#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nf6 s ASN 4 N 0.00 6.97 0.13 1.61 3.84 -1.26 -4.91 114.94 121.31 1nf6 s ASN 4 Ca 0.00 2.31 -0.28 0.00 0.21 0.00 0.00 52.86 55.09 1nf6 s ASN 4 Cb 0.00 -2.60 -0.05 0.00 -0.55 0.00 0.00 41.25 38.04 1nf6 s ASN 4 CO 0.00 -0.49 1.59 0.03 -2.79 0.00 0.00 177.10 175.45 1nf6 h ARG 5 N 5.61 -0.48 -0.49 0.43 2.47 -2.01 0.59 114.38 120.50 1nf6 h ARG 5 Ca -0.44 0.03 0.01 0.00 -1.26 0.00 0.00 59.98 58.32 1nf6 h ARG 5 Cb 1.21 0.11 -0.03 0.00 -1.65 0.00 0.00 29.97 29.61 1nf6 h ARG 5 CO 0.78 -0.32 0.31 0.93 0.56 0.00 0.00 179.97 182.23 1nf6 h GLU 6 N -0.50 0.61 -0.86 0.04 3.07 -1.99 -2.05 114.58 112.90 1nf6 h GLU 6 Ca 0.07 -0.04 -0.01 0.00 -0.50 0.00 0.00 59.36 58.88 1nf6 h GLU 6 Cb 0.61 -0.14 -0.04 0.00 -0.84 0.00 0.00 28.75 28.34 1nf6 h GLU 6 CO -0.34 0.40 0.48 0.38 -1.40 0.00 0.00 179.01 178.53 1nf6 h ASP 7 N 0.63 1.06 -0.49 1.42 -0.00 -1.78 0.22 116.42 117.47 1nf6 h ASP 7 Ca 0.19 -0.08 -0.03 0.00 -0.00 0.00 0.00 57.03 57.11 1nf6 h ASP 7 Cb -0.03 -0.27 -0.02 0.00 -0.00 0.00 0.00 39.33 39.01 1nf6 h ASP 7 CO -0.06 0.84 0.19 0.03 -0.00 0.00 0.00 179.24 180.24 1nf6 h ARG 8 N 1.19 0.73 -0.55 4.15 3.08 0.54 -2.35 114.38 121.17 1nf6 h ARG 8 Ca 0.30 -0.13 -0.10 0.00 0.07 0.00 0.00 59.98 60.12 1nf6 h ARG 8 Cb 0.00 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 1nf6 h ARG 8 CO -0.05 0.66 -0.06 0.87 -1.07 0.00 0.00 179.97 180.31 1nf6 h LYS 9 N 0.65 1.00 -0.65 0.04 1.57 -0.87 -2.82 116.57 115.48 1nf6 h LYS 9 Ca 0.16 -0.34 0.07 0.00 -1.87 0.00 0.00 60.65 58.67 1nf6 h LYS 9 Cb 0.20 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 32.37 1nf6 h LYS 9 CO -0.01 1.02 0.34 0.00 -0.57 0.00 0.00 179.45 180.23 1nf6 h ALA 10 N 1.01 0.88 -0.18 3.86 0.00 -0.17 0.16 119.26 124.82 1nf6 h ALA 10 Ca 0.15 0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.97 1nf6 h ALA 10 Cb 0.61 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1nf6 h ALA 10 CO 0.04 -0.02 -0.41 0.87 0.00 0.00 0.00 179.25 179.73 1nf6 h LYS 11 N 0.61 0.41 -0.01 0.00 1.57 -1.34 -2.03 116.57 115.79 1nf6 h LYS 11 Ca 0.30 -0.20 -0.22 0.00 -1.87 0.00 0.00 60.65 58.66 1nf6 h LYS 11 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1nf6 h LYS 11 CO -0.21 0.75 -0.93 0.28 -0.57 0.00 0.00 179.45 178.77 1nf6 h VAL 12 N 0.34 1.39 -0.66 0.50 2.07 -1.11 -2.70 116.25 116.08 1nf6 h VAL 12 Ca 0.03 -2.42 -0.00 0.00 0.82 0.00 0.00 66.70 65.13 1nf6 h VAL 12 Cb 0.87 2.39 -0.03 0.00 -1.52 0.00 0.00 31.29 33.00 1nf6 h VAL 12 CO 0.07 0.72 0.41 0.40 0.02 0.00 0.00 177.57 179.19 1nf6 h ILE 13 N 0.24 1.18 -0.44 4.57 2.04 -0.45 0.03 117.51 124.69 1nf6 h ILE 13 Ca -0.08 -0.38 -0.13 0.00 1.00 0.00 0.00 64.86 65.28 1nf6 h ILE 13 Cb 1.57 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 1nf6 h ILE 13 CO 0.16 0.18 -0.23 -0.08 0.00 0.00 0.00 178.15 178.19 1nf6 h GLU 14 N 0.90 0.90 0.06 2.37 4.81 -1.25 0.68 114.58 123.04 1nf6 h GLU 14 Ca 0.24 -0.38 -0.24 0.00 -0.13 0.00 0.00 59.36 58.85 1nf6 h GLU 14 Cb -0.06 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 1nf6 h GLU 14 CO -0.05 1.03 -1.06 -0.39 -0.73 0.00 0.00 179.01 177.82 1nf6 h VAL 15 N 0.78 1.52 -0.86 0.32 -1.51 -1.22 -2.20 116.25 113.07 1nf6 h VAL 15 Ca 0.10 -2.91 -0.00 0.00 -1.23 0.00 0.00 66.70 62.66 1nf6 h VAL 15 Cb 0.78 2.72 -0.04 0.00 -2.13 0.00 0.00 31.29 32.62 1nf6 h VAL 15 CO 0.06 0.85 0.52 -0.07 -1.23 0.00 0.00 177.57 177.70 1nf6 h LEU 16 N 0.09 1.03 -0.38 4.19 3.38 -0.81 0.18 115.31 123.00 1nf6 h LEU 16 Ca -0.08 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 57.77 1nf6 h LEU 16 Cb 1.75 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 42.23 1nf6 h LEU 16 CO 0.17 0.79 -0.27 0.78 0.09 0.00 0.00 178.44 179.99 1nf6 h ASN 17 N 1.19 0.00 -0.09 -0.43 2.35 -0.89 -1.26 115.58 116.45 1nf6 h ASN 17 Ca 0.31 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.89 1nf6 h ASN 17 Cb -0.05 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.32 1nf6 h ASN 17 CO -0.06 0.27 -0.60 0.11 -1.65 0.00 0.00 177.43 175.50 1nf6 h LYS 18 N 0.00 0.56 -0.36 0.81 1.57 -0.59 -2.32 116.57 116.24 1nf6 h LYS 18 Ca -0.00 -0.49 -0.02 0.00 -1.87 0.00 0.00 60.65 58.26 1nf6 h LYS 18 Cb 1.07 0.11 -0.02 0.00 0.08 0.00 0.00 32.23 33.48 1nf6 h LYS 18 CO 0.04 1.11 0.13 0.00 -0.57 0.00 0.00 179.45 180.16 1nf6 h ALA 19 N 0.46 0.47 -0.46 3.86 0.00 -0.63 -3.00 119.26 119.96 1nf6 h ALA 19 Ca -0.05 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1nf6 h ALA 19 Cb 1.26 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 1nf6 h ALA 19 CO 0.12 0.09 0.22 -0.09 0.00 0.00 0.00 179.25 179.59 1nf6 h ARG 20 N 0.44 0.64 -0.10 0.00 2.43 -1.27 -1.85 114.38 114.66 1nf6 h ARG 20 Ca 0.12 -0.07 -0.11 0.00 -0.81 0.00 0.00 59.98 59.11 1nf6 h ARG 20 Cb 0.22 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 1nf6 h ARG 20 CO -0.01 0.50 -0.43 0.00 -1.51 0.00 0.00 179.97 178.52 1nf6 h ALA 21 N 1.60 1.08 -0.51 2.80 0.00 -1.31 -1.75 119.26 121.17 1nf6 h ALA 21 Ca 0.16 -0.43 -0.11 0.00 0.00 0.00 0.00 54.91 54.54 1nf6 h ALA 21 Cb 0.08 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1nf6 h ALA 21 CO -0.02 0.60 -0.09 0.52 0.00 0.00 0.00 179.25 180.26 1nf6 h MET 22 N 0.19 0.97 -0.51 0.00 2.86 -1.31 0.28 114.93 117.40 1nf6 h MET 22 Ca 0.01 -0.36 -0.05 0.00 -2.06 0.00 0.00 59.70 57.24 1nf6 h MET 22 Cb 0.85 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.42 1nf6 h MET 22 CO 0.07 1.03 0.11 0.93 1.06 0.00 0.00 176.91 180.10 1nf6 h GLU 23 N 0.83 0.84 -0.74 1.72 4.39 -1.00 -0.48 114.58 120.14 1nf6 h GLU 23 Ca 0.13 -0.21 0.07 0.00 0.34 0.00 0.00 59.36 59.70 1nf6 h GLU 23 Cb 0.65 -0.10 -0.06 0.00 -0.10 0.00 0.00 28.75 29.13 1nf6 h GLU 23 CO 0.04 0.81 0.42 -0.07 -1.16 0.00 0.00 179.01 179.05 1nf6 h LEU 24 N 0.72 0.61 0.35 1.33 3.38 -1.34 0.13 115.31 120.49 1nf6 h LEU 24 Ca 0.16 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 