#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i08 s TYR 2 N 0.00 3.67 -0.09 7.33 2.02 -1.26 -5.07 117.35 123.94 1i08 s TYR 2 Ca 0.00 1.27 -0.00 0.00 -0.37 0.00 0.00 57.07 57.97 1i08 s TYR 2 Cb 0.00 -2.52 -0.03 0.00 -0.40 0.00 0.00 41.96 39.01 1i08 s TYR 2 CO 0.00 0.41 -0.07 0.99 -1.57 0.00 0.00 175.55 175.32 1i08 s THR 3 N -1.42 3.68 -0.11 -0.71 2.01 -1.26 -4.99 115.64 112.84 1i08 s THR 3 Ca 0.39 -0.47 -0.29 0.00 0.31 0.00 0.00 61.69 61.62 1i08 s THR 3 Cb -0.17 -2.53 -0.05 0.00 0.01 0.00 0.00 72.50 69.76 1i08 s THR 3 CO 0.20 0.57 1.68 -0.22 -0.69 0.00 0.00 174.62 176.16 1i08 s LEU 4 N -0.46 4.16 0.45 4.42 2.96 -1.26 -4.96 118.68 123.99 1i08 s LEU 4 Ca 0.07 2.05 -0.22 0.00 -0.22 0.00 0.00 54.13 55.81 1i08 s LEU 4 Cb -0.12 -3.53 -0.08 0.00 0.50 0.00 0.00 46.19 42.96 1i08 s LEU 4 CO 0.02 -1.08 1.08 -2.16 -1.32 0.00 0.00 176.35 172.90 1i08 s PRO 5 N 4.35 3.87 0.44 0.98 0.04 -1.26 -5.02 135.00 138.40 1i08 s PRO 5 Ca 0.75 1.55 -0.15 0.00 0.04 0.00 0.00 61.00 63.18 1i08 s PRO 5 Cb -0.31 -2.32 -0.08 0.00 0.04 0.00 0.00 34.50 31.83 1i08 s PRO 5 CO 0.30 -0.41 0.88 -1.54 0.04 0.00 0.00 177.00 176.27 1i08 s SER 6 N -1.65 6.65 0.35 6.66 1.04 -1.26 -5.03 113.70 120.46 1i08 s SER 6 Ca 0.64 1.41 -0.27 0.00 0.48 0.00 0.00 55.95 58.21 1i08 s SER 6 Cb -0.22 -2.44 -0.09 0.00 0.10 0.00 0.00 66.02 63.37 1i08 s SER 6 CO 0.27 -0.45 1.12 -0.76 0.98 0.00 0.00 173.24 174.40 1i08 s LEU 7 N -3.75 4.34 0.00 2.42 1.43 -1.26 -4.91 118.68 116.94 1i08 s LEU 7 Ca 0.56 2.27 0.00 0.00 -1.03 0.00 0.00 54.13 55.93 1i08 s LEU 7 Cb -0.10 -3.88 0.00 0.00 0.03 0.00 0.00 46.19 42.24 1i08 s LEU 7 CO 0.27 -0.41 0.79 -0.81 0.23 0.00 0.00 176.35 176.42 1i08 n PRO 8 N 0.53 0.99 -3.85 1.29 -0.04 -1.26 -4.83 135.00 127.83 1i08 n PRO 8 Ca 0.02 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.41 1i08 n PRO 8 Cb 0.46 -1.20 -0.02 0.00 -0.04 0.00 0.00 33.50 32.70 1i08 n PRO 8 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1i08 s TYR 9 N -1.59 -0.17 0.81 0.54 -0.85 -1.26 -5.16 117.35 109.67 1i08 s TYR 9 Ca 0.00 -0.27 -0.11 0.00 -0.52 0.00 0.00 57.07 56.16 1i08 s TYR 9 Cb 0.00 0.67 0.08 0.00 0.38 0.00 0.00 41.96 43.09 1i08 s TYR 9 CO 0.00 -1.21 1.13 0.00 -1.52 0.00 0.00 175.55 173.95 1i08 s ALA 10 N -3.92 1.98 -0.30 9.51 0.00 -1.26 -4.90 121.76 122.87 1i08 s ALA 10 Ca 0.11 0.50 0.26 0.00 0.00 0.00 0.00 51.96 52.83 1i08 s ALA 10 Cb -0.05 -3.37 1.13 0.00 0.00 0.00 0.00 23.12 20.82 1i08 s ALA 10 CO 0.06 -2.09 1.78 1.88 0.00 0.00 0.00 175.76 177.39 1i08 h TYR 11 N -1.16 0.00 -0.31 0.00 0.05 -1.98 -2.10 116.97 111.47 1i08 h TYR 11 Ca -0.44 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.34 1i08 h TYR 11 Cb 1.25 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.99 1i08 h TYR 11 CO 0.53 0.00 0.00 -0.40 -1.05 0.00 0.00 178.16 177.24 1i08 n ASP 12 N -2.42 2.99 0.13 3.88 5.75 -1.26 -4.09 116.55 121.54 1i08 n ASP 12 Ca 0.01 -2.14 0.11 0.00 -0.01 0.00 0.00 54.79 52.76 1i08 n ASP 12 Cb 0.21 -0.26 0.51 0.00 -1.03 0.00 0.00 41.12 40.55 1i08 n ASP 12 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1i08 n ALA 13 N 0.30 1.42 0.62 2.12 0.00 -0.79 -2.20 120.51 121.97 1i08 n ALA 13 Ca 0.12 0.12 0.10 0.00 0.00 0.00 0.00 53.44 53.79 1i08 n ALA 13 Cb 0.48 -1.35 0.13 0.00 0.00 0.00 0.00 19.45 18.71 1i08 n ALA 13 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1i08 n LEU 14 N -2.20 2.93 -4.75 0.00 4.77 -1.26 -4.73 117.00 111.76 1i08 n LEU 14 Ca 0.01 -1.20 -0.36 0.00 -0.03 0.00 0.00 56.01 54.43 1i08 n LEU 14 Cb 0.15 -0.09 0.05 0.00 -2.33 0.00 0.00 43.42 41.20 1i08 n LEU 14 CO 0.15 0.56 0.83 -1.61 -1.33 0.00 0.00 177.39 176.00 1i08 s GLU 15 N -1.58 2.75 -0.14 3.23 0.41 -0.94 -1.31 118.70 121.13 1i08 s GLU 15 Ca 0.28 1.81 0.09 0.00 -0.41 0.00 0.00 54.97 56.74 1i08 s GLU 15 Cb 0.18 -1.90 0.51 0.00 -1.78 0.00 0.00 34.13 31.14 1i08 s GLU 15 CO 0.27 -1.38 1.29 -0.35 -0.49 0.00 0.00 175.26 174.60 1i08 n PRO 16 N -1.90 3.36 -0.05 0.39 -0.04 -1.26 -4.89 135.00 130.61 1i08 n PRO 16 Ca 0.14 -1.96 -0.01 0.00 -0.04 0.00 0.00 63.50 61.63 1i08 n PRO 16 Cb 0.50 -1.94 -0.00 0.00 -0.04 0.00 0.00 33.50 32.01 1i08 n PRO 16 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1i08 h HIS 17 N 2.53 0.00 -3.36 0.54 3.86 -1.57 -3.45 115.15 113.70 1i08 h HIS 17 Ca 0.00 0.00 -0.63 0.00 -1.16 0.00 0.00 60.37 58.58 1i08 h HIS 17 Cb 1.37 0.00 -0.19 0.00 1.06 0.00 0.00 27.41 29.65 1i08 h HIS 17 CO 0.66 0.00 -0.62 -0.06 0.86 0.00 0.00 177.93 178.78 1i08 s PHE 18 N -1.65 3.13 0.39 2.45 0.40 -0.91 -4.99 117.98 116.79 1i08 s PHE 18 Ca -0.04 -0.17 -0.26 0.00 -0.60 0.00 0.00 56.93 55.86 1i08 s PHE 18 Cb 0.01 -2.06 -0.09 0.00 0.51 0.00 0.00 43.02 41.39 1i08 s PHE 18 CO 0.05 -0.02 1.18 0.16 0.70 0.00 0.00 175.22 177.30 1i08 s ASP 19 N 0.59 6.59 0.21 1.36 -4.77 -1.26 -3.43 116.67 115.96 1i08 s ASP 19 Ca 0.01 2.38 -0.10 0.00 -3.30 0.00 0.00 52.55 51.55 1i08 s ASP 19 Cb -0.14 -2.62 0.19 0.00 -1.09 0.00 0.00 42.92 39.27 1i08 s ASP 19 CO 0.02 -0.63 1.86 0.50 0.70 0.00 0.00 175.17 177.62 1i08 h LYS 20 N 2.79 0.92 -0.26 2.11 3.64 -1.93 -2.23 116.57 121.60 1i08 h LYS 20 Ca -0.49 -0.06 0.03 0.00 -1.27 0.00 0.00 60.65 58.87 1i08 h LYS 20 Cb 1.23 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.81 1i08 h LYS 20 CO 0.63 0.61 0.07 0.37 -2.27 0.00 0.00 179.45 178.86 1i08 h GLN 21 N 0.95 0.18 -0.36 1.90 4.15 -1.93 -1.44 115.11 118.55 1i08 h GLN 21 Ca 0.29 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.69 1i08 h GLN 21 Cb -0.02 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.61 1i08 h GLN 21 CO -0.09 0.12 0.18 1.15 -1.93 0.00 0.00 178.83 178.26 1i08 h THR 22 N 0.18 1.16 -0.57 2.39 2.02 -1.90 -2.07 112.91 114.12 1i08 h THR 22 Ca 0.12 -0.44 0.09 0.00 0.77 0.00 0.00 66.41 66.94 1i08 h THR 22 Cb 0.10 0.79 -0.07 0.00 -1.74 0.00 0.00 68.15 67.23 1i08 h THR 22 CO -0.14 0.17 0.20 0.24 0.37 0.00 0.00 175.52 176.36 1i08 h MET 23 N 0.45 0.36 -0.08 6.66 2.86 -1.05 0.25 114.93 124.39 1i08 h MET 23 Ca 0.13 -0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 57.74 1i08 h MET 23 Cb 0.10 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 31.68 1i08 h MET 23 CO -0.02 0.24 0.03 1.49 1.06 0.00 0.00 176.91 179.71 1i08 h GLU 24 N 0.37 0.12 -0.30 1.72 4.81 -1.04 -1.72 114.58 118.53 1i08 h GLU 24 Ca 0.29 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.44 1i08 h GLU 24 Cb 0.35 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 1i08 h GLU 24 CO -0.30 0.25 -0.02 0.82 -0.73 0.00 0.00 179.01 179.03 1i08 h ILE 25 N -0.03 1.27 -0.91 2.32 2.04 -1.06 -0.51 117.51 120.62 1i08 h ILE 25 Ca 0.03 -1.00 0.06 0.00 1.00 0.00 0.00 64.86 64.95 1i08 h ILE 25 Cb 0.17 1.31 -0.06 0.00 -0.74 0.00 0.00 36.82 37.50 1i08 h ILE 25 CO -0.00 0.32 0.57 -0.74 0.00 0.00 0.00 178.15 178.30 1i08 h HIS 26 N 0.34 1.06 0.00 1.37 2.76 -0.49 -0.26 115.15 119.92 1i08 h HIS 26 Ca 0.08 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.28 1i08 h HIS 26 Cb 0.47 -0.34 -0.00 0.00 1.55 0.00 0.00 27.41 29.09 1i08 h HIS 26 CO 0.04 0.54 -0.01 1.25 -1.30 0.00 0.00 177.93 178.46 1i08 h HIS 27 N 1.04 0.00 0.00 5.26 -0.00 -1.22 -1.39 115.15 