 n HIS 15 N -2.86 3.82 -0.10 0.00 8.25 -0.17 -4.92 115.22 119.24 1ft6 n HIS 15 Ca -0.11 -3.99 0.02 0.00 -0.26 0.00 0.00 57.72 53.38 1ft6 n HIS 15 Cb 0.85 -0.56 0.34 0.00 1.12 0.00 0.00 29.99 31.74 1ft6 n HIS 15 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 1ft6 h LYS 16 N 3.56 0.75 -0.12 -0.41 1.57 -1.75 -2.00 116.57 118.17 1ft6 h LYS 16 Ca 0.17 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 1ft6 h LYS 16 Cb 0.56 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.70 1ft6 h LYS 16 CO 0.85 0.50 0.03 0.00 -0.57 0.00 0.00 179.45 180.27 1ft6 h ALA 17 N 1.63 0.16 -0.59 3.86 0.00 -1.91 0.48 119.26 122.89 1ft6 h ALA 17 Ca 0.21 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1ft6 h ALA 17 Cb -0.07 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1ft6 h ALA 17 CO -0.04 -0.22 0.11 1.96 0.00 0.00 0.00 179.25 181.06 1ft6 h GLN 18 N -0.00 0.97 -0.56 0.00 7.50 -1.84 -2.25 115.11 118.92 1ft6 h GLN 18 Ca 0.04 -0.25 -0.03 0.00 0.50 0.00 0.00 58.65 58.91 1ft6 h GLN 18 Cb 0.24 -0.12 -0.03 0.00 0.05 0.00 0.00 27.48 27.63 1ft6 h GLN 18 CO -0.00 0.91 0.24 0.00 -1.50 0.00 0.00 178.83 178.47 1ft6 h ALA 19 N 1.02 0.73 -0.10 3.87 0.00 -1.19 0.33 119.26 123.92 1ft6 h ALA 19 Ca 0.18 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1ft6 h ALA 19 Cb 0.40 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1ft6 h ALA 19 CO 0.01 0.33 -0.30 0.37 0.00 0.00 0.00 179.25 179.66 1ft6 h GLN 20 N 0.77 0.18 -0.00 0.00 5.75 -0.83 -1.32 115.11 119.67 1ft6 h GLN 20 Ca 0.19 -0.07 -0.19 0.00 -0.15 0.00 0.00 58.65 58.43 1ft6 h GLN 20 Cb 0.18 -0.01 0.02 0.00 1.07 0.00 0.00 27.48 28.73 1ft6 h GLN 20 CO -0.02 0.47 -0.75 1.03 -2.65 0.00 0.00 178.83 176.92 1ft6 h SER 21 N 0.16 0.66 -0.93 -0.69 0.87 -0.91 -3.25 113.55 109.47 1ft6 h SER 21 Ca 0.02 -0.75 0.05 0.00 -1.23 0.00 0.00 61.79 59.88 1ft6 h SER 21 Cb 0.62 -0.20 -0.06 0.00 -0.44 0.00 0.00 62.40 62.32 1ft6 h SER 21 CO 0.05 1.33 0.61 -0.25 -0.53 0.00 0.00 176.83 178.03 1ft6 h TRP 22 N 0.06 1.11 -0.79 2.24 7.01 -0.20 -2.34 115.95 123.05 1ft6 h TRP 22 Ca -0.09 0.03 0.23 0.00 2.11 0.00 0.00 58.89 61.16 1ft6 h TRP 22 Cb 1.44 -0.37 -0.03 0.00 -2.10 0.00 0.00 29.16 28.10 1ft6 h TRP 22 CO 0.13 0.62 0.61 -0.22 -2.79 0.00 0.00 178.44 176.79 1ft6 h LYS 23 N 1.13 0.00 -0.36 2.65 1.63 -1.27 0.47 116.57 120.81 1ft6 h LYS 23 Ca 0.38 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.18 1ft6 h LYS 23 Cb 0.08 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.71 1ft6 h LYS 23 CO -0.13 0.00 0.00 -0.25 -3.45 0.00 0.00 179.45 175.62 1ft6 n ASP 24 N -4.14 2.98 -4.93 4.20 8.00 -0.88 -4.77 116.55 117.02 1ft6 n ASP 24 Ca 0.16 -1.93 -0.26 0.00 0.71 0.00 0.00 54.79 53.48 1ft6 n ASP 24 Cb 0.89 -0.23 0.01 0.00 -0.02 0.00 0.00 41.12 41.77 1ft6 n ASP 24 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1ft6 s THR 25 N -1.53 4.25 0.41 -3.53 -4.23 0.16 -4.97 115.64 106.20 1ft6 s THR 25 Ca 0.37 -0.12 0.08 0.00 -1.18 0.00 0.00 61.69 60.84 1ft6 s THR 25 Cb 0.21 -3.62 0.25 0.00 1.34 0.00 0.00 72.50 70.68 1ft6 s THR 25 CO 0.30 -0.55 2.04 0.00 -0.54 0.00 0.00 174.62 175.86 1ft6 h ALA 26 N 0.19 1.69 -0.61 3.99 0.00 -1.87 -2.18 119.26 120.46 1ft6 h ALA 26 Ca -0.46 -0.06 0.07 0.00 0.00 0.00 0.00 54.91 54.46 1ft6 h ALA 26 Cb 1.24 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.83 1ft6 h ALA 26 CO 0.60 0.27 0.29 0.45 0.00 0.00 0.00 179.25 180.86 1ft6 h HIS 27 N 0.46 0.53 -0.10 0.00 3.86 -1.86 -1.58 115.15 116.46 1ft6 h HIS 27 Ca 0.12 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.34 1ft6 h HIS 27 Cb 0.02 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 28.34 1ft6 h HIS 27 CO 0.00 0.21 -0.01 0.00 0.86 0.00 0.00 177.93 179.00 1ft6 h ALA 28 N 1.36 1.81 -0.57 2.45 0.00 -1.56 0.27 119.26 123.02 1ft6 h ALA 28 Ca 0.29 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1ft6 h ALA 28 Cb 0.26 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1ft6 h ALA 28 CO -0.23 0.15 0.00 1.63 0.00 0.00 0.00 179.25 180.80 1ft6 n LYS 29 N -4.44 3.91 -0.29 0.00 5.02 -0.71 -4.61 118.16 117.03 1ft6 n LYS 29 Ca -0.01 -2.92 0.15 0.00 -2.02 0.00 0.00 58.31 53.51 1ft6 n LYS 29 Cb 0.14 -1.95 0.40 0.00 -0.02 0.00 0.00 35.03 33.60 1ft6 n LYS 29 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ft6 h ALA 30 N 3.68 1.91 0.00 7.82 0.00 -0.85 0.28 119.26 132.10 1ft6 h ALA 30 Ca 0.00 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1ft6 h ALA 30 Cb 1.55 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.25 1ft6 h ALA 30 CO 0.29 -0.20 -0.33 1.98 0.00 0.00 0.00 179.25 180.98 1ft6 h MET 31 N 0.63 0.00 -0.03 0.00 1.85 -1.83 -2.92 114.93 112.63 1ft6 h MET 31 Ca 0.50 0.00 -0.03 0.00 -0.61 0.00 0.00 59.70 59.55 1ft6 h MET 31 Cb 0.93 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 32.95 1ft6 h MET 31 CO -0.25 0.33 -0.14 0.93 -0.40 0.00 0.00 176.91 177.38 1ft6 h GLU 32 N 0.00 0.05 0.00 0.39 4.39 -1.29 -1.34 114.58 116.78 1ft6 h GLU 32 Ca -0.00 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 1ft6 h GLU 32 Cb 0.84 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.48 1ft6 h GLU 32 CO 0.04 0.19 -0.05 0.77 -1.16 0.00 0.00 179.01 178.81 1ft6 h SER 33 N 0.05 0.00 0.25 1.42 0.02 -1.53 -2.11 113.55 111.65 1ft6 h SER 33 Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1ft6 h SER 33 Cb 0.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.82 1ft6 h SER 33 CO 0.02 0.05 -0.23 0.18 -1.14 0.00 0.00 176.83 175.71 1ft6 n LEU 34 N -3.47 0.96 -4.83 5.07 4.77 -0.51 -4.81 117.00 114.19 1ft6 n LEU 34 Ca -0.02 -0.23 -0.32 0.00 -0.03 0.00 0.00 56.01 55.40 1ft6 n LEU 34 Cb 0.17 -0.13 -0.03 0.00 -2.33 0.00 0.00 43.42 41.11 1ft6 n LEU 34 CO 0.27 0.18 0.69 -0.54 -1.33 0.00 0.00 177.39 176.65 1ft6 s LYS 35 N -2.48 3.84 0.42 3.23 1.02 -0.79 -0.28 119.74 124.70 1ft6 s LYS 35 Ca 0.25 1.05 -0.26 0.00 0.02 0.00 0.00 55.97 57.04 1ft6 s LYS 35 Cb 0.19 -2.12 -0.10 0.00 -0.52 0.00 0.00 37.83 35.29 1ft6 s LYS 35 CO 0.51 -0.37 1.36 -2.30 -0.92 0.00 0.00 175.35 173.62 1ft6 n PRO 36 N -1.53 2.15 -1.30 -1.68 -0.02 -1.22 -3.01 135.00 128.38 1ft6 n PRO 36 Ca 0.07 0.76 -0.10 0.00 -2.02 0.00 0.00 63.50 62.21 1ft6 n PRO 36 Cb 0.54 -2.50 -0.04 0.00 -0.02 0.00 0.00 33.50 31.47 1ft6 n PRO 36 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1ft6 n ASN 37 N 0.14 -5.45 -4.68 2.55 3.02 0.59 -4.99 115.26 106.43 1ft6 n ASN 37 Ca 0.05 0.26 -0.35 0.00 -0.03 0.00 0.00 54.58 54.51 1ft6 n ASN 37 Cb 0.40 -3.86 -0.09 0.00 -0.61 0.00 0.00 39.78 35.61 1ft6 n ASN 37 