1nf6 h LEU 24 Cb 0.36 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1nf6 h LEU 24 CO 0.01 0.38 -0.17 -0.74 0.09 0.00 0.00 178.44 178.00 1nf6 h HIS 25 N 0.74 -0.44 -0.81 1.13 2.76 -0.98 -2.44 115.15 115.12 1nf6 h HIS 25 Ca 0.34 -0.01 0.11 0.00 -2.20 0.00 0.00 60.37 58.61 1nf6 h HIS 25 Cb 0.25 0.14 -0.08 0.00 1.55 0.00 0.00 27.41 29.28 1nf6 h HIS 25 CO -0.07 -0.23 0.44 0.00 -1.30 0.00 0.00 177.93 176.77 1nf6 h ALA 26 N 0.09 1.16 -0.80 5.26 0.00 -0.84 0.23 119.26 124.35 1nf6 h ALA 26 Ca -0.05 0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1nf6 h ALA 26 Cb 0.41 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 1nf6 h ALA 26 CO 0.08 0.01 0.51 0.82 0.00 0.00 0.00 179.25 180.68 1nf6 h ILE 27 N 0.70 1.13 -0.03 0.00 2.04 -0.58 0.41 117.51 121.18 1nf6 h ILE 27 Ca 0.40 -0.34 -0.21 0.00 1.00 0.00 0.00 64.86 65.71 1nf6 h ILE 27 Cb 0.44 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.56 1nf6 h ILE 27 CO -0.28 0.18 -0.87 0.45 0.00 0.00 0.00 178.15 177.63 1nf6 h HIS 28 N 1.00 0.61 -0.19 1.37 3.86 -0.81 -1.91 115.15 119.09 1nf6 h HIS 28 Ca 0.32 -0.31 -0.03 0.00 -1.16 0.00 0.00 60.37 59.19 1nf6 h HIS 28 Cb -0.00 -0.08 -0.01 0.00 1.06 0.00 0.00 27.41 28.38 1nf6 h HIS 28 CO -0.03 1.11 0.01 0.37 0.86 0.00 0.00 177.93 180.26 1nf6 h GLN 29 N 0.26 0.32 -0.21 2.45 5.75 -0.25 -1.57 115.11 121.85 1nf6 h GLN 29 Ca -0.06 -0.10 -0.18 0.00 -0.15 0.00 0.00 58.65 58.16 1nf6 h GLN 29 Cb 1.49 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 30.01 1nf6 h GLN 29 CO 0.15 0.51 -0.56 1.88 -2.65 0.00 0.00 178.83 178.16 1nf6 h TYR 30 N 0.09 0.97 -0.65 3.99 0.99 -0.99 -2.00 116.97 119.38 1nf6 h TYR 30 Ca 0.06 -0.38 -0.06 0.00 2.00 0.00 0.00 58.73 60.35 1nf6 h TYR 30 Cb 0.35 -0.17 -0.03 0.00 1.00 0.00 0.00 36.73 37.89 1nf6 h TYR 30 CO 0.03 1.19 0.18 0.52 -0.00 0.00 0.00 178.16 180.07 1nf6 h MET 31 N 0.48 1.01 -0.14 4.88 2.86 -1.36 0.31 114.93 122.96 1nf6 h MET 31 Ca -0.01 -0.22 0.04 0.00 -2.06 0.00 0.00 59.70 57.45 1nf6 h MET 31 Cb 1.18 -0.15 -0.05 0.00 0.06 0.00 0.00 31.60 32.65 1nf6 h MET 31 CO 0.12 0.88 -0.14 -0.97 1.06 0.00 0.00 176.91 177.87 1nf6 h ASN 32 N 0.97 -0.44 0.37 1.22 -1.24 -1.18 -0.05 115.58 115.23 1nf6 h ASN 32 Ca 0.21 0.09 -0.03 0.00 0.71 0.00 0.00 56.30 57.28 1nf6 h ASN 32 Cb 0.32 0.21 -0.00 0.00 0.73 0.00 0.00 38.32 39.58 1nf6 h ASN 32 CO -0.00 -0.18 -0.14 1.56 -1.29 0.00 0.00 177.43 177.38 1nf6 h GLN 33 N -0.16 0.00 -0.43 6.67 4.20 -0.73 -2.17 115.11 122.48 1nf6 h GLN 33 Ca 0.10 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.73 1nf6 h GLN 33 Cb 0.30 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.07 1nf6 h GLN 33 CO -0.24 0.14 -0.03 1.25 -0.67 0.00 0.00 178.83 179.27 1nf6 h HIS 34 N 0.00 0.87 -0.51 2.96 2.76 0.94 -1.03 115.15 121.14 1nf6 h HIS 34 Ca -0.00 -0.16 -0.05 0.00 -2.20 0.00 0.00 60.37 57.95 1nf6 h HIS 34 Cb 0.36 -0.22 -0.02 0.00 1.55 0.00 0.00 27.41 29.07 1nf6 h HIS 34 CO 0.00 0.86 0.09 1.88 -1.30 0.00 0.00 177.93 179.46 1nf6 h TYR 35 N 0.62 0.83 -0.11 5.26 0.99 -0.42 -0.37 116.97 123.77 1nf6 h TYR 35 Ca 0.12 -0.08 -0.05 0.00 2.00 0.00 0.00 58.73 60.72 1nf6 h TYR 35 Cb 0.53 -0.24 -0.00 0.00 1.00 0.00 0.00 36.73 38.02 1nf6 h TYR 35 CO 0.04 0.72 -0.12 0.77 -0.00 0.00 0.00 178.16 179.56 1nf6 h SER 36 N 0.76 0.30 -0.75 3.88 0.02 -1.37 0.32 113.55 116.72 1nf6 h SER 36 Ca 0.16 -0.49 -0.02 0.00 -0.84 0.00 0.00 61.79 60.60 1nf6 h SER 36 Cb 0.33 -0.08 -0.04 0.00 0.14 0.00 0.00 62.40 62.75 1nf6 h SER 36 CO 0.00 0.73 0.40 -0.07 -1.14 0.00 0.00 176.83 176.76 1nf6 h LEU 37 N -0.13 0.94 -0.06 5.07 3.38 -1.06 0.65 115.31 124.10 1nf6 h LEU 37 Ca 0.02 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 1nf6 h LEU 37 Cb 0.65 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 1nf6 h LEU 37 CO 0.03 0.78 0.01 -0.78 0.09 0.00 0.00 178.44 178.56 1nf6 h ASP 38 N 1.04 0.10 -0.98 -0.43 3.58 -1.08 -1.08 116.42 117.57 1nf6 h ASP 38 Ca 0.26 -0.28 0.23 0.00 0.42 0.00 0.00 57.03 57.66 1nf6 h ASP 38 Cb 0.05 -0.03 -0.08 0.00 1.72 0.00 0.00 39.33 40.99 1nf6 h ASP 38 CO -0.04 0.36 0.64 -0.78 -2.88 0.00 0.00 179.24 176.53 1nf6 h ASP 39 N -0.16 0.46 1.33 2.28 3.58 -0.74 0.33 116.42 123.50 1nf6 h ASP 39 Ca 0.02 0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.53 1nf6 h ASP 39 Cb 0.30 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.34 1nf6 h ASP 39 CO 0.00 0.15 0.00 0.24 -2.88 0.00 0.00 179.24 176.75 1nf6 h MET 40 N 0.44 0.00 -2.85 0.28 2.86 -0.16 -3.47 114.93 112.03 1nf6 h MET 40 Ca 0.54 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 58.00 1nf6 h MET 40 Cb 1.29 0.00 0.05 0.00 0.06 0.00 0.00 31.60 33.00 1nf6 h MET 40 CO -0.25 0.00 -0.29 -3.47 1.06 0.00 0.00 176.91 173.96 1nf6 n ASP 41 N -2.53 -3.82 -4.00 1.22 2.03 0.11 -4.90 116.55 104.66 1nf6 n ASP 41 Ca 0.04 -0.20 -0.42 0.00 0.52 0.00 0.00 54.79 54.73 1nf6 n ASP 41 Cb 0.38 -2.49 -0.00 0.00 -0.72 0.00 0.00 41.12 38.29 1nf6 n ASP 41 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 1nf6 n TYR 42 N -3.67 2.77 -0.15 -0.67 0.53 -0.77 -0.63 117.16 114.56 1nf6 n TYR 42 Ca -0.01 -2.90 -0.04 0.00 -1.02 0.00 0.00 57.90 53.93 1nf6 n TYR 42 Cb 0.54 -1.25 -0.04 0.00 -1.03 0.00 0.00 39.34 37.56 1nf6 n TYR 42 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1nf6 n GLY 43 N 1.46 -1.52 0.05 2.72 0.00 -1.18 -1.38 105.19 105.35 1nf6 n GLY 43 Ca 0.26 0.54 -0.12 0.00 0.00 0.00 0.00 46.02 46.70 1nf6 n GLY 43 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1nf6 h GLU 44 N 0.00 -0.02 -0.36 1.61 4.81 -1.71 -0.46 114.58 118.46 1nf6 h GLU 44 Ca 0.06 0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.34 1nf6 h GLU 44 Cb 0.15 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.49 1nf6 h GLU 44 CO -0.34 0.15 0.11 -0.07 -0.73 0.00 0.00 179.01 178.12 1nf6 h LEU 45 N -0.18 0.09 -0.92 1.64 3.38 -1.79 0.22 115.31 117.76 1nf6 h LEU 45 Ca -0.00 