#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 4.33 0.13 1.61 4.22 -1.26 -4.83 114.94 119.14 1nf6 s ASN 4 Ca 0.00 0.32 -0.26 0.00 -2.14 0.00 0.00 52.86 50.78 1nf6 s ASN 4 Cb 0.00 -0.77 -0.03 0.00 1.28 0.00 0.00 41.25 41.72 1nf6 s ASN 4 CO 0.00 -1.93 1.62 0.03 -2.04 0.00 0.00 177.10 174.78 1nf6 h ARG 5 N -0.87 -0.40 -0.68 3.55 2.47 -2.01 -0.22 114.38 116.23 1nf6 h ARG 5 Ca -0.43 0.03 -0.03 0.00 -1.26 0.00 0.00 59.98 58.28 1nf6 h ARG 5 Cb 1.29 0.09 -0.03 0.00 -1.65 0.00 0.00 29.97 29.67 1nf6 h ARG 5 CO 0.53 -0.26 0.31 1.49 0.56 0.00 0.00 179.97 182.60 1nf6 h GLU 6 N -0.41 1.00 -0.26 0.04 4.22 -2.00 -2.25 114.58 114.93 1nf6 h GLU 6 Ca 0.08 -0.16 -0.07 0.00 0.08 0.00 0.00 59.36 59.29 1nf6 h GLU 6 Cb 0.53 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 1nf6 h GLU 6 CO -0.31 0.80 -0.14 0.22 -2.18 0.00 0.00 179.01 177.40 1nf6 h ASP 7 N 0.96 0.42 -0.25 1.04 3.58 -1.83 -1.74 116.42 118.60 1nf6 h ASP 7 Ca 0.23 -0.11 -0.11 0.00 0.42 0.00 0.00 57.03 57.46 1nf6 h ASP 7 Cb 0.15 -0.11 -0.01 0.00 1.72 0.00 0.00 39.33 41.07 1nf6 h ASP 7 CO -0.03 0.59 -0.23 0.03 -2.88 0.00 0.00 179.24 176.73 1nf6 h ARG 8 N 0.40 0.73 -0.08 0.28 3.08 -0.53 -2.35 114.38 115.91 1nf6 h ARG 8 Ca 0.07 -0.29 -0.23 0.00 0.07 0.00 0.00 59.98 59.60 1nf6 h ARG 8 Cb 0.49 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.52 1nf6 h ARG 8 CO 0.03 0.89 -0.87 0.87 -1.07 0.00 0.00 179.97 179.81 1nf6 h LYS 9 N 0.63 0.66 -0.60 0.04 1.57 -1.16 -3.10 116.57 114.62 1nf6 h LYS 9 Ca 0.09 -0.61 -0.05 0.00 -1.87 0.00 0.00 60.65 58.21 1nf6 h LYS 9 Cb 0.72 0.15 -0.03 0.00 0.08 0.00 0.00 32.23 33.16 1nf6 h LYS 9 CO 0.06 1.21 0.18 0.00 -0.57 0.00 0.00 179.45 180.33 1nf6 h ALA 10 N 0.59 0.79 -0.18 3.86 0.00 -1.25 0.42 119.26 123.50 1nf6 h ALA 10 Ca -0.08 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.53 1nf6 h ALA 10 Cb 1.50 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 1nf6 h ALA 10 CO 0.17 0.47 -0.30 0.87 0.00 0.00 0.00 179.25 180.46 1nf6 h LYS 11 N 0.86 0.34 0.15 0.00 1.57 -1.50 -2.48 116.57 115.51 1nf6 h LYS 11 Ca 0.19 -0.13 -0.29 0.00 -1.87 0.00 0.00 60.65 58.55 1nf6 h LYS 11 Cb 0.31 -0.02 0.03 0.00 0.08 0.00 0.00 32.23 32.63 1nf6 h LYS 11 CO -0.00 0.61 -1.23 0.28 -0.57 0.00 0.00 179.45 178.54 1nf6 h VAL 12 N 0.30 1.31 -0.91 0.50 2.07 -1.40 -3.07 116.25 115.05 1nf6 h VAL 12 Ca 0.04 -2.49 0.17 0.00 0.82 0.00 0.00 66.70 65.24 1nf6 h VAL 12 Cb 0.68 2.81 -0.07 0.00 -1.52 0.00 0.00 31.29 33.19 1nf6 h VAL 12 CO 0.05 0.75 0.59 0.40 0.02 0.00 0.00 177.57 179.38 1nf6 h ILE 13 N 0.17 0.76 -0.25 4.57 2.04 -0.85 -0.31 117.51 123.63 1nf6 h ILE 13 Ca -0.19 -0.20 -0.08 0.00 1.00 0.00 0.00 64.86 65.38 1nf6 h ILE 13 Cb 1.92 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 38.11 1nf6 h ILE 13 CO 0.23 0.11 -0.16 -0.08 0.00 0.00 0.00 178.15 178.25 1nf6 h GLU 14 N 0.59 0.55 0.00 2.37 4.81 -1.42 0.33 114.58 121.81 1nf6 h GLU 14 Ca 0.47 -0.26 -0.06 0.00 -0.13 0.00 0.00 59.36 59.38 1nf6 h GLU 14 Cb 0.91 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.27 1nf6 h GLU 14 CO -0.22 0.83 -0.30 -0.39 -0.73 0.00 0.00 179.01 178.19 1nf6 h VAL 15 N 0.26 0.67 -0.39 0.32 -1.51 -1.31 -1.78 116.25 112.51 1nf6 h VAL 15 Ca 0.05 -1.41 -0.11 0.00 -1.23 0.00 0.00 66.70 64.00 1nf6 h VAL 15 Cb 0.68 1.93 -0.01 0.00 -2.13 0.00 0.00 31.29 31.75 1nf6 h VAL 15 CO 0.04 0.30 -0.21 -0.07 -1.23 0.00 0.00 177.57 176.40 1nf6 h LEU 16 N 0.00 0.78 -0.07 4.19 3.38 -0.82 -0.96 115.31 121.80 1nf6 h LEU 16 Ca -0.00 -0.28 -0.17 0.00 0.09 0.00 0.00 57.88 57.52 1nf6 h LEU 16 Cb 0.90 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 1nf6 h LEU 16 CO 0.04 0.98 -0.83 0.78 0.09 0.00 0.00 178.44 179.49 1nf6 h ASN 17 N 0.68 0.00 -0.01 -0.43 2.35 -0.72 -0.19 115.58 117.27 1nf6 h ASN 17 Ca 0.10 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.85 1nf6 h ASN 17 Cb 0.72 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.09 1nf6 h ASN 17 CO 0.06 0.83 -0.00 0.11 -1.65 0.00 0.00 177.43 176.78 1nf6 h LYS 18 N 0.00 0.01 -0.57 0.81 1.57 -1.20 0.13 116.57 117.32 1nf6 h LYS 18 Ca -0.01 -0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.79 1nf6 h LYS 18 Cb 1.61 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.88 1nf6 h LYS 18 CO 0.11 0.35 0.35 0.00 -0.57 0.00 0.00 179.45 179.69 1nf6 h ALA 19 N 0.66 0.74 -0.54 3.86 0.00 -1.20 -1.27 119.26 121.51 1nf6 h ALA 19 Ca 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1nf6 h ALA 19 Cb 0.35 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1nf6 h ALA 19 CO 0.00 0.07 0.20 -0.09 0.00 0.00 0.00 179.25 179.43 1nf6 h ARG 20 N 0.69 0.79 -0.06 0.00 2.43 -0.96 -1.14 114.38 116.12 1nf6 h ARG 20 Ca 0.23 -0.13 -0.08 0.00 -0.81 0.00 0.00 59.98 59.19 1nf6 h ARG 20 Cb 0.02 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.42 1nf6 h ARG 20 CO -0.10 0.66 -0.34 0.00 -1.51 0.00 0.00 179.97 178.68 1nf6 h ALA 21 N 1.44 1.31 -0.28 2.80 0.00 0.01 -1.67 119.26 122.86 1nf6 h ALA 21 Ca 0.18 -0.34 -0.15 0.00 0.00 0.00 0.00 54.91 54.60 1nf6 h ALA 21 Cb 0.19 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1nf6 h ALA 21 CO -0.01 0.49 -0.44 0.52 0.00 0.00 0.00 179.25 179.81 1nf6 h MET 22 N 0.11 0.71 -0.31 0.00 2.86 -0.12 0.70 114.93 118.87 1nf6 h MET 22 Ca 0.01 -0.39 -0.06 0.00 -2.06 0.00 0.00 59.70 57.21 1nf6 h MET 22 Cb 0.66 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.33 1nf6 h MET 22 CO 0.05 1.00 -0.02 0.93 1.06 0.00 0.00 176.91 179.93 1nf6 h GLU 23 N 0.57 0.57 -0.33 1.72 4.39 -1.06 -1.51 114.58 118.93 1nf6 h GLU 23 Ca 0.04 -0.19 0.05 0.00 0.34 0.00 0.00 59.36 59.60 1nf6 h GLU 23 Cb 0.98 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.57 1nf6 h GLU 23 CO 0.09 0.72 0.22 -0.07 -1.16 0.00 0.00 179.01 178.81 1nf6 h LEU 24 N 0.36 0.20 -0.14 1.33 3.38 -1.24 0.42 115.31 119.62 