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1ft6 s VAL 38 N -1.98 4.58 -1.34 2.41 1.01 -1.16 -4.48 120.40 119.43 1ft6 s VAL 38 Ca 0.00 -0.13 -0.06 0.00 0.00 0.00 0.00 61.98 61.79 1ft6 s VAL 38 Cb 0.00 -2.98 0.02 0.00 0.00 0.00 0.00 36.38 33.42 1ft6 s VAL 38 CO 0.00 0.56 1.02 0.29 0.00 0.00 0.00 175.10 176.97 1ft6 n LYS 39 N 2.64 -6.66 -0.12 2.72 5.02 -1.26 -4.88 118.16 115.62 1ft6 n LYS 39 Ca -0.18 0.76 -0.05 0.00 -2.02 0.00 0.00 58.31 56.82 1ft6 n LYS 39 Cb 0.53 -5.70 0.03 0.00 -0.02 0.00 0.00 35.03 29.87 1ft6 n LYS 39 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1ft6 h LYS 40 N -2.23 0.14 -0.21 1.97 1.57 -1.87 -1.29 116.57 114.65 1ft6 h LYS 40 Ca -0.58 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.18 1ft6 h LYS 40 Cb 1.36 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.63 1ft6 h LYS 40 CO 0.56 0.10 0.11 0.93 -0.57 0.00 0.00 179.45 180.58 1ft6 h GLU 41 N 0.15 0.30 -0.59 3.15 5.08 -1.97 -0.79 114.58 119.90 1ft6 h GLU 41 Ca 0.19 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.50 1ft6 h GLU 41 Cb 0.25 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 1ft6 h GLU 41 CO -0.29 0.30 0.33 0.00 -1.00 0.00 0.00 179.01 178.35 1ft6 h ALA 42 N 0.99 0.76 -0.67 3.43 0.00 -1.94 -1.81 119.26 120.02 1ft6 h ALA 42 Ca 0.07 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1ft6 h ALA 42 Cb 0.09 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1ft6 h ALA 42 CO -0.01 0.28 0.43 0.87 0.00 0.00 0.00 179.25 180.82 1ft6 h LYS 43 N 0.81 0.90 -0.59 0.00 1.57 -1.03 -2.36 116.57 115.86 1ft6 h LYS 43 Ca 0.21 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.85 1ft6 h LYS 43 Cb 0.04 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.13 1ft6 h LYS 43 CO -0.03 0.62 0.09 1.96 -0.57 0.00 0.00 179.45 181.51 1ft6 h GLN 44 N 0.91 0.97 -0.39 3.15 4.20 -0.70 0.53 115.11 123.78 1ft6 h GLN 44 Ca 0.24 -0.24 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 1ft6 h GLN 44 Cb -0.07 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.57 1ft6 h GLN 44 CO -0.05 0.90 0.18 -0.22 -0.67 0.00 0.00 178.83 178.97 1ft6 h LYS 45 N 0.91 0.54 -0.52 1.46 3.64 -1.08 -0.04 116.57 121.47 1ft6 h LYS 45 Ca 0.18 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1ft6 h LYS 45 Cb 0.41 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 1ft6 h LYS 45 CO 0.01 0.43 0.00 0.00 -2.27 0.00 0.00 179.45 177.62 1ft6 n ALA 46 N -2.47 2.66 -3.06 5.00 0.00 -0.84 -4.92 120.51 116.87 1ft6 n ALA 46 Ca 0.03 -0.88 -0.23 0.00 0.00 0.00 0.00 53.44 52.37 1ft6 n ALA 46 Cb 0.12 -0.99 0.03 0.00 0.00 0.00 0.00 19.45 18.61 1ft6 n ALA 46 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1ft6 n LYS 47 N 0.70 -4.74 -3.29 0.00 4.76 -0.03 -5.01 118.16 110.55 1ft6 n LYS 47 Ca 0.15 0.86 -0.19 0.00 -2.87 0.00 0.00 58.31 56.27 1ft6 n LYS 47 Cb 0.49 -5.71 -0.01 0.00 -1.84 0.00 0.00 35.03 27.96 1ft6 n LYS 47 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1ft6 s LEU 48 N -6.67 3.66 -0.34 -0.35 1.43 0.12 -5.01 118.68 111.52 1ft6 s LEU 48 Ca 0.31 -0.45 -0.19 0.00 -1.03 0.00 0.00 54.13 52.78 1ft6 s LEU 48 Cb -0.14 -2.51 -0.00 0.00 0.03 0.00 0.00 46.19 43.56 1ft6 s LEU 48 CO 0.39 -0.64 0.55 -0.62 0.23 0.00 0.00 176.35 176.26 1ft6 s ASP 49 N -4.24 6.36 0.45 2.29 -1.08 -1.26 -4.20 116.67 115.00 1ft6 s ASP 49 Ca 0.50 0.07 0.31 0.00 -0.52 0.00 0.00 52.55 52.92 1ft6 s ASP 49 Cb -0.08 -2.29 1.57 0.00 -1.46 0.00 0.00 42.92 40.66 1ft6 s ASP 49 CO 0.31 -0.50 1.94 1.55 0.52 0.00 0.00 175.17 178.99 1ft6 h PRO 50 N 8.42 0.00 -0.01 4.34 0.13 -1.90 -2.75 132.00 140.23 1ft6 h PRO 50 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1ft6 h PRO 50 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1ft6 h PRO 50 CO 0.79 0.00 -0.22 0.00 -0.23 0.00 0.00 178.00 178.34 1ft6 n ALA 51 N -1.92 2.92 -1.77 -0.56 0.00 -1.26 -0.30 120.51 117.62 1ft6 n ALA 51 Ca -0.01 -0.56 -0.38 0.00 0.00 0.00 0.00 53.44 52.49 1ft6 n ALA 51 Cb 0.12 -0.54 -0.05 0.00 0.00 0.00 0.00 19.45 18.98 1ft6 n ALA 51 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1ft6 s LYS 52 N -1.68 4.39 -0.54 0.00 2.20 -1.04 -4.53 119.74 118.54 1ft6 s LYS 52 Ca 0.15 1.56 -0.23 0.00 -0.36 0.00 0.00 55.97 57.09 1ft6 s LYS 52 Cb 0.13 -2.79 0.05 0.00 -1.51 0.00 0.00 37.83 33.70 1ft6 s LYS 52 CO 0.33 0.05 0.85 0.34 -0.36 0.00 0.00 175.35 176.56 1ft6 s ASP 53 N -1.37 6.30 0.00 1.43 -1.08 -1.26 -3.43 116.67 117.26 1ft6 s ASP 53 Ca 0.52 -0.52 0.23 0.00 -0.52 0.00 0.00 52.55 52.26 1ft6 s ASP 53 Cb -0.24 -2.39 0.49 0.00 -1.46 0.00 0.00 42.92 39.31 1ft6 s ASP 53 CO 0.31 -1.13 1.43 -1.22 0.52 0.00 0.00 175.17 175.08 1ft6 n TYR 54 N 7.07 0.37 0.17 -5.34 4.02 0.62 -4.51 117.16 119.56 1ft6 n TYR 54 Ca -0.01 -0.18 0.06 0.00 -0.01 0.00 0.00 57.90 57.75 1ft6 n TYR 54 Cb 0.47 0.00 0.28 0.00 -0.02 0.00 0.00 39.34 40.07 1ft6 n TYR 54 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 1ft6 n THR 55 N 1.18 1.44 -1.59 -0.72 -2.24 -1.12 -2.14 114.28 109.09 1ft6 n THR 55 Ca 0.18 0.51 0.06 0.00 -2.27 0.00 0.00 64.05 62.53 1ft6 n THR 55 Cb 0.54 -1.46 0.12 0.00 -2.10 0.00 0.00 70.33 67.42 1ft6 n THR 55 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ft6 n GLN 56 N -1.81 0.95 -3.30 -0.78 6.02 -1.26 -4.90 117.38 112.30 1ft6 n GLN 56 Ca 0.00 -2.41 -0.40 0.00 -0.01 0.00 0.00 57.00 54.18 1ft6 n GLN 56 Cb 0.06 -1.14 -0.08 0.00 1.02 0.00 0.00 30.24 30.10 1ft6 n GLN 56 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1ft6 s ASP 57 N -2.51 6.30 0.00 1.08 -1.08 -0.91 -4.94 116.67 114.61 1ft6 s ASP 57 Ca 0.28 0.12 0.06 0.00 -0.52 0.00 0.00 52.55 52.49 1ft6 s ASP 57 Cb 0.27 -2.25 0.27 0.00 -1.46 0.00 0.00 42.92 39.75 1ft6 s ASP 57 CO -0.03 -0.35 1.16 2.29 0.52 0.00 0.00 175.17 178.76 1ft6 n LYS 58 N 5.55 0.02 -0.02 4.34 2.85 -1.26 -0.86 118.16 128.78 1ft6 n LYS 58 Ca -0.06 0.36 0.13 0.00 -1.05 0.00 0.00 58.31 57.69 1ft6 n LYS 58 Cb 0.50 -1.50 0.57 0.00 -0.65 0.00 0.00 35.03 33.94 1ft6 n LYS 58 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1ft6 n ASP 59 N -1.45 1.12 0.00 -5.58 8.00 -1.26 -4.52 116.55 112.85 1ft6 n ASP 59 Ca 0.02 -1.45 0.00 0.00 0.71 0.00 0.00 54.79 54.07 1ft6 n ASP 59 Cb 0.07 -0.03 0.00 0.00 -0.02 0.00 0.00 41.12 41.14 1ft6 n ASP 59 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ft6 h VAL 61 N 0.00 0.57 -0.01 0.00 -1.51 -1.57 -2.92 116.25 110.80 1ft6 h VAL 61 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 1ft6 h VAL 61 Cb 0.42 0.78 -0.00 0.00 -2.13 0.00 0.00 31.29 30.36 1ft6 h VAL 61 CO 0.00 0.00 0.06 1.23 -1.23 0.00 0.00 177.57 177.63 