0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.06 1nf6 h LEU 45 Cb 0.17 0.04 -0.06 0.00 0.09 0.00 0.00 40.66 40.91 1nf6 h LEU 45 CO 0.00 0.09 0.59 0.00 0.09 0.00 0.00 178.44 179.21 1nf6 h ALA 46 N 1.24 1.25 -0.21 1.53 0.00 -1.11 -1.39 119.26 120.57 1nf6 h ALA 46 Ca 0.17 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1nf6 h ALA 46 Cb 0.16 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1nf6 h ALA 46 CO -0.19 0.40 0.02 0.00 0.00 0.00 0.00 179.25 179.49 1nf6 h ALA 47 N 1.40 0.29 -0.07 0.00 0.00 -0.24 -2.96 119.26 117.68 1nf6 h ALA 47 Ca 0.38 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.97 1nf6 h ALA 47 Cb 0.09 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1nf6 h ALA 47 CO -0.15 -0.02 -0.56 -0.91 0.00 0.00 0.00 179.25 177.61 1nf6 h ASN 48 N 0.15 0.24 -0.30 0.00 2.35 -0.81 -2.49 115.58 114.72 1nf6 h ASN 48 Ca 0.06 -0.13 0.03 0.00 -0.55 0.00 0.00 56.30 55.71 1nf6 h ASN 48 Cb 0.35 -0.07 -0.03 0.00 0.05 0.00 0.00 38.32 38.62 1nf6 h ASN 48 CO 0.01 0.75 0.12 -0.03 -1.65 0.00 0.00 177.43 176.62 1nf6 h MET 49 N 0.17 0.25 -0.32 0.81 4.05 -1.24 -1.22 114.93 117.43 1nf6 h MET 49 Ca -0.00 -0.02 -0.06 0.00 -0.28 0.00 0.00 59.70 59.34 1nf6 h MET 49 Cb 1.03 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.76 1nf6 h MET 49 CO 0.08 0.17 -0.03 -0.22 0.23 0.00 0.00 176.91 177.14 1nf6 h LYS 50 N 0.26 0.59 -0.79 0.39 3.64 -1.45 -0.47 116.57 118.74 1nf6 h LYS 50 Ca 0.13 -0.21 0.06 0.00 -1.27 0.00 0.00 60.65 59.37 1nf6 h LYS 50 Cb 0.09 -0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 31.81 1nf6 h LYS 50 CO -0.13 0.74 0.48 -0.07 -2.27 0.00 0.00 179.45 178.20 1nf6 h LEU 51 N 0.38 0.74 -0.74 5.20 3.38 -1.33 0.29 115.31 123.23 1nf6 h LEU 51 Ca 0.09 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 1nf6 h LEU 51 Cb 0.50 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1nf6 h LEU 51 CO 0.02 0.47 0.20 0.40 0.09 0.00 0.00 178.44 179.63 1nf6 h ILE 52 N 0.87 1.26 -0.11 1.22 2.04 -0.95 -0.60 117.51 121.24 1nf6 h ILE 52 Ca 0.35 -0.95 -0.01 0.00 1.00 0.00 0.00 64.86 65.24 1nf6 h ILE 52 Cb 0.18 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 36.73 1nf6 h ILE 52 CO -0.18 0.37 0.00 0.00 0.00 0.00 0.00 178.15 178.35 1nf6 h ALA 53 N 1.11 1.81 -0.10 1.87 0.00 0.60 -0.51 119.26 124.03 1nf6 h ALA 53 Ca 0.23 -0.07 -0.14 0.00 0.00 0.00 0.00 54.91 54.93 1nf6 h ALA 53 Cb 0.34 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1nf6 h ALA 53 CO -0.00 0.15 -0.56 0.82 0.00 0.00 0.00 179.25 179.66 1nf6 h ILE 54 N 0.15 1.36 -0.54 0.00 2.04 0.75 -0.39 117.51 120.88 1nf6 h ILE 54 Ca 0.04 -1.87 0.03 0.00 1.00 0.00 0.00 64.86 64.06 1nf6 h ILE 54 Cb 0.10 1.90 -0.04 0.00 -0.74 0.00 0.00 36.82 38.04 1nf6 h ILE 54 CO 0.00 0.56 0.32 0.44 0.00 0.00 0.00 178.15 179.47 1nf6 h ASP 55 N 0.24 0.51 -0.62 1.72 3.32 0.33 -2.26 116.42 119.65 1nf6 h ASP 55 Ca 0.00 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 1nf6 h ASP 55 Cb 1.06 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 40.48 1nf6 h ASP 55 CO 0.09 0.35 0.39 -0.33 -1.72 0.00 0.00 179.24 178.02 1nf6 h GLU 56 N 0.63 0.84 -0.93 3.56 4.39 -0.73 -1.39 114.58 120.96 1nf6 h GLU 56 Ca 0.22 -0.06 0.01 0.00 0.34 0.00 0.00 59.36 59.86 1nf6 h GLU 56 Cb 0.05 -0.18 -0.05 0.00 -0.10 0.00 0.00 28.75 28.47 1nf6 h GLU 56 CO -0.11 0.58 0.60 0.52 -1.16 0.00 0.00 179.01 179.44 1nf6 h MET 57 N 0.86 1.23 -0.40 2.33 2.86 -0.53 -0.90 114.93 120.37 1nf6 h MET 57 Ca 0.23 -0.08 -0.08 0.00 -2.06 0.00 0.00 59.70 57.70 1nf6 h MET 57 Cb -0.06 -0.27 -0.01 0.00 0.06 0.00 0.00 31.60 31.32 1nf6 h MET 57 CO -0.05 0.83 -0.07 0.00 1.06 0.00 0.00 176.91 178.68 1nf6 h ARG 58 N 1.26 0.76 0.07 1.72 3.08 -0.78 -2.26 114.38 118.23 1nf6 h ARG 58 Ca 0.34 -0.28 0.02 0.00 0.07 0.00 0.00 59.98 60.13 1nf6 h ARG 58 Cb -0.12 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 29.85 1nf6 h ARG 58 CO -0.07 0.88 -0.17 0.45 -1.07 0.00 0.00 179.97 179.99 1nf6 h HIS 59 N 0.57 -0.44 -0.90 3.04 3.86 -0.88 0.34 115.15 120.75 1nf6 h HIS 59 Ca 0.11 0.01 0.21 0.00 -1.16 0.00 0.00 60.37 59.53 1nf6 h HIS 59 Cb 0.58 0.19 -0.12 0.00 1.06 0.00 0.00 27.41 29.12 1nf6 h HIS 59 CO 0.05 -0.25 0.42 0.00 0.86 0.00 0.00 177.93 179.00 1nf6 h ALA 60 N 0.54 1.43 -0.22 2.45 0.00 -1.06 0.66 119.26 123.07 1nf6 h ALA 60 Ca 0.03 0.14 -0.17 0.00 0.00 0.00 0.00 54.91 54.92 1nf6 h ALA 60 Cb 0.35 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1nf6 h ALA 60 CO -0.11 -0.29 -0.52 1.49 0.00 0.00 0.00 179.25 179.82 1nf6 h GLU 61 N 0.45 0.73 -0.17 0.00 4.81 -0.77 -2.10 114.58 117.53 1nf6 h GLU 61 Ca 0.55 -0.50 -0.11 0.00 -0.13 0.00 0.00 59.36 59.17 1nf6 h GLU 61 Cb 1.00 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.44 1nf6 h GLU 61 CO -0.49 1.12 -0.39 -0.91 -0.73 0.00 0.00 179.01 177.61 1nf6 h ASN 62 N 0.45 0.38 -0.39 1.04 -0.26 0.93 -0.01 115.58 117.73 1nf6 h ASN 62 Ca -0.00 -0.16 -0.03 0.00 -0.56 0.00 0.00 56.30 55.55 1nf6 h ASN 62 Cb 1.13 -0.11 -0.02 0.00 -1.06 0.00 0.00 38.32 38.27 1nf6 h ASN 62 CO 0.11 0.74 0.12 -0.26 -1.06 0.00 0.00 177.43 177.08 1nf6 h PHE 63 N 0.31 0.62 -0.42 1.19 0.05 -0.87 -2.08 116.94 115.74 1nf6 h PHE 63 Ca 0.03 -0.06 -0.11 0.00 3.82 0.00 0.00 57.97 61.65 1nf6 h PHE 63 Cb 0.82 -0.18 -0.02 0.00 2.00 0.00 0.00 35.95 38.58 1nf6 h PHE 63 CO 0.02 0.58 -0.17 0.00 -0.18 0.00 0.00 178.31 178.56 1nf6 h ALA 64 N 0.97 0.91 -0.67 2.45 0.00 -1.04 0.16 119.26 122.04 1nf6 h ALA 64 Ca 0.12 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 1nf6 h ALA 64 Cb 0.25 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1nf6 h ALA 64 CO -0.00 0.62 0.29 0.93 0.00 0.00 0.00 179.25 181.09 1nf6 h GLU 65 N 0.70 0.97 -0.23 0.00 5.08 -0.90 0.02 114.58 120.23 1nf6 h GLU 65 Ca 0.11 -0.15 -0.08 0.00 -1.00 0.00 0.00 59.36 58.25 1nf6 h GLU 65 Cb 0.68 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1nf6 h GLU 65 CO 0.05 0.78 -0.15 -0.09 -1.00 