#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 2.91 0.15 1.61 2.20 -1.26 -4.75 114.94 115.81 1nf6 s ASN 4 Ca 0.00 1.02 -0.28 0.00 -0.94 0.00 0.00 52.86 52.66 1nf6 s ASN 4 Cb 0.00 -1.61 -0.02 0.00 -2.00 0.00 0.00 41.25 37.62 1nf6 s ASN 4 CO 0.00 -2.93 1.57 0.03 -2.94 0.00 0.00 177.10 172.83 1nf6 h ARG 5 N -1.76 -0.30 -0.52 3.55 2.47 -2.00 -1.32 114.38 114.51 1nf6 h ARG 5 Ca -0.52 0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.22 1nf6 h ARG 5 Cb 1.33 0.07 -0.03 0.00 -1.65 0.00 0.00 29.97 29.69 1nf6 h ARG 5 CO 0.58 -0.20 0.32 0.93 0.56 0.00 0.00 179.97 182.17 1nf6 h GLU 6 N -0.31 0.69 -0.04 0.04 3.07 -2.01 -1.67 114.58 114.35 1nf6 h GLU 6 Ca 0.13 -0.05 -0.13 0.00 -0.50 0.00 0.00 59.36 58.82 1nf6 h GLU 6 Cb 0.58 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 28.33 1nf6 h GLU 6 CO -0.61 0.47 -0.56 0.38 -1.40 0.00 0.00 179.01 177.28 1nf6 h ASP 7 N 0.70 0.13 -0.21 1.42 2.03 -1.62 -2.70 116.42 116.17 1nf6 h ASP 7 Ca 0.19 -0.07 -0.06 0.00 -0.73 0.00 0.00 57.03 56.36 1nf6 h ASP 7 Cb -0.05 -0.04 -0.01 0.00 -0.83 0.00 0.00 39.33 38.41 1nf6 h ASP 7 CO -0.04 0.67 -0.09 0.03 -1.03 0.00 0.00 179.24 178.78 1nf6 h ARG 8 N 0.09 0.44 -0.47 4.15 3.08 -0.51 -2.16 114.38 118.99 1nf6 h ARG 8 Ca -0.00 -0.19 -0.02 0.00 0.07 0.00 0.00 59.98 59.84 1nf6 h ARG 8 Cb 1.02 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 31.04 1nf6 h ARG 8 CO 0.08 0.71 0.20 0.87 -1.07 0.00 0.00 179.97 180.76 1nf6 h LYS 9 N 0.15 0.70 -0.93 0.04 1.57 -1.46 -2.21 116.57 114.42 1nf6 h LYS 9 Ca 0.05 -0.12 0.04 0.00 -1.87 0.00 0.00 60.65 58.74 1nf6 h LYS 9 Cb 0.57 -0.12 -0.06 0.00 0.08 0.00 0.00 32.23 32.71 1nf6 h LYS 9 CO 0.03 0.62 0.61 0.00 -0.57 0.00 0.00 179.45 180.14 1nf6 h ALA 10 N 1.04 1.23 -0.08 3.86 0.00 -1.47 1.26 119.26 125.10 1nf6 h ALA 10 Ca 0.16 -0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.86 1nf6 h ALA 10 Cb 0.18 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1nf6 h ALA 10 CO -0.01 0.47 -0.69 0.87 0.00 0.00 0.00 179.25 179.89 1nf6 h LYS 11 N 1.17 0.36 0.06 0.00 1.57 -1.24 -1.68 116.57 116.81 1nf6 h LYS 11 Ca 0.37 -0.28 -0.27 0.00 -1.87 0.00 0.00 60.65 58.60 1nf6 h LYS 11 Cb 0.01 0.05 0.02 0.00 0.08 0.00 0.00 32.23 32.39 1nf6 h LYS 11 CO -0.12 0.92 -1.11 0.28 -0.57 0.00 0.00 179.45 178.85 1nf6 h VAL 12 N 0.26 1.34 -0.38 0.50 2.07 -0.82 -3.03 116.25 116.19 1nf6 h VAL 12 Ca -0.02 -2.47 0.04 0.00 0.82 0.00 0.00 66.70 65.07 1nf6 h VAL 12 Cb 1.24 2.56 -0.02 0.00 -1.52 0.00 0.00 31.29 33.56 1nf6 h VAL 12 CO 0.12 0.75 0.26 0.40 0.02 0.00 0.00 177.57 179.11 1nf6 h ILE 13 N 0.27 0.99 0.06 4.57 2.04 0.17 -0.10 117.51 125.51 1nf6 h ILE 13 Ca -0.14 -0.12 -0.00 0.00 1.00 0.00 0.00 64.86 65.60 1nf6 h ILE 13 Cb 1.77 0.62 0.00 0.00 -0.74 0.00 0.00 36.82 38.47 1nf6 h ILE 13 CO 0.20 0.06 -0.03 -0.08 0.00 0.00 0.00 178.15 178.31 1nf6 h GLU 14 N 0.34 -0.08 0.00 2.37 4.81 -1.19 -2.11 114.58 118.72 1nf6 h GLU 14 Ca 0.16 0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.30 1nf6 h GLU 14 Cb 0.21 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 1nf6 h GLU 14 CO -0.04 0.19 -0.44 -0.39 -0.73 0.00 0.00 179.01 177.60 1nf6 h VAL 15 N -0.35 1.15 -0.55 0.32 -1.51 -1.33 -2.51 116.25 111.48 1nf6 h VAL 15 Ca -0.01 -1.61 -0.04 0.00 -1.23 0.00 0.00 66.70 63.81 1nf6 h VAL 15 Cb 0.31 1.91 -0.03 0.00 -2.13 0.00 0.00 31.29 31.35 1nf6 h VAL 15 CO 0.01 0.43 0.17 -0.07 -1.23 0.00 0.00 177.57 176.89 1nf6 h LEU 16 N 0.00 0.76 -0.08 4.19 3.38 -0.94 -1.77 115.31 120.85 1nf6 h LEU 16 Ca -0.00 -0.12 -0.11 0.00 0.09 0.00 0.00 57.88 57.74 1nf6 h LEU 16 Cb 0.88 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 1nf6 h LEU 16 CO 0.06 0.72 -0.52 0.78 0.09 0.00 0.00 178.44 179.57 1nf6 h ASN 17 N 0.80 0.00 -0.30 -0.43 2.35 -1.06 -1.66 115.58 115.28 1nf6 h ASN 17 Ca 0.18 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.80 1nf6 h ASN 17 Cb 0.24 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.61 1nf6 h ASN 17 CO -0.01 0.52 -0.34 0.11 -1.65 0.00 0.00 177.43 176.06 1nf6 h LYS 18 N 0.00 0.75 -0.01 0.81 1.57 -1.20 -1.96 116.57 116.53 1nf6 h LYS 18 Ca -0.01 -0.41 0.00 0.00 -1.87 0.00 0.00 60.65 58.36 1nf6 h LYS 18 Cb 1.37 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.70 1nf6 h LYS 18 CO 0.07 1.04 0.01 0.00 -0.57 0.00 0.00 179.45 179.99 1nf6 h ALA 19 N 0.70 0.02 -0.69 3.86 0.00 -1.30 -2.45 119.26 119.41 1nf6 h ALA 19 Ca 0.04 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.99 1nf6 h ALA 19 Cb 0.92 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.65 1nf6 h ALA 19 CO 0.08 -0.48 0.41 -0.09 0.00 0.00 0.00 179.25 179.17 1nf6 h ARG 20 N 0.00 0.75 0.00 0.00 2.43 -1.28 0.26 114.38 116.54 1nf6 h ARG 20 Ca 0.00 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.09 1nf6 h ARG 20 Cb 0.01 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.39 1nf6 h ARG 20 CO -0.00 0.49 -0.19 0.00 -1.51 0.00 0.00 179.97 178.76 1nf6 h ALA 21 N 1.33 1.48 -0.12 2.80 0.00 -1.29 0.41 119.26 123.87 1nf6 h ALA 21 Ca 0.30 -0.17 -0.20 0.00 0.00 0.00 0.00 54.91 54.83 1nf6 h ALA 21 Cb 0.12 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1nf6 h ALA 21 CO -0.15 0.24 -0.75 0.52 0.00 0.00 0.00 179.25 179.10 1nf6 h MET 22 N 0.00 0.59 -0.33 0.00 2.86 -0.64 0.69 114.93 118.10 1nf6 h MET 22 Ca -0.00 -0.48 -0.17 0.00 -2.06 0.00 0.00 59.70 56.98 1nf6 h MET 22 Cb 0.39 0.10 -0.00 0.00 0.06 0.00 0.00 31.60 32.14 1nf6 h MET 22 CO 0.02 1.11 -0.47 0.93 1.06 0.00 0.00 176.91 179.56 1nf6 h GLU 23 N 0.40 0.91 -0.74 1.72 4.39 0.01 0.32 114.58 121.60 1nf6 h GLU 23 Ca -0.04 -0.53 0.03 0.00 0.34 0.00 0.00 59.36 59.16 1nf6 h GLU 23 Cb 1.35 0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 30.01 1nf6 h GLU 23 CO 0.14 1.18 0.49 -0.07 -1.16 0.00 0.00 179.01 179.58 1nf6 h LEU 24 N 0.71 0.77 -0.06 1.33 3.38 -0.27 0.16 115.31 121.34 1nf6 h LEU 24 Ca 0.04 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 1nf6 h LEU 24 Cb 1.07 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.64 1nf6 h LEU 24 CO 0.11 0.53 -0.05 -0.74 0.09 0.00 0.00 178.44 178.39 1nf6 h HIS 25 N 0.90 0.15 -0.52 1.13 2.76 -0.97 -3.04 115.15 115.57 1nf6 h HIS 25 Ca 0.29 -0.04 0.07 0.00 -2.20 0.00 0.00 60.37 58.49 1nf6 h HIS 25 Cb 0.05 -0.03 -0.06 0.00 1.55 0.00 0.00 27.41 28.92 1nf6 h HIS 25 CO -0.00 0.56 0.20 0.00 -1.30 0.00 0.00 177.93 177.39 1nf6 h ALA 26 N 0.57 0.65 -0.57 5.26 0.00 -0.53 0.72 119.26 125.36 1nf6 h ALA 26 Ca 0.01 0.06 0.10 0.00 0.00 0.00 0.00 54.91 55.08 1nf6 h ALA 26 Cb 0.53 0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.27 1nf6 h ALA 26 CO 0.01 -0.19 0.15 0.82 0.00 0.00 0.00 179.25 180.05 1nf6 h ILE 27 N 0.39 0.71 -0.12 0.00 2.04 -0.99 0.68 117.51 120.23 1nf6 h ILE 27 Ca 0.25 -0.10 -0.16 0.00 1.00 0.00 0.00 64.86 65.85 1nf6 h ILE 27 Cb 0.25 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.71 1nf6 h ILE 27 CO -0.24 0.05 -0.61 0.45 0.00 0.00 0.00 178.15 177.81 1nf6 h HIS 28 N 0.30 0.52 -0.04 1.37 3.86 -1.28 -1.32 115.15 118.57 1nf6 h HIS 28 Ca 0.29 -0.20 -0.14 0.00 -1.16 0.00 0.00 60.37 59.16 1nf6 h HIS 28 Cb 0.39 -0.09 0.01 0.00 1.06 0.00 0.00 27.41 28.78 1nf6 h HIS 28 CO -0.21 0.91 -0.53 0.37 0.86 0.00 0.00 177.93 179.33 1nf6 h GLN 29 N 0.30 0.42 -0.14 2.45 5.75 0.06 -2.38 115.11 121.58 1nf6 h GLN 29 Ca -0.01 -0.41 -0.17 0.00 -0.15 0.00 0.00 58.65 57.92 1nf6 h GLN 29 Cb 1.14 0.10 -0.01 0.00 1.07 0.00 0.00 27.48 29.79 1nf6 h GLN 29 CO 0.10 1.06 -0.61 1.88 -2.65 0.00 0.00 178.83 178.62 1nf6 h TYR 30 N -0.06 0.62 -0.23 3.99 0.99 0.29 -2.87 116.97 119.70 1nf6 h TYR 30 Ca -0.05 -0.23 -0.11 0.00 2.00 0.00 0.00 58.73 60.33 1nf6 h TYR 30 Cb 1.21 -0.11 -0.01 0.00 1.00 0.00 0.00 36.73 38.82 1nf6 h TYR 30 CO 0.14 0.96 -0.33 0.52 -0.00 0.00 0.00 178.16 179.45 1nf6 h MET 31 N 0.36 0.48 -0.76 4.88 2.86 -1.30 -1.63 114.93 119.81 1nf6 h MET 31 Ca -0.01 -0.21 0.09 0.00 -2.06 0.00 0.00 59.70 57.52 1nf6 h MET 31 Cb 1.15 -0.01 -0.07 0.00 0.06 0.00 0.00 31.60 32.73 1nf6 h MET 31 CO 0.11 0.75 0.41 -0.97 1.06 0.00 0.00 176.91 178.27 1nf6 h ASN 32 N 0.41 0.57 0.06 1.22 -0.73 -1.26 -1.76 115.58 114.09 1nf6 h ASN 32 Ca 0.05 0.05 -0.21 0.00 1.87 0.00 0.00 56.30 58.06 1nf6 h ASN 32 Cb 0.77 -0.05 0.00 0.00 0.27 0.00 0.00 38.32 39.32 1nf6 h ASN 32 CO 0.06 0.32 -0.77 1.56 -0.37 0.00 0.00 177.43 178.23 1nf6 h GLN 33 N 0.69 0.60 -0.78 6.67 4.20 -1.28 -2.92 115.11 122.28 1nf6 h GLN 33 Ca 0.37 -0.50 0.09 0.00 0.06 0.00 0.00 58.65 58.67 1nf6 h GLN 33 Cb 0.36 0.11 -0.07 0.00 0.30 0.00 0.00 27.48 28.18 1nf6 h GLN 33 CO -0.26 1.12 0.43 1.25 -0.67 0.00 0.00 178.83 180.71 1nf6 h HIS 34 N 0.40 0.78 -0.55 2.96 -0.00 -0.82 0.23 115.15 118.15 1nf6 h HIS 34 Ca -0.05 0.03 -0.00 0.00 -0.00 0.00 0.00 60.37 60.35 1nf6 h HIS 34 Cb 1.38 -0.23 -0.03 0.00 -0.00 0.00 0.00 27.41 28.53 1nf6 h HIS 34 CO 0.07 0.31 0.34 1.88 -0.00 0.00 0.00 177.93 180.53 1nf6 h TYR 35 N 0.73 0.71 -0.20 5.26 0.99 -1.15 0.55 116.97 123.86 1nf6 h TYR 35 Ca 0.38 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 61.10 1nf6 h TYR 35 Cb 0.35 -0.24 -0.01 0.00 1.00 0.00 0.00 36.73 37.83 1nf6 h TYR 35 CO -0.07 0.48 0.07 0.77 -0.00 0.00 0.00 178.16 179.41 1nf6 h SER 36 N 0.74 0.28 -0.85 3.88 0.02 -1.22 0.13 113.55 116.52 1nf6 h SER 36 Ca 0.20 -0.17 -0.03 0.00 -0.84 0.00 0.00 61.79 60.95 1nf6 h SER 36 Cb -0.03 -0.07 -0.04 0.00 0.14 0.00 0.00 62.40 62.40 1nf6 h SER 36 CO -0.04 0.38 0.43 -0.07 -1.14 0.00 0.00 176.83 176.39 1nf6 h LEU 37 N 0.16 1.10 -0.05 5.07 3.38 -0.28 0.11 115.31 124.80 1nf6 h LEU 37 Ca 0.07 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1nf6 h LEU 37 Cb 0.19 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 1nf6 h LEU 37 CO -0.00 0.91 0.03 -0.78 0.09 0.00 0.00 178.44 178.69 1nf6 h ASP 38 N 1.21 0.07 -0.80 -0.43 3.58 0.32 -1.96 116.42 118.41 1nf6 h ASP 38 Ca 0.30 -0.09 0.11 0.00 0.42 0.00 0.00 57.03 57.77 1nf6 h ASP 38 Cb 0.09 -0.02 -0.06 0.00 1.72 0.00 0.00 39.33 41.07 1nf6 h ASP 38 CO -0.04 0.13 0.52 -0.78 -2.88 0.00 0.00 179.24 176.20 1nf6 h ASP 39 N -0.01 0.64 0.70 2.28 3.58 -0.14 0.35 116.42 123.82 1nf6 h ASP 39 Ca 0.02 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.49 1nf6 h ASP 39 Cb 0.08 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 41.02 1nf6 h ASP 39 CO -0.00 0.37 0.00 0.23 -2.88 0.00 0.00 179.24 176.96 1nf6 n MET 40 N -4.51 0.12 -3.48 0.28 2.81 -0.03 -4.90 117.12 107.42 1nf6 n MET 40 Ca 0.14 0.08 -0.21 0.00 -1.81 0.00 0.00 57.70 55.90 1nf6 n MET 40 Cb 0.36 -1.50 0.08 0.00 -0.71 0.00 0.00 33.22 31.45 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 -1.42 -5.05 -3.89 7.83 2.03 0.12 -4.92 116.55 111.26 1nf6 n ASP 41 Ca 0.08 -0.52 -0.41 0.00 0.52 0.00 0.00 54.79 54.45 1nf6 n ASP 41 Cb 0.25 -4.76 0.00 0.00 -0.72 0.00 0.00 41.12 35.89 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 -4.61 2.44 -0.39 -0.67 0.53 -0.79 -2.25 117.16 111.41 1nf6 n TYR 42 Ca -0.06 -2.71 -0.10 0.00 -1.02 0.00 0.00 57.90 54.01 1nf6 n TYR 42 Cb 0.58 -1.18 -0.09 0.00 -1.03 0.00 0.00 39.34 37.63 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 1.04 -2.39 0.25 2.72 0.00 -1.24 -0.97 105.19 104.59 1nf6 n GLY 43 Ca 0.29 1.10 -0.01 0.00 0.00 0.00 0.00 46.02 47.41 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 0.54 -0.47 1.61 4.81 -1.71 0.14 114.58 119.50 1nf6 h GLU 44 Ca 0.15 -0.03 -0.13 0.00 -0.13 0.00 0.00 59.36 59.21 1nf6 h GLU 44 Cb 0.38 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 1nf6 h GLU 44 CO -0.87 0.35 -0.23 -0.07 -0.73 0.00 0.00 179.01 177.47 1nf6 h LEU 45 N 0.55 1.01 -0.30 1.64 3.38 -1.40 -2.82 115.31 117.36 1nf6 h LEU 45 Ca 0.31 -0.39 