1ft6 h GLY 62 N 0.00 0.00 -1.18 5.19 0.00 -1.84 -0.13 103.07 105.11 1ft6 h GLY 62 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.49 1ft6 h GLY 62 CO -0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.54 1ft6 n HIS 64 N 0.34 0.00 -4.07 0.00 8.25 -0.08 -4.89 115.22 114.78 1ft6 n HIS 64 Ca 0.11 -0.61 -0.11 0.00 -0.26 0.00 0.00 57.72 56.84 1ft6 n HIS 64 Cb 0.45 -0.09 -0.06 0.00 1.12 0.00 0.00 29.99 31.41 1ft6 n HIS 64 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1ft6 s VAL 65 N -1.59 0.00 -0.10 1.59 -7.23 -1.12 -1.94 120.40 110.01 1ft6 s VAL 65 Ca 0.13 -1.58 -0.22 0.00 -1.81 0.00 0.00 61.98 58.50 1ft6 s VAL 65 Cb 0.12 -2.40 -0.03 0.00 0.56 0.00 0.00 36.38 34.62 1ft6 s VAL 65 CO 0.01 0.00 0.66 -1.81 -0.31 0.00 0.00 175.10 173.65 1ft6 s ASP 66 N -3.12 6.88 -1.55 4.85 -0.00 0.02 -4.56 116.67 119.20 1ft6 s ASP 66 Ca 0.28 1.06 -0.05 0.00 -0.00 0.00 0.00 52.55 53.84 1ft6 s ASP 66 Cb 0.01 -2.38 0.01 0.00 -0.00 0.00 0.00 42.92 40.55 1ft6 s ASP 66 CO 0.13 -0.14 0.66 0.61 -0.00 0.00 0.00 175.17 176.43 1ft6 n GLY 67 N 3.27 -0.53 3.73 0.21 0.00 -1.26 -1.71 105.19 108.90 1ft6 n GLY 67 Ca -0.02 0.14 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1ft6 n GLY 67 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ft6 s PHE 68 N -3.20 2.85 0.00 1.61 5.36 -1.26 -1.50 117.98 121.84 1ft6 s PHE 68 Ca 0.33 0.47 0.00 0.00 -0.96 0.00 0.00 56.93 56.77 1ft6 s PHE 68 Cb -0.14 -4.13 0.00 0.00 -0.34 0.00 0.00 43.02 38.41 1ft6 s PHE 68 CO 0.41 -4.13 0.00 0.41 -1.46 0.00 0.00 175.22 170.45 1ft6 n GLY 69 N 3.42 0.58 3.35 13.12 0.00 -1.26 -5.00 105.19 119.41 1ft6 n GLY 69 Ca 0.14 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.94 1ft6 n GLY 69 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ft6 s GLN 70 N -0.04 1.34 0.20 1.61 -0.21 -0.56 -5.06 119.66 116.93 1ft6 s GLN 70 Ca 0.00 -1.47 -0.32 0.00 0.02 0.00 0.00 55.36 53.58 1ft6 s GLN 70 Cb 0.00 -1.38 -0.13 0.00 1.00 0.00 0.00 33.01 32.50 1ft6 s GLN 70 CO 0.00 0.27 1.66 0.36 -2.12 0.00 0.00 175.29 175.47 1ft6 n LYS 71 N 0.12 2.55 -0.10 2.91 2.85 -1.26 -0.80 118.16 124.43 1ft6 n LYS 71 Ca -0.12 0.92 0.00 0.00 -1.05 0.00 0.00 58.31 58.06 1ft6 n LYS 71 Cb 0.58 -2.73 0.00 0.00 -0.65 0.00 0.00 35.03 32.22 1ft6 n LYS 71 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1ft6 n GLY 72 N 3.63 2.56 3.76 2.58 0.00 -1.26 -1.42 105.19 115.04 1ft6 n GLY 72 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 1ft6 n GLY 72 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ft6 s GLY 73 N -1.99 1.57 0.38 -0.02 0.00 0.02 -4.49 107.32 102.79 1ft6 s GLY 73 Ca 0.00 -0.48 -0.27 0.00 0.00 0.00 0.00 44.72 43.97 1ft6 s GLY 73 CO 0.00 0.09 1.35 2.98 0.00 0.00 0.00 173.10 177.52 1ft6 n TYR 74 N -3.87 2.47 -4.09 1.90 9.36 -0.69 -4.89 117.16 117.35 1ft6 n TYR 74 Ca 0.06 0.50 -0.13 0.00 3.32 0.00 0.00 57.90 61.65 1ft6 n TYR 74 Cb 0.59 -2.44 -0.11 0.00 -0.63 0.00 0.00 39.34 36.74 1ft6 n TYR 74 CO 0.00 0.00 0.00 0.95 0.22 0.00 0.00 176.86 178.03 1ft6 s THR 75 N -1.14 0.59 0.38 2.97 -4.23 -1.21 -4.23 115.64 108.78 1ft6 s THR 75 Ca 0.57 -1.24 0.16 0.00 -1.18 0.00 0.00 61.69 60.00 1ft6 s THR 75 Cb -0.52 -0.81 0.14 0.00 1.34 0.00 0.00 72.50 72.65 1ft6 s THR 75 CO 0.61 -0.46 1.89 0.40 -0.54 0.00 0.00 174.62 176.52 1ft6 h ILE 76 N 4.22 1.11 -0.07 2.99 2.04 -1.96 -1.07 117.51 124.77 1ft6 h ILE 76 Ca -0.36 -1.06 -0.17 0.00 1.00 0.00 0.00 64.86 64.27 1ft6 h ILE 76 Cb 1.20 1.59 -0.01 0.00 -0.74 0.00 0.00 36.82 38.86 1ft6 h ILE 76 CO 0.45 0.29 -0.70 -0.08 0.00 0.00 0.00 178.15 178.11 1ft6 h GLU 77 N 0.00 0.34 -2.44 2.37 4.57 -2.00 -3.37 114.58 114.05 1ft6 h GLU 77 Ca -0.00 -0.27 -0.59 0.00 -1.18 0.00 0.00 59.36 57.31 1ft6 h GLU 77 Cb 0.57 0.05 -0.40 0.00 -0.16 0.00 0.00 28.75 28.81 1ft6 h GLU 77 CO 0.04 0.91 -0.87 0.43 -1.18 0.00 0.00 179.01 178.35 1ft6 n SER 78 N -3.83 0.94 -4.57 1.04 7.64 -0.84 -5.05 113.62 108.94 1ft6 n SER 78 Ca -0.04 -2.75 -0.43 0.00 1.01 0.00 0.00 58.87 56.66 1ft6 n SER 78 Cb 0.69 -0.63 -0.00 0.00 -1.01 0.00 0.00 64.21 63.25 1ft6 n SER 78 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1ft6 s PRO 79 N -0.83 3.95 0.13 1.43 0.04 -0.47 -3.30 135.00 135.95 1ft6 s PRO 79 Ca 0.32 -1.92 -0.32 0.00 0.04 0.00 0.00 61.00 59.13 1ft6 s PRO 79 Cb 0.06 -5.50 -0.12 0.00 0.04 0.00 0.00 34.50 28.98 1ft6 s PRO 79 CO -0.15 -2.24 1.78 1.63 0.04 0.00 0.00 177.00 178.06 1ft6 n LYS 80 N 8.35 2.64 -0.00 4.56 5.02 -1.26 -4.87 118.16 132.60 1ft6 n LYS 80 Ca 0.47 0.96 0.14 0.00 -2.02 0.00 0.00 58.31 57.86 1ft6 n LYS 80 Cb 0.46 -2.82 0.59 0.00 -0.02 0.00 0.00 35.03 33.24 1ft6 n LYS 80 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 1ft6 h PRO 81 N 7.80 0.20 0.00 1.97 0.11 -1.96 0.09 132.00 140.21 1ft6 h PRO 81 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1ft6 h PRO 81 Cb 1.23 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1ft6 h PRO 81 CO 0.94 0.13 0.00 -1.33 -0.21 0.00 0.00 178.00 177.53 1ft6 n MET 82 N -4.45 0.78 0.00 1.05 2.81 -1.26 -2.04 117.12 114.01 1ft6 n MET 82 Ca 0.08 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.97 1ft6 n MET 82 Cb 0.41 -1.46 0.00 0.00 -0.71 0.00 0.00 33.22 31.46 1ft6 n MET 82 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1ft6 n LEU 83 N -0.96 1.80 -4.72 4.03 4.77 -0.01 -1.60 117.00 120.31 1ft6 n LEU 83 Ca 0.17 -1.80 -0.39 0.00 -0.03 0.00 0.00 56.01 53.96 1ft6 n LEU 83 Cb 0.08 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.12 1ft6 n LEU 83 CO 0.13 0.45 0.27 -0.89 -1.33 0.00 0.00 177.39 176.03 1ft6 s THR 84 N -0.87 5.12 0.00 -5.08 2.01 -0.87 -0.80 115.64 115.15 1ft6 s THR 84 Ca 0.00 1.17 0.00 0.00 0.31 0.00 0.00 61.69 63.17 1ft6 s THR 84 Cb 0.00 -3.91 0.00 0.00 0.01 0.00 0.00 72.50 68.60 1ft6 s THR 84 CO 0.00 0.28 0.00 0.61 -0.69 0.00 0.00 174.62 174.82 1ft6 n GLY 85 N 3.23 0.96 3.52 4.40 0.00 -0.82 -4.81 105.19 111.68 1ft6 n GLY 85 Ca -0.04 -1.78 -0.43 0.00 0.00 0.00 0.00 46.02 43.77 1ft6 n GLY 85 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ft6 s VAL 86 N -3.00 4.41 0.00 1.61 1.01 0.04 -3.29 120.40 121.18 1ft6 s VAL 86 Ca 0.00 0.29 0.00 0.00 0.00 0.00 0.00 61.98 62.27 1ft6 s VAL 86 Cb 0.00 -4.53 0.00 0.00 0.00 0.00 0.00 36.38 31.85 1ft6 s VAL 86 CO 0.00 -1.09 0.00 0.61 0.00 0.00 0.00 175.10 174.62 1ft6 n GLY 87 N 5.11 3.80 0.19 4.51 0.00 -1.26 -4.21 105.19 113.32 1ft6 n GLY 87 Ca 0.02 -2.06 -0.03 0.00 0.00 0.00 0.00 46.02 43.94 1ft6 n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ft6 h GLU 89 N 0.15 0.00 0.00 0.00 5.08 -1.90 -1.10 114.58 116.81 1ft6 h GLU 89 Ca 0.23 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.57 1ft6 h GLU 89 Cb 0.33 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 1ft6 h GLU 89 CO -0.35 0.02 -0.09 0.77 -1.00 0.00 0.00 179.01 178.36 1ft6 h SER 90 N 0.00 0.00 0.00 1.42 0.02 -1.60 -0.62 113.55 112.76 1ft6 h SER 90 Ca -0.00 0.00 -0.24 0.00 -0.84 0.00 0.00 61.79 60.71 1ft6 h SER 90 Cb 0.61 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.11 1ft6 h SER 90 CO 0.00 0.09 -1.85 0.00 -1.14 0.00 0.00 176.83 173.94 1ft6 n HIS 92 N -3.24 0.31 0.00 0.00 -0.00 -0.44 -4.71 115.22 107.14 1ft6 n HIS 92 Ca -0.28 0.09 0.00 0.00 -0.00 0.00 0.00 57.72 57.53 1ft6 n HIS 92 Cb 0.75 -0.62 0.00 0.00 -0.00 0.00 0.00 29.99 30.12 1ft6 n HIS 92 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1ft6 n GLY 93 N 1.43 1.58 3.71 -1.41 0.00 -0.24 -0.51 105.19 109.76 1ft6 n GLY 93 Ca 0.06 -1.83 -0.43 0.00 0.00 0.00 0.00 46.02 43.82 1ft6 n GLY 93 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ft6 n PRO 94 N 1.47 2.43 0.00 1.61 -0.01 -1.25 -4.36 135.00 134.89 1ft6 n PRO 94 Ca 0.00 0.87 0.12 0.00 -0.01 0.00 0.00 63.50 64.48 1ft6 n PRO 94 Cb 0.00 -2.62 0.13 0.00 -0.01 0.00 0.00 33.50 31.00 1ft6 n PRO 94 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 1ft6 n GLY 95 N 2.50 0.29 0.32 -1.23 0.00 -1.25 -4.67 105.19 101.15 1ft6 n GLY 95 Ca 0.11 -0.61 0.08 0.00 0.00 0.00 0.00 46.02 45.60 1ft6 n GLY 95 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1ft6 h ARG 96 N 3.07 0.03 0.10 1.61 9.65 -1.87 -0.67 114.38 126.30 1ft6 h ARG 96 Ca 0.00 -0.00 -0.34 0.00 -1.10 0.00 0.00 59.98 58.54 1ft6 h ARG 96 Cb 0.79 -0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 29.34 1ft6 h ARG 96 CO 0.00 0.02 -1.84 -0.91 2.80 0.00 0.00 179.97 180.04 1ft6 h ASN 97 N 0.03 0.34 1.69 -3.80 2.35 -1.83 -3.39 115.58 110.97 1ft6 h ASN 97 Ca 0.48 -0.69 -0.05 0.00 -0.55 0.00 0.00 56.30 55.49 1ft6 h ASN 97 Cb 0.87 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 39.12 1ft6 h ASN 97 CO -0.86 1.61 -0.31 2.19 -1.65 0.00 0.00 177.43 178.41 1ft6 h PHE 98 N 0.06 0.00 0.00 1.19 -5.15 -1.60 -3.25 116.94 108.19 1ft6 h PHE 98 Ca -0.36 0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 57.40 1ft6 h PHE 98 Cb 2.04 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 38.20 1ft6 h PHE 98 CO 0.06 0.22 -0.04 0.07 -2.00 0.00 0.00 178.31 176.62 1ft6 h ARG 99 N 0.00 0.00 -0.15 6.09 0.11 -1.32 -0.58 114.38 118.53 1ft6 h ARG 99 Ca -0.01 0.00 -0.17 0.00 0.10 0.00 0.00 59.98 59.91 1ft6 h ARG 99 Cb 1.18 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.25 1ft6 h ARG 99 CO 0.03 0.04 -0.60 0.78 0.10 0.00 0.00 179.97 180.32 1ft6 h GLY 100 N 1.01 0.54 2.00 0.08 0.00 -1.78 -2.39 103.07 102.53 1ft6 h GLY 100 Ca -0.00 -0.66 -0.11 0.00 0.00 0.00 0.00 47.33 46.56 1ft6 h GLY 100 CO 0.01 0.59 -0.50 -0.55 0.00 0.00 0.00 176.54 176.09 1ft6 h ASP 101 N 0.37 0.00 -0.55 0.19 5.19 -1.27 -1.51 116.42 118.84 1ft6 h ASP 101 Ca -0.00 0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 56.29 1ft6 h ASP 101 Cb 1.15 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.64 1ft6 h ASP 101 CO 0.11 0.50 -0.09 0.45 -3.12 0.00 0.00 179.24 177.09 1ft6 h HIS 102 N 0.00 1.15 0.56 4.55 3.86 -1.00 0.11 115.15 124.38 1ft6 h HIS 102 Ca -0.01 -0.23 -0.03 0.00 -1.16 0.00 0.00 60.37 58.94 1ft6 h HIS 102 Cb 0.99 -0.29 0.01 0.00 1.06 0.00 0.00 27.41 29.18 1ft6 h HIS 102 CO 0.00 1.06 -0.27 -0.09 0.86 0.00 0.00 177.93 179.49 1ft6 h ARG 103 N 0.91 -0.72 -0.59 2.45 2.43 -1.17 -1.60 114.38 116.10 1ft6 h ARG 103 Ca 0.14 0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.32 1ft6 h ARG 103 Cb 0.66 0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 30.35 1ft6 h ARG 103 CO 0.05 -0.41 0.20 1.57 -1.51 0.00 0.00 179.97 179.86 1ft6 h LYS 104 N -0.97 0.87 -0.33 0.20 2.10 -1.30 -1.34 116.57 115.81 1ft6 h LYS 104 Ca -0.08 -0.15 -0.13 0.00 -2.00 0.00 0.00 60.65 58.29 1ft6 h LYS 104 Cb 0.64 -0.14 -0.01 0.00 -0.90 0.00 0.00 32.23 31.81 1ft6 h LYS 104 CO 0.13 0.74 -0.31 0.77 -2.00 0.00 0.00 179.45 178.78 1ft6 h SER 105 N 0.85 0.72 -0.16 7.07 0.02 -1.02 -0.96 113.55 120.09 1ft6 h SER 105 Ca 0.20 -0.29 -0.13 0.00 -0.84 0.00 0.00 61.79 60.73 1ft6 h SER 105 Cb 0.23 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 1ft6 h SER 105 CO -0.01 0.98 -0.33 1.23 -1.14 0.00 0.00 176.83 177.56 1ft6 h GLY 106 N 0.98 0.72 0.80 -3.77 0.00 -0.94 -0.46 103.07 100.39 1ft6 h GLY 106 Ca 0.07 -0.67 -0.06 0.00 0.00 0.00 0.00 47.33 46.67 1ft6 h GLY 106 CO 0.07 0.61 -0.10 1.46 0.00 0.00 0.00 176.54 178.58 1ft6 h GLN 107 N 0.56 0.42 -0.90 4.80 4.20 -1.02 -0.99 115.11 122.18 1ft6 h GLN 107 Ca 0.06 -0.19 -0.02 0.00 0.06 0.00 0.00 58.65 58.57 1ft6 h GLN 107 Cb 0.84 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.56 1ft6 h GLN 107 CO 0.07 0.72 0.49 0.00 -0.67 0.00 0.00 178.83 179.44 1ft6 h ALA 108 N 0.69 1.15 -0.40 3.87 0.00 -1.04 -1.25 119.26 122.28 1ft6 h ALA 108 Ca 0.04 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 1ft6 h ALA 108 Cb 0.59 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1ft6 h ALA 108 CO 0.03 0.66 -0.13 0.35 0.00 0.00 0.00 179.25 180.16 1ft6 h PHE 109 N 1.26 0.91 -0.39 0.00 3.57 -0.97 -0.79 116.94 120.51 1ft6 h PHE 109 Ca 0.32 -0.21 -0.05 0.00 3.53 0.00 0.00 57.97 61.56 1ft6 h PHE 109 Cb 0.03 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.53 1ft6 h PHE 109 CO 0.01 0.94 0.02 1.49 -2.23 0.00 0.00 178.31 178.54 1ft6 h GLU 110 N 0.61 0.61 0.05 1.11 4.81 -0.67 0.33 114.58 121.42 1ft6 h GLU 110 Ca 0.10 -0.13 -0.26 0.00 -0.13 0.00 0.00 59.36 58.94 1ft6 h GLU 110 Cb 0.67 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.94 1ft6 h GLU 110 CO 0.05 0.62 -1.32 -0.22 -0.73 0.00 0.00 179.01 177.41 1ft6 h LYS 111 N 0.58 0.10 0.00 1.92 1.63 -1.19 -3.42 116.57 116.18 1ft6 h LYS 111 Ca 0.12 -0.16 0.00 0.00 -0.85 0.00 0.00 60.65 59.76 1ft6 h LYS 111 Cb 0.34 0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.03 1ft6 h LYS 111 CO 0.01 0.95 0.00 -1.13 -3.45 0.00 0.00 179.45 175.83 1ft6 n SER 112 N -3.33 0.00 0.00 4.20 3.41 -0.31 -5.02 113.62 112.57 1ft6 n SER 112 Ca -0.09 -1.00 0.00 0.00 -0.26 0.00 0.00 58.87 57.52 1ft6 n SER 112 Cb 1.