0.00 0.00 179.01 178.59 1nf6 h ARG 66 N 0.96 0.51 -0.85 2.33 9.65 -0.90 -2.11 114.38 123.98 1nf6 h ARG 66 Ca 0.23 -0.24 0.11 0.00 -1.10 0.00 0.00 59.98 58.99 1nf6 h ARG 66 Cb 0.15 -0.01 -0.08 0.00 -1.39 0.00 0.00 29.97 28.64 1nf6 h ARG 66 CO -0.03 0.80 0.47 0.82 2.80 0.00 0.00 179.97 184.84 1nf6 h ILE 67 N 0.21 0.85 -0.24 1.20 2.04 -0.30 -0.91 117.51 120.36 1nf6 h ILE 67 Ca 0.05 -0.26 -0.12 0.00 1.00 0.00 0.00 64.86 65.53 1nf6 h ILE 67 Cb 0.67 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 1nf6 h ILE 67 CO 0.04 0.14 -0.34 0.11 0.00 0.00 0.00 178.15 178.10 1nf6 h LYS 68 N 0.75 0.51 -0.12 2.37 1.79 -0.89 0.83 116.57 121.81 1nf6 h LYS 68 Ca 0.43 -0.23 -0.06 0.00 -2.18 0.00 0.00 60.65 58.60 1nf6 h LYS 68 Cb 0.47 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.10 1nf6 h LYS 68 CO -0.29 0.79 -0.21 0.93 -1.08 0.00 0.00 179.45 179.58 1nf6 h GLU 69 N 0.44 0.20 -0.01 3.15 5.08 -0.49 -1.53 114.58 121.42 1nf6 h GLU 69 Ca 0.05 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1nf6 h GLU 69 Cb 0.80 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.03 1nf6 h GLU 69 CO 0.07 0.41 -0.09 1.28 -1.00 0.00 0.00 179.01 179.68 1nf6 n LEU 70 N -4.21 0.85 0.00 1.33 4.77 -0.70 -4.93 117.00 114.11 1nf6 n LEU 70 Ca -0.01 -0.21 0.00 0.00 -0.03 0.00 0.00 56.01 55.76 1nf6 n LEU 70 Cb 0.32 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 1nf6 n LEU 70 CO 0.39 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 1nf6 n GLY 71 N 1.22 0.63 4.00 -0.72 0.00 -0.58 -4.96 105.19 104.78 1nf6 n GLY 71 Ca 0.17 -0.27 -0.22 0.00 0.00 0.00 0.00 46.02 45.70 1nf6 n GLY 71 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1nf6 s GLY 72 N -2.25 1.76 -0.23 -0.02 0.00 0.25 -4.98 107.32 101.85 1nf6 s GLY 72 Ca 0.00 -1.83 -0.03 0.00 0.00 0.00 0.00 44.72 42.86 1nf6 s GLY 72 CO 0.00 -1.32 -0.06 1.85 0.00 0.00 0.00 173.10 173.57 1nf6 s GLU 73 N -4.97 3.18 0.21 2.90 2.56 -1.26 -4.18 118.70 117.13 1nf6 s GLU 73 Ca 0.64 -0.75 -0.31 0.00 0.00 0.00 0.00 54.97 54.55 1nf6 s GLU 73 Cb -0.06 -2.97 -0.11 0.00 2.00 0.00 0.00 34.13 33.00 1nf6 s GLU 73 CO 0.42 -0.26 1.57 -2.14 -0.56 0.00 0.00 175.26 174.29 1nf6 s PRO 74 N 1.42 4.19 0.49 4.30 0.02 -1.26 -4.96 135.00 139.20 1nf6 s PRO 74 Ca 0.04 2.43 -0.21 0.00 0.02 0.00 0.00 61.00 63.28 1nf6 s PRO 74 Cb -0.15 -3.11 -0.07 0.00 0.02 0.00 0.00 34.50 31.19 1nf6 s PRO 74 CO -0.04 -0.60 1.09 -0.08 -0.33 0.00 0.00 177.00 177.04 1nf6 s THR 75 N 0.70 3.46 -0.53 0.99 -1.32 -1.26 -4.96 115.64 112.72 1nf6 s THR 75 Ca 0.67 0.96 0.14 0.00 -1.21 0.00 0.00 61.69 62.25 1nf6 s THR 75 Cb -0.45 -3.42 0.42 0.00 -1.51 0.00 0.00 72.50 67.54 1nf6 s THR 75 CO 0.37 -0.15 1.34 0.35 -2.21 0.00 0.00 174.62 174.33 1nf6 n THR 76 N -0.90 1.68 -4.96 5.08 -2.24 -1.26 -4.92 114.28 106.76 1nf6 n THR 76 Ca 0.09 -1.46 -0.27 0.00 -2.27 0.00 0.00 64.05 60.15 1nf6 n THR 76 Cb 0.51 0.11 -0.16 0.00 -2.10 0.00 0.00 70.33 68.69 1nf6 n THR 76 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1nf6 s GLN 77 N -1.95 1.66 0.53 -0.78 -0.21 -1.26 -5.14 119.66 112.51 1nf6 s GLN 77 Ca 0.33 -0.70 -0.06 0.00 0.02 0.00 0.00 55.36 54.95 1nf6 s GLN 77 Cb 0.24 -1.57 -0.03 0.00 1.00 0.00 0.00 33.01 32.65 1nf6 s GLN 77 CO 0.12 0.40 0.84 -1.59 -2.12 0.00 0.00 175.29 172.94 1nf6 s LYS 78 N -0.38 3.39 -0.43 2.91 -2.85 -1.26 -4.37 119.74 116.74 1nf6 s LYS 78 Ca 0.06 0.21 -0.13 0.00 -1.00 0.00 0.00 55.97 55.11 1nf6 s LYS 78 Cb -0.08 -2.31 0.06 0.00 -2.06 0.00 0.00 37.83 33.43 1nf6 s LYS 78 CO -0.00 -0.38 0.31 -2.00 0.10 0.00 0.00 175.35 173.39 1nf6 s GLU 79 N -4.86 2.86 0.00 1.78 2.56 0.93 -4.94 118.70 117.03 1nf6 s GLU 79 Ca 0.50 -1.28 0.00 0.00 0.00 0.00 0.00 54.97 54.19 1nf6 s GLU 79 Cb -0.10 -3.95 0.00 0.00 2.00 0.00 0.00 34.13 32.08 1nf6 s GLU 79 CO 0.46 -0.91 0.00 0.41 -0.56 0.00 0.00 175.26 174.66 1nf6 n GLY 80 N 5.09 -2.46 3.79 -1.50 0.00 -1.26 -4.77 105.19 104.08 1nf6 n GLY 80 Ca -0.12 -2.11 -0.31 0.00 0.00 0.00 0.00 46.02 43.48 1nf6 n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nf6 s LYS 81 N -0.41 3.02 -0.15 1.61 1.02 -1.26 -5.02 119.74 118.53 1nf6 s LYS 81 Ca 0.00 -0.59 -0.22 0.00 0.02 0.00 0.00 55.97 55.19 1nf6 s LYS 81 Cb 0.00 -2.81 -0.03 0.00 -0.52 0.00 0.00 37.83 34.47 1nf6 s LYS 81 CO 0.00 0.60 0.67 0.08 -0.92 0.00 0.00 175.35 175.78 1nf6 s VAL 82 N -1.33 5.02 -0.16 3.17 1.01 -1.26 -5.06 120.40 121.78 1nf6 s VAL 82 Ca 0.28 1.30 -0.21 0.00 0.00 0.00 0.00 61.98 63.35 1nf6 s VAL 82 Cb -0.12 -3.99 -0.03 0.00 0.00 0.00 0.00 36.38 32.24 1nf6 s VAL 82 CO 0.20 0.15 0.60 -0.69 0.00 0.00 0.00 175.10 175.36 1nf6 s VAL 83 N 1.56 5.06 0.37 2.92 1.01 -1.26 -5.09 120.40 124.97 1nf6 s VAL 83 Ca 0.32 1.17 0.08 0.00 0.00 0.00 0.00 61.98 63.55 1nf6 s VAL 83 Cb -0.16 -3.93 -0.03 0.00 0.00 0.00 0.00 36.38 32.25 1nf6 s VAL 83 CO 0.13 0.18 0.25 0.42 0.00 0.00 0.00 175.10 176.08 1nf6 s THR 84 N 1.46 3.02 0.00 3.92 -4.23 -1.26 -4.64 115.64 113.91 1nf6 s THR 84 Ca 0.29 -1.50 0.00 0.00 -1.18 0.00 0.00 61.69 59.30 1nf6 s THR 84 Cb -0.16 -3.05 0.00 0.00 1.34 0.00 0.00 72.50 70.63 1nf6 s THR 84 CO 0.12 -0.12 0.00 0.61 -0.54 0.00 0.00 174.62 174.69 1nf6 n GLY 85 N -1.33 0.55 3.74 3.99 0.00 -1.26 -4.97 105.19 105.91 1nf6 n GLY 85 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 1nf6 n GLY 85 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1nf6 n GLN 86 N -1.89 1.70 -1.73 1.61 6.02 -1.26 -5.00 117.38 116.83 1nf6 n GLN 86 Ca 0.00 0.63 -0.29 0.00 -0.01 0.00 0.00 57.00 57.32 1nf6 n GLN 86 Cb 0.06 -2.56 0.12 0.00 1.02 0.00 0.00 30.24 28.89 1nf6 n GLN 86 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1nf6 s ALA 87 N -1.29 2.19 0.05 -1.58 0.00 -1.26 -4.79 121.76 115.08 1nf6 s ALA 87 Ca 0.71 -0.68 -0.24 0.00 0.00 0.00 0.00 51.96 51.75 1nf6 s ALA 87 Cb -0.42 -2.96 -0.17 0.00 0.00 0.00 0.00 23.12 19.57 1nf6 s ALA 87 CO 0.50 -2.07 1.58 0.28 0.00 0.00 0.00 175.76 176.05 