#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 5.19 0.00 1.61 4.22 -1.26 -4.88 114.94 119.82 1nf6 s ASN 4 Ca 0.00 -0.76 -0.00 0.00 -2.14 0.00 0.00 52.86 49.96 1nf6 s ASN 4 Cb 0.00 -0.15 -0.00 0.00 1.28 0.00 0.00 41.25 42.38 1nf6 s ASN 4 CO 0.00 -0.99 1.01 0.03 -2.04 0.00 0.00 177.10 175.11 1nf6 h ARG 5 N 0.58 -0.00 -0.70 3.55 2.47 -2.00 0.13 114.38 118.41 1nf6 h ARG 5 Ca -0.36 0.00 0.17 0.00 -1.26 0.00 0.00 59.98 58.52 1nf6 h ARG 5 Cb 1.28 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.56 1nf6 h ARG 5 CO 0.48 -0.00 0.48 0.93 0.56 0.00 0.00 179.97 182.42 1nf6 h GLU 6 N -0.00 0.21 0.09 0.04 3.07 -2.00 -1.23 114.58 114.77 1nf6 h GLU 6 Ca 0.00 -0.01 -0.00 0.00 -0.50 0.00 0.00 59.36 58.85 1nf6 h GLU 6 Cb 0.01 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 27.87 1nf6 h GLU 6 CO -0.01 0.14 -0.04 0.22 -1.40 0.00 0.00 179.01 177.92 1nf6 h ASP 7 N 0.22 -0.10 -0.78 1.42 1.82 -1.47 -1.62 116.42 115.91 1nf6 h ASP 7 Ca 0.34 -0.19 -0.02 0.00 -0.39 0.00 0.00 57.03 56.77 1nf6 h ASP 7 Cb 1.03 0.03 -0.04 0.00 0.68 0.00 0.00 39.33 41.03 1nf6 h ASP 7 CO -0.07 0.14 0.41 0.03 -1.61 0.00 0.00 179.24 178.13 1nf6 h ARG 8 N -0.34 1.11 -0.26 0.28 3.08 0.36 -2.57 114.38 116.05 1nf6 h ARG 8 Ca -0.01 -0.15 -0.05 0.00 0.07 0.00 0.00 59.98 59.85 1nf6 h ARG 8 Cb 0.29 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 1nf6 h ARG 8 CO 0.02 0.84 -0.02 0.87 -1.07 0.00 0.00 179.97 180.61 1nf6 h LYS 9 N 1.09 0.47 -0.80 0.04 1.57 -1.40 -2.80 116.57 114.74 1nf6 h LYS 9 Ca 0.27 -0.16 0.03 0.00 -1.87 0.00 0.00 60.65 58.92 1nf6 h LYS 9 Cb 0.07 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.30 1nf6 h LYS 9 CO -0.04 0.65 0.51 0.00 -0.57 0.00 0.00 179.45 180.00 1nf6 h ALA 10 N 0.80 1.04 -0.46 3.86 0.00 -1.11 0.74 119.26 124.13 1nf6 h ALA 10 Ca 0.07 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 1nf6 h ALA 10 Cb 0.45 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1nf6 h ALA 10 CO 0.02 0.33 -0.13 0.87 0.00 0.00 0.00 179.25 180.34 1nf6 h LYS 11 N 1.00 0.86 -0.03 0.00 1.57 -1.42 -1.96 116.57 116.58 1nf6 h LYS 11 Ca 0.32 -0.30 -0.23 0.00 -1.87 0.00 0.00 60.65 58.56 1nf6 h LYS 11 Cb 0.00 -0.06 0.02 0.00 0.08 0.00 0.00 32.23 32.27 1nf6 h LYS 11 CO -0.11 0.94 -0.90 0.28 -0.57 0.00 0.00 179.45 179.09 1nf6 h VAL 12 N 0.77 1.31 -0.83 0.50 2.07 -1.21 -2.92 116.25 115.93 1nf6 h VAL 12 Ca 0.12 -2.15 0.09 0.00 0.82 0.00 0.00 66.70 65.59 1nf6 h VAL 12 Cb 0.64 2.34 -0.06 0.00 -1.52 0.00 0.00 31.29 32.69 1nf6 h VAL 12 CO 0.04 0.66 0.54 0.40 0.02 0.00 0.00 177.57 179.23 1nf6 h ILE 13 N 0.32 0.97 -0.13 4.57 2.04 -0.72 -0.93 117.51 123.64 1nf6 h ILE 13 Ca -0.10 -0.28 -0.00 0.00 1.00 0.00 0.00 64.86 65.48 1nf6 h ILE 13 Cb 1.55 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 37.72 1nf6 h ILE 13 CO 0.18 0.15 0.07 -0.08 0.00 0.00 0.00 178.15 178.47 1nf6 h GLU 14 N 0.80 0.18 -0.01 2.37 4.81 -1.30 0.44 114.58 121.87 1nf6 h GLU 14 Ca 0.38 -0.02 -0.14 0.00 -0.13 0.00 0.00 59.36 59.44 1nf6 h GLU 14 Cb 0.40 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.72 1nf6 h GLU 14 CO -0.15 0.19 -0.67 -0.39 -0.73 0.00 0.00 179.01 177.26 1nf6 h VAL 15 N 0.11 1.46 -0.48 0.32 -1.51 -1.23 -2.07 116.25 112.87 1nf6 h VAL 15 Ca 0.04 -2.25 -0.04 0.00 -1.23 0.00 0.00 66.70 63.22 1nf6 h VAL 15 Cb 0.06 2.21 -0.02 0.00 -2.13 0.00 0.00 