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.95 1ft6 n SER 112 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ft6 n GLY 113 N 0.00 0.28 3.72 5.00 0.00 0.11 -4.97 105.19 109.34 1ft6 n GLY 113 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1ft6 n GLY 113 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ft6 s LYS 114 N -0.88 4.38 0.11 1.61 2.20 -1.24 -4.91 119.74 121.01 1ft6 s LYS 114 Ca 0.00 1.95 0.01 0.00 -0.36 0.00 0.00 55.97 57.58 1ft6 s LYS 114 Cb 0.00 -3.27 -0.04 0.00 -1.51 0.00 0.00 37.83 33.01 1ft6 s LYS 114 CO 0.00 -0.32 0.25 0.15 -0.36 0.00 0.00 175.35 175.07 1ft6 s LYS 115 N 0.82 3.44 -0.08 4.03 1.02 -1.26 -3.69 119.74 124.02 1ft6 s LYS 115 Ca 0.61 -0.53 0.02 0.00 0.02 0.00 0.00 55.97 56.09 1ft6 s LYS 115 Cb -0.34 -3.00 -0.02 0.00 -0.52 0.00 0.00 37.83 33.95 1ft6 s LYS 115 CO 0.31 0.56 -0.14 0.99 -0.92 0.00 0.00 175.35 176.16 1ft6 s THR 116 N -1.64 3.09 0.35 2.17 2.01 -0.20 -4.97 115.64 116.45 1ft6 s THR 116 Ca 0.35 -0.69 -0.28 0.00 0.31 0.00 0.00 61.69 61.38 1ft6 s THR 116 Cb -0.12 -2.24 -0.10 0.00 0.01 0.00 0.00 72.50 70.06 1ft6 s THR 116 CO 0.28 0.57 1.24 -2.16 -0.69 0.00 0.00 174.62 173.86 1ft6 s PRO 117 N -0.36 4.29 0.56 4.92 0.04 -1.26 -1.58 135.00 141.60 1ft6 s PRO 117 Ca 0.04 2.05 0.24 0.00 0.04 0.00 0.00 61.00 63.37 1ft6 s PRO 117 Cb -0.12 -2.96 1.59 0.00 0.04 0.00 0.00 34.50 33.05 1ft6 s PRO 117 CO 0.02 -0.19 2.21 0.00 0.04 0.00 0.00 177.00 179.09 1ft6 h ARG 118 N 3.20 0.00 -0.97 4.56 3.08 -0.82 -2.12 114.38 121.31 1ft6 h ARG 118 Ca -0.49 0.00 0.20 0.00 0.07 0.00 0.00 59.98 59.76 1ft6 h ARG 118 Cb 1.23 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 31.19 1ft6 h ARG 118 CO 0.65 0.00 0.61 -0.22 -1.07 0.00 0.00 179.97 179.94 1ft6 h LYS 119 N 0.00 0.60 -0.22 0.04 3.64 -1.76 0.16 116.57 119.02 1ft6 h LYS 119 Ca 0.00 -0.04 -0.10 0.00 -1.27 0.00 0.00 60.65 59.25 1ft6 h LYS 119 Cb 0.01 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.69 1ft6 h LYS 119 CO -0.00 0.39 -0.30 -0.44 -2.27 0.00 0.00 179.45 176.84 1ft6 h ASP 120 N 0.61 0.44 0.24 4.20 3.45 -1.73 -2.28 116.42 121.35 1ft6 h ASP 120 Ca 0.54 -0.16 -0.23 0.00 0.43 0.00 0.00 57.03 57.61 1ft6 h ASP 120 Cb 1.03 -0.12 0.01 0.00 -0.56 0.00 0.00 39.33 39.69 1ft6 h ASP 120 CO -0.29 0.72 -0.95 -0.07 -1.57 0.00 0.00 179.24 177.08 1ft6 h LEU 121 N 0.38 0.63 -0.96 1.55 3.38 -0.86 -3.01 115.31 116.42 1ft6 h LEU 121 Ca 0.05 -0.50 -0.06 0.00 0.09 0.00 0.00 57.88 57.46 1ft6 h LEU 121 Cb 0.72 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 1ft6 h LEU 121 CO 0.05 1.30 0.08 0.00 0.09 0.00 0.00 178.44 179.96 1ft6 h ALA 122 N 0.67 1.15 -0.00 1.53 0.00 -1.10 -0.43 119.26 121.07 1ft6 h ALA 122 Ca -0.09 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 1ft6 h ALA 122 Cb 1.58 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 19.16 1ft6 h ALA 122 CO 0.17 0.56 -0.08 0.87 0.00 0.00 0.00 179.25 180.78 1ft6 h LYS 123 N 0.80 0.00 -0.58 0.00 1.57 -1.36 -0.28 116.57 116.73 1ft6 h LYS 123 Ca 0.17 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 1ft6 h LYS 123 Cb 0.36 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.67 1ft6 h LYS 123 CO 0.01 0.08 0.00 1.63 -0.57 0.00 0.00 179.45 180.60 1ft6 n LYS 124 N -4.45 2.61 -0.21 3.15 5.02 -0.27 -4.91 118.16 119.09 1ft6 n LYS 124 Ca -0.03 -1.74 0.00 0.00 -2.02 0.00 0.00 58.31 54.52 1ft6 n LYS 124 Cb 0.16 -1.61 0.00 0.00 -0.02 0.00 0.00 35.03 33.55 1ft6 n LYS 124 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ft6 n GLY 125 N 0.86 0.64 3.76 0.72 0.00 -0.12 -3.78 105.19 107.28 1ft6 n GLY 125 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 1ft6 n GLY 125 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ft6 s GLN 126 N -0.79 4.47 -0.23 1.61 0.74 -0.59 -4.59 119.66 120.29 1ft6 s GLN 126 Ca 0.00 1.90 -0.13 0.00 0.05 0.00 0.00 55.36 57.17 1ft6 s GLN 126 Cb 0.00 -3.06 -0.04 0.00 1.10 0.00 0.00 33.01 31.01 1ft6 s GLN 126 CO 0.00 0.03 0.29 0.34 -0.55 0.00 0.00 175.29 175.39 1ft6 s ASP 127 N -0.85 6.25 -0.02 6.67 -1.08 0.34 -4.42 116.67 123.55 1ft6 s ASP 127 Ca 0.48 0.28 0.07 0.00 -0.52 0.00 0.00 52.55 52.85 1ft6 s ASP 127 Cb -0.33 -2.17 0.17 0.00 -1.46 0.00 0.00 42.92 39.13 1ft6 s ASP 127 CO 0.43 -0.04 1.14 0.49 0.52 0.00 0.00 175.17 177.71 1ft6 n PHE 128 N 4.59 0.24 -0.04 -5.34 3.72 -1.26 -4.73 117.46 114.64 1ft6 n PHE 128 Ca -0.11 -0.57 -0.07 0.00 -0.05 0.00 0.00 57.45 56.65 1ft6 n PHE 128 Cb 0.51 -0.07 -0.03 0.00 -0.94 0.00 0.00 39.48 38.95 1ft6 n PHE 128 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 176.76 178.29 1ft6 n HIS 129 N -0.22 0.00 0.00 1.38 -0.00 -1.26 -3.00 115.22 112.13 1ft6 n HIS 129 Ca 0.07 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.25 1ft6 n HIS 129 Cb 0.40 -0.29 0.00 0.00 -0.12 0.00 0.00 29.99 29.98 1ft6 n HIS 129 CO 0.00 0.00 0.00 1.19 0.46 0.00 0.00 176.34 177.99 1ft6 n PHE 130 N -3.01 0.00 -0.25 1.57 3.01 -1.26 -4.81 117.46 112.71 1ft6 n PHE 130 Ca -0.14 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.29 1ft6 n PHE 130 Cb 0.63 0.00 0.03 0.00 -0.01 0.00 0.00 39.48 40.13 1ft6 n PHE 130 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 1ft6 h GLU 131 N 0.00 -0.09 -0.62 -1.08 4.81 -1.96 -1.16 114.58 114.47 1ft6 h GLU 131 Ca 0.00 0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.30 1ft6 h GLU 131 Cb 0.00 0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.34 1ft6 h GLU 131 CO 0.00 -0.06 0.32 0.93 -0.73 0.00 0.00 179.01 179.46 1ft6 h GLU 132 N -0.10 0.56 -0.50 1.92 4.39 -1.98 0.23 114.58 119.10 1ft6 h GLU 132 Ca 0.28 -0.03 -0.03 0.00 0.34 0.00 0.00 59.36 59.92 1ft6 h GLU 132 Cb 0.56 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 29.06 1ft6 h GLU 132 CO -0.76 0.37 0.20 0.00 -1.16 0.00 0.00 179.01 177.67 1ft6 h ARG 133 N 0.58 0.74 -0.59 2.33 3.08 -1.60 -1.23 114.38 117.69 1ft6 h ARG 133 Ca 0.29 -0.13 -0.05 0.00 0.07 0.00 0.00 59.98 60.15 1ft6 h ARG 133 Cb 0.23 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.13 1ft6 h ARG 133 CO -0.21 0.65 0.15 0.00 -1.07 0.00 0.00 179.97 179.50 1ft6 h SER 135 N 0.88 0.23 0.29 0.00 0.02 -0.66 -0.47 113.55 113.84 1ft6 h SER 135 Ca 0.19 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1ft6 h SER 135 Cb 0.31 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.79 1ft6 h SER 135 CO -0.00 0.48 0.00 0.00 -1.14 0.00 0.00 176.83 176.17 1ft6 h ALA 136 N 1.55 1.00 0.00 3.77 0.00 -0.93 -1.31 119.26 123.34 1ft6 h ALA 136 Ca 0.04 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.77 1ft6 h ALA 136 Cb 0.54 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 1ft6 h ALA 136 CO 0.04 0.00 -1.49 0.00 0.00 0.00 0.00 179.25 177.79 1ft6 h HIS 138 N -0.82 0.32 -0.35 0.00 3.86 -1.12 -3.24 115.15 113.80 1ft6 h HIS 138 Ca -0.27 -0.13 -0.04 0.00 -1.16 0.00 0.00 60.37 58.77 1ft6 h HIS 138 Cb 1.14 