1nf6 h VAL 88 N -1.35 1.06 -0.86 0.00 2.07 -1.99 0.65 116.25 115.83 1nf6 h VAL 88 Ca -0.48 -0.34 0.08 0.00 0.82 0.00 0.00 66.70 66.78 1nf6 h VAL 88 Cb 1.32 1.29 -0.06 0.00 -1.52 0.00 0.00 31.29 32.32 1nf6 h VAL 88 CO 0.60 0.09 0.56 -0.65 0.02 0.00 0.00 177.57 178.19 1nf6 h PRO 89 N -0.21 0.89 0.00 1.57 0.11 -1.99 -2.03 132.00 130.35 1nf6 h PRO 89 Ca -0.01 -0.05 -0.13 0.00 0.11 0.00 0.00 66.00 65.92 1nf6 h PRO 89 Cb 0.19 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.08 1nf6 h PRO 89 CO 0.01 0.59 -0.60 0.28 -0.21 0.00 0.00 178.00 178.06 1nf6 h VAL 90 N 0.91 1.40 0.10 3.15 2.07 -1.86 -2.31 116.25 119.71 1nf6 h VAL 90 Ca 0.38 -2.09 0.01 0.00 0.82 0.00 0.00 66.70 65.83 1nf6 h VAL 90 Cb 0.29 2.14 -0.02 0.00 -1.52 0.00 0.00 31.29 32.18 1nf6 h VAL 90 CO -0.15 0.59 -0.18 0.40 0.02 0.00 0.00 177.57 178.26 1nf6 h ILE 91 N 0.00 0.60 0.00 4.57 2.04 -0.13 -1.49 117.51 123.10 1nf6 h ILE 91 Ca -0.01 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.85 1nf6 h ILE 91 Cb 1.09 0.60 0.00 0.00 -0.74 0.00 0.00 36.82 37.77 1nf6 h ILE 91 CO 0.08 0.00 -0.16 1.88 0.00 0.00 0.00 178.15 179.95 1nf6 h TYR 92 N -0.34 0.00 -0.02 1.37 -1.99 -1.50 -2.44 116.97 112.05 1nf6 h TYR 92 Ca 0.02 0.00 -0.07 0.00 2.00 0.00 0.00 58.73 60.68 1nf6 h TYR 92 Cb 0.36 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.09 1nf6 h TYR 92 CO -0.18 0.00 -0.26 1.49 -0.00 0.00 0.00 178.16 179.21 1nf6 h GLU 93 N 0.00 0.21 -0.43 4.88 4.81 -1.32 -2.94 114.58 119.78 1nf6 h GLU 93 Ca 0.00 -0.20 -0.09 0.00 -0.13 0.00 0.00 59.36 58.93 1nf6 h GLU 93 Cb 0.95 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.37 1nf6 h GLU 93 CO 0.00 0.90 -0.10 0.77 -0.73 0.00 0.00 179.01 179.85 1nf6 h SER 94 N -0.41 0.84 -0.55 1.04 0.02 -1.31 -2.42 113.55 110.77 1nf6 h SER 94 Ca -0.03 -0.36 -0.05 0.00 -0.84 0.00 0.00 61.79 60.51 1nf6 h SER 94 Cb 0.98 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 63.27 1nf6 h SER 94 CO 0.05 1.00 0.16 0.44 -1.14 0.00 0.00 176.83 177.34 1nf6 h ASP 95 N 0.66 0.82 -0.38 3.07 5.19 -1.55 0.30 116.42 124.53 1nf6 h ASP 95 Ca 0.11 -0.22 -0.00 0.00 -0.62 0.00 0.00 57.03 56.30 1nf6 h ASP 95 Cb 0.63 -0.21 -0.02 0.00 0.18 0.00 0.00 39.33 39.91 1nf6 h ASP 95 CO 0.04 0.82 0.23 0.00 -3.12 0.00 0.00 179.24 177.21 1nf6 h ALA 96 N 1.03 0.48 -0.41 3.45 0.00 -1.52 0.29 119.26 122.57 1nf6 h ALA 96 Ca 0.18 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.08 1nf6 h ALA 96 Cb 0.31 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 1nf6 h ALA 96 CO -0.00 -0.04 0.17 -0.44 0.00 0.00 0.00 179.25 178.94 1nf6 h ASP 97 N 0.50 0.22 0.09 0.00 3.32 -0.90 -0.09 116.42 119.54 1nf6 h ASP 97 Ca 0.14 0.04 -0.11 0.00 0.02 0.00 0.00 57.03 57.11 1nf6 h ASP 97 Cb -0.01 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 1nf6 h ASP 97 CO -0.03 0.16 -0.37 -0.61 -1.72 0.00 0.00 179.24 176.68 1nf6 h GLN 98 N 0.35 0.39 0.00 3.56 4.15 -0.13 0.74 115.11 124.18 1nf6 h GLN 98 Ca 0.18 -0.18 -0.10 0.00 0.77 0.00 0.00 58.65 59.32 1nf6 h GLN 98 Cb 0.14 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.81 1nf6 h GLN 98 CO -0.16 0.71 -0.49 0.93 -1.93 0.00 0.00 178.83 177.88 1nf6 h GLU 99 N 0.33 0.00 -0.01 1.69 4.39 -0.02 -1.04 114.58 119.92 1nf6 h GLU 99 Ca 0.03 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.48 1nf6 h GLU 99 Cb 0.80 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.47 1nf6 h GLU 99 CO 0.06 0.49 -1.01 0.22 -1.16 0.00 0.00 179.01 177.62 1nf6 h ASP 100 N 0.00 0.91 -0.09 1.42 1.82 -0.61 -2.63 116.42 117.23 1nf6 h ASP 100 Ca -0.00 -0.73 -0.07 0.00 -0.39 0.00 0.00 57.03 55.83 1nf6 h ASP 100 Cb 1.07 -0.28 -0.01 0.00 0.68 0.00 0.00 39.33 40.79 1nf6 h ASP 100 CO 0.06 1.52 -0.15 0.00 -1.61 0.00 0.00 179.24 179.06 1nf6 h ALA 101 N 0.41 1.26 -0.35 -0.78 0.00 -0.76 -1.92 119.26 117.12 1nf6 h ALA 101 Ca -0.12 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.43 1nf6 h ALA 101 Cb 1.66 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.31 1nf6 h ALA 101 CO 0.20 0.49 -0.10 1.15 0.00 0.00 0.00 179.25 180.99 1nf6 h THR 102 N 0.42 1.28 -0.24 0.00 2.02 -1.17 -1.09 112.91 114.13 1nf6 h THR 102 Ca 0.08 -1.17 -0.01 0.00 0.77 0.00 0.00 66.41 66.08 1nf6 h THR 102 Cb 0.51 1.32 -0.01 0.00 -1.74 0.00 0.00 68.15 68.23 1nf6 h THR 102 CO 0.03 0.38 0.13 0.40 0.37 0.00 0.00 175.52 176.84 1nf6 h ILE 103 N 0.47 1.12 -0.57 3.11 2.04 -1.35 0.13 117.51 122.45 1nf6 h ILE 103 Ca 0.09 -0.33 0.08 0.00 1.00 0.00 0.00 64.86 65.70 1nf6 h ILE 103 Cb 0.61 0.90 -0.07 0.00 -0.74 0.00 0.00 36.82 37.52 1nf6 h ILE 103 CO 0.04 0.12 0.21 -0.33 0.00 0.00 0.00 178.15 178.19 1nf6 h GLU 104 N 0.28 0.39 0.38 2.37 4.39 -1.27 0.36 114.58 121.47 1nf6 h GLU 104 Ca 0.08 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.74 1nf6 h GLU 104 Cb 0.08 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 28.64 1nf6 h GLU 104 CO -0.01 0.26 -0.18 0.00 -1.16 0.00 0.00 179.01 177.91 1nf6 h ALA 105 N 1.38 -0.51 -0.67 3.43 0.00 -0.85 -2.53 119.26 119.51 1nf6 h ALA 105 Ca 0.28 -0.16 0.11 0.00 0.00 0.00 0.00 54.91 55.14 1nf6 h ALA 105 Cb 0.32 0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 1nf6 h ALA 105 CO -0.28 -0.70 0.44 1.88 0.00 0.00 0.00 179.25 180.60 1nf6 h TYR 106 N -0.69 0.51 -0.52 0.00 -1.99 -0.49 0.21 116.97 114.02 1nf6 h TYR 106 Ca -0.05 0.01 -0.10 0.00 2.00 0.00 0.00 58.73 60.59 1nf6 h TYR 106 Cb 0.49 -0.17 -0.02 0.00 2.00 0.00 0.00 36.73 39.03 1nf6 h TYR 106 CO -0.01 0.24 -0.07 0.77 -0.00 0.00 0.00 178.16 179.08 1nf6 h SER 107 N 0.48 0.92 -0.42 3.88 0.02 -0.77 0.28 113.55 117.94 1nf6 h SER 107 Ca 0.31 -0.28 -0.07 0.00 -0.84 0.00 0.00 61.79 60.92 1nf6 h SER 107 Cb 0.58 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.85 1nf6 h SER 107 CO -0.10 1.02 0.00 1.56 -1.14 0.00 0.00 176.83 178.18 1nf6 h GLN 108 N 0.84 0.74 -0.16 3.45 1.08 -0.26 -1.69 115.11 119.12 1nf6 h GLN 108 Ca 0.14 -0.23 0.04 