31.29 31.41 1nf6 h VAL 15 CO -0.01 0.65 0.11 -0.07 -1.23 0.00 0.00 177.57 177.02 1nf6 h LEU 16 N 0.03 0.67 -0.33 4.19 3.38 -1.06 0.10 115.31 122.30 1nf6 h LEU 16 Ca -0.01 -0.11 -0.16 0.00 0.09 0.00 0.00 57.88 57.69 1nf6 h LEU 16 Cb 1.18 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.74 1nf6 h LEU 16 CO 0.09 0.66 -0.77 0.78 0.09 0.00 0.00 178.44 179.29 1nf6 h ASN 17 N 0.70 0.00 -0.19 -0.43 2.35 -0.58 0.18 115.58 117.61 1nf6 h ASN 17 Ca 0.16 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.86 1nf6 h ASN 17 Cb 0.26 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.63 1nf6 h ASN 17 CO -0.00 0.77 -0.09 0.11 -1.65 0.00 0.00 177.43 176.57 1nf6 h LYS 18 N 0.00 0.39 -0.44 0.81 1.57 -1.04 0.21 116.57 118.06 1nf6 h LYS 18 Ca -0.01 -0.17 -0.00 0.00 -1.87 0.00 0.00 60.65 58.60 1nf6 h LYS 18 Cb 1.43 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.71 1nf6 h LYS 18 CO 0.10 0.68 0.27 0.00 -0.57 0.00 0.00 179.45 179.94 1nf6 h ALA 19 N 0.69 0.56 -0.48 3.86 0.00 -0.72 -1.24 119.26 121.94 1nf6 h ALA 19 Ca 0.04 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1nf6 h ALA 19 Cb 0.57 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1nf6 h ALA 19 CO 0.03 0.05 0.23 -0.09 0.00 0.00 0.00 179.25 179.46 1nf6 h ARG 20 N 0.59 0.69 -0.43 0.00 2.43 -0.59 -1.12 114.38 115.96 1nf6 h ARG 20 Ca 0.16 -0.10 0.02 0.00 -0.81 0.00 0.00 59.98 59.25 1nf6 h ARG 20 Cb -0.01 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.39 1nf6 h ARG 20 CO -0.03 0.59 0.28 0.00 -1.51 0.00 0.00 179.97 179.30 1nf6 h ALA 21 N 1.07 1.79 -0.37 2.80 0.00 -0.21 -0.01 119.26 124.32 1nf6 h ALA 21 Ca 0.16 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 1nf6 h ALA 21 Cb 0.12 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1nf6 h ALA 21 CO -0.02 0.17 -0.19 0.52 0.00 0.00 0.00 179.25 179.73 1nf6 h MET 22 N 0.49 0.71 -0.30 0.00 2.86 -0.58 0.71 114.93 118.81 1nf6 h MET 22 Ca 0.17 -0.26 -0.15 0.00 -2.06 0.00 0.00 59.70 57.39 1nf6 h MET 22 Cb 0.07 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 1nf6 h MET 22 CO -0.04 0.85 -0.43 0.93 1.06 0.00 0.00 176.91 179.28 1nf6 h GLU 23 N 0.63 0.76 -0.87 1.72 4.39 0.06 -2.63 114.58 118.64 1nf6 h GLU 23 Ca 0.10 -0.41 -0.02 0.00 0.34 0.00 0.00 59.36 59.37 1nf6 h GLU 23 Cb 0.67 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.30 1nf6 h GLU 23 CO 0.05 1.04 0.48 -0.07 -1.16 0.00 0.00 179.01 179.35 1nf6 h LEU 24 N 0.61 1.08 0.05 1.33 3.38 -0.83 -1.16 115.31 119.77 1nf6 h LEU 24 Ca 0.04 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 1nf6 h LEU 24 Cb 0.99 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.47 1nf6 h LEU 24 CO 0.09 0.86 -0.03 -0.74 0.09 0.00 0.00 178.44 178.72 1nf6 h HIS 25 N 1.21 -0.07 -0.69 1.13 2.76 -1.34 -2.91 115.15 115.24 1nf6 h HIS 25 Ca 0.31 -0.00 0.03 0.00 -2.20 0.00 0.00 60.37 58.50 1nf6 h HIS 25 Cb 0.02 0.02 -0.04 0.00 1.55 0.00 0.00 27.41 28.96 1nf6 h HIS 25 CO 0.01 0.03 0.46 0.00 -1.30 0.00 0.00 177.93 177.13 1nf6 h ALA 26 N 0.80 1.58 -0.33 5.26 0.00 -1.28 0.51 119.26 125.79 1nf6 h ALA 26 Ca -0.01 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1nf6 h ALA 26 Cb 0.13 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1nf6 h ALA 26 CO 0.01 0.36 0.17 0.82 0.00 0.00 0.00 179.25 180.62 1nf6 h ILE 27 N 0.86 1.15 -0.17 0.00 2.04 -1.10 0.86 117.51 