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 29.53 1ft6 h HIS 138 CO -0.22 0.82 0.02 1.28 0.86 0.00 0.00 177.93 180.68 1ft6 n LEU 139 N -3.85 4.34 -4.15 2.43 4.77 -0.50 -4.85 117.00 115.19 1ft6 n LEU 139 Ca -0.03 -3.10 -0.43 0.00 -0.03 0.00 0.00 56.01 52.42 1ft6 n LEU 139 Cb 0.64 -0.59 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1ft6 n LEU 139 CO 0.45 0.74 1.58 -3.20 -1.33 0.00 0.00 177.39 175.63 1ft6 n ASN 140 N -0.41 5.29 -4.03 -1.43 5.15 -1.18 -4.57 115.26 114.09 1ft6 n ASN 140 Ca 0.25 -3.08 -0.09 0.00 -0.60 0.00 0.00 54.58 51.07 1ft6 n ASN 140 Cb 0.99 -1.49 -0.09 0.00 -0.53 0.00 0.00 39.78 38.66 1ft6 n ASN 140 CO 0.00 0.00 0.00 -0.72 1.40 0.00 0.00 177.26 177.94 1ft6 s TYR 141 N 0.47 0.52 0.27 1.20 -0.85 -1.26 -1.77 117.35 115.93 1ft6 s TYR 141 Ca 0.40 -0.95 -0.30 0.00 -0.52 0.00 0.00 57.07 55.69 1ft6 s TYR 141 Cb 0.03 -0.28 -0.11 0.00 0.38 0.00 0.00 41.96 41.98 1ft6 s TYR 141 CO 0.01 -0.52 1.54 -2.00 -1.52 0.00 0.00 175.55 173.06 1ft6 s GLU 142 N -3.95 4.18 -1.03 -3.49 2.12 -1.26 -2.03 118.70 113.23 1ft6 s GLU 142 Ca 0.14 2.47 0.00 0.00 0.36 0.00 0.00 54.97 57.94 1ft6 s GLU 142 Cb 0.06 -3.06 0.00 0.00 0.26 0.00 0.00 34.13 31.39 1ft6 s GLU 142 CO -0.05 -0.56 0.00 0.41 -0.54 0.00 0.00 175.26 174.52 1ft6 n GLY 143 N 2.33 1.09 3.77 -1.50 0.00 -1.26 -5.00 105.19 104.62 1ft6 n GLY 143 Ca 0.08 -0.36 -0.31 0.00 0.00 0.00 0.00 46.02 45.43 1ft6 n GLY 143 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ft6 s SER 144 N -2.69 4.36 0.61 1.61 0.15 -0.86 -4.90 113.70 111.98 1ft6 s SER 144 Ca 0.00 1.64 0.38 0.00 0.70 0.00 0.00 55.95 58.67 1ft6 s SER 144 Cb 0.00 -2.37 2.02 0.00 -1.71 0.00 0.00 66.02 63.96 1ft6 s SER 144 CO 0.00 -2.10 2.25 1.55 1.20 0.00 0.00 173.24 176.14 1ft6 h PRO 145 N -1.17 0.00 -5.98 5.44 0.13 -1.91 -3.42 132.00 125.09 1ft6 h PRO 145 Ca -0.46 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.10 1ft6 h PRO 145 Cb 1.25 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.31 1ft6 h PRO 145 CO 0.54 0.02 0.40 -0.46 -0.23 0.00 0.00 178.00 178.27 1ft6 s TRP 146 N -4.15 3.44 0.40 1.56 -0.00 -1.26 -4.96 118.94 113.96 1ft6 s TRP 146 Ca -0.04 1.29 0.38 0.00 -0.00 0.00 0.00 56.10 57.73 1ft6 s TRP 146 Cb 0.13 -3.03 1.85 0.00 -0.00 0.00 0.00 33.47 32.42 1ft6 s TRP 146 CO 0.48 -0.23 2.17 1.57 -0.00 0.00 0.00 176.95 180.94 1ft6 h LYS 147 N 7.28 0.00 -0.12 5.86 2.10 -1.94 -3.19 116.57 126.57 1ft6 h LYS 147 Ca -0.30 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.35 1ft6 h LYS 147 Cb 1.13 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.46 1ft6 h LYS 147 CO 0.84 0.02 0.00 0.41 -2.00 0.00 0.00 179.45 178.72 1ft6 n GLY 148 N -0.56 -0.24 3.71 0.07 0.00 -1.26 -4.97 105.19 101.95 1ft6 n GLY 148 Ca -0.01 -0.27 -0.43 0.00 0.00 0.00 0.00 46.02 45.31 1ft6 n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ft6 n ALA 149 N -0.11 2.10 -3.49 4.61 0.00 -1.21 -5.00 120.51 117.42 1ft6 n ALA 149 Ca 0.13 0.39 -0.16 0.00 0.00 0.00 0.00 53.44 53.81 1ft6 n ALA 149 Cb 0.20 -2.41 -0.07 0.00 0.00 0.00 0.00 19.45 17.17 1ft6 n ALA 149 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1ft6 s LYS 150 N -0.12 0.89 0.71 0.00 0.00 -1.26 -5.00 119.74 114.96 1ft6 s LYS 150 Ca 0.68 0.43 -0.16 0.00 0.00 0.00 0.00 55.97 56.93 1ft6 s LYS 150 Cb -0.55 0.42 0.03 0.00 0.00 0.00 0.00 37.83 37.72 1ft6 s LYS 150 CO 0.46 -0.22 1.21 0.00 0.00 0.00 0.00 175.35 176.80 1ft6 s ALA 151 N -0.63 2.18 0.40 0.59 0.00 -1.26 -4.44 121.76 118.60 1ft6 s ALA 151 Ca -0.07 0.91 -0.25 0.00 0.00 0.00 0.00 51.96 52.56 1ft6 s ALA 151 Cb -0.02 -3.47 -0.09 0.00 0.00 0.00 0.00 23.12 19.54 1ft6 s ALA 151 CO 0.06 -1.79 1.10 -1.25 0.00 0.00 0.00 175.76 173.87 1ft6 s PRO 152 N -3.83 4.11 0.27 0.00 0.04 -1.26 -5.17 135.00 129.17 1ft6 s PRO 152 Ca 0.75 1.65 0.01 0.00 0.04 0.00 0.00 61.00 63.45 1ft6 s PRO 152 Cb -0.30 -2.60 -0.03 0.00 0.04 0.00 0.00 34.50 31.61 1ft6 s PRO 152 CO 0.44 -0.22 0.45 0.71 0.04 0.00 0.00 177.00 178.42 1ft6 s TYR 153 N -1.55 3.48 0.18 0.56 1.51 -1.26 -4.98 117.35 115.29 1ft6 s TYR 153 Ca 0.57 0.25 -0.30 0.00 -1.01 0.00 0.00 57.07 56.58 1ft6 s TYR 153 Cb -0.26 -1.79 -0.08 0.00 -0.11 0.00 0.00 41.96 39.72 1ft6 s TYR 153 CO 0.32 0.29 1.05 -0.08 -1.11 0.00 0.00 175.55 176.02 1ft6 s THR 154 N -2.09 3.97 -0.04 -0.71 -1.32 -0.73 -4.91 115.64 109.82 1ft6 s THR 154 Ca 0.38 1.74 0.31 0.00 -1.21 0.00 0.00 61.69 62.92 1ft6 s THR 154 Cb -0.10 -4.11 0.37 0.00 -1.51 0.00 0.00 72.50 67.15 1ft6 s THR 154 CO 0.32 0.32 1.91 -0.65 -2.21 0.00 0.00 174.62 174.31 1ft6 h PRO 155 N 4.94 0.00 -4.17 7.08 0.11 -1.96 -3.41 132.00 134.60 1ft6 h PRO 155 Ca -0.44 0.00 -0.76 0.00 0.11 0.00 0.00 66.00 64.90 1ft6 h PRO 155 Cb 1.21 0.00 -0.24 0.00 0.11 0.00 0.00 31.00 32.08 1ft6 h PRO 155 CO 0.71 0.00 0.31 -0.06 -0.21 0.00 0.00 178.00 178.76 1ft6 s PHE 156 N -3.57 3.59 0.32 0.65 0.40 -1.26 -4.83 117.98 113.28 1ft6 s PHE 156 Ca 0.02 -1.83 0.10 0.00 -0.60 0.00 0.00 56.93 54.62 1ft6 s PHE 156 Cb 0.09 -3.95 -0.06 0.00 0.51 0.00 0.00 43.02 39.60 1ft6 s PHE 156 CO 0.54 -1.13 -0.13 0.95 0.70 0.00 0.00 175.22 176.15 1ft6 s THR 157 N 0.86 2.28 0.54 0.64 -4.23 -1.26 -4.90 115.64 109.58 1ft6 s THR 157 Ca 0.22 -2.27 0.30 0.00 -1.18 0.00 0.00 61.69 58.76 1ft6 s THR 157 Cb -0.08 -2.52 0.45 0.00 1.34 0.00 0.00 72.50 71.69 1ft6 s THR 157 CO -0.09 -0.27 1.92 -0.65 -0.54 0.00 0.00 174.62 174.98 1ft6 h PRO 158 N 2.12 0.00 -0.54 3.99 0.11 -1.72 0.11 132.00 136.07 1ft6 h PRO 158 Ca -0.41 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.64 1ft6 h PRO 158 Cb 1.25 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.34 1ft6 h PRO 158 CO 0.67 0.00 0.09 0.93 -0.21 0.00 0.00 178.00 179.48 1ft6 h GLU 159 N 0.00 0.90 -0.21 1.05 5.08 -1.95 -2.82 114.58 116.63 1ft6 h GLU 159 Ca 0.36 -0.24 -0.04 0.00 -1.00 0.00 0.00 59.36 58.44 1ft6 h GLU 159 Cb 1.48 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.62 1ft6 h GLU 159 CO -0.00 0.86 -0.04 0.28 -1.00 0.00 0.00 179.01 179.12 1ft6 h VAL 160 N 0.78 1.28 -1.88 3.13 2.07 -1.14 -3.45 116.25 117.04 1ft6 h VAL 160 Ca 0.17 -0.99 0.02 0.00 0.82 0.00 0.00 66.70 66.72 1ft6 h VAL 160 Cb 0.40 1.50 -0.23 0.00 -1.52 0.00 0.00 31.29 31.45 1ft6 h VAL 160 CO 0.01 0.30 0.15 -0.62 0.02 0.00 0.00 177.57 177.44 1ft6 s ASP 161 N -5.96 -0.77 0.62 0.57 -1.08 -0.63 -5.01 116.67 104.40 1ft6 s ASP 161 Ca -0.14 1.32 0.34 0.00 -0.52 0.00 0.00 52.55 53.55 1ft6 s ASP 161 Cb 0.07 1.33 2.01 0.00 -1.46 0.00 0.00 42.92 44.86 1ft6 s ASP 161 CO 0.74 -0.21 2.28 0.00 0.52 0.00 0.00 175.17 178.50 1ft6 