1nf6 h LEU 24 Ca 0.09 -0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.96 1nf6 h LEU 24 Cb 0.47 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1nf6 h LEU 24 CO 0.02 0.14 -0.27 -0.74 0.09 0.00 0.00 178.44 177.68 1nf6 h HIS 25 N 0.23 0.54 -0.52 1.13 2.76 -0.95 -3.17 115.15 115.17 1nf6 h HIS 25 Ca 0.14 -0.19 -0.02 0.00 -2.20 0.00 0.00 60.37 58.10 1nf6 h HIS 25 Cb 0.28 -0.10 -0.02 0.00 1.55 0.00 0.00 27.41 29.11 1nf6 h HIS 25 CO -0.00 0.89 0.25 0.00 -1.30 0.00 0.00 177.93 177.77 1nf6 h ALA 26 N 0.55 0.67 -0.34 5.26 0.00 -0.30 0.60 119.26 125.71 1nf6 h ALA 26 Ca 0.01 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 54.87 1nf6 h ALA 26 Cb 0.85 -0.21 -0.08 0.00 0.00 0.00 0.00 17.79 18.36 1nf6 h ALA 26 CO 0.06 0.23 -0.23 0.82 0.00 0.00 0.00 179.25 180.13 1nf6 h ILE 27 N 0.70 0.38 -0.26 0.00 2.04 -1.04 0.66 117.51 119.98 1nf6 h ILE 27 Ca 0.18 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.02 1nf6 h ILE 27 Cb 0.11 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 36.56 1nf6 h ILE 27 CO -0.02 0.00 0.08 0.45 0.00 0.00 0.00 178.15 178.65 1nf6 h HIS 28 N -0.19 0.42 -0.13 1.37 3.86 -1.47 -0.32 115.15 118.70 1nf6 h HIS 28 Ca 0.17 -0.04 -0.01 0.00 -1.16 0.00 0.00 60.37 59.33 1nf6 h HIS 28 Cb 0.46 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.80 1nf6 h HIS 28 CO -0.44 0.47 0.04 0.37 0.86 0.00 0.00 177.93 179.23 1nf6 h GLN 29 N 0.25 0.20 -0.36 2.45 5.75 -0.33 0.03 115.11 123.10 1nf6 h GLN 29 Ca 0.08 -0.04 -0.16 0.00 -0.15 0.00 0.00 58.65 58.38 1nf6 h GLN 29 Cb 0.25 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.76 1nf6 h GLN 29 CO -0.00 0.33 -0.40 1.88 -2.65 0.00 0.00 178.83 177.98 1nf6 h TYR 30 N 0.02 1.06 -0.69 3.99 0.99 0.30 -2.18 116.97 120.46 1nf6 h TYR 30 Ca 0.04 -0.32 -0.06 0.00 2.00 0.00 0.00 58.73 60.39 1nf6 h TYR 30 Cb 0.21 -0.22 -0.03 0.00 1.00 0.00 0.00 36.73 37.69 1nf6 h TYR 30 CO -0.00 1.13 0.21 0.52 -0.00 0.00 0.00 178.16 180.02 1nf6 h MET 31 N 0.71 1.06 -0.91 4.88 2.86 -0.96 0.27 114.93 122.85 1nf6 h MET 31 Ca 0.05 -0.22 0.01 0.00 -2.06 0.00 0.00 59.70 57.48 1nf6 h MET 31 Cb 0.99 -0.16 -0.05 0.00 0.06 0.00 0.00 31.60 32.44 1nf6 h MET 31 CO 0.10 0.91 0.61 -0.97 1.06 0.00 0.00 176.91 178.61 1nf6 h ASN 32 N 1.02 1.05 0.44 1.22 -1.24 -0.78 0.45 115.58 117.75 1nf6 h ASN 32 Ca 0.22 -0.03 -0.14 0.00 0.71 0.00 0.00 56.30 57.07 1nf6 h ASN 32 Cb 0.29 -0.26 -0.01 0.00 0.73 0.00 0.00 38.32 39.06 1nf6 h ASN 32 CO -0.01 0.76 -0.59 1.56 -1.29 0.00 0.00 177.43 177.86 1nf6 h GLN 33 N 1.24 0.15 -0.39 6.67 4.20 -0.78 -2.76 115.11 123.44 1nf6 h GLN 33 Ca 0.33 -0.10 0.06 0.00 0.06 0.00 0.00 58.65 59.01 1nf6 h GLN 33 Cb -0.14 0.01 -0.05 0.00 0.30 0.00 0.00 27.48 27.60 1nf6 h GLN 33 CO -0.07 0.69 0.07 1.25 -0.67 0.00 0.00 178.83 180.11 1nf6 h HIS 34 N 0.11 0.12 -0.33 2.96 2.76 0.71 0.18 115.15 121.66 1nf6 h HIS 34 Ca -0.00 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.17 1nf6 h HIS 34 Cb 1.07 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.02 1nf6 h HIS 34 CO 0.01 0.01 0.13 1.88 -1.30 0.00 0.00 177.93 178.67 1nf6 h TYR 35 N 0.20 0.45 -0.11 5.26 0.99 -0.75 -0.09 116.97 122.92 1nf6 h TYR 35 Ca 0.19 -0.01 -0.06 0.00 2.00 0.00 0.00 58.73 60.85 1nf6 h TYR 35 Cb 0.22 -0.14 -0.00 0.00 1.00 0.00 0.00 36.73 37.81 1nf6 h TYR 35 CO -0.20 0.36 -0.16 0.77 -0.00 0.00 0.00 178.16 178.93 1nf6 h SER 36 N 0.46 0.33 -0.75 3.88 0.02 -1.05 -2.00 113.55 114.44 1nf6 h SER 36 Ca 0.12 -0.53 -0.02 0.00 -0.84 0.00 0.00 61.79 60.52 1nf6 h SER 36 Cb 0.09 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 62.50 1nf6 h SER 36 CO -0.01 0.79 0.39 -0.07 -1.14 0.00 0.00 176.83 176.79 1nf6 h LEU 37 N -0.13 0.96 -0.64 5.07 3.38 -0.12 -1.10 115.31 122.72 1nf6 h LEU 37 Ca 0.01 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 57.78 1nf6 h LEU 37 Cb 0.72 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1nf6 h LEU 37 CO 0.04 0.80 0.08 -0.78 0.09 0.00 0.00 178.44 178.67 1nf6 h ASP 38 N 1.04 1.04 -0.77 -0.43 3.58 -1.08 -1.57 116.42 118.23 1nf6 h ASP 38 Ca 0.26 -0.27 0.01 0.00 0.42 0.00 0.00 57.03 57.45 1nf6 h ASP 38 Cb 0.07 -0.28 -0.04 0.00 1.72 0.00 0.00 39.33 40.81 1nf6 h ASP 38 CO -0.04 1.05 0.51 -0.78 -2.88 0.00 0.00 179.24 177.10 1nf6 h ASP 39 N 0.99 0.89 0.76 2.28 3.58 -0.97 -1.06 116.42 122.89 1nf6 h ASP 39 Ca 0.19 -0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.62 1nf6 h ASP 39 Cb 0.47 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 41.29 1nf6 h ASP 39 CO 0.02 0.65 0.00 0.23 -2.88 0.00 0.00 179.24 177.25 1nf6 n MET 40 N -4.42 0.16 -2.57 0.28 2.81 -0.45 -4.90 117.12 108.04 1nf6 n MET 40 Ca 0.08 0.03 -0.11 0.00 -1.81 0.00 0.00 57.70 55.90 1nf6 n MET 40 Cb 0.03 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.05 1nf6 n MET 40 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1nf6 n ASP 41 N -1.41 -3.69 -3.98 7.83 2.03 -0.40 -4.90 116.55 112.03 1nf6 n ASP 41 Ca 0.09 -0.12 -0.43 0.00 0.52 0.00 0.00 54.79 54.85 1nf6 n ASP 41 Cb 0.28 -2.63 0.01 0.00 -0.72 0.00 0.00 41.12 38.05 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 -3.87 2.54 -0.38 -0.67 0.53 -0.77 -1.20 117.16 113.34 1nf6 n TYR 42 Ca -0.06 -2.68 -0.10 0.00 -1.02 0.00 0.00 57.90 54.04 1nf6 n TYR 42 Cb 0.56 -1.46 -0.08 0.00 -1.03 0.00 0.00 39.34 37.33 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 1.77 -2.34 0.22 2.72 0.00 -1.24 -0.85 105.19 105.48 1nf6 n GLY 43 Ca 0.30 1.08 -0.04 0.00 0.00 0.00 0.00 46.02 47.36 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 0.43 -0.28 1.61 4.81 -1.73 0.48 114.58 119.89 1nf6 h GLU 44 Ca 0.16 -0.18 -0.06 0.00 -0.13 0.00 0.00 59.36 59.14 1nf6 h GLU 44 Cb 0.38 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 1nf6 h GLU 44 CO -0.86 0.70 -0.07 -0.07 -0.73 0.00 0.00 179.01 177.99 1nf6 h LEU 45 N 0.37 0.55 -0.56 1.64 3.38 -1.57 -2.29 115.31 116.83 1nf6 h LEU 45 Ca 0.05 -0.36 -0.02 0.00 0.09 0.00 0.00 57.88 57.63 1nf6 h LEU 45 Cb 0.75 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.32 1nf6 h LEU 45 CO 0.06 0.79 0.27 0.00 0.09 0.00 0.00 178.44 179.64 1nf6 h ALA 46 N 0.78 0.72 0.32 1.53 0.00 -0.71 -2.28 119.26 119.62 1nf6 h ALA 46 Ca 0.07 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1nf6 h ALA 46 Cb 0.54 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1nf6 h ALA 46 CO 0.03 0.28 -0.18 0.00 0.00 0.00 0.00 179.25 179.38 1nf6 h ALA 47 N 1.10 -0.46 -0.68 0.00 0.00 -0.87 -2.57 119.26 115.79 1nf6 h ALA 47 Ca 0.19 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1nf6 h ALA 47 Cb 0.12 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1nf6 h ALA 47 CO -0.02 -0.77 0.26 -0.91 0.00 0.00 0.00 179.25 177.81 1nf6 h ASN 48 N -0.47 0.92 -0.88 0.00 2.35 -1.38 -1.72 115.58 114.41 1nf6 h ASN 48 Ca -0.04 -0.13 -0.02 0.00 -0.55 0.00 0.00 56.30 55.56 1nf6 h ASN 48 Cb 0.38 -0.24 -0.04 0.00 0.05 0.00 0.00 38.32 38.47 1nf6 h ASN 48 CO 0.05 0.83 0.48 -0.03 -1.65 0.00 0.00 177.43 177.10 1nf6 h MET 49 N 0.99 1.23 -0.16 0.81 4.05 -1.36 -0.59 114.93 119.90 1nf6 h MET 49 Ca 0.23 -0.15 -0.14 0.00 -0.28 0.00 0.00 59.70 59.37 1nf6 h MET 49 Cb 0.20 -0.24 -0.01 0.00 -0.80 0.00 0.00 31.60 30.75 1nf6 h MET 49 CO -0.02 0.90 -0.49 -0.22 0.23 0.00 0.00 176.91 177.31 1nf6 h LYS 50 N 1.23 0.41 -0.12 0.39 3.64 -1.06 -1.69 116.57 119.38 1nf6 h LYS 50 Ca 0.31 -0.24 -0.10 0.00 -1.27 0.00 0.00 60.65 59.36 1nf6 h LYS 50 Cb 0.03 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 1nf6 h LYS 50 CO -0.05 0.81 -0.36 -0.07 -2.27 0.00 0.00 179.45 177.52 1nf6 h LEU 51 N 0.33 0.24 -0.11 5.20 3.38 -0.80 -1.40 115.31 122.15 1nf6 h LEU 51 Ca 0.02 -0.09 -0.24 0.00 0.09 0.00 0.00 57.88 57.66 1nf6 h LEU 51 Cb 0.98 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 41.67 1nf6 h LEU 51 CO 0.08 0.59 -0.96 0.40 0.09 0.00 0.00 178.44 178.64 1nf6 h ILE 52 N 0.20 1.33 -0.78 1.22 2.04 -0.97 -2.49 117.51 118.06 1nf6 h ILE 52 Ca 0.02 -2.29 0.07 0.00 1.00 0.00 0.00 64.86 63.67 1nf6 h ILE 52 Cb 0.73 2.33 -0.05 0.00 -0.74 0.00 0.00 36.82 39.09 1nf6 h ILE 52 CO 0.06 0.70 0.51 0.00 0.00 0.00 0.00 178.15 179.42 1nf6 h ALA 53 N 0.58 1.67 -0.07 1.87 0.00 -0.91 -1.58 119.26 120.83 1nf6 h ALA 53 Ca -0.10 -0.02 -0.22 0.00 0.00 0.00 0.00 54.91 54.58 1nf6 h ALA 53 Cb 1.60 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 19.19 1nf6 h ALA 53 CO 0.18 0.19 -0.84 0.82 0.00 0.00 0.00 179.25 179.60 1nf6 h ILE 54 N 0.81 1.33 -0.67 0.00 2.04 -1.19 -0.74 117.51 119.10 1nf6 h ILE 54 Ca 0.34 -2.17 0.12 0.00 1.00 0.00 0.00 64.86 64.15 1nf6 h ILE 54 Cb 0.29 2.18 -0.08 0.00 -0.74 0.00 0.00 36.82 38.47 1nf6 h ILE 54 CO -0.12 0.67 0.24 0.44 0.00 0.00 0.00 178.15 179.37 1nf6 h ASP 55 N 0.37 0.21 -0.76 1.72 3.32 -0.93 -1.36 116.42 118.99 1nf6 h ASP 55 Ca -0.06 0.10 -0.03 0.00 0.02 0.00 0.00 57.03 57.05 1nf6 h ASP 55 Cb 1.46 0.08 -0.04 0.00 0.22 0.00 0.00 39.33 41.06 1nf6 h ASP 55 CO 0.16 0.10 0.34 -0.33 -1.72 0.00 0.00 179.24 177.80 1nf6 h GLU 56 N 0.40 1.12 -0.78 3.56 4.39 -0.93 -0.39 114.58 121.96 1nf6 h GLU 56 Ca 0.35 -0.18 0.07 0.00 0.34 0.00 0.00 59.36 59.95 1nf6 h GLU 56 Cb 0.49 -0.20 -0.06 0.00 -0.10 0.00 0.00 28.75 28.88 1nf6 h GLU 56 CO -0.36 0.88 0.46 0.52 -1.16 0.00 0.00 179.01 179.35 1nf6 h MET 57 N 1.11 0.79 -0.13 2.33 2.86 -0.43 0.49 114.93 121.94 1nf6 h MET 57 Ca 0.26 -0.05 -0.13 0.00 -2.06 0.00 0.00 59.70 57.72 1nf6 h MET 57 Cb 0.15 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.62 1nf6 h MET 57 CO -0.03 0.52 -0.50 0.00 1.06 0.00 0.00 176.91 177.97 1nf6 h ARG 58 N 0.81 0.34 0.08 1.72 3.08 -0.38 -1.00 114.38 119.04 1nf6 h ARG 58 Ca 0.36 -0.20 -0.00 0.00 0.07 0.00 0.00 59.98 60.21 1nf6 h ARG 58 Cb 0.24 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.31 1nf6 h ARG 58 CO -0.20 0.77 -0.04 0.45 -1.07 0.00 0.00 179.97 179.87 1nf6 h HIS 59 N 0.27 -0.10 -0.92 3.04 3.86 -0.38 0.62 115.15 121.53 1nf6 h HIS 59 Ca 0.01 -0.00 0.08 0.00 -1.16 0.00 0.00 60.37 59.30 1nf6 h HIS 59 Cb 0.97 0.03 -0.06 0.00 1.06 0.00 0.00 27.41 29.41 1nf6 h HIS 59 CO 0.03 0.04 0.60 0.00 0.86 0.00 0.00 177.93 179.45 1nf6 h ALA 60 N 0.69 1.55 -0.31 2.45 0.00 -0.77 0.98 119.26 123.85 1nf6 h ALA 60 Ca -0.01 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 1nf6 h ALA 60 Cb 0.19 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1nf6 h ALA 60 CO 0.02 0.28 -0.11 1.49 0.00 0.00 0.00 179.25 180.93 1nf6 h GLU 61 N 0.99 0.63 -0.46 0.00 4.81 -0.84 -0.74 114.58 118.97 1nf6 h GLU 61 Ca 0.42 -0.26 -0.11 0.00 -0.13 0.00 0.00 59.36 59.28 1nf6 h GLU 61 Cb 0.31 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 1nf6 h GLU 61 CO -0.17 0.83 -0.16 -0.91 -0.73 0.00 0.00 179.01 177.86 1nf6 h ASN 62 N 0.39 0.89 -0.71 1.04 -0.26 -0.40 -0.52 115.58 116.03 1nf6 h ASN 62 Ca 0.08 -0.31 -0.06 0.00 -0.56 0.00 0.00 56.30 55.44 1nf6 h ASN 62 Cb 0.62 -0.24 -0.03 0.00 -1.06 0.00 0.00 38.32 37.60 1nf6 h ASN 62 CO 0.04 1.05 0.19 -0.26 -1.06 0.00 0.00 177.43 177.39 1nf6 h PHE 63 N 0.78 1.18 -0.50 1.19 0.05 -0.74 -2.51 116.94 116.39 1nf6 h PHE 63 Ca 0.12 -0.13 -0.11 0.00 3.82 0.00 0.00 57.97 61.67 1nf6 h PHE 63 Cb 0.70 -0.34 -0.02 0.00 2.00 0.00 0.00 35.95 38.29 1nf6 h PHE 63 CO 0.04 0.94 -0.13 0.00 -0.18 0.00 0.00 178.31 178.99 1nf6 h ALA 64 N 1.13 0.83 -0.73 2.45 0.00 -0.75 -2.04 119.26 120.15 1nf6 h ALA 64 Ca 0.23 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 1nf6 h ALA 64 Cb 0.34 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1nf6 h ALA 64 CO -0.00 0.65 0.24 0.93 0.00 0.00 0.00 179.25 181.07 1nf6 h GLU 65 N 0.84 1.13 -0.29 0.00 5.08 -0.97 -1.12 114.58 119.25 1nf6 h GLU 65 Ca 0.13 -0.24 -0.04 0.00 -1.00 0.00 0.00 59.36 58.21 1nf6 