0.00 -1.45 0.00 0.00 58.65 57.15 1nf6 h GLN 108 Cb 0.60 -0.07 -0.04 0.00 -0.05 0.00 0.00 27.48 27.93 1nf6 h GLN 108 CO 0.04 0.81 -0.08 0.74 -0.95 0.00 0.00 178.83 179.39 1nf6 h PHE 109 N 0.57 -0.18 -0.69 2.96 0.05 -0.57 -0.99 116.94 118.09 1nf6 h PHE 109 Ca 0.12 0.02 0.14 0.00 3.82 0.00 0.00 57.97 62.07 1nf6 h PHE 109 Cb 0.48 0.11 -0.10 0.00 2.00 0.00 0.00 35.95 38.43 1nf6 h PHE 109 CO 0.04 -0.12 0.14 1.25 -0.18 0.00 0.00 178.31 179.44 1nf6 h LEU 110 N -0.06 -0.02 -0.47 1.54 6.46 -0.38 -0.14 115.31 122.23 1nf6 h LEU 110 Ca 0.09 0.14 0.09 0.00 -0.12 0.00 0.00 57.88 58.08 1nf6 h LEU 110 Cb 0.19 0.19 -0.08 0.00 -0.73 0.00 0.00 40.66 40.23 1nf6 h LEU 110 CO -0.20 -0.03 -0.06 0.50 -0.62 0.00 0.00 178.44 178.03 1nf6 h LYS 111 N 0.25 0.05 -0.70 1.25 3.64 -0.27 -1.05 116.57 119.75 1nf6 h LYS 111 Ca 0.38 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.72 1nf6 h LYS 111 Cb 0.62 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.39 1nf6 h LYS 111 CO -0.48 0.03 0.31 0.28 -2.27 0.00 0.00 179.45 177.32 1nf6 h VAL 112 N 0.05 1.23 -0.11 2.00 2.07 0.16 -2.42 116.25 119.22 1nf6 h VAL 112 Ca 0.23 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 67.08 1nf6 h VAL 112 Cb 0.35 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 1nf6 h VAL 112 CO -0.44 0.28 0.07 0.00 0.02 0.00 0.00 177.57 177.49 1nf6 h LYS 114 N 0.14 0.14 -0.52 0.00 1.57 -1.00 -0.81 116.57 116.08 1nf6 h LYS 114 Ca 0.04 -0.01 0.08 0.00 -1.87 0.00 0.00 60.65 58.89 1nf6 h LYS 114 Cb -0.01 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.24 1nf6 h LYS 114 CO -0.02 0.09 0.35 0.93 -0.57 0.00 0.00 179.45 180.24 1nf6 h GLU 115 N 0.14 0.37 -0.21 3.15 5.08 -1.27 0.28 114.58 122.11 1nf6 h GLU 115 Ca 0.13 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1nf6 h GLU 115 Cb 0.14 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.31 1nf6 h GLU 115 CO -0.18 0.25 0.00 1.04 -1.00 0.00 0.00 179.01 179.12 1nf6 n GLN 116 N -4.47 1.63 -3.75 2.33 1.13 -0.41 -4.91 117.38 108.93 1nf6 n GLN 116 Ca 0.08 -0.96 -0.24 0.00 -1.94 0.00 0.00 57.00 53.94 1nf6 n GLN 116 Cb 0.31 -1.30 0.03 0.00 0.11 0.00 0.00 30.24 29.40 1nf6 n GLN 116 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1nf6 n GLY 117 N 1.01 -0.36 2.97 1.08 0.00 0.97 -4.93 105.19 105.93 1nf6 n GLY 117 Ca 0.13 0.15 -0.31 0.00 0.00 0.00 0.00 46.02 45.98 1nf6 n GLY 117 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1nf6 s ASP 118 N -4.03 4.72 0.16 1.61 -1.08 -0.67 -4.94 116.67 112.43 1nf6 s ASP 118 Ca 0.21 -3.26 -0.09 0.00 -0.52 0.00 0.00 52.55 48.89 1nf6 s ASP 118 Cb -0.10 -1.70 0.00 0.00 -1.46 0.00 0.00 42.92 39.67 1nf6 s ASP 118 CO 0.81 -0.21 1.50 0.40 0.52 0.00 0.00 175.17 178.19 1nf6 h ILE 119 N 5.07 1.28 -0.53 4.11 1.08 -1.92 -1.38 117.51 125.22 1nf6 h ILE 119 Ca 0.00 -1.56 0.02 0.00 -0.39 0.00 0.00 64.86 62.93 1nf6 h ILE 119 Cb 0.86 1.41 -0.03 0.00 -3.07 0.00 0.00 36.82 35.98 1nf6 h ILE 119 CO 0.71 0.52 0.33 0.58 -0.69 0.00 0.00 178.15 179.60 1nf6 h VAL 120 N 0.72 1.08 -0.06 1.67 2.07 -1.98 -1.27 116.25 118.47 1nf6 h VAL 120 Ca 0.06 -0.22 -0.23 0.00 0.82 0.00 0.00 66.70 67.13 1nf6 h VAL 120 Cb 0.97 0.37 0.01 0.00 -1.52 0.00 0.00 31.29 31.12 1nf6 h VAL 120 CO 0.09 0.12 -0.88 0.74 0.02 0.00 0.00 177.57 177.66 1nf6 h THR 121 N 0.65 1.33 -0.56 2.57 2.02 -1.96 -2.94 112.91 114.02 1nf6 h THR 121 Ca 0.21 -2.19 -0.01 0.00 0.77 0.00 0.00 66.41 65.19 1nf6 h THR 121 Cb -0.01 2.21 -0.03 0.00 -1.74 0.00 0.00 68.15 68.59 1nf6 h THR 121 CO -0.08 0.67 0.32 0.00 0.37 0.00 0.00 175.52 176.80 1nf6 h ALA 122 N 0.64 1.51 0.00 6.16 0.00 -0.98 -1.81 119.26 124.78 1nf6 h ALA 122 Ca -0.07 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.65 1nf6 h ALA 122 Cb 1.50 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 1nf6 h ALA 122 CO 0.17 0.42 -0.49 0.07 0.00 0.00 0.00 179.25 179.42 1nf6 h ARG 123 N 0.77 0.00 -0.12 0.00 -0.00 -1.18 -1.91 114.38 111.95 1nf6 h ARG 123 Ca 0.20 0.00 -0.13 0.00 -0.00 0.00 0.00 59.98 60.05 1nf6 h ARG 123 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 29.96 1nf6 h ARG 123 CO -0.03 0.49 -0.50 1.25 -0.00 0.00 0.00 179.97 181.17 1nf6 h LEU 124 N 0.00 0.36 -0.52 0.08 5.85 -1.17 -1.60 115.31 118.31 1nf6 h LEU 124 Ca -0.00 -0.18 -0.17 0.00 0.84 0.00 0.00 57.88 58.37 1nf6 h LEU 124 Cb 0.92 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.84 1nf6 h LEU 124 CO 0.06 0.80 -0.66 -0.26 -0.34 0.00 0.00 178.44 178.04 1nf6 h PHE 125 N 0.26 0.45 -0.50 1.25 -1.00 -1.08 -2.19 116.94 114.13 1nf6 h PHE 125 Ca 0.01 -0.18 -0.11 0.00 2.81 0.00 0.00 57.97 60.50 1nf6 h PHE 125 Cb 0.98 -0.07 -0.02 0.00 3.61 0.00 0.00 35.95 40.45 1nf6 h PHE 125 CO 0.02 0.90 -0.11 0.93 -1.61 0.00 0.00 178.31 178.44 1nf6 h GLU 126 N 0.24 0.96 0.13 1.51 5.08 -1.16 0.18 114.58 121.53 1nf6 h GLU 126 Ca -0.02 -0.36 -0.01 0.00 -1.00 0.00 0.00 59.36 57.97 1nf6 h GLU 126 Cb 1.20 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1nf6 h GLU 126 CO 0.11 1.03 -0.06 0.00 -1.00 0.00 0.00 179.01 179.09 1nf6 h ARG 127 N 0.82 -0.17 -0.31 2.33 3.08 -1.30 -2.92 114.38 115.90 1nf6 h ARG 127 Ca 0.13 0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.15 1nf6 h ARG 127 Cb 0.67 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.75 1nf6 h ARG 127 CO 0.05 0.03 0.03 0.82 -1.07 0.00 0.00 179.97 179.83 1nf6 h ILE 128 N -0.36 1.17 0.00 2.04 2.04 -1.32 -1.44 117.51 119.64 1nf6 h ILE 128 Ca -0.02 -0.64 -0.04 0.00 1.00 0.00 0.00 64.86 65.16 1nf6 h ILE 128 Cb 0.29 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 1nf6 h ILE 128 CO 0.03 0.22 -0.20 0.40 0.00 0.00 0.00 178.15 178.60 1nf6 h ILE 129 N 0.44 1.06 -0.11 -0.67 2.04 -0.92 -0.24 117.51 119.11 1nf6 h ILE 129 Ca 0.10 -0.70 -0.21 0.00 1.00 0.00 0.00 64.86 65.05 1nf6 h ILE 129 Cb 0.25 1.39 0.00 0.00 -0.74 0.00 0.00 36.82 37.72 1nf6 h ILE 129 CO 0.00 0.20 -0.76 -0.33 0.00 0.00 0.00 178.15 177.26 