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 1nf6 h LEU 45 Cb 0.29 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1nf6 h LEU 45 CO -0.24 1.18 -0.05 0.00 0.09 0.00 0.00 178.44 179.42 1nf6 h ALA 46 N 0.89 0.42 -0.01 1.53 0.00 -0.70 -2.28 119.26 119.10 1nf6 h ALA 46 Ca 0.11 -0.27 0.02 0.00 0.00 0.00 0.00 54.91 54.76 1nf6 h ALA 46 Cb 0.81 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1nf6 h ALA 46 CO 0.07 0.22 -0.08 0.00 0.00 0.00 0.00 179.25 179.46 1nf6 h ALA 47 N 0.81 -0.07 -0.17 0.00 0.00 -0.77 -2.48 119.26 116.57 1nf6 h ALA 47 Ca 0.08 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1nf6 h ALA 47 Cb 0.52 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1nf6 h ALA 47 CO 0.03 -0.57 -0.11 -0.91 0.00 0.00 0.00 179.25 177.69 1nf6 h ASN 48 N -0.13 0.26 -0.34 0.00 2.35 -1.45 0.53 115.58 116.79 1nf6 h ASN 48 Ca 0.03 -0.05 -0.14 0.00 -0.55 0.00 0.00 56.30 55.59 1nf6 h ASN 48 Cb 0.17 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.47 1nf6 h ASN 48 CO -0.09 0.40 -0.33 -0.03 -1.65 0.00 0.00 177.43 175.74 1nf6 h MET 49 N 0.26 0.83 -0.57 0.81 4.05 -1.30 -0.27 114.93 118.73 1nf6 h MET 49 Ca 0.05 -0.43 -0.09 0.00 -0.28 0.00 0.00 59.70 58.96 1nf6 h MET 49 Cb 0.37 0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.16 1nf6 h MET 49 CO 0.02 1.07 0.01 -0.22 0.23 0.00 0.00 176.91 178.02 1nf6 h LYS 50 N 0.61 0.98 -0.53 0.39 3.64 -1.00 -1.16 116.57 119.50 1nf6 h LYS 50 Ca 0.06 -0.29 -0.05 0.00 -1.27 0.00 0.00 60.65 59.10 1nf6 h LYS 50 Cb 0.91 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.61 1nf6 h LYS 50 CO 0.08 0.96 0.13 -0.07 -2.27 0.00 0.00 179.45 178.28 1nf6 h LEU 51 N 0.90 0.80 -1.03 5.20 3.38 -0.70 0.06 115.31 123.92 1nf6 h LEU 51 Ca 0.17 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 1nf6 h LEU 51 Cb 0.51 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1nf6 h LEU 51 CO 0.02 0.82 0.06 0.40 0.09 0.00 0.00 178.44 179.83 1nf6 h ILE 52 N 0.73 1.23 -0.43 1.22 2.04 -0.85 -1.64 117.51 119.81 1nf6 h ILE 52 Ca 0.17 -0.88 -0.03 0.00 1.00 0.00 0.00 64.86 65.12 1nf6 h ILE 52 Cb 0.33 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 1nf6 h ILE 52 CO 0.00 0.31 0.13 0.00 0.00 0.00 0.00 178.15 178.60 1nf6 h ALA 53 N 1.34 1.42 -0.13 1.87 0.00 -0.75 -2.25 119.26 120.76 1nf6 h ALA 53 Ca 0.15 -0.15 -0.14 0.00 0.00 0.00 0.00 54.91 54.78 1nf6 h ALA 53 Cb 0.36 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1nf6 h ALA 53 CO 0.01 0.43 -0.51 0.82 0.00 0.00 0.00 179.25 180.00 1nf6 h ILE 54 N 0.62 1.34 -0.54 0.00 2.04 -0.07 -1.27 117.51 119.63 1nf6 h ILE 54 Ca 0.15 -1.75 -0.01 0.00 1.00 0.00 0.00 64.86 64.25 1nf6 h ILE 54 Cb 0.20 1.80 -0.03 0.00 -0.74 0.00 0.00 36.82 38.05 1nf6 h ILE 54 CO -0.01 0.53 0.32 0.44 0.00 0.00 0.00 178.15 179.43 1nf6 h ASP 55 N 0.28 0.65 0.19 1.72 3.32 -0.84 -1.64 116.42 120.09 1nf6 h ASP 55 Ca 0.01 -0.07 -0.05 0.00 0.02 0.00 0.00 57.03 56.94 1nf6 h ASP 55 Cb 0.99 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.37 1nf6 h ASP 55 CO 0.08 0.53 -0.21 -0.33 -1.72 0.00 0.00 179.24 177.60 1nf6 h GLU 56 N 0.72 0.05 -0.33 3.56 4.39 -1.09 0.84 114.58 122.73 1nf6 h GLU 56 Ca 0.19 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.88 1nf6 h GLU 56 Cb 0.00 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.63 1nf6 h GLU 56 CO -0.03 0.26 0.20 0.52 -1.16 0.00 0.00 179.01 178.79 1nf6 h MET 57 N 0.05 0.45 -0.53 2.33 2.86 -0.84 0.40 114.93 119.64 1nf6 h MET 57 Ca 0.01 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1nf6 h MET 57 Cb 0.40 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.94 1nf6 h MET 57 CO 0.03 0.34 0.32 -0.09 1.06 0.00 0.00 176.91 178.57 1nf6 h ARG 58 N 0.43 0.72 0.27 1.72 2.43 -0.26 -0.78 114.38 118.91 1nf6 h ARG 58 Ca 0.12 -0.07 0.01 0.00 -0.81 0.00 0.00 59.98 59.23 1nf6 h ARG 58 Cb 0.01 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.38 1nf6 h ARG 58 CO -0.02 0.53 -0.39 0.45 -1.51 0.00 0.00 179.97 179.02 1nf6 h HIS 59 N 0.71 -1.08 -0.90 2.20 3.86 -0.69 0.33 115.15 119.58 1nf6 h HIS 59 Ca 0.19 0.02 0.17 0.00 -1.16 0.00 0.00 60.37 59.58 1nf6 h HIS 59 Cb -0.01 0.44 -0.07 0.00 1.06 0.00 0.00 27.41 28.83 1nf6 h HIS 59 CO -0.02 -0.52 0.58 0.00 0.86 0.00 0.00 177.93 178.83 1nf6 h ALA 60 N -0.28 1.94 -0.20 2.45 0.00 -0.77 0.15 119.26 122.56 1nf6 h ALA 60 Ca -0.01 0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.74 1nf6 h ALA 60 Cb 0.69 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.40 1nf6 h ALA 60 CO -0.14 -0.21 -0.59 1.49 0.00 0.00 0.00 179.25 179.80 1nf6 h GLU 61 N 0.60 0.75 -0.35 0.00 4.81 -0.52 -1.45 114.58 118.43 1nf6 h GLU 61 Ca 0.47 -0.54 -0.12 0.00 -0.13 0.00 0.00 59.36 59.03 1nf6 h GLU 61 Cb 0.88 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.34 1nf6 h GLU 61 CO -0.21 1.16 -0.27 -0.91 -0.73 0.00 0.00 179.01 178.05 1nf6 h ASN 62 N 0.48 0.75 -0.68 1.04 2.35 0.73 -1.28 115.58 118.96 1nf6 h ASN 62 Ca -0.02 -0.28 -0.02 0.00 -0.55 0.00 0.00 56.30 55.43 1nf6 h ASN 62 Cb 1.21 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 39.35 1nf6 h ASN 62 CO 0.13 0.98 0.34 -0.26 -1.65 0.00 0.00 177.43 176.96 1nf6 h PHE 63 N 0.63 0.97 -0.52 1.19 0.05 -0.73 -2.13 116.94 116.40 1nf6 h PHE 63 Ca 0.08 -0.04 -0.05 0.00 3.82 0.00 0.00 57.97 61.78 1nf6 h PHE 63 Cb 0.77 -0.30 -0.02 0.00 2.00 0.00 0.00 35.95 38.40 1nf6 h PHE 63 CO 0.04 0.72 0.12 0.00 -0.18 0.00 0.00 178.31 179.00 1nf6 h ALA 64 N 1.16 0.68 -0.70 2.45 0.00 -1.03 -1.83 119.26 119.99 1nf6 h ALA 64 Ca 0.24 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1nf6 h ALA 64 Cb 0.10 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1nf6 h ALA 64 CO -0.03 0.39 0.27 0.93 0.00 0.00 0.00 179.25 180.81 1nf6 h GLU 65 N 0.73 1.04 -0.27 0.00 5.08 -1.05 -0.89 114.58 119.22 1nf6 h GLU 65 Ca 0.16 -0.18 -0.19 0.00 -1.00 0.00 0.00 