h GLU 65 Cb 0.67 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1nf6 h GLU 65 CO 0.05 0.96 0.03 -0.09 -1.00 0.00 0.00 179.01 178.96 1nf6 h ARG 66 N 1.08 0.49 -0.76 2.33 9.65 -1.30 -0.35 114.38 125.51 1nf6 h ARG 66 Ca 0.24 -0.14 0.18 0.00 -1.10 0.00 0.00 59.98 59.15 1nf6 h ARG 66 Cb 0.29 -0.05 -0.12 0.00 -1.39 0.00 0.00 29.97 28.70 1nf6 h ARG 66 CO -0.01 0.61 0.12 0.82 2.80 0.00 0.00 179.97 184.31 1nf6 h ILE 67 N 0.30 0.41 -0.31 1.20 2.04 -1.20 0.26 117.51 120.21 1nf6 h ILE 67 Ca 0.09 -0.06 0.01 0.00 1.00 0.00 0.00 64.86 65.89 1nf6 h ILE 67 Cb 0.37 0.21 -0.02 0.00 -0.74 0.00 0.00 36.82 36.64 1nf6 h ILE 67 CO 0.01 0.03 0.19 0.11 0.00 0.00 0.00 178.15 178.50 1nf6 h LYS 68 N 0.19 0.38 0.00 2.37 1.79 -0.69 0.24 116.57 120.85 1nf6 h LYS 68 Ca 0.44 -0.02 -0.02 0.00 -2.18 0.00 0.00 60.65 58.86 1nf6 h LYS 68 Cb 0.78 -0.09 -0.00 0.00 -1.58 0.00 0.00 32.23 31.34 1nf6 h LYS 68 CO -0.60 0.25 -0.08 0.93 -1.08 0.00 0.00 179.45 178.88 1nf6 h GLU 69 N 0.40 0.00 -0.00 3.15 5.08 0.11 -1.01 114.58 122.30 1nf6 h GLU 69 Ca 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1nf6 h GLU 69 Cb -0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.23 1nf6 h GLU 69 CO -0.04 0.08 -0.50 1.28 -1.00 0.00 0.00 179.01 178.83 1nf6 n LEU 70 N -3.86 0.86 0.00 1.33 4.77 0.33 -4.94 117.00 115.48 1nf6 n LEU 70 Ca -0.02 -0.22 0.00 0.00 -0.03 0.00 0.00 56.01 55.74 1nf6 n LEU 70 Cb 0.18 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 1nf6 n LEU 70 CO 0.30 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1nf6 n GLY 71 N 1.45 0.89 2.86 -0.72 0.00 -0.38 -4.93 105.19 104.36 1nf6 n GLY 71 Ca 0.08 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.93 1nf6 n GLY 71 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nf6 n GLY 72 N -1.77 0.90 3.23 -0.02 0.00 0.77 -4.97 105.19 103.33 1nf6 n GLY 72 Ca 0.00 -2.04 -0.34 0.00 0.00 0.00 0.00 46.02 43.64 1nf6 n GLY 72 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1nf6 s GLU 73 N -4.31 3.19 0.17 1.61 2.56 -1.26 -4.20 118.70 116.46 1nf6 s GLU 73 Ca 0.48 -0.74 -0.32 0.00 0.00 0.00 0.00 54.97 54.40 1nf6 s GLU 73 Cb -0.03 -2.72 -0.11 0.00 2.00 0.00 0.00 34.13 33.27 1nf6 s GLU 73 CO 0.32 -0.12 1.78 -2.14 -0.56 0.00 0.00 175.26 174.54 1nf6 s PRO 74 N 1.16 4.13 0.76 4.30 0.02 -1.26 -4.95 135.00 139.16 1nf6 s PRO 74 Ca 0.01 2.62 -0.13 0.00 0.02 0.00 0.00 61.00 63.52 1nf6 s PRO 74 Cb -0.14 -3.32 0.06 0.00 0.02 0.00 0.00 34.50 31.12 1nf6 s PRO 74 CO -0.05 -0.80 1.16 -0.08 -0.33 0.00 0.00 177.00 176.90 1nf6 s THR 75 N 1.93 2.55 -1.29 0.99 -1.32 -1.26 -4.93 115.64 112.31 1nf6 s THR 75 Ca 0.78 0.23 0.11 0.00 -1.21 0.00 0.00 61.69 61.61 1nf6 s THR 75 Cb -0.48 -2.66 0.17 0.00 -1.51 0.00 0.00 72.50 68.01 1nf6 s THR 75 CO 0.34 -0.18 1.00 0.35 -2.21 0.00 0.00 174.62 173.93 1nf6 n THR 76 N -3.11 0.34 -4.18 5.08 -2.24 -1.26 -4.96 114.28 103.95 1nf6 n THR 76 Ca 0.12 -0.67 -0.35 0.00 -2.27 0.00 0.00 64.05 60.87 1nf6 n THR 76 Cb 0.51 0.99 -0.09 0.00 -2.10 0.00 0.00 70.33 69.65 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 -0.98 3.27 0.32 -0.78 -0.21 -1.26 -5.10 119.66 114.92 1nf6 s GLN 77 Ca 0.17 -0.32 -0.08 0.00 0.02 0.00 0.00 55.36 55.15 1nf6 s GLN 77 Cb 0.11 -2.97 -0.06 0.00 1.00 0.00 0.00 33.01 31.09 1nf6 s GLN 77 CO 0.15 0.65 0.63 -1.59 -2.12 0.00 0.00 175.29 173.01 1nf6 s LYS 78 N -0.72 3.72 -0.47 2.91 -2.85 -1.26 -4.37 119.74 116.70 1nf6 s LYS 78 Ca 0.12 0.22 -0.20 0.00 -1.00 0.00 0.00 55.97 55.11 1nf6 s LYS 78 Cb -0.12 -2.56 0.04 0.00 -2.06 0.00 0.00 37.83 33.14 1nf6 s LYS 78 CO 0.02 0.15 0.62 -2.00 0.10 0.00 0.00 175.35 174.25 1nf6 s GLU 79 N -3.50 3.18 0.00 1.78 2.56 0.18 -4.93 118.70 117.97 1nf6 s GLU 79 Ca 0.47 -0.67 0.00 0.00 0.00 0.00 0.00 54.97 54.77 1nf6 s GLU 79 Cb -0.11 -4.03 0.00 0.00 2.00 0.00 0.00 34.13 32.00 1nf6 s GLU 79 CO 0.28 -1.11 0.00 0.41 -0.56 0.00 0.00 175.26 174.28 1nf6 n GLY 80 N 5.12 0.98 3.90 -1.50 0.00 -1.26 -4.70 105.19 107.72 1nf6 n GLY 80 Ca -0.05 -2.05 -0.32 0.00 0.00 0.00 0.00 46.02 43.60 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 -1.59 3.57 -0.18 1.61 1.02 -1.26 -5.00 119.74 117.91 1nf6 s LYS 81 Ca 0.00 -0.16 -0.19 0.00 0.02 0.00 0.00 55.97 55.64 1nf6 s LYS 81 Cb 0.00 -2.94 -0.03 0.00 -0.52 0.00 0.00 37.83 34.34 1nf6 s LYS 81 CO 0.00 0.54 0.56 0.08 -0.92 0.00 0.00 175.35 175.61 1nf6 s VAL 82 N -1.55 5.08 -0.21 3.17 1.01 -1.26 -5.06 120.40 121.59 1nf6 s VAL 82 Ca 0.37 1.05 -0.18 0.00 0.00 0.00 0.00 61.98 63.22 1nf6 s VAL 82 Cb -0.13 -3.88 -0.03 0.00 0.00 0.00 0.00 36.38 32.34 1nf6 s VAL 82 CO 0.24 0.18 0.49 -0.69 0.00 0.00 0.00 175.10 175.31 1nf6 s VAL 83 N 1.57 5.12 0.43 2.92 1.01 -1.26 -5.08 120.40 125.11 1nf6 s VAL 83 Ca 0.26 0.88 0.07 0.00 0.00 0.00 0.00 61.98 63.20 1nf6 s VAL 83 Cb -0.16 -3.81 -0.02 0.00 0.00 0.00 0.00 36.38 32.40 1nf6 s VAL 83 CO 0.10 0.18 0.37 0.42 0.00 0.00 0.00 175.10 176.17 1nf6 s THR 84 N 1.66 2.49 -1.29 3.92 -4.23 -1.26 -4.65 115.64 112.28 1nf6 s THR 84 Ca 0.22 -1.39 0.00 0.00 -1.18 0.00 0.00 61.69 59.34 1nf6 s THR 84 Cb -0.15 -2.89 0.00 0.00 1.34 0.00 0.00 72.50 70.80 1nf6 s THR 84 CO 0.09 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.78 1nf6 n GLY 85 N -1.55 1.30 3.74 3.99 0.00 -1.26 -4.98 105.19 106.42 1nf6 n GLY 85 Ca 0.03 -0.35 -0.41 0.00 0.00 0.00 0.00 46.02 45.28 1nf6 n GLY 85 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1nf6 s GLN 86 N -2.96 4.43 0.84 1.61 -0.21 -1.26 -5.01 119.66 117.10 1nf6 s GLN 86 Ca 0.00 1.96 -0.11 0.00 0.02 0.00 0.00 55.36 57.23 1nf6 s GLN 86 Cb 0.00 -3.22 0.10 0.00 1.00 0.00 0.00 33.01 30.89 1nf6 s GLN 86 CO 0.00 -0.19 1.14 0.00 -2.12 0.00 0.00 175.29 174.12 1nf6 s ALA 87 N 0.14 1.82 0.15 6.09 0.00 -1.26 -4.73 121.76 123.97 1nf6 s ALA 87 Ca 0.55 0.54 -0.22 0.00 0.00 0.00 0.00 51.96 52.83 1nf6 s ALA 87 