118.84 1i08 h HIS 27 Ca 0.39 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.76 1i08 h HIS 27 Cb 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.58 1i08 h HIS 27 CO -0.02 0.15 0.00 1.79 -0.00 0.00 0.00 177.93 179.85 1i08 h THR 28 N -1.00 0.00 0.00 6.26 1.35 -1.14 -3.05 112.91 115.32 1i08 h THR 28 Ca -0.00 -0.62 0.00 0.00 -0.55 0.00 0.00 66.41 65.24 1i08 h THR 28 Cb 0.16 1.59 0.00 0.00 -1.73 0.00 0.00 68.15 68.16 1i08 h THR 28 CO -0.00 0.00 -0.31 0.29 -0.25 0.00 0.00 175.52 175.25 1i08 n LYS 29 N -2.92 0.16 0.33 4.72 4.76 -0.15 -4.45 118.16 120.62 1i08 n LYS 29 Ca 0.02 0.06 -0.17 0.00 -2.87 0.00 0.00 58.31 55.36 1i08 n LYS 29 Cb 0.37 -0.70 -0.09 0.00 -1.84 0.00 0.00 35.03 32.78 1i08 n LYS 29 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1i08 h ALA 30 N -0.60 -0.82 -0.71 7.82 0.00 -1.44 -1.63 119.26 121.88 1i08 h ALA 30 Ca 0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1i08 h ALA 30 Cb 0.31 0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 1i08 h ALA 30 CO 0.00 -0.92 0.40 1.25 0.00 0.00 0.00 179.25 179.98 1i08 h HIS 31 N -0.91 0.97 -0.74 0.00 -0.00 -1.30 -2.39 115.15 110.79 1i08 h HIS 31 Ca -0.08 -0.02 0.10 0.00 -0.00 0.00 0.00 60.37 60.37 1i08 h HIS 31 Cb 0.66 -0.31 -0.08 0.00 -0.00 0.00 0.00 27.41 27.68 1i08 h HIS 31 CO -0.02 0.68 0.36 0.37 -0.00 0.00 0.00 177.93 179.32 1i08 h GLN 32 N 0.98 0.58 -0.68 5.26 5.75 -1.48 -1.84 115.11 123.67 1i08 h GLN 32 Ca 0.25 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.70 1i08 h GLN 32 Cb 0.02 -0.13 -0.03 0.00 1.07 0.00 0.00 27.48 28.41 1i08 h GLN 32 CO -0.04 0.38 0.38 1.15 -2.65 0.00 0.00 178.83 178.05 1i08 h THR 33 N 0.60 1.21 -0.75 2.39 2.02 -0.78 -0.42 112.91 117.18 1i08 h THR 33 Ca 0.37 -0.53 -0.02 0.00 0.77 0.00 0.00 66.41 67.00 1i08 h THR 33 Cb 0.43 0.31 -0.03 0.00 -1.74 0.00 0.00 68.15 67.12 1i08 h THR 33 CO -0.29 0.23 0.39 1.88 0.37 0.00 0.00 175.52 178.10 1i08 h TYR 34 N 0.94 1.05 -0.31 3.16 0.05 -1.15 -0.69 116.97 120.00 1i08 h TYR 34 Ca 0.24 -0.04 -0.01 0.00 0.05 0.00 0.00 58.73 58.97 1i08 h TYR 34 Cb 0.04 -0.33 -0.01 0.00 1.01 0.00 0.00 36.73 37.43 1i08 h TYR 34 CO -0.01 0.75 0.15 0.28 -1.05 0.00 0.00 178.16 178.29 1i08 h VAL 35 N 1.04 1.15 -0.02 -2.88 2.07 -0.93 -0.01 116.25 116.68 1i08 h VAL 35 Ca 0.26 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1i08 h VAL 35 Cb 0.07 0.87 -0.00 0.00 -1.52 0.00 0.00 31.29 30.71 1i08 h VAL 35 CO -0.04 0.16 -0.00 0.78 0.02 0.00 0.00 177.57 178.49 1i08 h ASN 36 N 0.37 -0.02 -0.67 0.57 2.35 -0.69 -0.73 115.58 116.76 1i08 h ASN 36 Ca 0.11 0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.83 1i08 h ASN 36 Cb 0.12 0.01 -0.03 0.00 0.05 0.00 0.00 38.32 38.47 1i08 h ASN 36 CO -0.01 -0.01 0.30 0.78 -1.65 0.00 0.00 177.43 176.84 1i08 h ASN 37 N 0.00 0.92 -0.30 5.81 2.35 -1.02 -0.60 115.58 122.74 1i08 h ASN 37 Ca 0.01 -0.12 -0.03 0.00 -0.55 0.00 0.00 56.30 55.61 1i08 h ASN 37 Cb 0.01 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.13 1i08 h ASN 37 CO -0.02 0.81 0.06 0.00 -1.65 0.00 0.00 177.43 176.63 1i08 h ALA 38 N 1.33 0.40 -0.69 -0.83 0.00 -0.76 -1.93 119.26 116.78 1i08 h ALA 38 Ca 0.24 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 1i08 h ALA 38 Cb 0.16 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1i08 h ALA 38 CO -0.02 0.09 0.19 -0.91 0.00 0.00 0.00 179.25 178.59 1i08 h ASN 39 N 0.33 1.02 -0.66 0.00 2.35 -0.81 -2.08 115.58 115.72 1i08 h ASN 39 Ca 0.09 -0.20 -0.03 0.00 -0.55 0.00 0.00 56.30 55.61 1i08 h ASN 39 Cb 0.33 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.40 1i08 h ASN 39 CO 0.00 0.96 0.30 0.00 -1.65 0.00 0.00 177.43 177.04 1i08 h ALA 40 N 1.17 0.86 0.00 -0.83 0.00 -0.99 -2.40 119.26 117.07 1i08 h ALA 40 Ca 0.22 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 1i08 h ALA 40 Cb 0.33 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1i08 h ALA 40 CO -0.00 0.45 -0.12 0.00 0.00 0.00 0.00 179.25 179.57 1i08 h ALA 41 N 1.13 1.03 -0.02 0.00 0.00 -1.04 -2.93 119.26 117.44 1i08 h ALA 41 Ca 0.23 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1i08 h ALA 41 Cb 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1i08 h ALA 41 CO -0.02 0.15 -0.23 1.28 0.00 0.00 0.00 179.25 180.43 1i08 n LEU 42 N -3.28 1.82 -0.27 0.00 4.77 -0.81 -4.47 117.00 114.75 1i08 n LEU 42 Ca 0.00 -0.61 0.08 0.00 -0.03 0.00 0.00 56.01 55.46 1i08 n LEU 42 Cb 0.36 -0.04 0.22 0.00 -2.33 0.00 0.00 43.42 41.64 1i08 n LEU 42 CO 0.30 0.32 0.95 -0.08 -1.33 0.00 0.00 177.39 177.55 1i08 h GLU 43 N 2.50 0.27 -0.32 3.23 4.81 -1.24 -1.26 114.58 122.57 1i08 h GLU 43 Ca 0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1i08 h GLU 43 Cb 0.68 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.00 1i08 h GLU 43 CO 0.00 0.18 0.00 -1.13 -0.73 0.00 0.00 179.01 177.33 1i08 n SER 44 N -5.16 2.82 -3.69 1.04 3.41 -1.26 -4.63 113.62 106.14 1i08 n SER 44 Ca 0.17 -1.90 -0.30 0.00 -0.26 0.00 0.00 58.87 56.58 1i08 n SER 44 Cb 0.53 -0.20 -0.08 0.00 -0.26 0.00 0.00 64.21 64.20 1i08 n SER 44 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1i08 n LEU 45 N 1.08 3.81 -0.19 1.04 4.32 -0.48 -4.91 117.00 121.66 1i08 n LEU 45 Ca 0.18 -5.33 0.10 0.00 -0.02 0.00 0.00 56.01 50.94 1i08 n LEU 45 Cb 0.50 -0.79 0.40 0.00 -1.62 0.00 0.00 43.42 41.91 1i08 n LEU 45 CO 0.15 1.88 1.21 -0.65 -1.22 0.00 0.00 177.39 178.76 1i08 h PRO 46 N 4.84 0.63 -0.82 3.23 0.11 -1.82 0.15 132.00 138.32 1i08 h PRO 46 Ca 0.18 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 66.28 1i08 h PRO 46 Cb 0.70 -0.14 -0.05 0.00 0.11 0.00 0.00 31.00 31.62 1i08 h PRO 46 CO 0.84 0.42 0.53 1.05 -0.21 0.00 0.00 178.00 180.63 1i08 h GLU 47 N 0.65 1.01 0.00 1.05 9.09 -1.94 -3.08 114.58 121.36 1i08 h GLU 47 Ca 0.35 -0.06 -0.21 0.00 0.05 0.00 0.00 59.36 59.48 1i08 h GLU 47 Cb 0.48 -0.23 -0.04 0.00 -1.65 0.00 0.00 28.75 27.32 1i08 h GLU 47 CO -0.13 0.67 -1.60 1.19 0.05 0.00 0.00 179.01 179.19 1i08 n PHE 48 N -4.57 0.87 0.22 2.06 3.72 -0.93 -4.24 117.46 114.59 1i08 n PHE 48 Ca 0.10 0.30 0.13 0.00 -0.05 0.00 0.00 57.45 57.93 1i08 n PHE 48 Cb 0.08 -1.09 0.75 0.00 -0.94 0.00 0.00 39.48 38.28 1i08 n PHE 48 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1i08 h ALA 49 N 1.29 1.94 0.00 4.37 0.00 -0.89 -2.45 119.26 123.53 1i08 h ALA 49 Ca -0.22 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1i08 h ALA 49 Cb 1.74 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.53 1i08 h ALA 49 CO 0.05 -0.16 -0.05 -0.91 0.00 0.00 0.00 179.25 178.18 1i08 h ASN 50 N 0.00 0.00 -4.09 0.00 2.35 -1.73 -3.38 115.58 108.72 1i08 h ASN 50 Ca 0.06 0.00 -0.49 0.00 -0.55 0.00 0.00 56.30 55.32 1i08 h ASN 50 Cb 0.26 0.00 0.05 0.00 0.05 0.00 0.00 38.32 38.68 1i08 h ASN 50 CO -0.00 0.05 0.40 -0.76 -1.65 0.00 0.00 177.43 175.47 1i08 s LEU 51 N -6.23 3.76 0.64 1.61 1.43 -0.92 -5.01 118.68 113.95 1i08 s LEU 51 Ca 0.07 2.01 -0.16 0.00 -1.03 0.00 0.00 54.13 55.01 1i08 s LEU 51 Cb 0.05 -4.56 -0.01 0.00 0.03 0.00 0.00 46.19 41.70 1i08 s LEU 51 CO 0.68 -1.01 1.14 -2.84 0.23 0.00 0.00 176.35 174.55 1i08 s PRO 52 N -3.37 2.83 0.26 1.29 0.02 -1.26 -4.79 135.00 129.97 1i08 s PRO 52 Ca 