59.36 58.16 1nf6 h GLU 65 Cb 0.35 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1nf6 h GLU 65 CO 0.00 0.85 -0.56 -0.09 -1.00 0.00 0.00 179.01 178.21 1nf6 h ARG 66 N 1.01 0.85 -0.92 2.33 9.65 -1.26 -1.10 114.38 124.95 1nf6 h ARG 66 Ca 0.23 -0.56 0.10 0.00 -1.10 0.00 0.00 59.98 58.66 1nf6 h ARG 66 Cb 0.21 0.07 -0.07 0.00 -1.39 0.00 0.00 29.97 28.79 1nf6 h ARG 66 CO -0.02 1.19 0.59 0.82 2.80 0.00 0.00 179.97 185.35 1nf6 h ILE 67 N 0.62 0.97 -0.45 1.20 2.04 -1.00 0.50 117.51 121.39 1nf6 h ILE 67 Ca 0.01 -0.32 -0.05 0.00 1.00 0.00 0.00 64.86 65.49 1nf6 h ILE 67 Cb 1.17 -0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 1nf6 h ILE 67 CO 0.12 0.17 0.07 0.11 0.00 0.00 0.00 178.15 178.63 1nf6 h LYS 68 N 0.93 0.74 -0.23 2.37 1.79 -0.85 0.33 116.57 121.65 1nf6 h LYS 68 Ca 0.43 -0.20 -0.02 0.00 -2.18 0.00 0.00 60.65 58.69 1nf6 h LYS 68 Cb 0.41 -0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 30.96 1nf6 h LYS 68 CO -0.19 0.76 0.06 0.93 -1.08 0.00 0.00 179.45 179.93 1nf6 h GLU 69 N 0.60 0.32 -0.15 3.15 5.08 0.27 -1.74 114.58 122.11 1nf6 h GLU 69 Ca 0.14 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1nf6 h GLU 69 Cb 0.38 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.57 1nf6 h GLU 69 CO 0.01 0.30 0.00 1.28 -1.00 0.00 0.00 179.01 179.59 1nf6 n LEU 70 N -4.41 1.62 0.00 1.33 4.77 -0.02 -4.92 117.00 115.36 1nf6 n LEU 70 Ca 0.00 -0.66 0.00 0.00 -0.03 0.00 0.00 56.01 55.32 1nf6 n LEU 70 Cb 0.15 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1nf6 n LEU 70 CO 0.36 0.33 0.00 0.61 -1.33 0.00 0.00 177.39 177.36 1nf6 n GLY 71 N 1.13 0.72 4.02 -0.72 0.00 -0.65 -4.84 105.19 104.85 1nf6 n GLY 71 Ca 0.16 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.91 1.71 -0.20 -0.02 0.00 0.11 -4.98 107.32 102.03 1nf6 s GLY 72 Ca 0.00 -2.08 -0.03 0.00 0.00 0.00 0.00 44.72 42.61 1nf6 s GLY 72 CO 0.00 -1.51 -0.07 1.85 0.00 0.00 0.00 173.10 173.36 1nf6 s GLU 73 N -4.93 3.34 0.03 2.90 2.56 -1.26 -4.15 118.70 117.18 1nf6 s GLU 73 Ca 0.65 -0.65 -0.30 0.00 0.00 0.00 0.00 54.97 54.67 1nf6 s GLU 73 Cb -0.05 -2.90 -0.06 0.00 2.00 0.00 0.00 34.13 33.12 1nf6 s GLU 73 CO 0.42 -0.13 1.42 -2.14 -0.56 0.00 0.00 175.26 174.28 1nf6 s PRO 74 N 1.27 4.28 0.54 4.30 0.02 -1.26 -4.98 135.00 139.18 1nf6 s PRO 74 Ca 0.03 2.02 -0.20 0.00 0.02 0.00 0.00 61.00 62.87 1nf6 s PRO 74 Cb -0.14 -3.53 -0.05 0.00 0.02 0.00 0.00 34.50 30.80 1nf6 s PRO 74 CO -0.03 -0.57 1.19 -0.08 -0.33 0.00 0.00 177.00 177.18 1nf6 s THR 75 N 2.22 2.86 -0.91 0.99 -1.32 -1.26 -4.97 115.64 113.25 1nf6 s THR 75 Ca 0.65 0.57 0.10 0.00 -1.21 0.00 0.00 61.69 61.80 1nf6 s THR 75 Cb -0.33 -3.25 0.27 0.00 -1.51 0.00 0.00 72.50 67.68 1nf6 s THR 75 CO 0.28 -0.09 1.20 0.35 -2.21 0.00 0.00 174.62 174.15 1nf6 n THR 76 N -1.22 0.91 -4.65 5.08 -2.24 -1.26 -4.89 114.28 106.01 1nf6 n THR 76 Ca 0.11 -0.95 -0.33 0.00 -2.27 0.00 0.00 64.05 60.61 1nf6 n THR 76 Cb 0.49 0.57 -0.12 0.00 -2.10 0.00 0.00 70.33 69.17 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 -0.99 3.05 0.65 -0.78 -0.21 -1.26 -5.11 119.66 115.01 1nf6 s GLN 77 Ca 0.21 -0.60 -0.10 0.00 0.02 0.00 0.00 55.36 54.89 1nf6 s GLN 77 Cb 0.11 -2.64 -0.00 0.00 1.00 0.00 0.00 33.01 31.48 1nf6 s GLN 77 CO 0.15 0.47 1.03 -1.59 -2.12 0.00 0.00 175.29 173.22 1nf6 s LYS 78 N -0.29 3.11 -0.31 2.91 -2.85 -1.26 -4.36 119.74 116.70 1nf6 s LYS 78 Ca 0.03 0.45 -0.10 0.00 -1.00 0.00 0.00 55.97 55.35 1nf6 s LYS 78 Cb -0.13 -2.10 -0.02 0.00 -2.06 0.00 0.00 37.83 33.52 1nf6 s LYS 78 CO 0.03 -0.80 0.17 -2.00 0.10 0.00 0.00 175.35 172.84 1nf6 s GLU 79 N -5.21 3.53 0.04 1.78 2.56 0.23 -4.91 118.70 116.72 1nf6 s GLU 79 Ca 0.56 -0.60 0.00 0.00 0.00 0.00 0.00 54.97 54.93 1nf6 s GLU 79 Cb -0.11 -3.62 0.00 0.00 2.00 0.00 0.00 34.13 32.40 1nf6 s GLU 79 CO 0.51 -0.35 0.00 0.41 -0.56 0.00 0.00 175.26 175.27 1nf6 n GLY 80 N 5.02 -2.78 3.68 -1.50 0.00 -1.26 -4.74 105.19 103.62 1nf6 n GLY 80 Ca -0.14 -2.04 -0.35 0.00 0.00 0.00 0.00 46.02 43.49 1nf6 n GLY 80 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nf6 s LYS 81 N -0.42 2.98 -0.23 1.61 0.00 -1.26 -5.06 119.74 117.36 1nf6 s LYS 81 Ca 0.00 -0.41 -0.25 0.00 0.00 0.00 0.00 55.97 55.31 1nf6 s LYS 81 Cb 0.00 -2.79 -0.01 0.00 0.00 0.00 0.00 37.83 35.03 1nf6 s LYS 81 CO 0.00 0.70 0.85 0.08 0.00 0.00 0.00 175.35 176.98 1nf6 s VAL 82 N -0.89 4.83 -0.26 1.79 1.01 -1.26 -5.03 120.40 120.59 1nf6 s VAL 82 Ca 0.13 1.62 -0.18 0.00 0.00 0.00 0.00 61.98 63.55 1nf6 s VAL 82 Cb -0.11 -4.14 -0.02 0.00 0.00 0.00 0.00 36.38 32.10 1nf6 s VAL 82 CO 0.02 -0.07 0.53 -0.69 0.00 0.00 0.00 175.10 174.90 1nf6 s VAL 83 N 2.77 5.05 0.49 2.92 1.01 -1.26 -5.07 120.40 126.30 1nf6 s VAL 83 Ca 0.36 0.90 0.08 0.00 0.00 0.00 0.00 61.98 63.32 1nf6 s VAL 83 Cb -0.15 -3.85 0.03 0.00 0.00 0.00 0.00 36.38 32.40 1nf6 s VAL 83 CO 0.08 0.06 0.55 0.42 0.00 0.00 0.00 175.10 176.21 1nf6 s THR 84 N 2.35 2.40 -1.65 3.92 -4.23 -1.26 -4.58 115.64 112.59 1nf6 s THR 84 Ca 0.22 -1.19 0.00 0.00 -1.18 0.00 0.00 61.69 59.54 1nf6 s THR 84 Cb -0.16 -2.59 0.00 0.00 1.34 0.00 0.00 72.50 71.10 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 -1.86 1.48 3.77 3.99 0.00 -1.26 -4.94 105.19 106.36 1nf6 n GLY 85 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 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 -3.29 4.16 1.00 1.61 -0.21 -1.26 -5.01 119.66 116.66 1nf6 s GLN 86 Ca 0.00 2.21 -0.12 0.00 0.02 0.00 0.00 55.36 57.47 1nf6 s GLN 86 Cb 0.00 -2.92 0.19 0.00 1.00 0.00 0.00 33.01 31.28 1nf6 s GLN 86 CO 0.00 -0.35 1.08 0.00 -2.12 0.00 0.00 175.29 173.90 1nf6 s ALA 87 N -1.20 0.80 0.08 6.09 0.00 -1.26 -4.72 121.76 121.56 1nf6 s ALA 87 Ca 0.53 -0.02 -0.25 0.00 0.00 0.00 0.00 51.96 52.22 1nf6 s ALA 87 Cb -0.39 -3.24 -0.16 0.00 0.00 0.00 0.00 23.12 19.33 1nf6 s ALA 87 CO 0.52 -2.97 1.70 0.28 0.00 0.00 0.00 175.76 175.29 1nf6 h VAL 88 N -2.00 0.85 -0.77 0.00 2.07 -1.99 0.17 116.25 114.58 1nf6 h VAL 88 Ca -0.53 -0.02 0.07 0.00 0.82 0.00 0.00 66.70 67.04 1nf6 h VAL 88 Cb 1.30 0.86 -0.06 0.00 -1.52 0.00 0.00 31.29 31.87 1nf6 h VAL 88 CO 0.51 0.01 0.45 -0.65 0.02 0.00 0.00 177.57 177.91 1nf6 h PRO 89 N -0.23 0.77 -0.65 1.57 0.11 -1.97 -1.62 132.00 129.98 1nf6 h PRO 89 Ca -0.02 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 66.01 1nf6 h PRO 89 Cb 0.18 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 31.08 1nf6 h PRO 89 CO 0.04 0.51 0.28 0.28 -0.21 0.00 0.00 178.00 178.90 1nf6 h VAL 90 N 0.79 1.22 -0.42 3.15 2.07 -1.86 0.79 116.25 121.99 1nf6 h VAL 90 Ca 0.35 -0.65 0.03 0.00 0.82 0.00 0.00 66.70 67.26 1nf6 h VAL 90 Cb 0.25 0.42 -0.04 0.00 -1.52 0.00 0.00 31.29 30.40 1nf6 h VAL 90 CO -0.21 0.27 0.21 0.40 0.02 0.00 0.00 177.57 178.26 1nf6 h ILE 91 N 0.92 0.97 0.00 4.57 2.04 0.02 0.12 117.51 126.15 1nf6 h ILE 91 Ca 0.22 -0.14 -0.12 0.00 1.00 0.00 0.00 64.86 65.82 1nf6 h ILE 91 Cb 0.14 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 1nf6 h ILE 91 CO -0.02 0.08 -0.75 1.88 0.00 0.00 0.00 178.15 179.33 1nf6 h TYR 92 N 0.42 0.00 0.15 1.37 -1.99 -1.21 -2.21 116.97 113.49 1nf6 h TYR 92 Ca 0.18 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.90 1nf6 h TYR 92 Cb 0.09 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.82 1nf6 h TYR 92 CO -0.10 0.52 -0.07 1.49 -0.00 0.00 0.00 178.16 179.99 1nf6 h GLU 93 N 0.00 -0.19 -0.05 4.88 4.81 -0.58 -2.88 114.58 120.57 1nf6 h GLU 93 Ca -0.04 0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.12 1nf6 h GLU 93 Cb 1.43 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.84 1nf6 h GLU 93 CO 0.06 0.25 -0.32 0.66 -0.73 0.00 0.00 179.01 178.93 1nf6 h SER 94 N -0.75 0.10 -0.02 1.04 4.64 -0.85 -2.63 113.55 115.07 1nf6 h SER 94 Ca -0.02 -0.03 -0.16 0.00 -0.47 0.00 0.00 61.79 61.11 1nf6 h SER 94 Cb 0.53 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 1nf6 h SER 94 CO 0.03 0.42 -0.52 0.44 -0.87 0.00 0.00 176.83 176.33 1nf6 h ASP 95 N 0.09 0.65 -0.34 4.97 3.32 -1.46 -0.91 116.42 122.74 1nf6 h ASP 95 Ca 0.01 -0.33 -0.14 0.00 0.02 0.00 0.00 57.03 56.59 1nf6 h ASP 95 Cb 0.61 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 1nf6 h ASP 95 CO 0.04 1.05 -0.33 0.00 -1.72 0.00 0.00 179.24 178.28 1nf6 h ALA 96 N 0.97 0.69 -0.75 3.45 0.00 -1.35 -1.29 119.26 120.99 1nf6 h ALA 96 Ca 0.02 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 1nf6 h ALA 96 Cb 1.06 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 1nf6 h ALA 96 CO 0.10 0.67 0.40 -0.44 0.00 0.00 0.00 179.25 179.98 1nf6 h ASP 97 N 0.73 0.94 -0.14 0.00 3.32 -1.40 -1.42 116.42 118.45 1nf6 h ASP 97 Ca 0.07 -0.10 -0.15 0.00 0.02 0.00 0.00 57.03 56.87 1nf6 h ASP 97 Cb 0.89 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.20 1nf6 h ASP 97 CO 0.08 0.77 -0.46 -0.61 -1.72 0.00 0.00 179.24 177.30 1nf6 h GLN 98 N 1.03 0.69 0.00 3.56 4.15 -1.00 0.40 115.11 123.95 1nf6 h GLN 98 Ca 0.26 -0.39 -0.12 0.00 0.77 0.00 0.00 58.65 59.17 1nf6 h GLN 98 Cb 0.05 0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.75 1nf6 h GLN 98 CO -0.04 1.01 -0.58 0.93 -1.93 0.00 0.00 178.83 178.21 1nf6 h GLU 99 N 0.55 0.00 -0.00 1.69 4.39 -1.17 -0.73 114.58 119.31 1nf6 h GLU 99 Ca 0.03 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.73 1nf6 h GLU 99 Cb 1.01 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.66 1nf6 h GLU 99 CO 0.10 0.58 -0.00 0.22 -1.16 0.00 0.00 179.01 178.75 1nf6 h ASP 100 N 0.00 0.00 -0.71 1.42 1.82 -1.08 -1.32 116.42 116.56 1nf6 h ASP 100 Ca -0.01 -0.53 0.01 0.00 -0.39 0.00 0.00 57.03 56.11 1nf6 h ASP 100 Cb 1.04 -0.00 -0.04 0.00 0.68 0.00 0.00 39.33 41.01 1nf6 h ASP 100 CO 0.08 0.53 0.46 0.00 -1.61 0.00 0.00 179.24 178.70 1nf6 h ALA 101 N 0.47 1.48 -0.05 -0.78 0.00 -0.90 -1.27 119.26 118.21 1nf6 h ALA 101 Ca 0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1nf6 h ALA 101 Cb 0.53 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 1nf6 h ALA 101 CO 0.00 0.48 0.00 1.15 0.00 0.00 0.00 179.25 180.88 1nf6 h THR 102 N 0.97 1.23 -0.80 0.00 2.02 -1.11 0.68 112.91 115.92 1nf6 h THR 102 Ca 0.26 -0.72 0.11 0.00 0.77 0.00 0.00 66.41 66.83 1nf6 h THR 102 Cb -0.10 1.62 -0.08 0.00 -1.74 0.00 0.00 68.15 67.85 1nf6 h THR 102 CO -0.05 0.20 0.42 0.40 0.37 0.00 0.00 175.52 176.85 1nf6 h ILE 103 N -0.18 0.83 -0.58 3.11 2.04 -0.98 0.14 117.51 121.89 1nf6 h ILE 103 Ca 0.02 -0.23 0.01 0.00 1.00 0.00 0.00 64.86 65.65 1nf6 h ILE 103 Cb 0.31 0.09 -0.03 0.00 -0.74 0.00 0.00 36.82 36.45 1nf6 h ILE 103 CO 0.00 0.12 0.38 -0.08 0.00 0.00 0.00 178.15 178.58 1nf6 h GLU 104 N 0.68 0.75 -0.43 2.37 4.57 -0.90 -1.79 114.58 119.83 1nf6 h GLU 104 Ca 0.40 -0.05 -0.11 0.00 -1.18 0.00 0.00 59.36 58.43 1nf6 h GLU 104 Cb 0.45 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 28.86 1nf6 h GLU 104 CO -0.29 0.50 -0.16 0.00 -1.18 0.00 0.00 179.01 177.88 1nf6 h ALA 105 N 1.22 0.60 0.00 2.92 0.00 0.03 -2.96 119.26 121.07 1nf6 h ALA 105 Ca 0.22 -0.35 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 1nf6 h ALA 105 Cb -0.08 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1nf6 h ALA 105 CO -0.05 0.53 -0.42 1.88 0.00 0.00 0.00 179.25 181.19 1nf6 h TYR 106 N 0.69 0.00 -0.41 0.00 -1.99 -0.51 -1.27 116.97 113.48 1nf6 h TYR 106 Ca 0.10 0.00 -0.07 0.00 2.00 0.00 0.00 58.73 60.77 1nf6 h TYR 106 Cb 0.71 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.42 1nf6 h TYR 106 CO 0.05 0.42 -0.02 0.77 -0.00 0.00 0.00 178.16 179.38 1nf6 h SER 107 N 0.00 0.64 -0.21 3.88 0.02 -1.27 0.55 113.55 117.16 1nf6 h SER 107 Ca -0.00 -0.15 -0.07 0.00 -0.84 0.00 0.00 61.79 60.73 1nf6 h SER 107 Cb 0.77 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.14 1nf6 