Cb -0.34 -3.40 0.04 0.00 0.00 0.00 0.00 23.12 19.42 1nf6 s ALA 87 CO 0.37 -2.31 1.62 0.28 0.00 0.00 0.00 175.76 175.72 1nf6 h VAL 88 N -1.39 0.36 -0.49 0.00 2.07 -2.00 -0.70 116.25 114.10 1nf6 h VAL 88 Ca -0.44 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.14 1nf6 h VAL 88 Cb 1.26 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 31.36 1nf6 h VAL 88 CO 0.46 0.00 0.33 -0.65 0.02 0.00 0.00 177.57 177.72 1nf6 h PRO 89 N -0.24 0.39 -0.00 1.57 0.11 -1.99 -2.25 132.00 129.57 1nf6 h PRO 89 Ca 0.15 -0.02 -0.20 0.00 0.11 0.00 0.00 66.00 66.04 1nf6 h PRO 89 Cb 0.48 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.49 1nf6 h PRO 89 CO -0.43 0.26 -0.87 0.28 -0.21 0.00 0.00 178.00 177.03 1nf6 h VAL 90 N 0.40 1.47 0.13 3.15 2.07 -1.66 -2.24 116.25 119.57 1nf6 h VAL 90 Ca 0.21 -2.54 0.02 0.00 0.82 0.00 0.00 66.70 65.21 1nf6 h VAL 90 Cb 0.33 2.42 -0.03 0.00 -1.52 0.00 0.00 31.29 32.49 1nf6 h VAL 90 CO -0.05 0.75 -0.23 0.40 0.02 0.00 0.00 177.57 178.45 1nf6 h ILE 91 N 0.14 0.48 0.00 4.57 2.04 -0.56 -1.31 117.51 122.88 1nf6 h ILE 91 Ca -0.05 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.71 1nf6 h ILE 91 Cb 1.49 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 38.04 1nf6 h ILE 91 CO 0.14 0.00 -0.48 1.88 0.00 0.00 0.00 178.15 179.69 1nf6 h TYR 92 N -0.44 0.00 -0.01 1.37 -1.99 -1.49 -1.77 116.97 112.64 1nf6 h TYR 92 Ca 0.03 0.00 -0.20 0.00 2.00 0.00 0.00 58.73 60.56 1nf6 h TYR 92 Cb 0.46 0.00 0.02 0.00 2.00 0.00 0.00 36.73 39.20 1nf6 h TYR 92 CO -0.21 0.48 -0.77 1.49 -0.00 0.00 0.00 178.16 179.15 1nf6 h GLU 93 N 0.00 0.54 0.00 4.88 4.81 -1.31 -2.56 114.58 120.94 1nf6 h GLU 93 Ca -0.00 -0.57 -0.11 0.00 -0.13 0.00 0.00 59.36 58.55 1nf6 h GLU 93 Cb 1.06 0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.59 1nf6 h GLU 93 CO 0.06 1.19 -0.52 0.66 -0.73 0.00 0.00 179.01 179.67 1nf6 h SER 94 N 0.12 0.00 -0.13 1.04 4.64 -1.20 -2.28 113.55 115.73 1nf6 h SER 94 Ca -0.09 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.00 1nf6 h SER 94 Cb 1.45 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.55 1nf6 h SER 94 CO 0.15 0.52 -0.79 0.44 -0.87 0.00 0.00 176.83 176.28 1nf6 h ASP 95 N 0.00 0.92 -0.73 4.97 3.32 -1.40 0.43 116.42 123.93 1nf6 h ASP 95 Ca -0.01 -0.64 0.07 0.00 0.02 0.00 0.00 57.03 56.47 1nf6 h ASP 95 Cb 1.27 -0.27 -0.06 0.00 0.22 0.00 0.00 39.33 40.49 1nf6 h ASP 95 CO 0.07 1.42 0.42 0.00 -1.72 0.00 0.00 179.24 179.43 1nf6 h ALA 96 N 0.52 0.99 -0.52 3.45 0.00 -1.40 -0.24 119.26 122.06 1nf6 h ALA 96 Ca -0.06 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 1nf6 h ALA 96 Cb 1.43 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 1nf6 h ALA 96 CO 0.16 0.10 0.07 -0.44 0.00 0.00 0.00 179.25 179.14 1nf6 h ASP 97 N 0.75 0.78 -0.15 0.00 3.32 -1.15 -2.44 116.42 117.53 1nf6 h ASP 97 Ca 0.33 -0.16 -0.19 0.00 0.02 0.00 0.00 57.03 57.02 1nf6 h ASP 97 Cb 0.22 -0.20 0.01 0.00 0.22 0.00 0.00 39.33 39.57 1nf6 h ASP 97 CO -0.19 0.80 -0.66 -0.61 -1.72 0.00 0.00 179.24 176.85 1nf6 h GLN 98 N 0.78 0.71 -0.57 3.56 4.15 -0.20 -1.46 115.11 122.09 1nf6 h GLN 98 Ca 0.16 -0.57 -0.06 0.00 0.77 0.00 0.00 58.65 58.95 1nf6 h GLN 98 Cb 0.37 0.11 -0.03 0.00 0.21 0.00 0.00 27.48 28.15 1nf6 h GLN 98 CO 0.01 1.18 0.11 0.93 -1.93 0.00 0.00 178.83 179.13 1nf6 h GLU 99 N 0.41 0.91 -0.61 1.69 4.39 -0.98 0.15 114.58 120.55 1nf6 h GLU 99 Ca -0.04 -0.21 -0.08 0.00 0.34 0.00 0.00 59.36 59.37 1nf6 h GLU 99 Cb 1.30 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 29.80 1nf6 h GLU 99 CO 0.14 0.83 0.05 0.22 -1.16 0.00 0.00 179.01 179.09 1nf6 h ASP 100 N 0.86 0.99 -0.05 1.42 1.82 -1.42 0.20 116.42 120.25 1nf6 h ASP 100 Ca 0.18 -0.25 -0.10 0.00 -0.39 0.00 0.00 57.03 56.46 1nf6 h ASP 100 Cb 0.36 -0.26 -0.01 0.00 0.68 0.00 0.00 39.33 40.09 1nf6 h ASP 100 CO 0.00 1.02 -0.28 0.00 -1.61 0.00 0.00 179.24 178.37 1nf6 h ALA 101 N 1.09 1.05 -0.13 -0.78 0.00 -0.87 -2.44 119.26 117.18 1nf6 h ALA 101 Ca 0.18 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 1nf6 h ALA 101 Cb 0.49 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 1nf6 h ALA 101 CO 0.02 0.58 -0.06 1.15 0.00 0.00 0.00 179.25 180.94 1nf6 h THR 102 N 0.43 1.32 -0.88 0.00 2.02 -0.20 -2.13 112.91 113.47 1nf6 h THR 102 Ca 0.06 -1.08 0.03 0.00 0.77 0.00 0.00 66.41 66.18 1nf6 h THR 102 Cb 0.72 1.77 -0.05 0.00 -1.74 0.00 0.00 68.15 68.85 1nf6 h THR 102 CO 0.06 0.31 0.58 0.40 0.37 0.00 0.00 175.52 177.23 1nf6 h ILE 103 N -0.08 1.16 -0.87 3.11 2.04 -0.54 0.17 117.51 122.51 1nf6 h ILE 103 Ca 0.03 -0.39 -0.03 0.00 1.00 0.00 0.00 64.86 65.47 1nf6 h ILE 103 Cb 0.52 -0.07 -0.04 0.00 -0.74 0.00 0.00 36.82 36.49 1nf6 h ILE 103 CO 0.02 0.21 0.43 -0.33 0.00 0.00 0.00 178.15 178.47 1nf6 h GLU 104 N 1.13 1.24 0.01 2.37 4.39 -1.43 -1.47 114.58 120.82 1nf6 h GLU 104 Ca 0.35 -0.18 -0.27 0.00 0.34 0.00 0.00 59.36 59.60 1nf6 h GLU 104 Cb -0.03 -0.23 0.02 0.00 -0.10 0.00 0.00 28.75 28.41 1nf6 h GLU 104 CO -0.11 0.94 -1.05 0.00 -1.16 0.00 0.00 179.01 177.63 1nf6 h ALA 105 N 1.23 0.14 0.00 3.43 0.00 -0.80 -2.92 119.26 120.34 1nf6 h ALA 105 Ca 0.30 -0.70 -0.07 0.00 0.00 0.00 0.00 54.91 54.44 1nf6 h ALA 105 Cb 0.10 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1nf6 h ALA 105 CO -0.04 0.70 -0.33 1.88 0.00 0.00 0.00 179.25 181.46 1nf6 h TYR 106 N 0.38 0.00 -0.23 0.00 -1.99 -0.59 0.09 116.97 114.63 1nf6 h TYR 106 Ca -0.13 0.00 -0.14 0.00 2.00 0.00 0.00 58.73 60.46 1nf6 h TYR 106 Cb 1.70 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 40.42 1nf6 h TYR 106 CO 0.10 0.33 -0.43 0.77 -0.00 0.00 0.00 178.16 178.93 1nf6 h SER 107 N 0.00 0.59 0.10 3.88 0.02 -1.25 0.25 113.55 117.13 1nf6 h SER 107 Ca -0.00 -0.27 -0.21 0.00 -0.84 0.00 0.00 61.79 60.47 1nf6 h SER 107 Cb 0.67 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.05 