0.69 1.55 -0.04 0.00 0.02 0.00 0.00 61.00 63.22 1i08 s PRO 52 Cb -0.19 -1.94 0.36 0.00 0.02 0.00 0.00 34.50 32.75 1i08 s PRO 52 CO 0.25 -1.26 1.89 -0.24 -0.33 0.00 0.00 177.00 177.31 1i08 h VAL 53 N 0.32 1.12 -0.08 3.83 3.04 -1.96 -1.66 116.25 120.86 1i08 h VAL 53 Ca -0.48 -0.40 0.02 0.00 -1.01 0.00 0.00 66.70 64.83 1i08 h VAL 53 Cb 1.26 -0.17 -0.00 0.00 -2.01 0.00 0.00 31.29 30.37 1i08 h VAL 53 CO 0.54 0.22 0.06 -0.33 -1.01 0.00 0.00 177.57 177.04 1i08 h GLU 54 N 1.18 0.00 0.13 4.17 3.07 -1.94 -2.48 114.58 118.71 1i08 h GLU 54 Ca 0.41 0.00 -0.34 0.00 -0.50 0.00 0.00 59.36 58.93 1i08 h GLU 54 Cb 0.10 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.00 1i08 h GLU 54 CO -0.15 0.00 -1.74 1.49 -1.40 0.00 0.00 179.01 177.21 1i08 h GLU 55 N 0.00 0.29 -0.56 2.33 4.81 -1.71 -3.37 114.58 116.36 1i08 h GLU 55 Ca 0.04 -0.49 0.07 0.00 -0.13 0.00 0.00 59.36 58.85 1i08 h GLU 55 Cb 0.15 0.18 -0.06 0.00 0.63 0.00 0.00 28.75 29.66 1i08 h GLU 55 CO -0.00 1.16 0.23 1.25 -0.73 0.00 0.00 179.01 180.92 1i08 h LEU 56 N 0.08 0.26 -0.02 1.64 5.85 -0.89 -1.32 115.31 120.90 1i08 h LEU 56 Ca -0.33 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.45 1i08 h LEU 56 Cb 2.05 0.03 0.00 0.00 0.37 0.00 0.00 40.66 43.11 1i08 h LEU 56 CO 0.14 0.17 0.00 2.30 -0.34 0.00 0.00 178.44 180.71 1i08 n ILE 57 N -4.96 1.38 1.09 4.05 -5.35 -1.05 -0.89 119.36 113.63 1i08 n ILE 57 Ca 0.07 0.35 0.12 0.00 -0.27 0.00 0.00 62.75 63.02 1i08 n ILE 57 Cb 0.22 -1.20 0.34 0.00 -1.74 0.00 0.00 39.64 37.26 1i08 n ILE 57 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1i08 n THR 58 N -1.52 0.17 -1.98 7.28 -2.24 -0.50 -4.10 114.28 111.40 1i08 n THR 58 Ca 0.02 -0.42 0.05 0.00 -2.27 0.00 0.00 64.05 61.43 1i08 n THR 58 Cb 0.10 0.71 0.10 0.00 -2.10 0.00 0.00 70.33 69.15 1i08 n THR 58 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1i08 n LYS 59 N 0.68 0.74 -0.29 -0.78 5.02 -0.07 -4.87 118.16 118.60 1i08 n LYS 59 Ca 0.17 -2.49 0.00 0.00 -2.02 0.00 0.00 58.31 53.98 1i08 n LYS 59 Cb 0.43 -0.82 0.13 0.00 -0.02 0.00 0.00 35.03 34.75 1i08 n LYS 59 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1i08 h LEU 60 N 0.83 0.75 -0.14 -0.35 3.38 -1.71 -1.17 115.31 116.91 1i08 h LEU 60 Ca -0.10 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1i08 h LEU 60 Cb 1.42 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 42.04 1i08 h LEU 60 CO 0.04 0.48 0.00 0.47 0.09 0.00 0.00 178.44 179.52 1i08 n ASP 61 N -4.67 0.06 -1.25 -0.43 8.00 -1.26 -1.15 116.55 115.85 1i08 n ASP 61 Ca 0.11 0.53 0.12 0.00 0.71 0.00 0.00 54.79 56.26 1i08 n ASP 61 Cb 0.18 -0.53 0.27 0.00 -0.02 0.00 0.00 41.12 41.01 1i08 n ASP 61 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1i08 n GLN 62 N -1.57 2.60 -3.71 -1.24 6.02 -0.44 -4.95 117.38 114.08 1i08 n GLN 62 Ca 0.00 -2.45 -0.28 0.00 -0.01 0.00 0.00 57.00 54.26 1i08 n GLN 62 Cb 0.02 -1.54 -0.03 0.00 1.02 0.00 0.00 30.24 29.70 1i08 n GLN 62 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1i08 s LEU 63 N -1.28 4.24 0.29 1.08 1.43 -0.30 -5.04 118.68 119.10 1i08 s LEU 63 Ca 0.43 0.41 -0.30 0.00 -1.03 0.00 0.00 54.13 53.65 1i08 s LEU 63 Cb 0.24 -3.17 -0.11 0.00 0.03 0.00 0.00 46.19 43.18 1i08 s LEU 63 CO 0.33 -0.01 1.60 -2.16 0.23 0.00 0.00 176.35 176.34 1i08 s PRO 64 N -3.17 4.12 0.21 1.29 0.04 -1.26 -4.70 135.00 131.54 1i08 s PRO 64 Ca 0.38 2.58 0.00 0.00 0.04 0.00 0.00 61.00 64.01 1i08 s PRO 64 Cb -0.11 -3.03 0.50 0.00 0.04 0.00 0.00 34.50 31.90 1i08 s PRO 64 CO 0.28 -0.64 1.10 0.00 0.04 0.00 0.00 177.00 177.78 1i08 n ALA 65 N 2.28 0.33 1.62 8.56 0.00 -1.26 0.56 120.51 132.60 1i08 n ALA 65 Ca 0.09 0.76 0.11 0.00 0.00 0.00 0.00 53.44 54.39 1i08 n ALA 65 Cb 0.37 -0.53 0.63 0.00 0.00 0.00 0.00 19.45 19.92 1i08 n ALA 65 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1i08 n ASP 66 N -4.98 0.00 -0.00 0.00 5.75 -1.26 -3.22 116.55 112.83 1i08 n ASP 66 Ca 0.16 -0.96 0.01 0.00 -0.01 0.00 0.00 54.79 53.99 1i08 n ASP 66 Cb 0.51 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.57 1i08 n ASP 66 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1i08 n LYS 67 N -0.91 0.50 -0.03 0.11 4.76 0.19 -4.78 118.16 118.02 1i08 n LYS 67 Ca 0.16 -0.03 -0.09 0.00 -2.87 0.00 0.00 58.31 55.48 1i08 n LYS 67 Cb 0.07 -1.09 -0.02 0.00 -1.84 0.00 0.00 35.03 32.15 1i08 n LYS 67 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 1i08 h LYS 68 N 0.00 -0.23 -0.15 1.97 3.64 -1.45 -2.30 116.57 118.06 1i08 h LYS 68 Ca -0.01 0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 1i08 h LYS 68 Cb 0.29 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 1i08 h LYS 68 CO 0.00 -0.15 0.00 1.15 -2.27 0.00 0.00 179.45 178.18 1i08 h THR 69 N -0.24 1.25 -0.98 1.00 2.02 -1.87 -0.01 112.91 114.08 1i08 h THR 69 Ca 0.12 -0.81 0.04 0.00 0.77 0.00 0.00 66.41 66.52 1i08 h THR 69 Cb 0.42 1.49 -0.06 0.00 -1.74 0.00 0.00 68.15 68.26 1i08 h THR 69 CO -0.33 0.24 0.64 1.62 0.37 0.00 0.00 175.52 178.07 1i08 h VAL 70 N 0.01 1.17 0.02 3.16 3.04 -1.85 -1.25 116.25 120.56 1i08 h VAL 70 Ca 0.04 -0.43 -0.22 0.00 -1.01 0.00 0.00 66.70 65.09 1i08 h VAL 70 Cb 0.36 -0.18 -0.00 0.00 -2.01 0.00 0.00 31.29 29.46 1i08 h VAL 70 CO 0.01 0.23 -0.95 -0.07 -1.01 0.00 0.00 177.57 175.77 1i08 h LEU 71 N 1.24 0.40 -0.31 3.16 3.38 -1.37 -0.95 115.31 120.87 1i08 h LEU 71 Ca 0.39 -0.34 0.01 0.00 0.09 0.00 0.00 57.88 58.03 1i08 h LEU 71 Cb -0.00 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1i08 h LEU 71 CO -0.12 1.15 0.19 -0.09 0.09 0.00 0.00 178.44 179.66 1i08 h ARG 72 N 0.16 0.38 -0.12 1.13 2.43 -0.52 0.40 114.38 118.23 1i08 h ARG 72 Ca -0.07 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.02 1i08 h ARG 72 Cb 1.60 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 31.06 1i08 h ARG 72 CO 0.16 0.25 -0.15 -0.91 -1.51 0.00 0.00 179.97 177.81 1i08 h ASN 73 N 0.39 0.34 0.22 -3.80 2.35 -1.23 -2.42 115.58 111.43 1i08 h ASN 73 Ca 0.12 -0.50 -0.35 0.00 -0.55 0.00 0.00 56.30 55.02 1i08 h ASN 73 Cb -0.02 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 38.25 1i08 h ASN 73 CO -0.05 0.77 -1.80 0.78 -1.65 0.00 0.00 177.43 175.49 1i08 h ASN 74 N -0.09 0.51 0.23 5.81 2.35 -1.11 -1.46 115.58 121.82 1i08 h ASN 74 Ca 0.02 -0.85 -0.14 0.00 -0.55 0.00 0.00 56.30 54.77 1i08 h ASN 74 Cb 0.69 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.88 1i08 h ASN 74 CO 0.03 1.74 -0.53 0.00 -1.65 0.00 0.00 177.43 177.03 1i08 h ALA 75 N 0.19 0.89 -0.26 -0.83 0.00 -0.39 -0.35 119.26 118.51 1i08 h ALA 75 Ca -0.35 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.04 1i08 h ALA 75 Cb 2.07 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.76 1i08 h ALA 75 CO 0.15 0.68 0.07 0.78 0.00 0.00 0.00 179.25 180.92 1i08 h GLY 76 N 1.30 0.44 0.90 0.00 0.00 -1.27 -0.45 103.07 103.99 1i08 h GLY 76 Ca 0.01 -0.27 0.03 0.00 0.00 0.00 0.00 47.33 47.09 1i08 h GLY 76 CO 0.09 0.26 0.57 -1.33 0.00 0.00 0.00 176.54 176.13 1i08 h GLY 77 N 0.25 1.28 0.82 4.60 0.00 -0.90 -0.16 103.07 108.97 1i08 h GLY 77 Ca 0.08 -0.44 -0.02 0.00 0.00 0.00 0.00 47.33 46.95 1i08 h GLY 77 CO 0.00 0.39 0.03 0.84 0.00 0.00 0.00 176.54 177.79 1i08 h HIS 