h ALA 162 N 6.03 1.38 0.00 3.66 0.00 -1.81 -0.87 119.26 127.65 1ft6 h ALA 162 Ca -0.29 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 1ft6 h ALA 162 Cb 1.20 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 1ft6 h ALA 162 CO 0.13 -0.03 -0.02 1.57 0.00 0.00 0.00 179.25 180.91 1ft6 h LYS 163 N 0.00 0.00 -0.94 0.00 2.10 -1.92 -2.55 116.57 113.26 1ft6 h LYS 163 Ca 0.01 0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 58.61 1ft6 h LYS 163 Cb 0.05 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.35 1ft6 h LYS 163 CO -0.00 0.02 0.06 0.66 -2.00 0.00 0.00 179.45 178.19 1ft6 n TYR 164 N -3.21 0.59 -2.95 0.07 0.53 -0.33 -4.83 117.16 107.02 1ft6 n TYR 164 Ca -0.02 -0.43 -0.41 0.00 -1.02 0.00 0.00 57.90 56.02 1ft6 n TYR 164 Cb 0.16 -0.28 -0.05 0.00 -1.03 0.00 0.00 39.34 38.14 1ft6 n TYR 164 CO 0.00 0.00 0.00 0.99 -1.02 0.00 0.00 176.86 176.83 1ft6 s THR 165 N -1.16 4.88 -0.23 -0.72 2.01 -0.96 -4.15 115.64 115.31 1ft6 s THR 165 Ca 0.13 1.45 -0.08 0.00 0.31 0.00 0.00 61.69 63.51 1ft6 s THR 165 Cb 0.10 -4.07 -0.04 0.00 0.01 0.00 0.00 72.50 68.51 1ft6 s THR 165 CO 0.03 -0.03 0.08 0.12 -0.69 0.00 0.00 174.62 174.13 1ft6 s PHE 166 N 2.67 3.16 -0.18 4.92 5.36 -1.26 -5.07 117.98 127.58 1ft6 s PHE 166 Ca 0.33 -0.16 0.00 0.00 -0.96 0.00 0.00 56.93 56.14 1ft6 s PHE 166 Cb -0.15 -2.20 0.04 0.00 -0.34 0.00 0.00 43.02 40.37 1ft6 s PHE 166 CO 0.08 -0.14 -0.09 0.21 -1.46 0.00 0.00 175.22 173.82 1ft6 s LYS 167 N 1.17 1.81 0.17 10.12 2.47 -1.26 -5.02 119.74 129.20 1ft6 s LYS 167 Ca 0.05 -0.67 -0.18 0.00 -1.56 0.00 0.00 55.97 53.61 1ft6 s LYS 167 Cb -0.14 -2.20 0.10 0.00 -1.46 0.00 0.00 37.83 34.12 1ft6 s LYS 167 CO 0.04 -0.41 1.66 0.35 0.16 0.00 0.00 175.35 177.15 1ft6 h PHE 168 N 8.04 -0.31 0.00 4.03 3.57 -1.98 -0.04 116.94 130.25 1ft6 h PHE 168 Ca -0.27 0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.26 1ft6 h PHE 168 Cb 1.11 0.20 -0.00 0.00 2.79 0.00 0.00 35.95 40.05 1ft6 h PHE 168 CO 0.48 -0.21 -0.02 -0.44 -2.23 0.00 0.00 178.31 175.89 1ft6 h ASP 169 N -0.05 0.00 0.00 0.41 3.32 -2.00 -1.06 116.42 117.04 1ft6 h ASP 169 Ca 0.19 0.00 -0.29 0.00 0.02 0.00 0.00 57.03 56.96 1ft6 h ASP 169 Cb 0.34 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.85 1ft6 h ASP 169 CO -0.43 0.02 -1.56 -0.62 -1.72 0.00 0.00 179.24 174.93 1ft6 n GLU 170 N -3.40 0.57 0.09 3.56 -0.58 -0.65 -4.42 120.64 115.81 1ft6 n GLU 170 Ca -0.03 0.50 0.01 0.00 -0.42 0.00 0.00 57.16 57.23 1ft6 n GLU 170 Cb 0.11 -1.69 0.33 0.00 -0.57 0.00 0.00 31.44 29.62 1ft6 n GLU 170 CO 0.00 0.00 0.00 0.52 -0.48 0.00 0.00 177.13 177.17 1ft6 h MET 171 N -0.99 0.29 0.00 3.49 2.86 -0.85 -2.17 114.93 117.56 1ft6 h MET 171 Ca -0.43 -0.08 0.00 0.00 -2.06 0.00 0.00 59.70 57.13 1ft6 h MET 171 Cb 1.38 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 33.01 1ft6 h MET 171 CO -0.26 0.48 0.00 -0.24 1.06 0.00 0.00 176.91 177.95 1ft6 h VAL 172 N 0.27 0.00 -0.67 -2.22 3.04 -1.42 -0.49 116.25 114.75 1ft6 h VAL 172 Ca 0.05 -0.21 0.00 0.00 -1.01 0.00 0.00 66.70 65.53 1ft6 h VAL 172 Cb 0.49 1.03 0.00 0.00 -2.01 0.00 0.00 31.29 30.81 1ft6 h VAL 172 CO 0.03 0.00 0.00 0.29 -1.01 0.00 0.00 177.57 176.88 1ft6 n LYS 173 N -2.70 3.06 -2.39 4.17 5.02 -0.82 -4.86 118.16 119.63 1ft6 n LYS 173 Ca -0.00 -2.69 -0.37 0.00 -2.02 0.00 0.00 58.31 53.23 1ft6 n LYS 173 Cb 0.17 -1.65 -0.03 0.00 -0.02 0.00 0.00 35.03 33.50 1ft6 n LYS 173 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1ft6 s GLU 174 N -1.29 3.34 0.63 1.97 2.56 -0.20 -4.83 118.70 120.89 1ft6 s GLU 174 Ca 0.47 -1.21 0.28 0.00 0.00 0.00 0.00 54.97 54.52 1ft6 s GLU 174 Cb 0.27 -5.34 1.50 0.00 2.00 0.00 0.00 34.13 32.57 1ft6 s GLU 174 CO 0.29 -2.71 1.88 -0.39 -0.56 0.00 0.00 175.26 173.77 1ft6 h VAL 175 N 6.46 0.17 0.00 3.70 -1.51 -1.87 0.15 116.25 123.35 1ft6 h VAL 175 Ca 0.25 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.72 1ft6 h VAL 175 Cb 0.96 0.62 0.00 0.00 -2.13 0.00 0.00 31.29 30.74 1ft6 h VAL 175 CO 1.37 0.00 0.00 0.29 -1.23 0.00 0.00 177.57 178.00 1ft6 n LYS 176 N -3.27 0.17 0.00 5.19 5.02 -1.26 -4.20 118.16 119.81 1ft6 n LYS 176 Ca 0.03 0.15 0.00 0.00 -2.02 0.00 0.00 58.31 56.47 1ft6 n LYS 176 Cb 0.54 -1.70 0.00 0.00 -0.02 0.00 0.00 35.03 33.85 1ft6 n LYS 176 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ft6 n ALA 177 N -1.68 0.86 -2.71 7.82 0.00 0.46 -4.84 120.51 120.42 1ft6 n ALA 177 Ca 0.06 -0.14 -0.27 0.00 0.00 0.00 0.00 53.44 53.09 1ft6 n ALA 177 Cb 0.39 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.77 1ft6 n ALA 177 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1ft6 s MET 178 N -0.09 2.57 0.50 0.00 -1.94 -0.68 -4.55 119.30 115.11 1ft6 s MET 178 Ca 0.00 -1.01 -0.22 0.00 -1.71 0.00 0.00 55.69 52.75 1ft6 s MET 178 Cb 0.00 -2.46 -0.06 0.00 2.01 0.00 0.00 34.83 34.31 1ft6 s MET 178 CO 0.00 0.47 1.20 -3.38 -0.01 0.00 0.00 175.02 173.31 1ft6 s HIS 179 N -1.71 2.69 0.72 -0.03 -3.43 -1.26 -4.81 115.29 107.46 1ft6 s HIS 179 Ca 0.28 1.50 -0.16 0.00 -0.80 0.00 0.00 55.06 55.89 1ft6 s HIS 179 Cb -0.10 -3.47 0.01 0.00 -1.43 0.00 0.00 32.58 27.59 1ft6 s HIS 179 CO 0.20 -1.86 0.97 -1.91 -2.00 0.00 0.00 174.74 170.14 1ft6 n GLU 180 N -0.78 0.50 -3.97 -0.38 4.07 -1.26 -4.99 120.64 113.83 1ft6 n GLU 180 Ca 0.09 0.23 -0.36 0.00 -0.06 0.00 0.00 57.16 57.05 1ft6 n GLU 180 Cb 0.48 -2.22 -0.07 0.00 -0.06 0.00 0.00 31.44 29.57 1ft6 n GLU 180 CO 0.00 0.00 0.00 -1.01 -0.06 0.00 0.00 177.13 176.06 1ft6 s HIS 181 N -1.82 3.52 0.12 4.31 3.76 -1.26 -4.79 115.29 119.12 1ft6 s HIS 181 Ca 0.73 0.46 0.09 0.00 -0.15 0.00 0.00 55.06 56.20 1ft6 s HIS 181 Cb -0.34 -1.91 -0.04 0.00 1.11 0.00 0.00 32.58 31.40 1ft6 s HIS 181 CO 0.50 0.69 -0.23 0.71 -0.85 0.00 0.00 174.74 175.56 1ft6 s TYR 182 N -1.02 2.01 0.35 1.40 1.51 -1.26 -1.40 117.35 118.93 1ft6 s TYR 182 Ca 0.15 -0.40 -0.29 0.00 -1.01 0.00 0.00 57.07 55.52 1ft6 s TYR 182 Cb -0.12 -1.09 -0.11 0.00 -0.11 0.00 0.00 41.96 40.53 1ft6 s TYR 182 CO 0.04 0.27 1.52 0.21 -1.11 0.00 0.00 175.55 176.48 1ft6 s LYS 183 N -1.99 4.11 0.10 -0.62 2.47 -0.20 -4.84 119.74 118.77 1ft6 s LYS 183 Ca 0.10 2.57 0.01 0.00 -1.56 0.00 0.00 55.97 57.09 1ft6 s LYS 183 Cb -0.10 -2.99 -0.04 0.00 -1.46 0.00 0.00 37.83 33.25 1ft6 s LYS 183 CO 0.05 -0.57 0.25 -0.51 0.16 0.00 0.00 175.35 174.73 1ft6 s LEU 184 N -1.55 4.35 0.32 5.43 1.43 -1.26 -4.46 118.68 122.94 1ft6 s LEU 184 Ca 0.56 0.24 0.17 0.00 -1.03 0.00 0.00 54.13 54.07 1ft6 s LEU 184 Cb -0.47 -2.95 0.24 0.00 0.03 0.00 0.00 46.19 43.04 1ft6 s LEU 184 CO 0.58 