121.14 1nf6 h ILE 27 Ca 0.27 -0.40 -0.12 0.00 1.00 0.00 0.00 64.86 65.61 1nf6 h ILE 27 Cb 0.01 0.80 0.00 0.00 -0.74 0.00 0.00 36.82 36.89 1nf6 h ILE 27 CO -0.07 0.15 -0.35 0.45 0.00 0.00 0.00 178.15 178.33 1nf6 h HIS 28 N 0.41 0.67 0.16 1.37 3.86 -1.21 -1.06 115.15 119.36 1nf6 h HIS 28 Ca 0.12 -0.25 -0.01 0.00 -1.16 0.00 0.00 60.37 59.07 1nf6 h HIS 28 Cb 0.08 -0.12 0.00 0.00 1.06 0.00 0.00 27.41 28.43 1nf6 h HIS 28 CO -0.02 0.98 -0.08 0.37 0.86 0.00 0.00 177.93 180.04 1nf6 h GLN 29 N 0.17 -0.21 -0.59 2.45 5.75 0.04 -1.15 115.11 121.57 1nf6 h GLN 29 Ca 0.00 0.01 -0.03 0.00 -0.15 0.00 0.00 58.65 58.49 1nf6 h GLN 29 Cb 0.95 0.05 -0.03 0.00 1.07 0.00 0.00 27.48 29.53 1nf6 h GLN 29 CO 0.08 -0.12 0.27 1.88 -2.65 0.00 0.00 178.83 178.28 1nf6 h TYR 30 N -0.24 0.87 -0.09 3.99 0.99 -0.89 -2.64 116.97 118.95 1nf6 h TYR 30 Ca -0.02 -0.05 -0.09 0.00 2.00 0.00 0.00 58.73 60.57 1nf6 h TYR 30 Cb 0.19 -0.27 -0.01 0.00 1.00 0.00 0.00 36.73 37.64 1nf6 h TYR 30 CO -0.06 0.67 -0.35 0.52 -0.00 0.00 0.00 178.16 178.95 1nf6 h MET 31 N 0.81 0.19 -0.90 4.88 2.86 -1.05 -1.30 114.93 120.41 1nf6 h MET 31 Ca 0.20 -0.08 -0.01 0.00 -2.06 0.00 0.00 59.70 57.76 1nf6 h MET 31 Cb 0.15 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.75 1nf6 h MET 31 CO -0.02 0.52 0.52 -0.97 1.06 0.00 0.00 176.91 178.02 1nf6 h ASN 32 N 0.16 1.10 -0.10 1.22 -1.24 -0.90 -1.06 115.58 114.77 1nf6 h ASN 32 Ca 0.02 -0.08 -0.13 0.00 0.71 0.00 0.00 56.30 56.82 1nf6 h ASN 32 Cb 0.70 -0.28 -0.01 0.00 0.73 0.00 0.00 38.32 39.46 1nf6 h ASN 32 CO 0.05 0.86 -0.37 1.56 -1.29 0.00 0.00 177.43 178.24 1nf6 h GLN 33 N 1.25 0.61 -0.70 6.67 4.20 -1.11 -2.53 115.11 123.51 1nf6 h GLN 33 Ca 0.32 -0.30 -0.01 0.00 0.06 0.00 0.00 58.65 58.72 1nf6 h GLN 33 Cb -0.02 -0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.72 1nf6 h GLN 33 CO -0.06 0.89 0.40 1.25 -0.67 0.00 0.00 178.83 180.64 1nf6 h HIS 34 N 0.51 0.94 -0.46 2.96 2.76 -0.60 0.39 115.15 121.65 1nf6 h HIS 34 Ca 0.05 -0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.20 1nf6 h HIS 34 Cb 0.88 -0.30 -0.02 0.00 1.55 0.00 0.00 27.41 29.51 1nf6 h HIS 34 CO 0.04 0.65 0.28 1.88 -1.30 0.00 0.00 177.93 179.48 1nf6 h TYR 35 N 0.95 0.60 0.28 5.26 0.99 -1.07 0.13 116.97 124.11 1nf6 h TYR 35 Ca 0.25 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.98 1nf6 h TYR 35 Cb 0.01 -0.20 -0.01 0.00 1.00 0.00 0.00 36.73 37.53 1nf6 h TYR 35 CO -0.01 0.41 -0.21 0.77 -0.00 0.00 0.00 178.16 179.12 1nf6 h SER 36 N 0.61 -0.54 -0.71 3.88 0.02 -1.00 0.21 113.55 116.02 1nf6 h SER 36 Ca 0.17 0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 61.14 1nf6 h SER 36 Cb -0.02 0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.66 1nf6 h SER 36 CO -0.03 -0.33 0.39 -0.07 -1.14 0.00 0.00 176.83 175.66 1nf6 h LEU 37 N -0.49 0.91 -0.91 5.07 3.38 -0.01 -0.42 115.31 122.83 1nf6 h LEU 37 Ca -0.02 -0.08 -0.10 0.00 0.09 0.00 0.00 57.88 57.78 1nf6 h LEU 37 Cb 0.43 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1nf6 h LEU 37 CO -0.00 0.73 -0.22 -0.78 0.09 0.00 0.00 178.44 178.26 1nf6 h ASP 38 N 1.02 0.54 -0.16 -0.43 3.58 -0.68 -1.42 116.42 118.86 1nf6 h ASP 38 Ca 0.26 -0.18 -0.10 0.00 0.42 0.00 0.00 57.03 57.43 1nf6 h ASP 38 Cb 0.04 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 40.92 1nf6 h ASP 38 CO -0.04 0.77 -0.22 -0.78 -2.88 