78 N 1.12 0.29 -0.31 5.60 6.17 -0.78 -2.18 115.15 125.06 1i08 h HIS 78 Ca 0.35 -0.04 -0.01 0.00 0.71 0.00 0.00 60.37 61.37 1i08 h HIS 78 Cb -0.02 -0.08 -0.01 0.00 2.52 0.00 0.00 27.41 29.82 1i08 h HIS 78 CO -0.02 0.43 0.14 0.00 0.71 0.00 0.00 177.93 179.20 1i08 h ALA 79 N 0.82 0.40 -0.42 5.26 0.00 -0.80 -1.86 119.26 122.66 1i08 h ALA 79 Ca 0.05 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1i08 h ALA 79 Cb 0.30 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1i08 h ALA 79 CO 0.00 -0.02 0.20 -0.91 0.00 0.00 0.00 179.25 178.52 1i08 h ASN 80 N 0.36 0.55 0.23 0.00 2.35 -1.02 -2.47 115.58 115.58 1i08 h ASN 80 Ca 0.11 -0.13 -0.13 0.00 -0.55 0.00 0.00 56.30 55.60 1i08 h ASN 80 Cb 0.14 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 1i08 h ASN 80 CO -0.01 0.52 -0.49 0.45 -1.65 0.00 0.00 177.43 176.25 1i08 h HIS 81 N 0.54 0.37 -0.63 1.19 3.86 -1.38 -0.80 115.15 118.31 1i08 h HIS 81 Ca 0.15 -0.12 -0.01 0.00 -1.16 0.00 0.00 60.37 59.22 1i08 h HIS 81 Cb 0.12 -0.08 -0.03 0.00 1.06 0.00 0.00 27.41 28.48 1i08 h HIS 81 CO -0.01 0.74 0.34 0.77 0.86 0.00 0.00 177.93 180.62 1i08 h SER 82 N 0.24 0.80 -0.46 2.45 0.02 -1.19 -1.36 113.55 114.05 1i08 h SER 82 Ca 0.01 -0.10 -0.09 0.00 -0.84 0.00 0.00 61.79 60.76 1i08 h SER 82 Cb 0.95 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.28 1i08 h SER 82 CO 0.08 0.67 -0.09 0.25 -1.14 0.00 0.00 176.83 176.61 1i08 h LEU 83 N 0.86 0.86 -0.17 5.07 6.46 -1.26 -3.19 115.31 123.95 1i08 h LEU 83 Ca 0.22 -0.35 0.03 0.00 -0.12 0.00 0.00 57.88 57.66 1i08 h LEU 83 Cb 0.06 -0.24 -0.03 0.00 -0.73 0.00 0.00 40.66 39.73 1i08 h LEU 83 CO -0.03 1.01 -0.02 0.15 -0.62 0.00 0.00 178.44 178.93 1i08 h PHE 84 N 0.70 -0.05 -0.60 1.25 3.57 -0.61 -1.60 116.94 119.60 1i08 h PHE 84 Ca 0.12 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.68 1i08 h PHE 84 Cb 0.62 0.05 -0.05 0.00 2.79 0.00 0.00 35.95 39.36 1i08 h PHE 84 CO 0.05 -0.05 0.33 -1.49 -2.23 0.00 0.00 178.31 174.92 1i08 h TRP 85 N 0.02 0.61 0.00 0.41 -0.00 -1.29 -1.50 115.95 114.20 1i08 h TRP 85 Ca 0.08 0.02 0.00 0.00 -0.00 0.00 0.00 58.89 58.99 1i08 h TRP 85 Cb 0.11 -0.19 0.00 0.00 -0.00 0.00 0.00 29.16 29.09 1i08 h TRP 85 CO -0.18 0.30 0.00 0.87 -0.00 0.00 0.00 178.44 179.43 1i08 h LYS 86 N 0.63 0.00 -0.41 0.49 1.57 -1.49 -3.00 116.57 114.36 1i08 h LYS 86 Ca 0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 1i08 h LYS 86 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1i08 h LYS 86 CO -0.16 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.13 1i08 n GLY 87 N 0.20 0.85 3.33 3.86 0.00 -0.57 -4.81 105.19 108.05 1i08 n GLY 87 Ca 0.01 -0.40 -0.31 0.00 0.00 0.00 0.00 46.02 45.32 1i08 n GLY 87 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1i08 s LEU 88 N -1.03 2.17 0.00 0.99 1.43 -1.13 -0.08 118.68 121.03 1i08 s LEU 88 Ca 0.25 -0.44 0.00 0.00 -1.03 0.00 0.00 54.13 52.91 1i08 s LEU 88 Cb 0.13 -1.39 0.00 0.00 0.03 0.00 0.00 46.19 44.97 1i08 s LEU 88 CO 0.16 0.30 0.00 1.17 0.23 0.00 0.00 176.35 178.21 1i08 n LYS 89 N 2.57 0.00 -2.65 1.70 4.81 0.14 -4.70 118.16 120.03 1i08 n LYS 89 Ca -0.17 0.00 -0.30 0.00 -0.87 0.00 0.00 58.31 56.98 1i08 n LYS 89 Cb 0.51 0.00 -0.02 0.00 0.02 0.00 0.00 35.03 35.54 1i08 n LYS 89 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1i08 s LYS 90 N -0.68 3.72 0.00 1.64 1.02 -1.26 -4.16 119.74 120.02 1i08 s LYS 90 Ca 0.00 0.49 0.00 0.00 0.02 0.00 0.00 55.97 56.48 1i08 s LYS 90 Cb 0.00 -2.33 0.00 0.00 -0.52 0.00 0.00 37.83 34.98 1i08 s LYS 90 CO 0.00 -0.16 0.00 0.41 -0.92 0.00 0.00 175.35 174.68 1i08 n GLY 91 N -1.71 0.57 3.96 -3.33 0.00 -1.26 -5.05 105.19 98.36 1i08 n GLY 91 Ca 0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 1i08 n GLY 91 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1i08 s THR 92 N -2.25 3.19 -0.03 2.61 -4.23 -1.26 -5.10 115.64 108.56 1i08 s THR 92 Ca 0.00 -0.49 0.01 0.00 -1.18 0.00 0.00 61.69 60.03 1i08 s THR 92 Cb 0.00 -3.21 0.02 0.00 1.34 0.00 0.00 72.50 70.65 1i08 s THR 92 CO 0.00 -0.17 -0.01 -0.89 -0.54 0.00 0.00 174.62 173.01 1i08 s THR 93 N -2.77 0.25 0.06 3.99 2.01 -1.26 -4.90 115.64 113.02 1i08 s THR 93 Ca 0.54 0.01 -0.31 0.00 0.31 0.00 0.00 61.69 62.24 1i08 s THR 93 Cb -0.10 -0.31 -0.07 0.00 0.01 0.00 0.00 72.50 72.03 1i08 s THR 93 CO 0.40 0.15 1.44 -0.22 -0.69 0.00 0.00 174.62 175.69 1i08 s LEU 94 N 0.80 4.35 0.00 4.42 2.96 -1.26 -4.79 118.68 125.15 1i08 s LEU 94 Ca -0.08 2.26 -0.13 0.00 -0.22 0.00 0.00 54.13 55.96 1i08 s LEU 94 Cb -0.12 -3.57 0.05 0.00 0.50 0.00 0.00 46.19 43.05 1i08 s LEU 94 CO -0.01 -0.72 0.66 0.00 -1.32 0.00 0.00 176.35 174.96 1i08 n GLN 95 N 4.80 0.63 0.00 1.98 10.64 -1.26 -4.92 117.38 129.25 1i08 n GLN 95 Ca 0.13 -1.32 0.00 0.00 -1.83 0.00 0.00 57.00 53.98 1i08 n GLN 95 Cb 0.43 1.70 0.00 0.00 -0.86 0.00 0.00 30.24 31.51 1i08 n GLN 95 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1i08 n GLY 96 N -0.45 0.73 0.37 2.61 0.00 -1.26 -3.22 105.19 103.97 1i08 n GLY 96 Ca -0.04 -0.73 0.04 0.00 0.00 0.00 0.00 46.02 45.28 1i08 n GLY 96 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1i08 h ASP 97 N 7.21 1.01 -0.49 1.61 3.32 -1.99 -2.36 116.42 124.72 1i08 h ASP 97 Ca 0.00 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 1i08 h ASP 97 Cb 0.00 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.33 1i08 h ASP 97 CO 0.00 0.62 0.28 0.25 -1.72 0.00 0.00 179.24 178.67 1i08 h LEU 98 N 1.13 0.61 -0.73 1.55 5.85 -1.94 0.72 115.31 122.50 1i08 h LEU 98 Ca 0.45 -0.08 -0.03 0.00 0.84 0.00 0.00 57.88 59.06 1i08 h LEU 98 Cb 0.24 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 1i08 h LEU 98 CO -0.19 0.51 0.35 0.50 -0.34 0.00 0.00 178.44 179.27 1i08 h LYS 99 N 0.66 1.05 -0.57 1.25 3.64 -1.44 -0.75 116.57 120.41 1i08 h LYS 99 Ca 0.18 -0.15 -0.03 0.00 -1.27 0.00 0.00 60.65 59.37 1i08 h LYS 99 Cb 0.03 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 31.63 1i08 h LYS 99 CO -0.03 0.82 0.23 0.00 -2.27 0.00 0.00 179.45 178.20 1i08 h ALA 100 N 1.17 0.74 -0.68 5.00 0.00 -0.99 -1.30 119.26 123.21 1i08 h ALA 100 Ca 0.25 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1i08 h ALA 100 Cb 0.11 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1i08 h ALA 100 CO -0.03 0.35 0.23 0.00 0.00 0.00 0.00 179.25 179.80 1i08 h ALA 101 N 1.08 1.11 -0.15 0.00 0.00 -0.46 -0.26 119.26 120.58 1i08 h ALA 101 Ca 0.19 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1i08 h ALA 101 Cb 0.20 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1i08 h ALA 101 CO -0.02 0.61 -0.02 0.82 0.00 0.00 0.00 179.25 180.64 1i08 h ILE 102 N 1.00 1.28 -0.31 0.00 2.04 -0.82 -0.42 117.51 120.28 1i08 h ILE 102 Ca 0.22 -0.94 -0.03 0.00 1.00 0.00 0.00 64.86 65.12 1i08 h ILE 102 Cb 0.26 1.59 -0.02 0.00 -0.74 0.00 0.00 36.82 37.92 1i08 h ILE 102 CO -0.01 0.28 0.07 -0.33 0.00 0.00 0.00 178.15 178.16 1i08 h GLU 103 N 0.00 0.44 -0.03 2.37 5.08 -1.09 0.27 114.58 121.62 1i08 h GLU 103 Ca 0.04 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1i08 h GLU 103 Cb 0.44 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.61 1i08 h GLU 103 CO 0.01 0.41 -0.00 -0.09 -1.00 0.00 