0.11 1.53 -0.33 0.23 0.00 0.00 176.35 178.47 1ft6 h GLU 185 N 2.64 0.00 0.00 1.70 4.39 -2.00 -3.48 114.58 117.83 1ft6 h GLU 185 Ca -0.47 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.23 1ft6 h GLU 185 Cb 1.18 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.83 1ft6 h GLU 185 CO 0.73 0.40 0.00 0.41 -1.16 0.00 0.00 179.01 179.39 1ft6 n GLY 186 N 1.02 1.78 0.29 -3.84 0.00 -1.26 -5.02 105.19 98.15 1ft6 n GLY 186 Ca 0.02 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.04 1ft6 n GLY 186 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1ft6 h VAL 187 N 0.00 0.98 -2.99 1.61 2.07 -1.92 -3.43 116.25 112.57 1ft6 h VAL 187 Ca 0.00 -0.27 -0.62 0.00 0.82 0.00 0.00 66.70 66.62 1ft6 h VAL 187 Cb 0.00 0.12 -0.06 0.00 -1.52 0.00 0.00 31.29 29.83 1ft6 h VAL 187 CO 0.00 0.14 -0.53 -0.36 0.02 0.00 0.00 177.57 176.84 1ft6 s PHE 188 N -6.07 3.41 0.21 1.57 0.40 -1.26 -1.03 117.98 115.21 1ft6 s PHE 188 Ca -0.13 0.19 -0.12 0.00 -0.60 0.00 0.00 56.93 56.27 1ft6 s PHE 188 Cb 0.17 -1.71 -0.00 0.00 0.51 0.00 0.00 43.02 41.99 1ft6 s PHE 188 CO 0.77 0.57 0.42 -1.83 0.70 0.00 0.00 175.22 175.84 1ft6 s GLU 189 N -2.49 1.38 0.15 0.44 4.04 -0.61 -4.90 118.70 116.70 1ft6 s GLU 189 Ca 0.33 -1.16 0.00 0.00 0.04 0.00 0.00 54.97 54.18 1ft6 s GLU 189 Cb -0.13 0.45 0.00 0.00 0.02 0.00 0.00 34.13 34.47 1ft6 s GLU 189 CO 0.26 -0.55 0.00 0.41 -1.84 0.00 0.00 175.26 173.54 1ft6 n GLY 190 N -0.32 -2.43 3.89 -3.83 0.00 -1.26 -0.25 105.19 100.99 1ft6 n GLY 190 Ca -0.05 -1.59 -0.29 0.00 0.00 0.00 0.00 46.02 44.09 1ft6 n GLY 190 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ft6 s GLU 191 N -0.84 3.66 0.14 1.61 0.41 -1.26 -4.05 118.70 118.37 1ft6 s GLU 191 Ca 0.00 0.37 -0.30 0.00 -0.41 0.00 0.00 54.97 54.63 1ft6 s GLU 191 Cb 0.00 -2.36 -0.06 0.00 -1.78 0.00 0.00 34.13 29.93 1ft6 s GLU 191 CO 0.00 -0.15 0.99 -1.25 -0.49 0.00 0.00 175.26 174.36 1ft6 s PRO 192 N -4.35 4.69 -0.06 0.39 0.04 -1.26 -2.77 135.00 131.67 1ft6 s PRO 192 Ca 0.50 1.52 0.05 0.00 0.04 0.00 0.00 61.00 63.11 1ft6 s PRO 192 Cb -0.10 -3.35 -0.01 0.00 0.04 0.00 0.00 34.50 31.08 1ft6 s PRO 192 CO 0.39 0.20 -0.23 0.21 0.04 0.00 0.00 177.00 177.61 1ft6 s LYS 193 N -0.17 2.50 0.28 4.56 2.20 -1.26 -4.84 119.74 123.01 1ft6 s LYS 193 Ca 0.47 -0.84 -0.30 0.00 -0.36 0.00 0.00 55.97 54.95 1ft6 s LYS 193 Cb -0.25 -2.07 -0.13 0.00 -1.51 0.00 0.00 37.83 33.87 1ft6 s LYS 193 CO 0.31 0.31 1.29 0.34 -0.36 0.00 0.00 175.35 177.24 1ft6 n PHE 194 N 3.12 2.02 0.25 4.03 -0.00 -1.16 -4.86 117.46 120.85 1ft6 n PHE 194 Ca -0.18 0.53 0.17 0.00 -0.00 0.00 0.00 57.45 57.97 1ft6 n PHE 194 Cb 0.52 -2.40 0.88 0.00 -0.00 0.00 0.00 39.48 38.48 1ft6 n PHE 194 CO 0.00 0.00 0.00 1.57 -0.00 0.00 0.00 176.76 178.33 1ft6 h LYS 195 N 3.28 0.00 -0.42 -4.13 2.10 -1.94 -1.70 116.57 113.76 1ft6 h LYS 195 Ca -0.44 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.21 1ft6 h LYS 195 Cb 1.29 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.62 1ft6 h LYS 195 CO 0.69 0.00 0.00 1.19 -2.00 0.00 0.00 179.45 179.33 1ft6 n PHE 196 N -3.69 0.69 0.10 0.07 0.99 -1.26 -4.72 117.46 109.64 1ft6 n PHE 196 Ca -0.00 -0.55 -0.12 0.00 -0.00 0.00 0.00 57.45 56.77 1ft6 n PHE 196 Cb 0.25 -0.08 -0.06 0.00 -1.00 0.00 0.00 39.48 38.60 1ft6 n PHE 196 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.76 178.01 1ft6 h HIS 197 N 2.52 -0.39 -0.71 1.38 2.76 -1.66 0.61 115.15 119.66 1ft6 h HIS 197 Ca 0.00 0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.13 1ft6 h HIS 197 Cb 0.92 0.16 -0.03 0.00 1.55 0.00 0.00 27.41 30.01 1ft6 h HIS 197 CO 0.35 -0.23 0.28 -0.44 -1.30 0.00 0.00 177.93 176.59 1ft6 h ASP 198 N -0.30 0.98 -0.35 3.26 3.32 -1.84 0.12 116.42 121.61 1ft6 h ASP 198 Ca 0.02 -0.18 0.02 0.00 0.02 0.00 0.00 57.03 56.91 1ft6 h ASP 198 Cb 0.31 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.58 1ft6 h ASP 198 CO -0.08 0.89 0.19 -0.08 -1.72 0.00 0.00 179.24 178.45 1ft6 h GLU 199 N 1.01 0.38 -0.34 3.56 4.81 -1.83 0.70 114.58 122.88 1ft6 h GLU 199 Ca 0.24 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 59.35 1ft6 h GLU 199 Cb 0.22 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.50 1ft6 h GLU 199 CO -0.02 0.25 -0.16 0.74 -0.73 0.00 0.00 179.01 179.10 1ft6 h PHE 200 N 0.40 0.67 -0.05 0.92 0.05 -0.52 -2.73 116.94 115.68 1ft6 h PHE 200 Ca 0.14 -0.12 -0.17 0.00 3.82 0.00 0.00 57.97 61.64 1ft6 h PHE 200 Cb 0.03 -0.17 -0.01 0.00 2.00 0.00 0.00 35.95 37.80 1ft6 h PHE 200 CO -0.09 0.73 -0.73 1.96 -0.18 0.00 0.00 178.31 180.01 1ft6 h GLN 201 N 0.55 0.28 -0.14 1.51 1.08 -0.56 -0.81 115.11 117.03 1ft6 h GLN 201 Ca 0.09 -0.24 -0.08 0.00 -1.45 0.00 0.00 58.65 56.98 1ft6 h GLN 201 Cb 0.59 0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 28.05 1ft6 h GLN 201 CO 0.04 0.89 -0.28 0.00 -0.95 0.00 0.00 178.83 178.54 1ft6 h ALA 202 N 1.04 1.27 -0.22 3.87 0.00 -0.70 -2.66 119.26 121.86 1ft6 h ALA 202 Ca -0.03 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1ft6 h ALA 202 Cb 1.29 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1ft6 h ALA 202 CO 0.12 0.49 0.00 0.43 0.00 0.00 0.00 179.25 180.29 1ft6 n SER 203 N -4.14 3.09 -4.75 0.00 7.64 -1.04 -5.01 113.62 109.41 1ft6 n SER 203 Ca -0.01 -1.96 -0.34 0.00 1.01 0.00 0.00 58.87 57.57 1ft6 n SER 203 Cb 0.38 -0.14 0.06 0.00 -1.01 0.00 0.00 64.21 63.51 1ft6 n SER 203 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ft6 s ALA 204 N -1.73 2.36 0.45 -0.43 0.00 -0.32 -5.02 121.76 117.07 1ft6 s ALA 204 Ca 0.34 0.84 -0.21 0.00 0.00 0.00 0.00 51.96 52.93 1ft6 s ALA 204 Cb 0.21 -3.42 -0.10 0.00 0.00 0.00 0.00 23.12 19.81 1ft6 s ALA 204 CO 0.31 -1.47 1.00 0.15 0.00 0.00 0.00 175.76 175.75 1ft6 s LYS 205 N -3.75 4.04 0.44 0.00 3.01 -0.49 -4.68 119.74 118.31 1ft6 s LYS 205 Ca 0.73 1.27 -0.26 0.00 -1.01 0.00 0.00 55.97 56.71 1ft6 s LYS 205 Cb -0.27 -2.20 -0.09 0.00 -1.01 0.00 0.00 37.83 34.27 1ft6 s LYS 205 CO 0.40 -0.21 1.45 -2.30 0.51 0.00 0.00 175.35 175.20 1ft6 n PRO 206 N -0.69 2.34 0.07 -1.68 -0.02 -1.26 -1.04 135.00 132.72 1ft6 n PRO 206 Ca 0.08 0.83 0.04 0.00 -2.02 0.00 0.00 63.50 62.43 1ft6 n PRO 206 Cb 0.53 -2.65 0.21 0.00 -0.02 0.00 0.00 33.50 31.56 1ft6 n PRO 206 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ft6 n ALA 207 N -0.11 0.81 -0.50 3.55 0.00 -1.26 -4.71 120.51 118.28 1ft6 n ALA 207 Ca 0.04 0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1ft6 n ALA 207 Cb 0.41 -0.90 0.00 0.00 0.00 0.00 0.00 19.45 18.96 1ft6 n ALA 207 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13