0.00 0.00 179.24 176.08 1nf6 h ASP 39 N 0.48 0.61 0.63 2.28 3.58 0.50 -2.74 116.42 121.77 1nf6 h ASP 39 Ca 0.07 -0.21 0.00 0.00 0.42 0.00 0.00 57.03 57.32 1nf6 h ASP 39 Cb 0.65 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 41.54 1nf6 h ASP 39 CO 0.05 0.83 -0.13 0.23 -2.88 0.00 0.00 179.24 177.34 1nf6 n MET 40 N -4.12 0.30 -2.49 0.28 2.81 -0.31 -4.92 117.12 108.67 1nf6 n MET 40 Ca 0.00 -0.08 -0.08 0.00 -1.81 0.00 0.00 57.70 55.74 1nf6 n MET 40 Cb 0.41 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.43 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 -1.28 -3.06 -4.03 7.83 2.03 -0.87 -4.89 116.55 112.28 1nf6 n ASP 41 Ca 0.10 -0.09 -0.43 0.00 0.52 0.00 0.00 54.79 54.89 1nf6 n ASP 41 Cb 0.30 -2.01 0.01 0.00 -0.72 0.00 0.00 41.12 38.70 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 -3.69 2.87 -0.31 -0.67 0.53 -0.59 -0.82 117.16 114.48 1nf6 n TYR 42 Ca -0.04 -2.81 -0.09 0.00 -1.02 0.00 0.00 57.90 53.94 1nf6 n TYR 42 Cb 0.54 -1.50 -0.05 0.00 -1.03 0.00 0.00 39.34 37.31 1nf6 n TYR 42 CO 0.00 0.00 0.00 0.78 -1.02 0.00 0.00 176.86 176.62 1nf6 h GLY 43 N 6.27 -0.56 1.27 2.72 0.00 -1.68 -0.53 103.07 110.56 1nf6 h GLY 43 Ca 0.24 0.66 -0.03 0.00 0.00 0.00 0.00 47.33 48.20 1nf6 h GLY 43 CO 1.36 -0.09 0.28 -2.09 0.00 0.00 0.00 176.54 175.99 1nf6 h GLU 44 N -0.13 0.94 -0.60 4.80 4.81 -1.71 1.00 114.58 123.68 1nf6 h GLU 44 Ca 0.19 -0.14 -0.07 0.00 -0.13 0.00 0.00 59.36 59.21 1nf6 h GLU 44 Cb 0.52 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 1nf6 h GLU 44 CO -0.83 0.75 0.11 -0.07 -0.73 0.00 0.00 179.01 178.25 1nf6 h LEU 45 N 0.92 0.95 -0.44 1.64 3.38 -1.62 -2.07 115.31 118.07 1nf6 h LEU 45 Ca 0.22 -0.25 -0.10 0.00 0.09 0.00 0.00 57.88 57.83 1nf6 h LEU 45 Cb 0.15 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1nf6 h LEU 45 CO -0.02 0.96 -0.13 0.00 0.09 0.00 0.00 178.44 179.33 1nf6 h ALA 46 N 1.02 0.60 0.22 1.53 0.00 -0.35 -2.24 119.26 120.05 1nf6 h ALA 46 Ca 0.19 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1nf6 h ALA 46 Cb 0.40 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1nf6 h ALA 46 CO 0.01 0.52 -0.11 0.00 0.00 0.00 0.00 179.25 179.67 1nf6 h ALA 47 N 0.85 -0.30 -0.25 0.00 0.00 -0.78 -2.20 119.26 116.59 1nf6 h ALA 47 Ca 0.11 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 1nf6 h ALA 47 Cb 0.68 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1nf6 h ALA 47 CO 0.05 -0.66 -0.26 -0.91 0.00 0.00 0.00 179.25 177.47 1nf6 h ASN 48 N -0.32 0.47 -0.39 0.00 2.35 -1.37 -1.20 115.58 115.12 1nf6 h ASN 48 Ca -0.03 -0.16 -0.01 0.00 -0.55 0.00 0.00 56.30 55.55 1nf6 h ASN 48 Cb 0.24 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.47 1nf6 h ASN 48 CO 0.05 0.73 0.22 -0.03 -1.65 0.00 0.00 177.43 176.74 1nf6 h MET 49 N 0.42 0.54 -0.64 0.81 4.05 -1.33 -0.86 114.93 117.92 1nf6 h MET 49 Ca 0.06 -0.06 -0.07 0.00 -0.28 0.00 0.00 59.70 59.34 1nf6 h MET 49 Cb 0.67 -0.11 -0.03 0.00 -0.80 0.00 0.00 31.60 31.34 1nf6 h MET 49 CO 0.05 0.44 0.10 -0.22 0.23 0.00 0.00 176.91 177.51 1nf6 h LYS 50 N 0.50 1.05 -0.19 0.39 3.64 -1.10 -1.53 116.57 119.33 1nf6 h LYS 50 Ca 0.14 -0.27 -0.09 0.00 -1.27 0.00 0.00 60.65 59.16 1nf6 h LYS 50 Cb 0.05 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.73 1nf6 h LYS 50 CO -0.02 0.96 -0.29 -0.07 -2.27 0.00 0.00 179.45 177.76 1nf6 h LEU 