1nf6 h SER 107 CO 0.04 0.94 -0.80 1.56 -1.14 0.00 0.00 176.83 177.43 1nf6 h GLN 108 N 0.45 0.57 -0.64 3.45 1.08 -1.24 -2.82 115.11 115.95 1nf6 h GLN 108 Ca 0.03 -0.49 0.05 0.00 -1.45 0.00 0.00 58.65 56.79 1nf6 h GLN 108 Cb 0.93 0.11 -0.05 0.00 -0.05 0.00 0.00 27.48 28.42 1nf6 h GLN 108 CO 0.08 1.12 0.36 0.74 -0.95 0.00 0.00 178.83 180.18 1nf6 h PHE 109 N 0.38 0.66 -0.56 2.96 0.05 -0.70 -2.21 116.94 117.52 1nf6 h PHE 109 Ca -0.05 0.02 0.11 0.00 3.82 0.00 0.00 57.97 61.87 1nf6 h PHE 109 Cb 1.41 -0.20 -0.08 0.00 2.00 0.00 0.00 35.95 39.07 1nf6 h PHE 109 CO 0.07 0.33 0.09 1.25 -0.18 0.00 0.00 178.31 179.86 1nf6 h LEU 110 N 0.67 -0.06 -1.14 1.54 6.46 -0.42 -1.00 115.31 121.36 1nf6 h LEU 110 Ca 0.28 0.11 -0.00 0.00 -0.12 0.00 0.00 57.88 58.16 1nf6 h LEU 110 Cb 0.16 0.17 -0.04 0.00 -0.73 0.00 0.00 40.66 40.22 1nf6 h LEU 110 CO -0.17 -0.02 0.49 0.11 -0.62 0.00 0.00 178.44 178.24 1nf6 h LYS 111 N 0.21 1.08 -0.26 1.25 1.57 -1.18 -1.55 116.57 117.70 1nf6 h LYS 111 Ca 0.29 -0.09 0.03 0.00 -1.87 0.00 0.00 60.65 59.01 1nf6 h LYS 111 Cb 0.43 -0.23 -0.03 0.00 0.08 0.00 0.00 32.23 32.48 1nf6 h LYS 111 CO -0.40 0.75 0.10 0.28 -0.57 0.00 0.00 179.45 179.60 1nf6 h VAL 112 N 1.10 0.94 -0.65 0.50 2.07 -0.62 -0.95 116.25 118.65 1nf6 h VAL 112 Ca 0.29 -0.08 0.09 0.00 0.82 0.00 0.00 66.70 67.83 1nf6 h VAL 112 Cb -0.06 0.70 -0.07 0.00 -1.52 0.00 0.00 31.29 30.34 1nf6 h VAL 112 CO -0.06 0.04 0.28 0.00 0.02 0.00 0.00 177.57 177.86 1nf6 h LYS 114 N 0.49 0.60 -0.22 0.00 1.57 -0.79 0.27 116.57 118.51 1nf6 h LYS 114 Ca 0.32 -0.12 -0.05 0.00 -1.87 0.00 0.00 60.65 58.93 1nf6 h LYS 114 Cb 0.37 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 1nf6 h LYS 114 CO -0.28 0.60 -0.07 0.93 -0.57 0.00 0.00 179.45 180.06 1nf6 h GLU 115 N 0.49 0.34 -0.21 3.15 5.08 -0.31 -0.44 114.58 122.68 1nf6 h GLU 115 Ca 0.13 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1nf6 h GLU 115 Cb 0.24 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1nf6 h GLU 115 CO -0.01 0.42 0.00 1.04 -1.00 0.00 0.00 179.01 179.47 1nf6 n GLN 116 N -4.29 1.50 -3.84 2.33 1.13 0.39 -4.92 117.38 109.69 1nf6 n GLN 116 Ca 0.00 -0.77 -0.24 0.00 -1.94 0.00 0.00 57.00 54.05 1nf6 n GLN 116 Cb 0.25 -1.19 0.01 0.00 0.11 0.00 0.00 30.24 29.42 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 0.86 -0.30 3.03 1.08 0.00 -0.17 -4.92 105.19 104.77 1nf6 n GLY 117 Ca 0.08 0.14 -0.33 0.00 0.00 0.00 0.00 46.02 45.91 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 -4.19 5.32 0.11 1.61 -1.08 0.89 -4.95 116.67 114.38 1nf6 s ASP 118 Ca 0.12 -3.50 -0.17 0.00 -0.52 0.00 0.00 52.55 48.47 1nf6 s ASP 118 Cb -0.06 -1.79 -0.05 0.00 -1.46 0.00 0.00 42.92 39.56 1nf6 s ASP 118 CO 0.85 -0.20 1.58 0.40 0.52 0.00 0.00 175.17 178.32 1nf6 h ILE 119 N 4.57 1.24 -0.47 4.11 1.08 -1.93 -1.25 117.51 124.86 1nf6 h ILE 119 Ca 0.09 -0.83 -0.01 0.00 -0.39 0.00 0.00 64.86 63.72 1nf6 h ILE 119 Cb 0.83 1.15 -0.02 0.00 -3.07 0.00 0.00 36.82 35.71 1nf6 h ILE 119 CO 0.77 0.28 0.25 0.58 -0.69 0.00 0.00 178.15 179.33 1nf6 h VAL 120 N 0.37 1.17 -0.28 1.67 2.07 -1.97 -0.82 116.25 118.46 1nf6 h VAL 120 Ca 0.10 -0.46 -0.13 0.00 0.82 0.00 0.00 66.70 67.03 1nf6 h VAL 120 Cb 0.36 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 1nf6 h VAL 120 CO 0.01 0.19 -0.35 0.74 0.02 0.00 0.00 177.57 178.18 1nf6 h THR 121 N 0.62 1.29 -0.70 2.57 2.02 -1.95 -2.58 112.91 114.18 1nf6 h THR 121 Ca 0.16 -1.48 0.04 0.00 0.77 0.00 0.00 66.41 65.90 1nf6 h THR 121 Cb 0.07 1.45 -0.05 0.00 -1.74 0.00 0.00 68.15 67.89 1nf6 h THR 121 CO -0.02 0.47 0.43 0.00 0.37 0.00 0.00 175.52 176.77 1nf6 h ALA 122 N 1.10 0.92 -0.49 6.16 0.00 -0.90 -2.20 119.26 123.86 1nf6 h ALA 122 Ca 0.06 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1nf6 h ALA 122 Cb 0.84 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1nf6 h ALA 122 CO 0.07 0.18 0.12 0.07 0.00 0.00 0.00 179.25 179.69 1nf6 h ARG 123 N 0.83 0.74 -0.38 0.00 -0.00 -0.92 -0.51 114.38 114.13 1nf6 h ARG 123 Ca 0.29 -0.14 -0.05 0.00 -0.00 0.00 0.00 59.98 60.08 1nf6 h ARG 123 Cb 0.06 -0.12 -0.01 0.00 -0.00 0.00 0.00 29.97 29.90 1nf6 h ARG 123 CO -0.13 0.67 0.05 1.25 -0.00 0.00 0.00 179.97 181.81 1nf6 h LEU 124 N 0.71 0.62 -0.69 0.08 5.85 -1.14 -1.94 115.31 118.80 1nf6 h LEU 124 Ca 0.16 -0.27 -0.02 0.00 0.84 0.00 0.00 57.88 58.59 1nf6 h LEU 124 Cb 0.26 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 1nf6 h LEU 124 CO -0.00 0.73 0.35 -0.26 -0.34 0.00 0.00 178.44 178.92 1nf6 h PHE 125 N 0.48 0.99 -0.25 1.25 -1.00 -0.90 -1.11 116.94 116.41 1nf6 h PHE 125 Ca 0.11 -0.04 0.06 0.00 2.81 0.00 0.00 57.97 60.91 1nf6 h PHE 125 Cb 0.39 -0.31 -0.07 0.00 3.61 0.00 0.00 35.95 39.57 1nf6 h PHE 125 CO 0.03 0.72 -0.28 0.93 -1.61 0.00 0.00 178.31 178.10 1nf6 h GLU 126 N 0.96 -0.27 -0.25 1.51 5.08 -0.87 0.94 114.58 121.67 1nf6 h GLU 126 Ca 0.24 0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.60 1nf6 h GLU 126 Cb 0.10 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1nf6 h GLU 126 CO -0.03 -0.18 0.10 0.00 -1.00 0.00 0.00 179.01 177.89 1nf6 h ARG 127 N -0.29 0.38 -0.13 2.33 3.08 -1.15 -2.34 114.38 116.27 1nf6 h ARG 127 Ca 0.13 -0.07 -0.06 0.00 0.07 0.00 0.00 59.98 60.05 1nf6 h ARG 127 Cb 0.50 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 1nf6 h ARG 127 CO -0.41 0.42 -0.21 0.82 -1.07 0.00 0.00 179.97 179.52 1nf6 h ILE 128 N 0.25 1.21 -0.65 2.04 2.04 -0.97 -2.27 117.51 119.17 1nf6 h ILE 128 Ca 0.08 -0.97 -0.04 0.00 1.00 0.00 0.00 64.86 64.93 1nf6 h ILE 128 Cb 0.18 1.34 -0.03 0.00 -0.74 0.00 0.00 36.82 37.58 1nf6 h ILE 128 CO -0.01 0.30 0.25 0.40 0.00 0.00 0.00 178.15 179.09 1nf6 h ILE 129 N 0.21 1.24 -0.17 -0.67 2.04 -0.37 -0.36 117.51 119.43 1nf6 h ILE 129 Ca 0.04 -0.76 -0.01 0.00 1.00 0.00 0.00 64.86 65.12 1nf6 h ILE 129 Cb 0.49 