h SER 107 CO 0.05 0.72 -0.15 1.56 -1.14 0.00 0.00 176.83 177.88 1nf6 h GLN 108 N 0.63 0.47 -0.84 3.45 4.20 -1.18 -2.51 115.11 119.33 1nf6 h GLN 108 Ca 0.12 -0.23 0.05 0.00 0.06 0.00 0.00 58.65 58.65 1nf6 h GLN 108 Cb 0.43 -0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.16 1nf6 h GLN 108 CO 0.02 0.78 0.55 0.74 -0.67 0.00 0.00 178.83 180.25 1nf6 h PHE 109 N 0.15 0.98 -0.28 2.96 0.05 -0.89 -1.65 116.94 118.26 1nf6 h PHE 109 Ca 0.04 0.02 0.01 0.00 3.82 0.00 0.00 57.97 61.86 1nf6 h PHE 109 Cb 0.67 -0.32 -0.02 0.00 2.00 0.00 0.00 35.95 38.28 1nf6 h PHE 109 CO 0.07 0.55 0.17 1.25 -0.18 0.00 0.00 178.31 180.17 1nf6 h LEU 110 N 0.99 0.27 -0.43 1.54 6.46 -0.84 -1.78 115.31 121.53 1nf6 h LEU 110 Ca 0.34 0.00 0.09 0.00 -0.12 0.00 0.00 57.88 58.19 1nf6 h LEU 110 Cb 0.10 -0.06 -0.09 0.00 -0.73 0.00 0.00 40.66 39.89 1nf6 h LEU 110 CO -0.11 0.20 -0.18 0.50 -0.62 0.00 0.00 178.44 178.23 1nf6 h LYS 111 N 0.34 -0.09 -0.89 1.25 3.64 -0.85 -1.61 116.57 118.36 1nf6 h LYS 111 Ca 0.11 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.50 1nf6 h LYS 111 Cb -0.01 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.79 1nf6 h LYS 111 CO -0.05 -0.06 0.59 0.28 -2.27 0.00 0.00 179.45 177.95 1nf6 h VAL 112 N -0.09 1.23 -0.48 2.00 2.07 -1.05 0.19 116.25 120.12 1nf6 h VAL 112 Ca 0.21 -0.42 0.03 0.00 0.82 0.00 0.00 66.70 67.34 1nf6 h VAL 112 Cb 0.41 -0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.06 1nf6 h VAL 112 CO -0.49 0.22 0.27 0.00 0.02 0.00 0.00 177.57 177.59 1nf6 h LYS 114 N 0.53 1.18 0.00 0.00 1.57 -0.41 -0.40 116.57 119.04 1nf6 h LYS 114 Ca 0.20 -0.20 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 1nf6 h LYS 114 Cb 0.06 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 1nf6 h LYS 114 CO -0.12 0.94 -0.23 0.93 -0.57 0.00 0.00 179.45 180.41 1nf6 h GLU 115 N 1.16 0.00 -0.23 3.15 5.08 0.41 -2.41 114.58 121.74 1nf6 h GLU 115 Ca 0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 1nf6 h GLU 115 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1nf6 h GLU 115 CO -0.03 0.23 0.00 1.04 -1.00 0.00 0.00 179.01 179.25 1nf6 n GLN 116 N -3.85 2.05 -3.38 2.33 1.13 0.12 -4.95 117.38 110.84 1nf6 n GLN 116 Ca -0.02 -1.58 -0.19 0.00 -1.94 0.00 0.00 57.00 53.27 1nf6 n GLN 116 Cb 0.32 -1.45 0.07 0.00 0.11 0.00 0.00 30.24 29.29 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 1.28 -0.29 2.98 1.08 0.00 -0.70 -4.91 105.19 104.64 1nf6 n GLY 117 Ca 0.17 0.09 -0.31 0.00 0.00 0.00 0.00 46.02 45.97 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 -3.40 4.58 0.23 1.61 -1.08 -0.24 -4.93 116.67 113.44 1nf6 s ASP 118 Ca 0.42 -3.09 0.10 0.00 -0.52 0.00 0.00 52.55 49.46 1nf6 s ASP 118 Cb -0.18 -1.69 0.20 0.00 -1.46 0.00 0.00 42.92 39.79 1nf6 s ASP 118 CO 0.61 -0.24 1.52 0.40 0.52 0.00 0.00 175.17 177.98 1nf6 h ILE 119 N 5.31 1.50 -0.37 4.11 1.08 -1.94 -2.44 117.51 124.77 1nf6 h ILE 119 Ca -0.04 -2.48 -0.15 0.00 -0.39 0.00 0.00 64.86 61.80 1nf6 h ILE 119 Cb 0.89 2.34 -0.01 0.00 -3.07 0.00 0.00 36.82 36.97 1nf6 h ILE 119 CO 0.70 0.71 -0.37 0.58 -0.69 0.00 0.00 178.15 179.08 1nf6 h VAL 120 N 0.00 1.28 -0.16 1.67 2.07 -1.97 -1.77 116.25 117.37 1nf6 h VAL 120 Ca -0.01 -1.54 -0.21 0.00 0.82 0.00 0.00 66.70 65.76 1nf6 h VAL 120 Cb 1.28 1.38 0.01 0.00 -1.52 0.00 0.00 31.29 32.44 1nf6 h VAL 120 CO 0.09 0.51 -0.74 0.74 0.02 0.00 0.00 177.57 178.19 1nf6 h THR 121 N 0.72 1.29 -0.73 2.57 2.02 -1.95 -2.83 112.91 114.00 1nf6 h THR 121 Ca 0.06 -1.96 0.01 0.00 0.77 0.00 0.00 66.41 65.29 1nf6 h THR 121 Cb 0.94 1.95 -0.04 0.00 -1.74 0.00 0.00 68.15 69.26 1nf6 h THR 121 CO 0.09 0.62 0.48 0.00 0.37 0.00 0.00 175.52 177.08 1nf6 h ALA 122 N 0.64 0.93 -0.58 6.16 0.00 -1.41 -1.24 119.26 123.75 1nf6 h ALA 122 Ca -0.04 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 1nf6 h ALA 122 Cb 1.36 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1nf6 h ALA 122 CO 0.15 0.32 0.07 0.00 0.00 0.00 0.00 179.25 179.79 1nf6 h ARG 123 N 0.97 0.94 -0.97 0.00 2.47 -1.32 -0.68 114.38 115.78 1nf6 h ARG 123 Ca 0.27 -0.24 0.04 0.00 -1.26 0.00 0.00 59.98 58.79 1nf6 h ARG 123 Cb -0.08 -0.12 -0.06 0.00 -1.65 0.00 0.00 29.97 28.06 1nf6 h ARG 123 CO -0.07 0.89 0.63 1.25 0.56 0.00 0.00 179.97 183.23 1nf6 h LEU 124 N 0.89 1.05 -0.35 3.04 5.85 -1.11 -0.76 115.31 123.92 1nf6 h LEU 124 Ca 0.18 -0.01 -0.19 0.00 0.84 0.00 0.00 57.88 58.70 1nf6 h LEU 124 Cb 0.42 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.21 1nf6 h LEU 124 CO 0.01 0.71 -0.75 -0.26 -0.34 0.00 0.00 178.44 177.82 1nf6 h PHE 125 N 1.22 0.64 -0.27 1.25 -1.00 -0.83 -2.66 116.94 115.29 1nf6 h PHE 125 Ca 0.39 -0.29 -0.01 0.00 2.81 0.00 0.00 57.97 60.88 1nf6 h PHE 125 Cb 0.03 -0.10 -0.01 0.00 3.61 0.00 0.00 35.95 39.48 1nf6 h PHE 125 CO -0.01 1.06 0.13 0.93 -1.61 0.00 0.00 178.31 178.81 1nf6 h GLU 126 N 0.32 0.39 -0.03 1.51 5.08 -0.54 0.14 114.58 121.46 1nf6 h GLU 126 Ca -0.04 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1nf6 h GLU 126 Cb 1.33 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.51 1nf6 h GLU 126 CO 0.13 0.38 0.01 0.00 -1.00 0.00 0.00 179.01 178.54 1nf6 h ARG 127 N 0.30 0.04 -0.52 2.33 3.08 -1.21 -2.64 114.38 115.75 1nf6 h ARG 127 Ca 0.09 -0.00 -0.09 0.00 0.07 0.00 0.00 59.98 60.05 1nf6 h ARG 127 Cb 0.12 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 1nf6 h ARG 127 CO -0.01 0.12 -0.03 0.82 -1.07 0.00 0.00 179.97 179.79 1nf6 h ILE 128 N -0.06 1.26 -0.24 2.04 2.04 -1.40 -1.96 117.51 119.19 1nf6 h ILE 128 Ca 0.01 -1.12 -0.00 0.00 1.00 0.00 0.00 64.86 64.74 1nf6 h ILE 128 Cb 0.09 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 1nf6 h ILE 128 CO -0.00 0.40 0.13 0.40 0.00 0.00 0.00 178.15 179.08 1nf6 h ILE 129 N 0.83 1.08 -0.26 -0.67 2.04 -0.65 -0.76 117.51 119.12 1nf6 h ILE 129 Ca 0.15 -0.18 -0.12 