0.00 179.01 178.34 1i08 h ARG 104 N 0.43 0.05 0.00 2.33 2.43 -0.75 0.24 114.38 119.12 1i08 h ARG 104 Ca 0.10 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1i08 h ARG 104 Cb 0.17 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 1i08 h ARG 104 CO -0.00 0.37 -0.53 -0.44 -1.51 0.00 0.00 179.97 177.86 1i08 h ASP 105 N -0.27 0.00 0.00 -3.80 3.32 -0.82 -3.37 116.42 111.48 1i08 h ASP 105 Ca 0.01 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.98 1i08 h ASP 105 Cb 0.35 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.90 1i08 h ASP 105 CO 0.00 0.04 0.00 0.49 -1.72 0.00 0.00 179.24 178.05 1i08 n PHE 106 N -2.50 0.00 0.00 4.55 3.72 0.92 -5.00 117.46 119.14 1i08 n PHE 106 Ca 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.43 1i08 n PHE 106 Cb 0.49 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.03 1i08 n PHE 106 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1i08 n GLY 107 N 0.21 2.14 3.62 1.37 0.00 0.86 -4.48 105.19 108.90 1i08 n GLY 107 Ca 0.00 -0.30 -0.04 0.00 0.00 0.00 0.00 46.02 45.67 1i08 n GLY 107 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1i08 s SER 108 N 0.11 -0.22 0.29 1.61 1.04 -1.23 -4.79 113.70 110.50 1i08 s SER 108 Ca 0.00 -0.16 -0.00 0.00 0.48 0.00 0.00 55.95 56.27 1i08 s SER 108 Cb 0.00 0.34 0.43 0.00 0.10 0.00 0.00 66.02 66.89 1i08 s SER 108 CO 0.00 -0.60 1.83 0.58 0.98 0.00 0.00 173.24 176.03 1i08 h VAL 109 N 2.00 1.22 -0.62 5.02 2.07 -1.90 -2.31 116.25 121.73 1i08 h VAL 109 Ca -0.22 -0.81 -0.07 0.00 0.82 0.00 0.00 66.70 66.41 1i08 h VAL 109 Cb 1.22 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 31.68 1i08 h VAL 109 CO 0.27 0.30 0.11 0.44 0.02 0.00 0.00 177.57 178.71 1i08 h ASP 110 N 0.75 0.97 -0.39 0.57 3.32 -1.95 -0.69 116.42 119.01 1i08 h ASP 110 Ca 0.17 -0.26 -0.01 0.00 0.02 0.00 0.00 57.03 56.94 1i08 h ASP 110 Cb 0.30 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 1i08 h ASP 110 CO 0.00 0.98 0.18 0.78 -1.72 0.00 0.00 179.24 179.47 1i08 h ASN 111 N 0.93 0.51 -0.09 6.45 2.35 -1.76 -1.13 115.58 122.85 1i08 h ASN 111 Ca 0.19 -0.13 0.03 0.00 -0.55 0.00 0.00 56.30 55.84 1i08 h ASN 111 Cb 0.42 -0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.62 1i08 h ASN 111 CO 0.01 0.50 -0.09 0.15 -1.65 0.00 0.00 177.43 176.34 1i08 h PHE 112 N 0.48 -0.23 -0.73 1.19 3.57 -1.15 0.06 116.94 120.14 1i08 h PHE 112 Ca 0.13 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.71 1i08 h PHE 112 Cb 0.13 0.12 -0.06 0.00 2.79 0.00 0.00 35.95 38.92 1i08 h PHE 112 CO -0.01 -0.14 0.42 0.87 -2.23 0.00 0.00 178.31 177.22 1i08 h LYS 113 N -0.12 0.75 -0.53 1.11 1.57 -0.90 0.16 116.57 118.61 1i08 h LYS 113 Ca 0.07 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.79 1i08 h LYS 113 Cb 0.22 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 1i08 h LYS 113 CO -0.16 0.49 0.27 0.00 -0.57 0.00 0.00 179.45 179.48 1i08 h ALA 114 N 1.37 0.68 -0.57 3.86 0.00 -0.69 0.36 119.26 124.27 1i08 h ALA 114 Ca 0.33 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 1i08 h ALA 114 Cb 0.20 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1i08 h ALA 114 CO -0.18 0.23 0.13 1.49 0.00 0.00 0.00 179.25 180.91 1i08 h GLU 115 N 0.71 0.91 -0.29 0.00 4.57 -0.21 -1.48 114.58 118.80 1i08 h GLU 115 Ca 0.18 -0.22 -0.04 0.00 -1.18 0.00 0.00 59.36 58.10 1i08 h GLU 115 Cb 0.09 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.55 1i08 h GLU 115 CO -0.03 0.85 0.01 0.35 -1.18 0.00 0.00 179.01 179.02 1i08 h PHE 116 N 0.82 0.54 -0.76 0.92 3.57 -0.43 -2.15 116.94 119.45 1i08 h PHE 116 Ca 0.18 -0.09 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 1i08 h PHE 116 Cb 0.35 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.91 1i08 h PHE 116 CO 0.02 0.64 0.43 0.93 -2.23 0.00 0.00 178.31 178.10 1i08 h GLU 117 N 0.29 1.04 -0.38 1.11 5.08 -0.83 -0.72 114.58 120.17 1i08 h GLU 117 Ca 0.08 -0.10 -0.03 0.00 -1.00 0.00 0.00 59.36 58.30 1i08 h GLU 117 Cb 0.41 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1i08 h GLU 117 CO 0.01 0.74 0.10 0.87 -1.00 0.00 0.00 179.01 179.74 1i08 h LYS 118 N 1.05 0.61 -0.56 2.33 1.57 -1.10 0.01 116.57 120.47 1i08 h LYS 118 Ca 0.27 -0.14 -0.06 0.00 -1.87 0.00 0.00 60.65 58.85 1i08 h LYS 118 Cb -0.01 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.20 1i08 h LYS 118 CO -0.05 0.63 0.12 0.00 -0.57 0.00 0.00 179.45 179.58 1i08 h ALA 119 N 0.95 0.74 -0.45 3.86 0.00 -0.98 -0.44 119.26 122.95 1i08 h ALA 119 Ca 0.12 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 54.69 1i08 h ALA 119 Cb 0.29 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1i08 h ALA 119 CO -0.00 0.46 -0.13 0.00 0.00 0.00 0.00 179.25 179.58 1i08 h ALA 120 N 1.01 0.92 0.02 0.00 0.00 -1.00 -2.90 119.26 117.31 1i08 h ALA 120 Ca 0.17 -0.34 -0.21 0.00 0.00 0.00 0.00 54.91 54.54 1i08 h ALA 120 Cb 0.38 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1i08 h ALA 120 CO 0.01 0.62 -0.97 0.00 0.00 0.00 0.00 179.25 178.91 1i08 h ALA 121 N 1.10 0.42 -0.00 0.00 0.00 -0.85 -3.29 119.26 116.64 1i08 h ALA 121 Ca 0.12 -0.84 0.00 0.00 0.00 0.00 0.00 54.91 54.19 1i08 h ALA 121 Cb 0.64 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1i08 h ALA 121 CO 0.04 1.11 -0.10 -1.13 0.00 0.00 0.00 179.25 179.18 1i08 n SER 122 N -3.47 0.28 -4.58 0.00 3.41 -0.19 -4.74 113.62 104.33 1i08 n SER 122 Ca -0.02 -0.30 -0.41 0.00 -0.26 0.00 0.00 58.87 57.88 1i08 n SER 122 Cb 0.89 -0.16 -0.03 0.00 -0.26 0.00 0.00 64.21 64.66 1i08 n SER 122 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1i08 s ARG 123 N -2.60 3.21 -0.03 4.33 6.06 -1.10 -4.96 118.95 123.86 1i08 s ARG 123 Ca 0.26 0.72 -0.29 0.00 -2.50 0.00 0.00 55.73 53.91 1i08 s ARG 123 Cb 0.20 -4.18 -0.03 0.00 0.06 0.00 0.00 34.95 31.01 1i08 s ARG 123 CO 0.49 -2.03 0.97 0.12 -2.50 0.00 0.00 175.30 172.35 1i08 s PHE 124 N 6.71 3.62 0.00 5.12 5.36 -1.26 -4.80 117.98 132.73 1i08 s PHE 124 Ca 0.61 1.65 0.00 0.00 -0.96 0.00 0.00 56.93 58.23 1i08 s PHE 124 Cb -0.14 -3.12 0.00 0.00 -0.34 0.00 0.00 43.02 39.43 1i08 s PHE 124 CO 0.27 -0.05 0.00 0.41 -1.46 0.00 0.00 175.22 174.38 1i08 n GLY 125 N 2.96 -0.33 3.84 13.12 0.00 -1.26 -4.90 105.19 118.63 1i08 n GLY 125 Ca 0.06 -1.43 -0.35 0.00 0.00 0.00 0.00 46.02 44.31 1i08 n GLY 125 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1i08 s SER 126 N -4.00 6.85 0.00 1.61 0.01 -1.26 -4.81 113.70 112.10 1i08 s SER 126 Ca 0.00 1.16 0.00 0.00 1.31 0.00 0.00 55.95 58.42 1i08 s SER 126 Cb 0.00 -2.32 0.00 0.00 0.21 0.00 0.00 66.02 63.91 1i08 s SER 126 CO 0.00 0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.29 1i08 n GLY 127 N 0.55 -1.10 3.05 3.44 0.00 -1.26 -0.85 105.19 109.03 1i08 n GLY 127 Ca -0.03 -0.98 -0.10 0.00 0.00 0.00 0.00 46.02 44.90 1i08 n GLY 127 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1i08 s TRP 128 N -3.00 0.54 -0.08 1.61 0.52 -0.51 -1.22 118.94 116.80 1i08 s TRP 128 Ca 0.00 -0.66 0.02 0.00 0.02 0.00 0.00 56.10 55.49 1i08 s TRP 128 Cb 0.00 -0.35 -0.02 0.00 -1.15 0.00 0.00 33.47 31.95 1i08 s TRP 128 CO 0.00 -0.17 -0.15 0.00 0.02 0.00 0.00 176.95 176.65 1i08 s ALA 129 N -2.12 2.60 0.11 0.98 0.00 -0.73 -0.90 121.76 121.71 1i08 s ALA 129 Ca -0.06 -0.95 0.05 0.00 0.00 0.00 0.00 51.96 50.99 1i08 s ALA 129 Cb -0.05 -1.03 -0.04 0.00 0.00 0.00 0.00 23.12 22.00 1i08 s ALA 129 CO -0.02 0.43 -0.11 -1.58 0.00 0.00 0.00 175.76 174.47 1i08 s TRP 130 N -0.27 1.21 -0.29 0.00 0.52 0.27 -0.87 118.94 119.52 1i08 s TRP 130 Ca 0.01 -0.64 -0.02 0.00 0.02 0.00 0.00 56.10 55.47 1i08 s TRP 130 Cb -0.13 -0.64 0.04 0.00 -1.15 0.00 0.00 33.47 31.59 1i08 s TRP 130 CO 0.03 0.06 -0.01 -1.17 0.02 0.00 0.00 176.95 175.88 1i08 s LEU 131 N -2.59 3.75 0.28 2.99 2.96 -0.74 -1.50 118.68 123.83 1i08 s LEU 131 Ca 0.09 -1.16 0.11 0.00 -0.22 0.00 0.00 54.13 52.95 1i08 s LEU 131 Cb -0.02 -1.71 -0.05 0.00 0.50 0.00 0.00 46.19 44.90 1i08 s LEU 131 CO 0.01 -0.23 -0.13 0.68 -1.32 0.00 0.00 176.35 175.37 1i08 s VAL 132 N 1.28 2.74 -0.32 1.68 -7.23 0.16 -0.37 120.40 118.35 1i08 s VAL 132 Ca -0.04 -2.23 -0.07 0.00 -1.81 0.00 0.00 61.98 57.83 1i08 s VAL 132 Cb -0.19 -2.50 0.03 0.00 0.56 0.00 0.00 36.38 34.27 1i08 s VAL 132 CO -0.02 -0.37 0.10 -0.22 -0.31 0.00 0.00 175.10 174.29 1i08 s LEU 133 N -3.58 4.15 -0.81 1.32 2.96 0.20 -1.13 118.68 121.80 1i08 s LEU 133 Ca 0.31 -0.95 -0.08 0.00 -0.22 0.00 0.00 54.13 53.18 1i08 s LEU 133 Cb -0.05 -1.88 0.21 0.00 0.50 0.00 0.00 46.19 44.97 1i08 s LEU 133 CO 0.17 -0.27 0.71 -0.54 -1.32 0.00 0.00 176.35 175.09 1i08 s LYS 134 N 1.45 3.32 3.98 1.98 1.02 0.32 -1.74 119.74 130.08 1i08 s LYS 134 Ca 0.00 -2.68 0.00 0.00 0.02 0.00 0.00 55.97 53.31 1i08 s LYS 134 Cb -0.18 -4.17 0.00 0.00 -0.52 0.00 0.00 37.83 32.95 1i08 s LYS 134 CO 0.03 -1.25 0.00 0.41 -0.92 0.00 0.00 175.35 173.62 1i08 n GLY 135 N 3.46 2.11 0.03 -3.33 0.00 -1.26 -2.86 105.19 103.34 1i08 n GLY 135 Ca 0.14 -0.10 0.01 0.00 0.00 0.00 0.00 46.02 46.07 1i08 n GLY 135 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1i08 n ASP 136 N 6.99 0.61 -4.63 1.61 5.75 -1.26 -5.03 116.55 120.58 1i08 n ASP 136 Ca 0.00 -0.80 -0.32 0.00 -0.01 0.00 0.00 54.79 53.66 1i08 n ASP 136 Cb 0.00 0.50 -0.09 0.00 -1.03 0.00 0.00 41.12 40.50 1i08 n ASP 136 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1i08 s LYS 137 N -0.64 2.60 0.07 0.11 1.02 -1.13 -5.11 119.74 116.66 1i08 s LYS 137 Ca 0.01 -0.72 -0.14 0.00 0.02 0.00 0.00 55.97 55.14 1i08 s LYS 137 Cb 0.01 -2.55 -0.06 0.00 -0.52 0.00 0.00 37.83 34.71 1i08 s LYS 137 CO 0.04 0.59 0.46 -0.51 -0.92 0.00 0.00 175.35 175.02 1i08 s LEU 138 N -1.65 4.40 0.05 3.17 1.43 -1.26 -0.52 118.68 124.30 1i08 s LEU 138 Ca 0.19 0.97 -0.10 0.00 -1.03 0.00 0.00 54.13 54.17 1i08 s LEU 138 Cb -0.11 -2.94 0.01 0.00 0.03 0.00 0.00 46.19 43.18 1i08 s LEU 138 CO 0.10 0.21 0.21 0.00 0.23 0.00 0.00 176.35 177.10 1i08 s ALA 139 N -1.29 -0.39 -0.18 4.21 0.00 -0.28 -4.95 121.76 118.88 1i08 s ALA 139 Ca 0.31 -0.28 -0.05 0.00 0.00 0.00 0.00 51.96 51.94 1i08 s ALA 139 Cb -0.16 0.31 -0.03 0.00 0.00 0.00 0.00 23.12 23.24 1i08 s ALA 139 CO 0.17 -0.39 0.01 0.08 0.00 0.00 0.00 175.76 175.63 1i08 s VAL 140 N -2.71 4.20 0.17 0.00 1.01 -1.26 -0.66 120.40 121.15 1i08 s VAL 140 Ca -0.04 -0.24 -0.02 0.00 0.00 0.00 0.00 61.98 61.69 1i08 s VAL 140 Cb -0.00 -2.88 -0.04 0.00 0.00 0.00 0.00 36.38 33.46 1i08 s VAL 140 CO -0.05 0.45 0.11 0.68 0.00 0.00 0.00 175.10 176.30 1i08 s VAL 141 N 0.63 0.05 0.06 2.92 -7.23 -0.56 -4.99 120.40 111.28 1i08 s VAL 141 Ca 0.00 -1.91 0.01 0.00 -1.81 0.00 0.00 61.98 58.27 1i08 s VAL 141 Cb -0.14 -2.25 -0.03 0.00 0.56 0.00 0.00 36.38 34.53 1i08 s VAL 141 CO 0.02 -0.23 -0.06 -0.94 -0.31 0.00 0.00 175.10 173.58 1i08 s SER 142 N -3.09 0.76 0.21 4.85 1.04 -1.26 0.97 113.70 117.18 1i08 s SER 142 Ca 0.30 -0.75 0.04 0.00 0.48 0.00 0.00 55.95 56.03 1i08 s SER 142 Cb 0.07 0.09 -0.05 0.00 0.10 0.00 0.00 66.02 66.23 1i08 s SER 142 CO 0.07 -0.36 -0.05 0.42 0.98 0.00 0.00 173.24 174.29 1i08 s THR 143 N -2.47 1.20 0.21 2.02 -4.23 -0.07 -4.84 115.64 107.45 1i08 s THR 143 Ca -0.02 -2.07 -0.04 0.00 -1.18 0.00 0.00 61.69 58.38 1i08 s THR 143 Cb -0.03 -2.18 -0.05 0.00 1.34 0.00 0.00 72.50 71.58 1i08 s THR 143 CO -0.03 -0.47 0.44 0.00 -0.54 0.00 0.00 174.62 174.02 1i08 s ALA 144 N -3.31 3.74 0.00 3.99 0.00 -1.26 -1.42 121.76 123.49 1i08 s ALA 144 Ca 0.24 -0.60 0.00 0.00 0.00 0.00 0.00 51.96 51.60 1i08 s ALA 144 Cb 0.04 -2.17 0.00 0.00 0.00 0.00 0.00 23.12 20.99 1i08 s ALA 144 CO 0.06 0.48 0.00 0.09 0.00 0.00 0.00 175.76 176.39 1i08 n ASN 145 N -0.41 0.00 -0.99 0.00 3.02 -0.03 -1.00 115.26 115.85 1i08 n ASN 145 Ca -0.03 0.00 0.03 0.00 -0.03 0.00 0.00 54.58 54.55 1i08 n ASN 145 Cb 0.53 0.00 0.23 0.00 -0.61 0.00 0.00 39.78 39.93 1i08 n ASN 145 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1i08 n GLN 146 N 9.26 2.42 -2.00 3.52 1.13 -1.26 -4.09 117.38 126.36 1i08 n GLN 146 Ca 0.00 -2.97 -0.34 0.00 -1.94 0.00 0.00 57.00 51.76 1i08 n GLN 146 Cb 0.00 -1.83 0.02 0.00 0.11 0.00 0.00 30.24 28.54 1i08 n GLN 146 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1i08 s ASP 147 N -2.19 5.48 0.04 1.08 1.01 -0.17 -4.12 116.67 117.80 1i08 s ASP 147 Ca 0.43 2.01 0.04 0.00 0.71 0.00 0.00 52.55 55.74 1i08 s ASP 147 Cb 0.37 -2.56 -0.02 0.00 1.01 0.00 0.00 42.92 41.72 1i08 s ASP 147 CO 0.05 -1.38 -0.13 -0.55 0.21 0.00 0.00 175.17 173.38 1i08 s SER 148 N -2.36 1.47 0.59 0.27 0.15 -1.26 -4.72 113.70 107.84 1i08 s SER 148 Ca 0.68 -0.46 0.29 0.00 0.70 0.00 0.00 55.95 57.16 1i08 s SER 148 Cb -0.20 -0.08 1.70 0.00 -1.71 0.00 0.00 66.02 65.73 1i08 s SER 148 CO 0.35 -0.01 2.13 -0.65 1.20 0.00 0.00 173.24 176.26 1i08 h PRO 149 N 4.87 0.00 0.00 5.44 0.11 -1.84 0.87 132.00 141.45 1i08 h PRO 149 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1i08 h PRO 149 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1i08 h PRO 149 CO 0.43 0.00 0.00 -0.07 -0.21 0.00 0.00 178.00 178.15 1i08 h LEU 150 N 0.00 0.00 -0.09 2.35 3.38 -1.87 -2.17 115.31 116.91 1i08 h LEU 150 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1i08 h LEU 150 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1i08 h LEU 150 CO -0.00 0.00 0.00 0.24 0.09 0.00 0.00 178.44 178.77 1i08 h MET 151 N 0.00 0.00 0.00 1.13 2.86 -0.97 -3.37 114.93 114.57 1i08 h MET 151 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1i08 h MET 151 Cb 0.22 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.88 1i08 h MET 151 CO 0.00 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.38 1i08 n GLY 152 N 1.11 2.32 0.27 8.32 0.00 -0.82 -4.57 105.19 111.83 1i08 n GLY 152 Ca 0.05 -1.89 -0.06 0.00 0.00 0.00 0.00 46.02 44.11 1i08 n GLY 152 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1i08 h GLU 153 N 0.00 0.76 -0.71 1.61 5.08 -1.63 -1.08 114.58 118.60 1i08 h GLU 153 Ca 0.00 -0.27 0.06 0.00 -1.00 0.00 0.00 59.36 58.15 1i08 h GLU 153 Cb 0.00 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.15 1i08 h GLU 153 CO 0.00 0.87 0.47 0.00 -1.00 0.00 0.00 179.01 179.35 1i08 h ALA 154 N 1.15 1.72 0.00 3.43 0.00 -1.87 0.36 119.26 124.04 1i08 h ALA 154 Ca 0.11 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.81 1i08 h ALA 154 Cb 0.64 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1i08 h ALA 154 CO 0.05 0.17 -1.22 -0.89 0.00 0.00 0.00 