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 37.08 1nf6 h ILE 129 CO 0.03 0.30 0.04 -0.33 0.00 0.00 0.00 178.15 178.19 1nf6 h GLU 130 N 0.92 0.23 -0.09 2.37 5.08 -0.91 -0.76 114.58 121.43 1nf6 h GLU 130 Ca 0.22 -0.02 -0.19 0.00 -1.00 0.00 0.00 59.36 58.36 1nf6 h GLU 130 Cb 0.22 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 1nf6 h GLU 130 CO -0.02 0.22 -0.74 0.93 -1.00 0.00 0.00 179.01 178.41 1nf6 h GLU 131 N 0.23 0.48 -0.37 2.33 5.08 -0.99 -2.51 114.58 118.83 1nf6 h GLU 131 Ca 0.06 -0.39 -0.06 0.00 -1.00 0.00 0.00 59.36 57.97 1nf6 h GLU 131 Cb 0.10 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 1nf6 h GLU 131 CO -0.00 1.02 -0.02 0.93 -1.00 0.00 0.00 179.01 179.94 1nf6 h GLU 132 N 0.33 0.59 -0.67 2.33 4.39 -0.29 -0.83 114.58 120.43 1nf6 h GLU 132 Ca -0.03 -0.14 -0.07 0.00 0.34 0.00 0.00 59.36 59.45 1nf6 h GLU 132 Cb 1.32 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 29.87 1nf6 h GLU 132 CO 0.13 0.63 0.12 0.37 -1.16 0.00 0.00 179.01 179.11 1nf6 h GLN 133 N 0.56 1.08 -0.30 2.33 5.75 -1.01 0.15 115.11 123.67 1nf6 h GLN 133 Ca 0.11 -0.27 -0.06 0.00 -0.15 0.00 0.00 58.65 58.28 1nf6 h GLN 133 Cb 0.39 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 28.79 1nf6 h GLN 133 CO 0.02 0.98 -0.08 0.00 -2.65 0.00 0.00 178.83 177.09 1nf6 h ALA 134 N 1.11 1.30 -0.27 3.38 0.00 -0.96 -0.40 119.26 123.42 1nf6 h ALA 134 Ca 0.21 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1nf6 h ALA 134 Cb 0.41 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1nf6 h ALA 134 CO 0.01 0.47 -0.05 0.45 0.00 0.00 0.00 179.25 180.13 1nf6 h HIS 135 N 0.47 0.57 0.01 0.00 3.86 -0.46 -2.66 115.15 116.94 1nf6 h HIS 135 Ca 0.09 -0.12 -0.00 0.00 -1.16 0.00 0.00 60.37 59.18 1nf6 h HIS 135 Cb 0.43 -0.14 0.00 0.00 1.06 0.00 0.00 27.41 28.76 1nf6 h HIS 135 CO 0.01 0.71 -0.01 1.25 0.86 0.00 0.00 177.93 180.76 1nf6 h LEU 136 N 0.26 -0.01 -0.94 2.43 5.85 -0.43 -2.46 115.31 120.00 1nf6 h LEU 136 Ca 0.07 -0.01 0.08 0.00 0.84 0.00 0.00 57.88 58.86 1nf6 h LEU 136 Cb 0.52 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 41.48 1nf6 h LEU 136 CO 0.02 -0.00 0.59 0.74 -0.34 0.00 0.00 178.44 179.45 1nf6 h THR 137 N -0.02 1.01 -0.08 1.05 2.02 -1.10 -0.75 112.91 115.04 1nf6 h THR 137 Ca -0.00 -0.35 0.00 0.00 0.77 0.00 0.00 66.41 66.83 1nf6 h THR 137 Cb 0.02 -0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 66.31 1nf6 h THR 137 CO 0.00 0.19 0.05 0.22 0.37 0.00 0.00 175.52 176.35 1nf6 h TYR 138 N 1.03 0.09 -0.61 3.16 3.20 -1.18 -2.10 116.97 120.56 1nf6 h TYR 138 Ca 0.43 0.00 -0.10 0.00 3.14 0.00 0.00 58.73 62.20 1nf6 h TYR 138 Cb 0.27 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.49 1nf6 h TYR 138 CO -0.02 0.06 -0.01 1.88 -1.64 0.00 0.00 178.16 178.43 1nf6 h TYR 139 N 0.10 1.18 -0.95 -3.82 0.99 -0.98 -2.34 116.97 111.15 1nf6 h TYR 139 Ca 0.03 -0.21 0.02 0.00 2.00 0.00 0.00 58.73 60.57 1nf6 h TYR 139 Cb -0.01 -0.31 -0.05 0.00 1.00 0.00 0.00 36.73 37.37 1nf6 h TYR 139 CO -0.08 1.04 0.63 0.93 -0.00 0.00 0.00 178.16 180.67 1nf6 h GLU 140 N 0.98 1.22 -0.01 4.88 5.08 -1.02 -0.92 114.58 124.80 1nf6 h GLU 140 Ca 0.17 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1nf6 h GLU 140 Cb 0.57 -0.28 -0.00 0.00 0.50 0.00 0.00 28.75 29.55 1nf6 h GLU 140 CO 0.03 0.81 0.00 -0.91 -1.00 0.00 0.00 179.01 177.94 1nf6 h ASN 141 N 1.26 0.02 -0.46 1.42 2.35 -1.05 -1.37 115.58 117.74 1nf6 h ASN 141 Ca 0.36 -0.28 -0.04 0.00 -0.55 0.00 0.00 56.30 55.79 1nf6 h ASN 141 Cb -0.10 -0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.24 1nf6 h ASN 141 CO -0.09 0.29 0.13 0.40 -1.65 0.00 0.00 177.43 176.51 1nf6 h ILE 142 N -0.26 1.23 -0.93 2.81 1.08 -1.35 -0.81 117.51 119.28 1nf6 h ILE 142 Ca 0.00 -0.79 0.12 0.00 -0.39 0.00 0.00 64.86 63.80 1nf6 h ILE 142 Cb 0.28 0.87 -0.07 0.00 -3.07 0.00 0.00 36.82 34.82 1nf6 h ILE 142 CO 0.00 0.28 0.60 1.23 -0.69 0.00 0.00 178.15 179.57 1nf6 h GLY 143 N 0.62 1.39 0.78 5.37 0.00 -1.15 -0.71 103.07 109.38 1nf6 h GLY 143 Ca 0.15 -0.37 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 1nf6 h GLY 143 CO -0.00 0.16 0.01 1.76 0.00 0.00 0.00 176.54 178.48 1nf6 h SER 144 N 0.88 0.10 0.34 0.19 0.02 -0.63 -2.51 113.55 111.93 1nf6 h SER 144 Ca 0.45 -0.25 -0.08 0.00 -0.84 0.00 0.00 61.79 61.08 1nf6 h SER 144 Cb 0.51 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.01 1nf6 h SER 144 CO -0.21 0.32 -0.35 0.45 -1.14 0.00 0.00 176.83 175.89 1nf6 h HIS 145 N -0.12 0.03 -0.24 3.45 -0.00 -0.70 -1.32 115.15 116.25 1nf6 h HIS 145 Ca 0.02 -0.01 -0.16 0.00 -0.00 0.00 0.00 60.37 60.22 1nf6 h HIS 145 Cb 0.26 -0.01 -0.01 0.00 -0.00 0.00 0.00 27.41 27.66 1nf6 h HIS 145 CO 0.01 0.38 -0.50 0.82 -0.00 0.00 0.00 177.93 178.63 1nf6 h ILE 146 N 0.02 1.30 -0.05 2.45 2.04 -1.04 -1.35 117.51 120.88 1nf6 h ILE 146 Ca 0.00 -1.72 -0.03 0.00 1.00 0.00 0.00 64.86 64.12 1nf6 h ILE 146 Cb 0.64 1.66 -0.00 0.00 -0.74 0.00 0.00 36.82 38.38 1nf6 h ILE 146 CO 0.05 0.54 -0.08 0.50 0.00 0.00 0.00 178.15 179.16 1nf6 h LYS 147 N 0.52 0.14 0.00 2.37 3.64 -1.14 0.40 116.57 122.50 1nf6 h LYS 147 Ca 0.02 -0.09 -0.11 0.00 -1.27 0.00 0.00 60.65 59.21 1nf6 h LYS 147 Cb 1.06 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.87 1nf6 h LYS 147 CO 0.10 0.64 -0.50 -0.91 -2.27 0.00 0.00 179.45 176.51 1nf6 h ASN 148 N -0.34 0.00 0.00 4.20 2.35 -1.30 -3.38 115.58 117.10 1nf6 h ASN 148 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1nf6 h ASN 148 Cb 0.63 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.00 1nf6 h ASN 148 CO 0.02 0.50 -0.18 0.18 -1.65 0.00 0.00 177.43 176.30 1nf6 n LEU 149 N -3.23 0.00 0.00 1.61 4.77 -0.51 -5.09 117.00 114.55 1nf6 n LEU 149 Ca 0.02 -0.29 0.00 0.00 -0.03 0.00 0.00 56.01 55.71 1nf6 n LEU 149 Cb 0.73 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.82 