51 N 0.98 0.36 -0.29 5.20 3.38 -0.89 -1.30 115.31 122.76 1nf6 h LEU 51 Ca 0.20 -0.13 -0.20 0.00 0.09 0.00 0.00 57.88 57.84 1nf6 h LEU 51 Cb 0.42 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 1nf6 h LEU 51 CO 0.01 0.65 -0.83 0.40 0.09 0.00 0.00 178.44 178.76 1nf6 h ILE 52 N 0.32 1.39 -1.00 1.22 2.04 -0.92 -2.44 117.51 118.11 1nf6 h ILE 52 Ca 0.04 -2.29 0.04 0.00 1.00 0.00 0.00 64.86 63.66 1nf6 h ILE 52 Cb 0.68 2.25 -0.06 0.00 -0.74 0.00 0.00 36.82 38.95 1nf6 h ILE 52 CO 0.05 0.69 0.65 0.00 0.00 0.00 0.00 178.15 179.54 1nf6 h ALA 53 N 0.83 1.36 -0.09 1.87 0.00 -0.90 -1.00 119.26 121.34 1nf6 h ALA 53 Ca -0.05 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 1nf6 h ALA 53 Cb 1.44 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1nf6 h ALA 53 CO 0.14 0.53 -0.38 0.82 0.00 0.00 0.00 179.25 180.36 1nf6 h ILE 54 N 1.25 1.30 -0.80 0.00 2.04 -1.15 0.33 117.51 120.47 1nf6 h ILE 54 Ca 0.40 -1.43 -0.04 0.00 1.00 0.00 0.00 64.86 64.79 1nf6 h ILE 54 Cb 0.04 1.65 -0.04 0.00 -0.74 0.00 0.00 36.82 37.73 1nf6 h ILE 54 CO -0.13 0.42 0.35 0.44 0.00 0.00 0.00 178.15 179.23 1nf6 h ASP 55 N 0.17 1.08 -0.03 1.72 3.32 -0.85 -2.04 116.42 119.78 1nf6 h ASP 55 Ca 0.02 -0.16 -0.10 0.00 0.02 0.00 0.00 57.03 56.81 1nf6 h ASP 55 Cb 0.76 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 40.01 1nf6 h ASP 55 CO 0.06 0.94 -0.28 -0.33 -1.72 0.00 0.00 179.24 177.90 1nf6 h GLU 56 N 1.15 0.48 -0.64 3.56 4.39 -0.37 -1.04 114.58 122.11 1nf6 h GLU 56 Ca 0.27 -0.19 -0.04 0.00 0.34 0.00 0.00 59.36 59.74 1nf6 h GLU 56 Cb 0.18 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.78 1nf6 h GLU 56 CO -0.03 0.72 0.25 0.52 -1.16 0.00 0.00 179.01 179.32 1nf6 h MET 57 N 0.42 0.96 -0.64 2.33 2.86 -0.78 -0.42 114.93 119.66 1nf6 h MET 57 Ca 0.06 -0.18 -0.05 0.00 -2.06 0.00 0.00 59.70 57.48 1nf6 h MET 57 Cb 0.71 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 32.19 1nf6 h MET 57 CO 0.05 0.81 0.22 0.00 1.06 0.00 0.00 176.91 179.05 1nf6 h ARG 58 N 0.90 0.98 0.11 1.72 3.08 -1.04 -1.43 114.38 118.71 1nf6 h ARG 58 Ca 0.21 -0.20 0.02 0.00 0.07 0.00 0.00 59.98 60.08 1nf6 h ARG 58 Cb 0.21 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 30.07 1nf6 h ARG 58 CO -0.02 0.85 -0.32 0.45 -1.07 0.00 0.00 179.97 179.87 1nf6 h HIS 59 N 0.92 -0.87 -0.84 3.04 3.86 -0.92 0.14 115.15 120.48 1nf6 h HIS 59 Ca 0.21 0.02 0.14 0.00 -1.16 0.00 0.00 60.37 59.58 1nf6 h HIS 59 Cb 0.26 0.37 -0.09 0.00 1.06 0.00 0.00 27.41 29.01 1nf6 h HIS 59 CO 0.02 -0.42 0.43 0.00 0.86 0.00 0.00 177.93 178.81 1nf6 h ALA 60 N 0.12 1.25 -0.08 2.45 0.00 -0.77 -0.85 119.26 121.38 1nf6 h ALA 60 Ca 0.03 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1nf6 h ALA 60 Cb 0.57 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 1nf6 h ALA 60 CO -0.19 -0.09 0.05 1.49 0.00 0.00 0.00 179.25 180.51 1nf6 h GLU 61 N 0.62 0.11 -0.69 0.00 4.81 -0.81 -0.72 114.58 117.91 1nf6 h GLU 61 Ca 0.45 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.62 1nf6 h GLU 61 Cb 0.62 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.95 1nf6 h GLU 61 CO -0.35 0.13 0.22 -0.91 -0.73 0.00 0.00 179.01 177.37 1nf6 h ASN 62 N 0.07 0.99 -0.35 1.04 -0.26 0.30 0.26 115.58 117.63 1nf6 h ASN 62 Ca 0.03 -0.17 -0.01 0.00 -0.56 0.00 0.00 56.30 55.58 1nf6 h ASN 62 Cb 0.04 -0.26 -0.02 0.00 -1.06 0.00 