1nf6 h GLU 130 N 0.00 0.59 -0.56 2.37 5.08 -1.07 -2.04 114.58 118.95 1nf6 h GLU 130 Ca -0.00 -0.49 -0.11 0.00 -1.00 0.00 0.00 59.36 57.76 1nf6 h GLU 130 Cb 0.37 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 1nf6 h GLU 130 CO 0.03 1.11 -0.09 0.93 -1.00 0.00 0.00 179.01 179.99 1nf6 h GLU 131 N 0.40 1.05 -0.81 2.33 5.08 -1.19 -2.19 114.58 119.25 1nf6 h GLU 131 Ca -0.04 -0.38 0.04 0.00 -1.00 0.00 0.00 59.36 57.98 1nf6 h GLU 131 Cb 1.37 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 30.50 1nf6 h GLU 131 CO 0.14 1.08 0.53 0.93 -1.00 0.00 0.00 179.01 180.69 1nf6 h GLU 132 N 0.93 0.93 -0.15 2.33 4.39 -0.92 -0.46 114.58 121.64 1nf6 h GLU 132 Ca 0.15 -0.06 -0.11 0.00 0.34 0.00 0.00 59.36 59.69 1nf6 h GLU 132 Cb 0.66 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 29.09 1nf6 h GLU 132 CO 0.05 0.62 -0.37 0.37 -1.16 0.00 0.00 179.01 178.51 1nf6 h GLN 133 N 0.96 0.32 -0.38 2.33 5.75 -1.09 -0.31 115.11 122.69 1nf6 h GLN 133 Ca 0.33 -0.14 -0.14 0.00 -0.15 0.00 0.00 58.65 58.55 1nf6 h GLN 133 Cb 0.10 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.63 1nf6 h GLN 133 CO -0.10 0.65 -0.34 0.00 -2.65 0.00 0.00 178.83 176.39 1nf6 h ALA 134 N 1.35 0.69 -0.47 3.38 0.00 -0.55 -1.55 119.26 122.11 1nf6 h ALA 134 Ca 0.03 -0.43 -0.04 0.00 0.00 0.00 0.00 54.91 54.47 1nf6 h ALA 134 Cb 0.78 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1nf6 h ALA 134 CO 0.06 0.67 0.13 0.45 0.00 0.00 0.00 179.25 180.56 1nf6 h HIS 135 N 0.72 0.76 0.25 0.00 3.86 -0.91 -2.11 115.15 117.72 1nf6 h HIS 135 Ca 0.07 -0.08 -0.00 0.00 -1.16 0.00 0.00 60.37 59.20 1nf6 h HIS 135 Cb 0.90 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 29.14 1nf6 h HIS 135 CO 0.05 0.68 -0.20 1.25 0.86 0.00 0.00 177.93 180.57 1nf6 h LEU 136 N 0.62 -0.53 -0.96 2.43 5.85 -0.98 -1.95 115.31 119.79 1nf6 h LEU 136 Ca 0.15 0.04 0.17 0.00 0.84 0.00 0.00 57.88 59.08 1nf6 h LEU 136 Cb 0.29 0.17 -0.10 0.00 0.37 0.00 0.00 40.66 41.39 1nf6 h LEU 136 CO -0.00 -0.31 0.56 0.74 -0.34 0.00 0.00 178.44 179.09 1nf6 h THR 137 N -0.47 0.74 -0.44 1.05 2.02 -1.30 -0.74 112.91 113.77 1nf6 h THR 137 Ca -0.01 -0.26 -0.03 0.00 0.77 0.00 0.00 66.41 66.87 1nf6 h THR 137 Cb 0.42 -0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 66.73 1nf6 h THR 137 CO -0.02 0.14 0.14 0.22 0.37 0.00 0.00 175.52 176.37 1nf6 h TYR 138 N 0.75 0.71 -0.44 3.16 3.20 -0.77 -1.16 116.97 122.42 1nf6 h TYR 138 Ca 0.53 -0.07 -0.14 0.00 3.14 0.00 0.00 58.73 62.20 1nf6 h TYR 138 Cb 0.77 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.83 1nf6 h TYR 138 CO -0.03 0.64 -0.26 1.88 -1.64 0.00 0.00 178.16 178.74 1nf6 h TYR 139 N 0.57 1.12 -0.70 -3.82 0.99 -0.64 -2.32 116.97 112.16 1nf6 h TYR 139 Ca 0.14 -0.29 0.07 0.00 2.00 0.00 0.00 58.73 60.65 1nf6 h TYR 139 Cb 0.26 -0.25 -0.06 0.00 1.00 0.00 0.00 36.73 37.68 1nf6 h TYR 139 CO 0.01 1.11 0.38 0.93 -0.00 0.00 0.00 178.16 180.60 1nf6 h GLU 140 N 0.80 0.66 -0.44 4.88 5.08 -1.06 -0.76 114.58 123.73 1nf6 h GLU 140 Ca 0.09 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.37 1nf6 h GLU 140 Cb 0.85 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.93 1nf6 h GLU 140 CO 0.07 0.43 0.13 -0.91 -1.00 0.00 0.00 179.01 177.74 1nf6 h ASN 141 N 0.68 0.65 -0.26 1.42 2.35 -0.83 -1.43 115.58 118.16 1nf6 h ASN 141 Ca 0.33 -0.22 -0.13 0.00 -0.55 0.00 0.00 56.30 55.74 1nf6 h ASN 141 Cb 0.26 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 38.46 1nf6 h ASN 141 CO -0.22 0.69 -0.33 0.40 -1.65 0.00 0.00 177.43 176.32 1nf6 h ILE 142 N 0.57 1.31 -0.72 2.81 1.08 -1.05 -1.25 117.51 120.26 1nf6 h ILE 142 Ca 0.14 -1.52 0.09 0.00 -0.39 0.00 0.00 64.86 63.18 1nf6 h ILE 142 Cb 0.29 1.68 -0.05 0.00 -3.07 0.00 0.00 36.82 35.67 1nf6 h ILE 142 CO -0.00 0.48 0.48 1.23 -0.69 0.00 0.00 178.15 179.65 1nf6 h GLY 143 N 0.40 0.89 0.98 5.37 0.00 -1.13 0.66 103.07 110.24 1nf6 h GLY 143 Ca 0.03 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.10 1nf6 h GLY 143 CO 0.08 0.16 0.04 0.23 0.00 0.00 0.00 176.54 177.06 1nf6 h SER 144 N 0.64 0.07 -0.42 0.19 0.87 -0.54 -0.60 113.55 113.76 1nf6 h SER 144 Ca 0.33 0.00 -0.10 0.00 -1.23 0.00 0.00 61.79 60.79 1nf6 h SER 144 Cb 0.43 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.37 1nf6 h SER 144 CO -0.11 0.05 -0.15 0.45 -0.53 0.00 0.00 176.83 176.54 1nf6 h HIS 145 N 0.09 0.95 -0.56 2.24 -0.00 -0.22 -0.57 115.15 117.09 1nf6 h HIS 145 Ca 0.03 -0.22 -0.06 0.00 -0.00 0.00 0.00 60.37 60.12 1nf6 h HIS 145 Cb -0.00 -0.23 -0.02 0.00 -0.00 0.00 0.00 27.41 27.16 1nf6 h HIS 145 CO -0.08 0.97 0.09 0.82 -0.00 0.00 0.00 177.93 179.73 1nf6 h ILE 146 N 0.66 1.24 0.27 2.45 2.04 -0.80 0.67 117.51 124.04 1nf6 h ILE 146 Ca 0.10 -0.93 -0.01 0.00 1.00 0.00 0.00 64.86 65.02 1nf6 h ILE 146 Cb 0.69 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 37.49 1nf6 h ILE 146 CO 0.05 0.34 -0.13 0.50 0.00 0.00 0.00 178.15 178.91 1nf6 h LYS 147 N 0.85 -0.35 0.00 2.37 3.64 -0.95 0.27 116.57 122.40 1nf6 h LYS 147 Ca 0.18 0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.52 1nf6 h LYS 147 Cb 0.38 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 1nf6 h LYS 147 CO 0.01 -0.08 -0.34 -0.91 -2.27 0.00 0.00 179.45 175.86 1nf6 h ASN 148 N -0.58 0.00 0.00 4.20 2.35 -0.95 -3.37 115.58 117.23 1nf6 h ASN 148 Ca -0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 1nf6 h ASN 148 Cb 0.42 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.79 1nf6 h ASN 148 CO 0.06 0.27 -0.37 0.18 -1.65 0.00 0.00 177.43 175.92 1nf6 n LEU 149 N -3.14 0.00 0.00 1.61 4.77 0.23 -5.07 117.00 115.40 1nf6 n LEU 149 Ca 0.02 -0.24 0.00 0.00 -0.03 0.00 0.00 56.01 55.76 1nf6 n LEU 149 Cb 0.64 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.73 1nf6 n LEU 149 CO 0.38 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 1nf6 n GLY 150 N 1.42 2.85 0.23 -0.72 0.00 0.97 -2.21 105.19 107.72 1nf6 n GLY 