0.00 1.00 0.00 0.00 64.86 65.71 1nf6 h ILE 129 Cb 0.54 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 37.36 1nf6 h ILE 129 CO 0.03 0.08 -0.34 -0.33 0.00 0.00 0.00 178.15 177.59 1nf6 h GLU 130 N 0.33 0.55 -0.42 2.37 5.08 -0.99 -2.34 114.58 119.16 1nf6 h GLU 130 Ca 0.09 -0.25 -0.13 0.00 -1.00 0.00 0.00 59.36 58.06 1nf6 h GLU 130 Cb 0.00 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1nf6 h GLU 130 CO -0.02 0.82 -0.26 0.93 -1.00 0.00 0.00 179.01 179.48 1nf6 h GLU 131 N 0.47 0.88 -0.73 2.33 5.08 -0.89 -2.79 114.58 118.93 1nf6 h GLU 131 Ca 0.05 -0.39 0.08 0.00 -1.00 0.00 0.00 59.36 58.10 1nf6 h GLU 131 Cb 0.81 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.97 1nf6 h GLU 131 CO 0.07 1.03 0.40 0.93 -1.00 0.00 0.00 179.01 180.44 1nf6 h GLU 132 N 0.75 0.68 -0.90 2.33 4.39 -1.07 -1.34 114.58 119.42 1nf6 h GLU 132 Ca 0.09 -0.04 0.05 0.00 0.34 0.00 0.00 59.36 59.80 1nf6 h GLU 132 Cb 0.81 -0.15 -0.05 0.00 -0.10 0.00 0.00 28.75 29.26 1nf6 h GLU 132 CO 0.07 0.45 0.59 0.37 -1.16 0.00 0.00 179.01 179.33 1nf6 h GLN 133 N 0.70 1.04 -0.12 2.33 5.75 -1.24 0.69 115.11 124.27 1nf6 h GLN 133 Ca 0.34 -0.06 -0.10 0.00 -0.15 0.00 0.00 58.65 58.68 1nf6 h GLN 133 Cb 0.28 -0.23 -0.01 0.00 1.07 0.00 0.00 27.48 28.58 1nf6 h GLN 133 CO -0.22 0.69 -0.39 0.00 -2.65 0.00 0.00 178.83 176.26 1nf6 h ALA 134 N 1.49 1.12 -0.09 3.38 0.00 -1.07 -0.16 119.26 123.94 1nf6 h ALA 134 Ca 0.37 -0.40 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 1nf6 h ALA 134 Cb 0.10 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1nf6 h ALA 134 CO -0.12 0.58 -0.23 0.45 0.00 0.00 0.00 179.25 179.92 1nf6 h HIS 135 N 0.22 0.41 -0.94 0.00 3.86 -0.00 -2.70 115.15 116.00 1nf6 h HIS 135 Ca 0.02 -0.16 0.06 0.00 -1.16 0.00 0.00 60.37 59.13 1nf6 h HIS 135 Cb 0.79 -0.07 -0.06 0.00 1.06 0.00 0.00 27.41 29.12 1nf6 h HIS 135 CO 0.01 0.85 0.61 1.25 0.86 0.00 0.00 177.93 181.51 1nf6 h LEU 136 N -0.15 0.96 -0.35 2.43 5.85 0.48 -2.44 115.31 122.10 1nf6 h LEU 136 Ca -0.00 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.63 1nf6 h LEU 136 Cb 0.84 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.66 1nf6 h LEU 136 CO 0.05 0.62 -0.12 0.74 -0.34 0.00 0.00 178.44 179.39 1nf6 h THR 137 N 1.09 1.28 -0.49 1.05 2.02 -0.99 -2.45 112.91 114.42 1nf6 h THR 137 Ca 0.40 -1.21 0.00 0.00 0.77 0.00 0.00 66.41 66.37 1nf6 h THR 137 Cb 0.16 1.34 -0.02 0.00 -1.74 0.00 0.00 68.15 67.88 1nf6 h THR 137 CO -0.15 0.40 0.32 0.22 0.37 0.00 0.00 175.52 176.68 1nf6 h TYR 138 N 0.48 0.62 -0.47 3.16 3.20 -1.22 -2.48 116.97 120.26 1nf6 h TYR 138 Ca 0.08 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.90 1nf6 h TYR 138 Cb 0.64 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.68 1nf6 h TYR 138 CO 0.05 0.40 0.02 1.88 -1.64 0.00 0.00 178.16 178.88 1nf6 h TYR 139 N 0.67 0.88 -0.69 -3.82 0.99 -1.41 -2.04 116.97 111.54 1nf6 h TYR 139 Ca 0.18 -0.14 0.04 0.00 2.00 0.00 0.00 58.73 60.80 1nf6 h TYR 139 Cb -0.07 -0.23 -0.05 0.00 1.00 0.00 0.00 36.73 37.38 1nf6 h TYR 139 CO -0.04 0.84 0.42 0.93 -0.00 0.00 0.00 178.16 180.30 1nf6 h GLU 140 N 0.67 0.78 0.04 4.88 5.08 -1.35 -1.13 114.58 123.56 1nf6 h GLU 140 Ca 0.14 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1nf6 h GLU 140 Cb 0.47 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1nf6 h GLU 140 CO 0.02 0.52 -0.02 -0.91 -1.00 0.00 0.00 179.01 177.61 1nf6 h ASN 141 N 0.80 -0.05 -0.16 1.42 2.35 -1.20 -1.37 115.58 117.38 1nf6 h ASN 141 Ca 0.29 -0.34 0.02 0.00 -0.55 0.00 0.00 56.30 55.71 1nf6 h ASN 141 Cb 0.07 0.01 -0.02 0.00 0.05 0.00 0.00 38.32 38.43 1nf6 h ASN 141 CO -0.13 0.32 0.05 0.40 -1.65 0.00 0.00 177.43 176.42 1nf6 h ILE 142 N -0.43 0.95 -0.64 2.81 1.08 -1.34 -0.82 117.51 119.13 1nf6 h ILE 142 Ca -0.01 -0.04 0.09 0.00 -0.39 0.00 0.00 64.86 64.51 1nf6 h ILE 142 Cb 0.39 0.82 -0.07 0.00 -3.07 0.00 0.00 36.82 34.88 1nf6 h ILE 142 CO 0.01 0.02 0.27 1.23 -0.69 0.00 0.00 178.15 178.99 1nf6 h GLY 143 N 0.13 0.92 0.36 5.37 0.00 -1.18 -0.23 103.07 108.43 1nf6 h GLY 143 Ca 0.07 -0.15 0.03 0.00 0.00 0.00 0.00 47.33 47.28 1nf6 h GLY 143 CO -0.08 0.01 -0.29 0.23 0.00 0.00 0.00 176.54 176.41 1nf6 h SER 144 N 0.47 -0.87 -0.67 0.19 0.87 -0.66 0.16 113.55 113.03 1nf6 h SER 144 Ca 0.32 0.11 -0.03 0.00 -1.23 0.00 0.00 61.79 60.97 1nf6 h SER 144 Cb 0.37 0.35 -0.03 0.00 -0.44 0.00 0.00 62.40 62.65 1nf6 h SER 144 CO -0.29 -0.36 0.32 0.45 -0.53 0.00 0.00 176.83 176.42 1nf6 h HIS 145 N -0.45 0.99 -0.47 2.24 -0.00 -0.59 0.49 115.15 117.37 1nf6 h HIS 145 Ca 0.06 -0.04 -0.08 0.00 -0.00 0.00 0.00 60.37 60.30 1nf6 h HIS 145 Cb 0.53 -0.31 -0.02 0.00 -0.00 0.00 0.00 27.41 27.61 1nf6 h HIS 145 CO -0.32 0.73 -0.03 0.82 -0.00 0.00 0.00 177.93 179.13 1nf6 h ILE 146 N 0.99 1.27 0.17 2.45 2.04 -0.54 0.15 117.51 124.04 1nf6 h ILE 146 Ca 0.24 -1.12 -0.01 0.00 1.00 0.00 0.00 64.86 64.97 1nf6 h ILE 146 Cb 0.12 1.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.25 1nf6 h ILE 146 CO -0.03 0.39 -0.08 0.50 0.00 0.00 0.00 178.15 178.93 1nf6 h LYS 147 N 0.70 -0.22 0.00 2.37 3.64 -0.09 -2.27 116.57 120.71 1nf6 h LYS 147 Ca 0.13 0.02 -0.20 0.00 -1.27 0.00 0.00 60.65 59.32 1nf6 h LYS 147 Cb 0.55 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.39 1nf6 h LYS 147 CO 0.03 -0.08 -1.11 -0.91 -2.27 0.00 0.00 179.45 175.11 1nf6 h ASN 148 N -0.32 0.00 0.00 4.20 -0.26 0.04 -3.40 115.58 115.84 1nf6 h ASN 148 Ca -0.02 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.72 1nf6 h ASN 148 Cb 0.25 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.51 1nf6 h ASN 148 CO 0.04 0.83 -0.92 0.18 -1.06 0.00 0.00 177.43 176.50 1nf6 n LEU 149 N -3.19 0.00 0.00 1.61 4.77 0.50 -5.06 117.00 115.64 1nf6 n LEU 149 Ca -0.05 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 1nf6 n LEU 149 Cb 0.91 