0.00 38.32 37.03 1nf6 h ASN 62 CO -0.01 0.92 0.17 -0.26 -1.06 0.00 0.00 177.43 177.19 1nf6 h PHE 63 N 1.03 0.50 -0.60 1.19 0.05 -1.06 -1.48 116.94 116.57 1nf6 h PHE 63 Ca 0.23 -0.02 -0.05 0.00 3.82 0.00 0.00 57.97 61.95 1nf6 h PHE 63 Cb 0.28 -0.16 -0.03 0.00 2.00 0.00 0.00 35.95 38.05 1nf6 h PHE 63 CO 0.02 0.43 0.17 0.00 -0.18 0.00 0.00 178.31 178.75 1nf6 h ALA 64 N 1.03 1.18 -0.52 2.45 0.00 -0.59 0.18 119.26 122.99 1nf6 h ALA 64 Ca 0.12 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 1nf6 h ALA 64 Cb 0.11 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1nf6 h ALA 64 CO -0.02 0.57 -0.01 0.93 0.00 0.00 0.00 179.25 180.72 1nf6 h GLU 65 N 0.88 0.93 -0.53 0.00 5.08 -0.73 -1.10 114.58 119.12 1nf6 h GLU 65 Ca 0.20 -0.30 -0.11 0.00 -1.00 0.00 0.00 59.36 58.15 1nf6 h GLU 65 Cb 0.27 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 1nf6 h GLU 65 CO -0.01 0.95 -0.10 -0.09 -1.00 0.00 0.00 179.01 178.76 1nf6 h ARG 66 N 0.80 0.98 -0.54 2.33 9.65 -0.98 -1.49 114.38 125.14 1nf6 h ARG 66 Ca 0.15 -0.35 0.01 0.00 -1.10 0.00 0.00 59.98 58.68 1nf6 h ARG 66 Cb 0.54 -0.07 -0.03 0.00 -1.39 0.00 0.00 29.97 29.02 1nf6 h ARG 66 CO 0.03 1.03 0.35 0.82 2.80 0.00 0.00 179.97 184.99 1nf6 h ILE 67 N 0.88 1.11 -0.96 1.20 2.04 -0.78 -1.39 117.51 119.62 1nf6 h ILE 67 Ca 0.14 -0.24 0.02 0.00 1.00 0.00 0.00 64.86 65.78 1nf6 h ILE 67 Cb 0.66 0.35 -0.05 0.00 -0.74 0.00 0.00 36.82 37.04 1nf6 h ILE 67 CO 0.05 0.13 0.63 0.11 0.00 0.00 0.00 178.15 179.06 1nf6 h LYS 68 N 0.70 1.22 0.00 2.37 1.79 -1.04 -0.04 116.57 121.56 1nf6 h LYS 68 Ca 0.20 -0.07 -0.02 0.00 -2.18 0.00 0.00 60.65 58.58 1nf6 h LYS 68 Cb -0.05 -0.28 -0.00 0.00 -1.58 0.00 0.00 32.23 30.32 1nf6 h LYS 68 CO -0.06 0.81 -0.10 0.93 -1.08 0.00 0.00 179.45 179.95 1nf6 h GLU 69 N 1.26 0.00 -0.02 3.15 5.08 -0.25 -2.07 114.58 121.74 1nf6 h GLU 69 Ca 0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 1nf6 h GLU 69 Cb -0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.17 1nf6 h GLU 69 CO -0.10 0.10 -0.04 1.28 -1.00 0.00 0.00 179.01 179.25 1nf6 n LEU 70 N -3.93 1.57 0.00 1.33 4.77 -0.51 -4.92 117.00 115.31 1nf6 n LEU 70 Ca -0.02 -0.51 0.00 0.00 -0.03 0.00 0.00 56.01 55.44 1nf6 n LEU 70 Cb 0.19 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 1nf6 n LEU 70 CO 0.31 0.26 0.00 0.61 -1.33 0.00 0.00 177.39 177.25 1nf6 n GLY 71 N 1.22 0.73 3.96 -0.72 0.00 -0.78 -4.91 105.19 104.69 1nf6 n GLY 71 Ca 0.17 -0.34 -0.23 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.31 2.06 -0.23 -0.02 0.00 -0.15 -5.00 107.32 101.67 1nf6 s GLY 72 Ca 0.00 -1.71 -0.05 0.00 0.00 0.00 0.00 44.72 42.96 1nf6 s GLY 72 CO 0.00 -1.80 -0.01 1.85 0.00 0.00 0.00 173.10 173.14 1nf6 s GLU 73 N -4.45 3.48 0.05 2.90 2.56 -1.26 -4.10 118.70 117.87 1nf6 s GLU 73 Ca 0.48 -0.57 -0.30 0.00 0.00 0.00 0.00 54.97 54.57 1nf6 s GLU 73 Cb -0.04 -3.11 -0.08 0.00 2.00 0.00 0.00 34.13 32.90 1nf6 s GLU 73 CO 0.30 -0.18 1.65 -2.14 -0.56 0.00 0.00 175.26 174.33 1nf6 s PRO 74 N 1.48 4.20 0.84 4.30 0.02 -1.26 -4.98 135.00 139.60 1nf6 s PRO 74 Ca 0.06 2.30 -0.12 0.00 0.02 0.00 0.00 61.00 63.25 1nf6 s PRO 74 Cb -0.15 -3.67 0.10 0.00 0.02 0.00 0.00 34.50 30.80 1nf6 s PRO 74 CO -0.01 -0.75 1.19 -0.08 -0.33 0.00 0.00 177.00 177.03 1nf6 s THR 75 N 2.88 2.05 0.00 0.99 -1.32 -1.26 -4.97 115.64 114.01 1nf6 s THR 75 Ca 