150 Ca 0.00 0.18 0.07 0.00 0.00 0.00 0.00 46.02 46.27 1nf6 n GLY 150 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1nf6 h ASP 151 N 0.00 0.00 -0.02 1.61 3.32 -1.94 -2.44 116.42 116.95 1nf6 h ASP 151 Ca 0.00 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.97 1nf6 h ASP 151 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1nf6 h ASP 151 CO 0.00 0.21 -0.19 0.74 -1.72 0.00 0.00 179.24 178.28 1nf6 h THR 152 N 0.00 1.24 0.02 0.35 2.02 -1.86 0.28 112.91 114.95 1nf6 h THR 152 Ca -0.00 -1.09 -0.15 0.00 0.77 0.00 0.00 66.41 65.94 1nf6 h THR 152 Cb 0.42 1.28 0.01 0.00 -1.74 0.00 0.00 68.15 68.13 1nf6 h THR 152 CO 0.03 0.34 -0.60 0.22 0.37 0.00 0.00 175.52 175.88 1nf6 h TYR 153 N 0.35 0.57 0.00 3.16 3.20 -1.53 -3.23 116.97 119.50 1nf6 h TYR 153 Ca 0.06 -0.32 -0.05 0.00 3.14 0.00 0.00 58.73 61.56 1nf6 h TYR 153 Cb 0.55 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 1nf6 h TYR 153 CO 0.01 1.15 -0.22 -0.07 -1.64 0.00 0.00 178.16 177.40 1nf6 h LEU 154 N -0.17 0.00 -1.29 2.82 3.38 -1.39 -1.98 115.31 116.68 1nf6 h LEU 154 Ca -0.08 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.82 1nf6 h LEU 154 Cb 1.33 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.07 1nf6 h LEU 154 CO 0.12 0.22 -0.33 0.00 0.09 0.00 0.00 178.44 178.53 1nf6 h ALA 155 N 1.78 1.25 0.03 1.53 0.00 -1.00 -0.51 119.26 122.35 1nf6 h ALA 155 Ca -0.00 -0.30 -0.22 0.00 0.00 0.00 0.00 54.91 54.39 1nf6 h ALA 155 Cb 0.64 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1nf6 h ALA 155 CO 0.03 0.41 -0.98 -0.22 0.00 0.00 0.00 179.25 178.50 1nf6 h LYS 156 N 0.00 0.21 0.00 0.00 3.64 -1.38 -3.28 116.57 115.76 1nf6 h LYS 156 Ca -0.00 -0.26 -0.09 0.00 -1.27 0.00 0.00 60.65 59.02 1nf6 h LYS 156 Cb 0.67 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.56 1nf6 h LYS 156 CO 0.04 1.03 -0.75 0.82 -2.27 0.00 0.00 179.45 178.32 1nf6 h ILE 157 N 0.10 0.51 -0.82 2.00 1.08 -1.24 -3.45 117.51 115.69 1nf6 h ILE 157 Ca -0.06 -1.80 -0.72 0.00 -0.39 0.00 0.00 64.86 61.89 1nf6 h ILE 157 Cb 1.64 2.12 -0.02 0.00 -3.07 0.00 0.00 36.82 37.49 1nf6 h ILE 157 CO 0.15 0.29 1.29 0.00 -0.69 0.00 0.00 178.15 179.20 1nf6 n ALA 158 N -2.25 0.57 -0.45 1.87 0.00 -0.23 -1.13 120.51 118.90 1nf6 n ALA 158 Ca -0.01 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1nf6 n ALA 158 Cb 0.71 -2.34 0.00 0.00 0.00 0.00 0.00 19.45 17.82 1nf6 n ALA 158 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nf6 n GLY 159 N 6.43 0.75 3.76 0.00 0.00 0.20 -4.99 105.19 111.33 1nf6 n GLY 159 Ca 0.43 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.12 1nf6 n GLY 159 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nf6 s THR 160 N -2.91 3.06 0.52 2.61 -4.23 -0.28 -4.87 115.64 109.54 1nf6 s THR 160 Ca 0.00 0.45 -0.21 0.00 -1.18 0.00 0.00 61.69 60.75 1nf6 s THR 160 Cb 0.00 -2.94 -0.07 0.00 1.34 0.00 0.00 72.50 70.83 1nf6 s THR 160 CO 0.00 -0.34 1.04 -2.65 -0.54 0.00 0.00 174.62 172.13 1nf6 n PRO 161 N -2.82 1.23 0.00 3.99 -0.02 -1.26 -3.09 135.00 133.02 1nf6 n PRO 161 Ca 0.11 0.45 0.03 0.00 -2.02 0.00 0.00 63.50 62.07 1nf6 n PRO 161 Cb 0.52 -2.18 0.01 0.00 -0.02 0.00 0.00 33.50 31.82 1nf6 n PRO 161 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1nf6 n SER 162 N -0.26 1.16 -4.72 2.55 3.41 -1.26 -2.86 113.62 111.65 1nf6 n SER 162 Ca 0.11 -1.08 -0.42 0.00 -0.26 0.00 0.00 58.87 57.22 1nf6 n SER 162 Cb 0.44 0.27 -0.01 0.00 -0.26 0.00 0.00 64.21 64.65 1nf6 n SER 162 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1nf6 n SER 163 N -0.06 3.04 -0.81 4.04 2.88 -1.26 -4.26 113.62 117.18 1nf6 n SER 163 Ca 0.03 1.21 0.04 0.00 -1.33 0.00 0.00 58.87 58.82 1nf6 n SER 163 Cb 0.13 -1.52 0.21 0.00 -0.75 0.00 0.00 64.21 62.29 1nf6 n SER 163 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1nf6 n THR 164 N 0.49 2.30 0.00 2.46 -2.24 -1.26 -4.92 114.28 111.11 1nf6 n THR 164 Ca 0.04 -2.37 0.00 0.00 -2.27 0.00 0.00 64.05 59.46 1nf6 n THR 164 Cb 0.36 -0.28 0.00 0.00 -2.10 0.00 0.00 70.33 68.32 1nf6 n THR 164 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1nf6 n GLY 165 N -0.95 0.06 3.74 3.38 0.00 -1.26 -4.99 105.19 105.17 1nf6 n GLY 165 Ca 0.24 -1.83 -0.34 0.00 0.00 0.00 0.00 46.02 44.09 1nf6 n GLY 165 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1nf6 s THR 166 N 0.00 2.58 0.56 2.61 -1.32 -1.26 -4.99 115.64 113.82 1nf6 s THR 166 Ca 0.00 0.29 -0.19 0.00 -1.21 0.00 0.00 61.69 60.58 1nf6 s THR 166 Cb 0.00 -2.86 -0.05 0.00 -1.51 0.00 0.00 72.50 68.08 1nf6 s THR 166 CO 0.00 -0.15 1.14 0.00 -2.21 0.00 0.00 174.62 173.41 1nf6 s ALA 167 N -2.03 2.65 -0.35 11.08 0.00 -1.26 -4.91 121.76 126.93 1nf6 s ALA 167 Ca 0.73 0.84 -0.38 0.00 0.00 0.00 0.00 51.96 53.15 1nf6 s ALA 167 Cb -0.27 -3.37 -0.14 0.00 0.00 0.00 0.00 23.12 19.34 1nf6 s ALA 167 CO 0.43 -0.87 2.05 -1.13 0.00 0.00 0.00 175.76 176.24 1nf6 n SER 168 N -1.42 1.98 -4.63 0.00 3.41 -1.26 -4.91 113.62 106.79 1nf6 n SER 168 Ca 0.12 0.65 -0.43 0.00 -0.26 0.00 0.00 58.87 58.96 1nf6 n SER 168 Cb 0.51 -1.17 -0.03 0.00 -0.26 0.00 0.00 64.21 63.26 1nf6 n SER 168 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1nf6 s LYS 169 N 5.41 3.70 0.00 4.33 -2.85 -1.26 -4.90 119.74 124.16 1nf6 s LYS 169 Ca 1.08 2.23 0.00 0.00 -1.00 0.00 0.00 55.97 58.28 1nf6 s LYS 169 Cb -1.03 -4.22 0.00 0.00 -2.06 0.00 0.00 37.83 30.52 1nf6 s LYS 169 CO 0.57 -1.45 0.00 0.41 0.10 0.00 0.00 175.35 174.98 1nf6 n GLY 170 N 5.02 5.68 0.11 0.59 0.00 -1.26 -5.12 105.19 110.22 1nf6 n GLY 170 Ca 0.23 -1.49 -0.23 0.00 0.00 0.00 0.00 46.02 44.54 1nf6 n GLY 170 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1nf6 n PHE 171 N 0.00 0.92 0.60 1.61 7.35 -1.26 -5.31 117.46 121.37 1nf6 n PHE 171 Ca 0.00 0.39 0.05 0.00 -0.76 0.00 0.00 57.45 57.13 1nf6 n PHE 171 Cb 0.00 -1.09 0.28 0.00 0.35 0.00 0.00 39.48 39.02 1nf6 n PHE 171 CO 0.00 0.00 0.00 1.33 -0.76 0.00 0.00 176.76 177.33