179.25 177.36 1i08 n ILE 155 N -4.48 1.50 0.71 0.00 5.41 -1.15 -4.61 119.36 116.74 1i08 n ILE 155 Ca 0.10 0.00 0.11 0.00 1.00 0.00 0.00 62.75 63.97 1i08 n ILE 155 Cb 0.23 -2.14 0.08 0.00 -0.71 0.00 0.00 39.64 37.10 1i08 n ILE 155 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1i08 n SER 156 N -4.46 0.63 0.00 4.38 3.41 -0.42 -4.94 113.62 112.22 1i08 n SER 156 Ca -0.27 -0.25 0.00 0.00 -0.26 0.00 0.00 58.87 58.08 1i08 n SER 156 Cb 0.59 0.61 0.00 0.00 -0.26 0.00 0.00 64.21 65.15 1i08 n SER 156 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1i08 n GLY 157 N 1.41 0.53 3.34 5.00 0.00 0.13 -4.69 105.19 110.90 1i08 n GLY 157 Ca 0.03 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.96 1i08 n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i08 s ALA 158 N -2.07 -0.12 0.22 4.61 0.00 -1.26 -4.91 121.76 118.23 1i08 s ALA 158 Ca 0.00 -0.79 -0.15 0.00 0.00 0.00 0.00 51.96 51.02 1i08 s ALA 158 Cb 0.00 0.82 0.01 0.00 0.00 0.00 0.00 23.12 23.95 1i08 s ALA 158 CO 0.00 -0.65 0.49 -1.54 0.00 0.00 0.00 175.76 174.07 1i08 s SER 159 N -2.95 -0.16 0.00 0.00 1.04 -1.26 -1.81 113.70 108.56 1i08 s SER 159 Ca 0.15 -0.71 0.00 0.00 0.48 0.00 0.00 55.95 55.87 1i08 s SER 159 Cb 0.03 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.73 1i08 s SER 159 CO -0.02 -1.09 0.00 0.61 0.98 0.00 0.00 173.24 173.73 1i08 n GLY 160 N -0.35 2.84 3.63 7.32 0.00 -1.25 -4.87 105.19 112.52 1i08 n GLY 160 Ca -0.06 -2.08 -0.40 0.00 0.00 0.00 0.00 46.02 43.48 1i08 n GLY 160 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1i08 s PHE 161 N -2.43 3.29 0.04 1.61 5.36 -0.71 -4.04 117.98 121.11 1i08 s PHE 161 Ca 0.00 0.77 -0.30 0.00 -0.96 0.00 0.00 56.93 56.44 1i08 s PHE 161 Cb 0.00 -2.79 -0.07 0.00 -0.34 0.00 0.00 43.02 39.82 1i08 s PHE 161 CO 0.00 -0.28 1.64 -2.14 -1.46 0.00 0.00 175.22 172.98 1i08 s PRO 162 N 2.32 4.20 -0.19 10.12 0.02 -1.26 -0.62 135.00 149.58 1i08 s PRO 162 Ca 0.25 2.28 -0.04 0.00 0.02 0.00 0.00 61.00 63.50 1i08 s PRO 162 Cb -0.16 -3.69 -0.21 0.00 0.02 0.00 0.00 34.50 30.45 1i08 s PRO 162 CO 0.09 -0.75 0.08 -0.89 -0.33 0.00 0.00 177.00 175.20 1i08 n ILE 163 N 4.90 1.64 -3.47 2.83 2.08 0.50 -4.95 119.36 122.90 1i08 n ILE 163 Ca 0.16 -0.58 -0.13 0.00 0.56 0.00 0.00 62.75 62.76 1i08 n ILE 163 Cb 0.41 -1.62 -0.03 0.00 -0.75 0.00 0.00 39.64 37.65 1i08 n ILE 163 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1i08 s MET 164 N -2.53 1.11 0.10 0.38 0.23 -1.20 -4.54 119.30 112.85 1i08 s MET 164 Ca -0.29 -0.21 -0.11 0.00 -1.03 0.00 0.00 55.69 54.05 1i08 s MET 164 Cb 0.08 0.52 0.01 0.00 -1.53 0.00 0.00 34.83 33.91 1i08 s MET 164 CO 0.68 -0.45 0.26 0.20 -2.03 0.00 0.00 175.02 173.69 1i08 s GLY 165 N -2.19 -0.04 -0.10 3.16 0.00 -1.26 -1.80 107.32 105.08 1i08 s GLY 165 Ca -0.02 -0.39 0.03 0.00 0.00 0.00 0.00 44.72 44.34 1i08 s GLY 165 CO -0.05 -0.60 -0.18 -2.27 0.00 0.00 0.00 173.10 169.99 1i08 s LEU 166 N -2.78 1.87 -0.24 0.66 2.96 -0.05 -4.91 118.68 116.19 1i08 s LEU 166 Ca 0.04 -0.47 -0.29 0.00 -0.22 0.00 0.00 54.13 53.19 1i08 s LEU 166 Cb 0.03 -1.19 0.01 0.00 0.50 0.00 0.00 46.19 45.55 1i08 s LEU 166 CO -0.11 0.07 1.10 -0.62 -1.32 0.00 0.00 176.35 175.47 1i08 s ASP 167 N 0.73 7.02 -0.19 3.68 2.15 -1.26 -1.77 116.67 127.03 1i08 s ASP 167 Ca -0.11 1.36 0.16 0.00 0.43 0.00 0.00 52.55 54.39 1i08 s ASP 167 Cb -0.16 -2.54 0.53 0.00 -0.30 0.00 0.00 42.92 40.45 1i08 s ASP 167 CO 0.02 -0.75 1.43 1.33 -0.17 0.00 0.00 175.17 177.03 1i08 n VAL 168 N 5.48 2.31 -2.18 1.11 0.24 -0.36 -4.87 118.33 120.07 1i08 n VAL 168 Ca 0.12 -1.92 -0.37 0.00 -2.04 0.00 0.00 64.34 60.14 1i08 n VAL 168 Cb 0.46 -0.26 0.00 0.00 -1.47 0.00 0.00 33.84 32.57 1i08 n VAL 168 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 1i08 s TRP 169 N -2.86 2.70 0.47 6.34 0.52 -1.23 -4.46 118.94 120.43 1i08 s TRP 169 Ca 0.43 1.52 0.13 0.00 0.02 0.00 0.00 56.10 58.19 1i08 s TRP 169 Cb 0.35 -3.41 1.10 0.00 -1.15 0.00 0.00 33.47 30.35 1i08 s TRP 169 CO 0.08 -1.76 2.11 0.93 0.02 0.00 0.00 176.95 178.33 1i08 h GLU 170 N 1.61 0.20 0.00 4.98 5.08 -1.94 -1.68 114.58 122.84 1i08 h GLU 170 Ca -0.50 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 1i08 h GLU 170 Cb 1.26 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1i08 h GLU 170 CO 0.58 0.14 0.00 1.12 -1.00 0.00 0.00 179.01 179.86 1i08 h HIS 171 N 0.20 0.00 0.00 4.33 2.07 -1.99 0.12 115.15 119.89 1i08 h HIS 171 Ca 0.05 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.57 1i08 h HIS 171 Cb 0.00 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.98 1i08 h HIS 171 CO 0.00 0.00 -0.14 0.00 -3.07 0.00 0.00 177.93 174.72 1i08 h ALA 172 N 2.02 0.91 0.00 6.11 0.00 -1.64 -3.40 119.26 123.26 1i08 h ALA 172 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1i08 h ALA 172 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1i08 h ALA 172 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 179.25 181.73 1i08 n TYR 173 N -2.26 0.00 -0.21 0.00 0.18 -0.69 -4.95 117.16 109.22 1i08 n TYR 173 Ca 0.05 0.00 -0.08 0.00 1.88 0.00 0.00 57.90 59.75 1i08 n TYR 173 Cb 0.44 0.01 0.03 0.00 -0.38 0.00 0.00 39.34 39.43 1i08 n TYR 173 CO 0.00 0.00 0.00 -0.92 -2.08 0.00 0.00 176.86 173.86 1i08 h TYR 174 N 0.00 1.06 -0.81 -3.48 3.20 -0.98 0.14 116.97 116.09 1i08 h TYR 174 Ca 0.00 -0.15 0.06 0.00 3.14 0.00 0.00 58.73 61.79 1i08 h TYR 174 Cb 0.36 -0.29 -0.06 0.00 1.54 0.00 0.00 36.73 38.28 1i08 h TYR 174 CO 0.00 0.91 0.49 -0.07 -1.64 0.00 0.00 178.16 177.85 1i08 h LEU 175 N 0.90 0.76 0.05 2.82 3.38 -1.87 0.12 115.31 121.46 1i08 h LEU 175 Ca 0.18 0.02 -0.38 0.00 0.09 0.00 0.00 57.88 57.80 1i08 h LEU 175 Cb 0.42 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.98 1i08 h LEU 175 CO 0.01 0.48 -2.23 1.17 0.09 0.00 0.00 178.44 177.97 1i08 n LYS 176 N -4.67 0.68 0.00 1.13 4.81 -1.20 -4.59 118.16 114.32 1i08 n LYS 176 Ca 0.11 0.23 0.10 0.00 -0.87 0.00 0.00 58.31 57.89 1i08 n LYS 176 Cb 0.18 -1.60 -0.01 0.00 0.02 0.00 0.00 35.03 33.61 1i08 n LYS 176 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 1i08 n PHE 177 N -3.53 0.00 0.00 5.64 3.72 0.46 -5.05 117.46 118.71 1i08 n PHE 177 Ca -0.41 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 56.99 1i08 n PHE 177 Cb 0.98 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.52 1i08 n PHE 177 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1i08 n GLN 178 N -0.17 0.00 0.00 -1.08 3.00 0.42 -0.98 117.38 118.57 1i08 n GLN 178 Ca 0.08 0.00 0.14 0.00 -0.01 0.00 0.00 57.00 57.21 1i08 n GLN 178 Cb 0.42 0.00 0.64 0.00 0.00 0.00 0.00 30.24 31.30 1i08 n GLN 178 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.06 177.33 1i08 n ASN 179 N 4.63 0.10 -3.82 1.08 6.94 -1.26 -4.25 115.26 118.69 1i08 n ASN 179 Ca 0.00 0.08 -0.42 0.00 -0.02 0.00 0.00 54.58 54.21 1i08 n ASN 179 Cb 0.00 -0.31 -0.00 0.00 -2.36 0.00 0.00 39.78 37.11 1i08 n ASN 179 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1i08 n ARG 180 N -1.36 2.88 -0.18 -3.83 1.74 -0.15 -4.75 116.66 111.02 1i08 n ARG 180 Ca 0.10 -2.67 0.03 0.00 -0.77 0.00 0.00 57.85 54.54 1i08 n ARG 180 Cb 0.30 -3.31 0.30 0.00 -1.02 0.00 0.00 32.46 28.72 