0.74 0.02 0.00 0.00 -1.21 0.00 0.00 61.69 61.24 1nf6 s THR 75 Cb -0.38 -2.32 0.00 0.00 -1.51 0.00 0.00 72.50 68.29 1nf6 s THR 75 CO 0.32 -0.02 0.68 0.35 -2.21 0.00 0.00 174.62 173.74 1nf6 n THR 76 N -3.57 0.42 -4.16 5.08 -2.24 -1.26 -4.93 114.28 103.62 1nf6 n THR 76 Ca 0.13 -0.66 -0.35 0.00 -2.27 0.00 0.00 64.05 60.91 1nf6 n THR 76 Cb 0.51 0.85 -0.10 0.00 -2.10 0.00 0.00 70.33 69.49 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 -0.42 3.69 0.64 -0.78 -0.21 -1.26 -5.09 119.66 116.23 1nf6 s GLN 77 Ca 0.00 -0.38 -0.13 0.00 0.02 0.00 0.00 55.36 54.87 1nf6 s GLN 77 Cb 0.00 -3.06 -0.02 0.00 1.00 0.00 0.00 33.01 30.93 1nf6 s GLN 77 CO 0.00 0.38 1.05 -1.59 -2.12 0.00 0.00 175.29 173.01 1nf6 s LYS 78 N 0.03 3.19 -0.38 2.91 -2.85 -1.26 -4.45 119.74 116.93 1nf6 s LYS 78 Ca 0.04 1.00 -0.15 0.00 -1.00 0.00 0.00 55.97 55.87 1nf6 s LYS 78 Cb -0.13 -2.02 0.00 0.00 -2.06 0.00 0.00 37.83 33.63 1nf6 s LYS 78 CO 0.01 -0.90 0.33 -2.00 0.10 0.00 0.00 175.35 172.89 1nf6 s GLU 79 N -4.71 3.25 0.00 1.78 2.56 0.20 -4.91 118.70 116.88 1nf6 s GLU 79 Ca 0.59 -0.75 0.00 0.00 0.00 0.00 0.00 54.97 54.82 1nf6 s GLU 79 Cb -0.14 -3.90 0.00 0.00 2.00 0.00 0.00 34.13 32.09 1nf6 s GLU 79 CO 0.48 -0.65 0.00 0.41 -0.56 0.00 0.00 175.26 174.94 1nf6 n GLY 80 N 5.09 0.43 3.75 -1.50 0.00 -1.26 -4.73 105.19 106.97 1nf6 n GLY 80 Ca -0.10 -2.08 -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 0.54 0.00 0.00 0.00 173.32 173.86 1nf6 s LYS 81 N -1.11 3.08 -0.03 1.61 1.02 -1.26 -5.00 119.74 118.05 1nf6 s LYS 81 Ca 0.00 -0.38 -0.29 0.00 0.02 0.00 0.00 55.97 55.32 1nf6 s LYS 81 Cb 0.00 -2.88 -0.03 0.00 -0.52 0.00 0.00 37.83 34.40 1nf6 s LYS 81 CO 0.00 0.70 0.95 0.08 -0.92 0.00 0.00 175.35 176.16 1nf6 s VAL 82 N -1.00 4.88 -0.24 3.17 1.01 -1.26 -5.02 120.40 121.93 1nf6 s VAL 82 Ca 0.16 1.98 -0.14 0.00 0.00 0.00 0.00 61.98 63.99 1nf6 s VAL 82 Cb -0.12 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 31.94 1nf6 s VAL 82 CO 0.06 0.14 0.32 -0.69 0.00 0.00 0.00 175.10 174.93 1nf6 s VAL 83 N 1.16 5.23 0.47 2.92 1.01 -1.26 -5.08 120.40 124.86 1nf6 s VAL 83 Ca 0.50 0.50 0.08 0.00 0.00 0.00 0.00 61.98 63.06 1nf6 s VAL 83 Cb -0.20 -3.65 0.03 0.00 0.00 0.00 0.00 36.38 32.56 1nf6 s VAL 83 CO 0.25 0.24 0.60 0.42 0.00 0.00 0.00 175.10 176.61 1nf6 s THR 84 N 1.56 2.61 0.00 3.92 -4.23 -1.26 -4.62 115.64 113.61 1nf6 s THR 84 Ca 0.14 -1.08 0.00 0.00 -1.18 0.00 0.00 61.69 59.57 1nf6 s THR 84 Cb -0.15 -2.69 0.00 0.00 1.34 0.00 0.00 72.50 71.01 1nf6 s THR 84 CO 0.08 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.77 1nf6 n GLY 85 N -1.92 0.25 3.76 3.99 0.00 -1.26 -4.95 105.19 105.05 1nf6 n GLY 85 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.04 3.38 0.66 1.61 -0.21 -1.26 -4.99 119.66 117.80 1nf6 s GLN 86 Ca 0.00 2.28 -0.11 0.00 0.02 0.00 0.00 55.36 57.55 1nf6 s GLN 86 Cb 0.00 -2.42 -0.02 0.00 1.00 0.00 0.00 33.01 31.58 1nf6 s GLN 86 CO 0.00 -1.02 1.05 0.00 -2.12 0.00 0.00 175.29 173.20 1nf6 s ALA 87 N -1.27 2.93 0.17 6.09 0.00 -1.26 -4.78 121.76 123.64 1nf6 s ALA 87 Ca 0.67 -0.07 -0.19 0.00 0.00 0.00 0.00 51.96 52.36 1nf6 s ALA 87 Cb -0.41 -3.10 0.09 0.00 0.00 0.00 0.00 23.12 19.70 1nf6 s ALA 87 CO 0.50 -0.92 1.64 0.28 0.00 0.00 0.00 175.76 177.26 1nf6 h VAL 88 N -0.49 0.42 -0.65 0.00 2.07 -2.00 0.43 116.25 116.04 1nf6 h VAL 88 Ca -0.44 