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.00 1nf6 n LEU 149 CO 0.45 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 1nf6 n GLY 150 N 2.53 1.96 0.37 -0.72 0.00 -0.85 -3.36 105.19 105.12 1nf6 n GLY 150 Ca 0.00 -0.35 0.28 0.00 0.00 0.00 0.00 46.02 45.94 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 4.81 0.42 -0.97 1.61 5.19 -1.93 1.69 116.42 127.24 1nf6 h ASP 151 Ca 0.00 0.18 0.03 0.00 -0.62 0.00 0.00 57.03 56.62 1nf6 h ASP 151 Cb 0.00 0.14 -0.05 0.00 0.18 0.00 0.00 39.33 39.60 1nf6 h ASP 151 CO 0.00 -0.17 0.64 0.74 -3.12 0.00 0.00 179.24 177.32 1nf6 h THR 152 N 0.23 1.19 -0.11 0.35 2.02 -1.98 0.34 112.91 114.95 1nf6 h THR 152 Ca 0.76 -0.43 -0.07 0.00 0.77 0.00 0.00 66.41 67.44 1nf6 h THR 152 Cb 1.95 -0.17 0.00 0.00 -1.74 0.00 0.00 68.15 68.19 1nf6 h THR 152 CO -0.56 0.23 -0.21 0.22 0.37 0.00 0.00 175.52 175.56 1nf6 h TYR 153 N 1.25 0.43 -0.03 3.16 3.20 0.23 -3.29 116.97 121.93 1nf6 h TYR 153 Ca 0.38 -0.16 -0.10 0.00 3.14 0.00 0.00 58.73 61.99 1nf6 h TYR 153 Cb -0.03 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.14 1nf6 h TYR 153 CO -0.01 0.83 -0.46 -0.07 -1.64 0.00 0.00 178.16 176.81 1nf6 h LEU 154 N -0.09 0.07 -2.18 2.82 3.38 -0.69 -2.68 115.31 115.94 1nf6 h LEU 154 Ca 0.00 -0.03 0.03 0.00 0.09 0.00 0.00 57.88 57.97 1nf6 h LEU 154 Cb 0.80 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.53 1nf6 h LEU 154 CO 0.05 0.52 0.07 0.00 0.09 0.00 0.00 178.44 179.17 1nf6 h ALA 155 N 1.48 1.88 0.00 1.53 0.00 -0.39 -0.42 119.26 123.34 1nf6 h ALA 155 Ca 0.00 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 1nf6 h ALA 155 Cb 0.84 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 1nf6 h ALA 155 CO 0.06 -0.12 -0.52 -0.22 0.00 0.00 0.00 179.25 178.46 1nf6 h LYS 156 N 0.00 0.00 0.00 0.00 3.64 -1.57 -3.15 116.57 115.50 1nf6 h LYS 156 Ca 0.04 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.39 1nf6 h LYS 156 Cb 0.19 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 1nf6 h LYS 156 CO -0.00 0.52 -1.07 0.82 -2.27 0.00 0.00 179.45 177.45 1nf6 h ILE 157 N 0.00 0.11 -2.43 2.00 1.08 -1.19 -3.45 117.51 113.63 1nf6 h ILE 157 Ca -0.01 -1.22 -0.54 0.00 -0.39 0.00 0.00 64.86 62.71 1nf6 h ILE 157 Cb 1.04 1.63 0.03 0.00 -3.07 0.00 0.00 36.82 36.45 1nf6 h ILE 157 CO 0.07 0.06 1.14 0.00 -0.69 0.00 0.00 178.15 178.73 1nf6 n ALA 158 N -2.22 1.95 -1.07 1.87 0.00 -0.74 -2.13 120.51 118.17 1nf6 n ALA 158 Ca -0.02 0.29 -0.02 0.00 0.00 0.00 0.00 53.44 53.68 1nf6 n ALA 158 Cb 0.61 -2.61 -0.01 0.00 0.00 0.00 0.00 19.45 17.44 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 4.31 0.53 3.83 0.00 0.00 -0.96 -5.00 105.19 107.91 1nf6 n GLY 159 Ca 0.19 -0.26 -0.31 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.88 3.92 0.44 2.61 -4.23 -0.90 -4.94 115.64 110.67 1nf6 s THR 160 Ca 0.00 0.62 -0.25 0.00 -1.18 0.00 0.00 61.69 60.89 1nf6 s THR 160 Cb 0.00 -3.41 -0.09 0.00 1.34 0.00 0.00 72.50 70.34 1nf6 s THR 160 CO 0.00 -0.82 1.31 -0.81 -0.54 0.00 0.00 174.62 173.77 1nf6 n PRO 161 N -3.13 1.97 0.00 3.99 -0.04 -1.26 -3.63 135.00 132.90 1nf6 n PRO 161 Ca 0.07 0.70 0.07 0.00 -0.04 0.00 0.00 63.50 64.30 1nf6 n PRO 161 Cb 0.54 -2.46 0.04 0.00 -0.04 0.00 0.00 33.50 31.58 1nf6 n PRO 161 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1nf6 n SER 162 N -0.02 1.89 -4.69 3.54 3.41 -1.26 -2.78 113.62 113.71 1nf6 n SER 162 Ca 0.07 -1.44 -0.44 0.00 -0.26 0.00 0.00 58.87 56.79 1nf6 n SER 162 Cb 0.41 0.15 -0.03 0.00 -0.26 0.00 0.00 64.21 64.47 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 0.46 3.21 -0.93 4.04 2.88 -1.26 -4.25 113.62 117.77 1nf6 n SER 163 Ca 0.07 1.11 0.10 0.00 -1.33 0.00 0.00 58.87 58.82 1nf6 n SER 163 Cb 0.31 -1.47 0.15 0.00 -0.75 0.00 0.00 64.21 62.45 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 2.70 0.33 0.00 2.46 -2.24 -1.26 -4.92 114.28 111.36 1nf6 n THR 164 Ca 0.13 -0.67 0.00 0.00 -2.27 0.00 0.00 64.05 61.25 1nf6 n THR 164 Cb 0.32 1.11 0.00 0.00 -2.10 0.00 0.00 70.33 69.66 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 1.21 0.33 3.66 3.38 0.00 -1.26 -5.05 105.19 107.46 1nf6 n GLY 165 Ca 0.15 -2.30 -0.42 0.00 0.00 0.00 0.00 46.02 43.45 1nf6 n GLY 165 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1nf6 n THR 166 N 0.02 2.26 -1.54 2.61 5.66 -1.26 -4.90 114.28 117.14 1nf6 n THR 166 Ca 0.00 -0.50 -0.42 0.00 -3.05 0.00 0.00 64.05 60.08 1nf6 n THR 166 Cb 0.00 -1.39 0.01 0.00 -1.55 0.00 0.00 70.33 67.40 1nf6 n THR 166 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1nf6 n ALA 167 N -0.03 -0.67 -1.63 1.79 0.00 -1.26 -4.84 120.51 113.87 1nf6 n ALA 167 Ca 0.07 0.22 -0.65 0.00 0.00 0.00 0.00 53.44 53.07 1nf6 n ALA 167 Cb 0.37 -1.93 -0.10 0.00 0.00 0.00 0.00 19.45 17.79 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 0.91 1.10 -4.67 0.00 3.41 -1.26 -4.87 113.62 108.24 1nf6 n SER 168 Ca 0.11 1.08 -0.42 0.00 -0.26 0.00 0.00 58.87 59.37 1nf6 n SER 168 Cb 0.38 -0.87 -0.03 0.00 -0.26 0.00 0.00 64.21 63.43 1nf6 n SER 168 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1nf6 s LYS 169 N 3.53 4.14 0.22 4.33 1.02 -1.26 -4.93 119.74 126.79 1nf6 s LYS 169 Ca 1.06 2.59 0.01 0.00 0.02 0.00 0.00 55.97 59.65 1nf6 s LYS 169 Cb -1.48 -4.04 -0.00 0.00 -0.52 0.00 0.00 37.83 31.79 1nf6 s LYS 169 CO 0.78 -0.93 0.04 0.41 -0.92 0.00 0.00 175.35 174.73 1nf6 n GLY 170 N 4.46 3.77 0.06 -3.33 0.00 -1.26 -5.10 105.19 103.79 1nf6 n GLY 170 Ca 0.19 -2.13 -0.07 0.00 0.00 0.00 0.00 46.02 44.02 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 1.25 -0.01 0.00 1.61 3.57 -2.05 -3.56 116.94 117.74 1nf6 h PHE 171 Ca -0.17 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.33 1nf6 h PHE 171 Cb 0.60 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.34 1nf6 h PHE 171 CO 0.00 0.46 0.00 1.33 -2.23 0.00 0.00 178.31 177.87