1nf6 n LEU 149 CO 0.41 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 1nf6 n GLY 150 N 1.02 2.60 0.27 -0.72 0.00 0.13 -1.26 105.19 107.23 1nf6 n GLY 150 Ca 0.00 0.08 0.18 0.00 0.00 0.00 0.00 46.02 46.29 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 -0.55 1.61 3.32 -1.93 -2.28 116.42 116.59 1nf6 h ASP 151 Ca 0.00 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 1nf6 h ASP 151 Cb 0.00 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 1nf6 h ASP 151 CO 0.00 0.00 -0.07 0.74 -1.72 0.00 0.00 179.24 178.19 1nf6 h THR 152 N 0.00 1.27 -0.06 0.35 2.02 -1.58 -1.44 112.91 113.46 1nf6 h THR 152 Ca 0.00 -1.22 -0.02 0.00 0.77 0.00 0.00 66.41 65.94 1nf6 h THR 152 Cb 0.22 0.90 -0.00 0.00 -1.74 0.00 0.00 68.15 67.54 1nf6 h THR 152 CO 0.00 0.44 -0.02 0.22 0.37 0.00 0.00 175.52 176.53 1nf6 h TYR 153 N 0.93 0.14 -0.75 3.16 3.20 -1.43 -3.12 116.97 119.10 1nf6 h TYR 153 Ca 0.15 -0.03 0.07 0.00 3.14 0.00 0.00 58.73 62.06 1nf6 h TYR 153 Cb 0.63 -0.03 -0.06 0.00 1.54 0.00 0.00 36.73 38.80 1nf6 h TYR 153 CO 0.04 0.47 0.43 -0.07 -1.64 0.00 0.00 178.16 177.39 1nf6 h LEU 154 N -0.22 0.63 -1.83 2.82 3.38 -1.46 0.18 115.31 118.81 1nf6 h LEU 154 Ca 0.02 0.04 0.09 0.00 0.09 0.00 0.00 57.88 58.11 1nf6 h LEU 154 Cb 0.42 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1nf6 h LEU 154 CO 0.01 0.39 0.29 0.00 0.09 0.00 0.00 178.44 179.22 1nf6 h ALA 155 N 1.40 2.14 0.00 1.53 0.00 -1.29 0.28 119.26 123.31 1nf6 h ALA 155 Ca 0.35 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.20 1nf6 h ALA 155 Cb 0.25 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1nf6 h ALA 155 CO -0.21 -0.24 -0.22 -0.22 0.00 0.00 0.00 179.25 178.36 1nf6 h LYS 156 N 0.20 0.00 0.02 0.00 3.64 -0.59 -3.23 116.57 116.62 1nf6 h LYS 156 Ca 0.20 0.00 -0.32 0.00 -1.27 0.00 0.00 60.65 59.25 1nf6 h LYS 156 Cb 0.52 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.29 1nf6 h LYS 156 CO -0.03 0.22 -1.91 -0.89 -2.27 0.00 0.00 179.45 174.57 1nf6 n ILE 157 N -3.44 1.59 -1.64 2.00 2.08 0.74 -4.83 119.36 115.86 1nf6 n ILE 157 Ca -0.00 -0.78 -0.51 0.00 0.56 0.00 0.00 62.75 62.02 1nf6 n ILE 157 Cb 0.41 -1.05 -0.06 0.00 -0.75 0.00 0.00 39.64 38.19 1nf6 n ILE 157 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1nf6 n ALA 158 N -2.68 -0.01 -0.25 -1.39 0.00 0.14 -1.76 120.51 114.57 1nf6 n ALA 158 Ca -0.23 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.66 1nf6 n ALA 158 Cb 1.07 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 18.30 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 3.27 2.10 3.71 0.00 0.00 -0.34 -4.97 105.19 108.95 1nf6 n GLY 159 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 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 -3.11 2.57 0.47 2.61 -4.23 -0.72 -4.91 115.64 108.32 1nf6 s THR 160 Ca 0.00 0.18 -0.24 0.00 -1.18 0.00 0.00 61.69 60.46 1nf6 s THR 160 Cb 0.00 -2.40 -0.07 0.00 1.34 0.00 0.00 72.50 71.37 1nf6 s THR 160 CO 0.00 -0.24 1.31 -2.84 -0.54 0.00 0.00 174.62 172.31 1nf6 s PRO 161 N -4.75 3.59 0.00 3.99 0.02 -1.26 -3.59 135.00 132.99 1nf6 s PRO 161 Ca 0.65 2.13 0.15 0.00 0.02 0.00 0.00 61.00 63.94 1nf6 s PRO 161 Cb -0.20 -2.48 -0.02 0.00 0.02 0.00 0.00 34.50 31.81 1nf6 s PRO 161 CO 0.57 -0.80 0.79 -1.13 -0.33 0.00 0.00 177.00 176.11 1nf6 n SER 162 N -0.47 1.46 -4.68 2.53 3.41 -1.25 -2.84 113.62 111.78 1nf6 n SER 162 Ca 0.07 -1.23 -0.45 0.00 -0.26 0.00 0.00 58.87 57.00 1nf6 n SER 162 Cb 0.45 0.52 -0.04 0.00 -0.26 0.00 0.00 64.21 64.88 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 -0.26 3.14 -0.85 4.04 2.88 -1.26 -3.93 113.62 117.38 1nf6 n SER 163 Ca 0.06 1.10 0.11 0.00 -1.33 0.00 0.00 58.87 58.80 1nf6 n SER 163 Cb 0.31 -1.45 0.09 0.00 -0.75 0.00 0.00 64.21 62.41 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 3.12 0.01 0.00 2.46 -2.24 -1.26 -4.94 114.28 111.42 1nf6 n THR 164 Ca 0.15 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 1nf6 n THR 164 Cb 0.30 1.44 0.00 0.00 -2.10 0.00 0.00 70.33 69.97 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 1.19 0.74 3.74 3.38 0.00 -1.26 -5.08 105.19 107.90 1nf6 n GLY 165 Ca 0.12 -2.04 -0.34 0.00 0.00 0.00 0.00 46.02 43.76 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 -1.33 2.66 0.33 2.61 -1.32 -1.26 -4.89 115.64 112.44 1nf6 s THR 166 Ca 0.00 0.32 -0.29 0.00 -1.21 0.00 0.00 61.69 60.51 1nf6 s THR 166 Cb 0.00 -2.86 -0.12 0.00 -1.51 0.00 0.00 72.50 68.01 1nf6 s THR 166 CO 0.00 -0.18 1.44 0.00 -2.21 0.00 0.00 174.62 173.67 1nf6 n ALA 167 N -2.58 1.92 -1.25 11.08 0.00 -1.26 -4.84 120.51 123.58 1nf6 n ALA 167 Ca 0.12 0.36 -0.60 0.00 0.00 0.00 0.00 53.44 53.33 1nf6 n ALA 167 Cb 0.51 -2.36 -0.12 0.00 0.00 0.00 0.00 19.45 17.48 1nf6 n ALA 167 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1nf6 n SER 168 N 1.11 0.76 -4.65 0.00 3.41 -1.26 -4.85 113.62 108.14 1nf6 n SER 168 Ca 0.05 0.69 -0.42 0.00 -0.26 0.00 0.00 58.87 58.92 1nf6 n SER 168 Cb 0.37 -0.90 -0.03 0.00 -0.26 0.00 0.00 64.21 63.39 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 5.93 3.97 0.00 4.33 -2.85 -1.26 -4.93 119.74 124.93 1nf6 s LYS 169 Ca 1.19 2.43 0.00 0.00 -1.00 0.00 0.00 55.97 58.60 1nf6 s LYS 169 Cb -1.49 -4.17 0.00 0.00 -2.06 0.00 0.00 37.83 30.10 1nf6 s LYS 169 CO 0.66 -1.14 0.00 0.41 0.10 0.00 0.00 175.35 175.38 1nf6 n GLY 170 N 4.70 7.11 0.07 0.59 0.00 -1.26 -5.09 105.19 111.31 1nf6 n GLY 170 Ca 0.21 -2.04 -0.12 0.00 0.00 0.00 0.00 46.02 44.06 1nf6 n GLY 170 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1nf6 h PHE 171 N 0.07 0.00 0.00 1.61 3.57 -2.05 -3.56 116.94 116.58 1nf6 h PHE 171 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1nf6 h PHE 171 Cb 0.00 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.74 1nf6 h PHE 171 CO 0.00 0.88 0.00 1.33 -2.23 0.00 0.00 178.31 178.29