1i08 n ARG 180 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 1i08 h ARG 181 N 6.17 0.86 -0.95 5.56 2.43 -1.83 -2.40 114.38 124.22 1i08 h ARG 181 Ca 0.56 -0.05 0.06 0.00 -0.81 0.00 0.00 59.98 59.73 1i08 h ARG 181 Cb 0.66 -0.19 -0.06 0.00 -0.42 0.00 0.00 29.97 29.96 1i08 h ARG 181 CO 1.84 0.57 0.62 -1.35 -1.51 0.00 0.00 179.97 180.14 1i08 h PRO 182 N 0.89 1.09 -0.56 0.20 0.11 -1.98 -0.07 132.00 131.68 1i08 h PRO 182 Ca 0.27 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 66.24 1i08 h PRO 182 Cb -0.02 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 30.82 1i08 h PRO 182 CO -0.07 0.72 0.06 -0.44 -0.21 0.00 0.00 178.00 178.06 1i08 h ASP 183 N 1.12 0.87 -0.32 -2.05 3.32 -1.84 -1.64 116.42 115.89 1i08 h ASP 183 Ca 0.40 -0.20 -0.02 0.00 0.02 0.00 0.00 57.03 57.23 1i08 h ASP 183 Cb 0.15 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 1i08 h ASP 183 CO -0.15 0.90 0.11 0.22 -1.72 0.00 0.00 179.24 178.61 1i08 h TYR 184 N 0.86 0.50 -0.77 4.55 3.20 -1.15 -1.97 116.97 122.19 1i08 h TYR 184 Ca 0.17 -0.04 -0.00 0.00 3.14 0.00 0.00 58.73 62.00 1i08 h TYR 184 Cb 0.43 -0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.52 1i08 h TYR 184 CO 0.03 0.49 0.47 0.82 -1.64 0.00 0.00 178.16 178.33 1i08 h ILE 185 N 0.36 1.21 -0.45 1.81 2.04 -0.77 -1.97 117.51 119.74 1i08 h ILE 185 Ca 0.10 -0.44 -0.05 0.00 1.00 0.00 0.00 64.86 65.47 1i08 h ILE 185 Cb 0.22 0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 36.39 1i08 h ILE 185 CO -0.01 0.22 0.10 0.11 0.00 0.00 0.00 178.15 178.57 1i08 h LYS 186 N 1.05 0.73 0.00 2.37 1.79 -0.98 -2.70 116.57 118.83 1i08 h LYS 186 Ca 0.28 -0.18 -0.03 0.00 -2.18 0.00 0.00 60.65 58.53 1i08 h LYS 186 Cb -0.06 -0.09 -0.00 0.00 -1.58 0.00 0.00 32.23 30.49 1i08 h LYS 186 CO -0.05 0.74 -0.16 0.93 -1.08 0.00 0.00 179.45 179.82 1i08 h GLU 187 N 0.61 0.00 -0.88 3.15 4.39 -0.87 -2.84 114.58 118.14 1i08 h GLU 187 Ca 0.14 0.00 0.13 0.00 0.34 0.00 0.00 59.36 59.97 1i08 h GLU 187 Cb 0.34 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 28.92 1i08 h GLU 187 CO 0.00 0.16 0.57 0.35 -1.16 0.00 0.00 179.01 178.93 1i08 h PHE 188 N 0.00 0.84 0.00 4.33 3.57 -1.02 -0.75 116.94 123.90 1i08 h PHE 188 Ca -0.00 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.52 1i08 h PHE 188 Cb 0.31 -0.27 -0.00 0.00 2.79 0.00 0.00 35.95 38.78 1i08 h PHE 188 CO 0.00 0.34 -0.01 -1.49 -2.23 0.00 0.00 178.31 174.91 1i08 h TRP 189 N 0.73 0.00 0.00 0.41 -0.00 -1.58 -0.76 115.95 114.75 1i08 h TRP 189 Ca 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 59.32 1i08 h TRP 189 Cb 0.62 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.78 1i08 h TRP 189 CO -0.00 0.01 -0.15 -0.91 -0.00 0.00 0.00 178.44 177.39 1i08 h ASN 190 N 0.00 0.00 -0.00 -3.49 2.35 -1.31 -3.35 115.58 109.78 1i08 h ASN 190 Ca -0.00 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1i08 h ASN 190 Cb 0.05 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.42 1i08 h ASN 190 CO 0.00 0.01 0.00 1.33 -1.65 0.00 0.00 177.43 177.12 1i08 n VAL 191 N -2.69 0.27 -2.15 2.81 0.24 -0.40 -4.48 118.33 111.94 1i08 n VAL 191 Ca 0.04 -0.64 -0.42 0.00 -2.04 0.00 0.00 64.34 61.29 1i08 n VAL 191 Cb 0.49 0.87 -0.03 0.00 -1.47 0.00 0.00 33.84 33.70 1i08 n VAL 191 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1i08 s VAL 192 N -0.28 3.31 -0.89 3.34 0.11 -0.57 0.27 120.40 125.70 1i08 s VAL 192 Ca 0.00 0.90 -0.24 0.00 -2.93 0.00 0.00 61.98 59.72 1i08 s VAL 192 Cb 0.00 -3.58 0.06 0.00 -1.53 0.00 0.00 36.38 31.33 1i08 s VAL 192 CO 0.00 0.05 1.31 0.21 -3.33 0.00 0.00 175.10 173.34 1i08 s ASN 193 N 1.34 6.38 0.45 3.54 3.84 0.88 -4.60 114.94 126.79 1i08 s ASN 193 Ca 0.65 -1.19 0.21 0.00 0.21 0.00 0.00 52.86 52.74 1i08 s ASN 193 Cb -0.37 -2.53 1.08 0.00 -0.55 0.00 0.00 41.25 38.89 1i08 s ASN 193 CO 0.30 -1.54 1.94 -0.50 -2.79 0.00 0.00 177.10 174.51 1i08 h TRP 194 N 9.71 0.00 -0.28 0.43 4.06 -1.87 -1.98 115.95 126.02 1i08 h TRP 194 Ca 0.00 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 60.93 1i08 h TRP 194 Cb 1.03 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.18 1i08 h TRP 194 CO 1.19 0.23 0.07 -0.44 -3.56 0.00 0.00 178.44 175.92 1i08 h ASP 195 N 0.00 0.43 -0.57 -3.49 3.32 -1.89 0.13 116.42 114.36 1i08 h ASP 195 Ca -0.00 -0.23 -0.06 0.00 0.02 0.00 0.00 57.03 56.75 1i08 h ASP 195 Cb 0.51 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.92 1i08 h ASP 195 CO 0.03 0.55 0.12 -0.08 -1.72 0.00 0.00 179.24 178.14 1i08 h GLU 196 N 0.29 0.92 -0.61 3.56 4.57 -1.82 -0.68 114.58 120.81 1i08 h GLU 196 Ca 0.09 -0.23 0.01 0.00 -1.18 0.00 0.00 59.36 58.04 1i08 h GLU 196 Cb 0.29 -0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.73 1i08 h GLU 196 CO 0.00 0.87 0.40 0.00 -1.18 0.00 0.00 179.01 179.10 1i08 h ALA 197 N 1.01 0.77 -0.49 2.92 0.00 -1.12 -0.64 119.26 121.71 1i08 h ALA 197 Ca 0.18 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1i08 h ALA 197 Cb 0.37 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1i08 h ALA 197 CO 0.01 0.20 0.22 0.00 0.00 0.00 0.00 179.25 179.68 1i08 h ALA 198 N 1.22 0.64 -0.52 0.00 0.00 -0.42 -0.97 119.26 119.20 1i08 h ALA 198 Ca 0.22 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 55.04 1i08 h ALA 198 Cb -0.10 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.46 1i08 h ALA 198 CO -0.05 0.22 0.29 0.00 0.00 0.00 0.00 179.25 179.71 1i08 h ALA 199 N 1.06 0.67 -0.41 0.00 0.00 -0.53 -0.48 119.26 119.57 1i08 h ALA 199 Ca 0.17 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 1i08 h ALA 199 Cb 0.15 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1i08 h ALA 199 CO -0.02 -0.04 -0.13 0.00 0.00 0.00 0.00 179.25 179.07 1i08 h ARG 200 N 0.56 0.74 -0.69 0.00 3.08 -0.89 -1.63 114.38 115.54 1i08 h ARG 200 Ca 0.22 -0.25 -0.05 0.00 0.07 0.00 0.00 59.98 59.97 1i08 h ARG 200 Cb 0.09 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.05 1i08 h ARG 200 CO -0.13 0.84 0.22 0.35 -1.07 0.00 0.00 179.97 180.17 1i08 h PHE 201 N 0.67 1.10 -0.45 3.04 3.57 -0.49 0.23 116.94 124.61 1i08 h PHE 201 Ca 0.11 -0.10 -0.13 0.00 3.53 0.00 0.00 57.97 61.38 1i08 h PHE 201 Cb 0.59 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.00 1i08 h PHE 201 CO 0.03 0.87 -0.24 0.00 -2.23 0.00 0.00 178.31 176.74 1i08 h ALA 202 N 1.21 0.71 -0.28 2.41 0.00 -0.78 -3.19 119.26 119.33 1i08 h ALA 202 Ca 0.23 -0.40 -0.14 0.00 0.00 0.00 0.00 54.91 54.60 1i08 h ALA 202 Cb 0.29 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1i08 h ALA 202 CO -0.01 0.67 -0.37 0.00 0.00 0.00 0.00 179.25 179.54 1i08 h ALA 203 N 0.90 0.42 0.00 0.00 0.00 -0.97 -3.46 119.26 116.15 1i08 h ALA 203 Ca 0.10 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1i08 h ALA 203 Cb 0.81 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1i08 h ALA 203 CO 0.07 0.50 0.00 1.63 0.00 0.00 0.00 179.25 181.45 1i08 n LYS 204 N -4.19 0.00 0.00 0.00 5.02 0.04 -5.10 118.16 113.92 1i08 n LYS 204 Ca -0.04 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.25 1i08 n LYS 204 Cb 0.52 -4.26 0.00 0.00 -0.02 0.00 0.00 35.03 31.27 1i08 n LYS 204 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05