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.03 1nf6 h VAL 88 Cb 1.21 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 1nf6 h VAL 88 CO 0.61 0.00 0.22 -0.65 0.02 0.00 0.00 177.57 177.77 1nf6 h PRO 89 N -0.13 0.97 -0.56 1.57 0.11 -1.99 -2.12 132.00 129.85 1nf6 h PRO 89 Ca 0.19 -0.18 -0.06 0.00 0.11 0.00 0.00 66.00 66.07 1nf6 h PRO 89 Cb 0.42 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 31.35 1nf6 h PRO 89 CO -0.47 0.82 0.12 0.28 -0.21 0.00 0.00 178.00 178.54 1nf6 h VAL 90 N 0.94 1.23 -0.76 3.15 2.07 -1.56 -1.65 116.25 119.67 1nf6 h VAL 90 Ca 0.21 -0.86 0.12 0.00 0.82 0.00 0.00 66.70 66.99 1nf6 h VAL 90 Cb 0.24 0.67 -0.08 0.00 -1.52 0.00 0.00 31.29 30.60 1nf6 h VAL 90 CO -0.01 0.32 0.37 0.40 0.02 0.00 0.00 177.57 178.67 1nf6 h ILE 91 N 0.83 0.79 0.00 4.57 2.04 -0.28 0.12 117.51 125.58 1nf6 h ILE 91 Ca 0.18 -0.20 -0.07 0.00 1.00 0.00 0.00 64.86 65.77 1nf6 h ILE 91 Cb 0.32 0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 36.53 1nf6 h ILE 91 CO 0.00 0.11 -0.72 1.88 0.00 0.00 0.00 178.15 179.42 1nf6 h TYR 92 N 0.59 0.00 0.10 1.37 -1.99 -1.33 -2.35 116.97 113.37 1nf6 h TYR 92 Ca 0.39 0.00 -0.28 0.00 2.00 0.00 0.00 58.73 60.84 1nf6 h TYR 92 Cb 0.48 0.00 0.03 0.00 2.00 0.00 0.00 36.73 39.24 1nf6 h TYR 92 CO -0.11 0.27 -1.16 1.49 -0.00 0.00 0.00 178.16 178.66 1nf6 h GLU 93 N 0.00 0.61 -0.34 4.88 4.81 -0.85 -2.77 114.58 120.91 1nf6 h GLU 93 Ca -0.04 -0.79 -0.09 0.00 -0.13 0.00 0.00 59.36 58.31 1nf6 h GLU 93 Cb 1.24 0.26 -0.01 0.00 0.63 0.00 0.00 28.75 30.87 1nf6 h GLU 93 CO 0.03 1.35 -0.15 0.77 -0.73 0.00 0.00 179.01 180.28 1nf6 h SER 94 N 0.23 0.73 -0.57 1.04 0.02 -0.85 -2.73 113.55 111.42 1nf6 h SER 94 Ca -0.17 -0.40 -0.10 0.00 -0.84 0.00 0.00 61.79 60.28 1nf6 h SER 94 Cb 1.84 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 64.16 1nf6 h SER 94 CO 0.22 0.96 -0.05 0.44 -1.14 0.00 0.00 176.83 177.26 1nf6 h ASP 95 N 0.49 1.03 -0.18 3.07 3.32 -1.52 0.40 116.42 123.02 1nf6 h ASP 95 Ca 0.08 -0.33 0.03 0.00 0.02 0.00 0.00 57.03 56.83 1nf6 h ASP 95 Cb 0.68 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.91 1nf6 h ASP 95 CO 0.05 1.12 -0.03 0.00 -1.72 0.00 0.00 179.24 178.65 1nf6 h ALA 96 N 0.95 0.13 -0.83 3.45 0.00 -1.54 0.56 119.26 121.99 1nf6 h ALA 96 Ca 0.15 0.07 0.07 0.00 0.00 0.00 0.00 54.91 55.20 1nf6 h ALA 96 Cb 0.62 0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.47 1nf6 h ALA 96 CO 0.04 -0.47 0.50 -0.44 0.00 0.00 0.00 179.25 178.88 1nf6 h ASP 97 N 0.02 0.76 -0.23 0.00 3.32 -1.15 -1.42 116.42 117.73 1nf6 h ASP 97 Ca 0.09 0.03 -0.04 0.00 0.02 0.00 0.00 57.03 57.13 1nf6 h ASP 97 Cb 0.13 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1nf6 h ASP 97 CO -0.18 0.47 -0.00 -0.61 -1.72 0.00 0.00 179.24 177.20 1nf6 h GLN 98 N 0.89 0.40 -0.68 3.56 4.15 -0.28 0.99 115.11 124.14 1nf6 h GLN 98 Ca 0.37 -0.13 -0.01 0.00 0.77 0.00 0.00 58.65 59.65 1nf6 h GLN 98 Cb 0.23 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 27.85 1nf6 h GLN 98 CO -0.19 0.59 0.38 0.93 -1.93 0.00 0.00 178.83 178.61 1nf6 h GLU 99 N 0.17 0.92 -0.22 1.69 4.39 -0.64 0.60 114.58 121.50 1nf6 h GLU 99 Ca 0.06 -0.09 -0.05 0.00 0.34 0.00 0.00 59.36 59.62 1nf6 h GLU 99 Cb 0.41 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 1nf6 h GLU 99 CO 0.01 0.67 -0.07 0.22 -1.16 0.00 0.00 179.01 178.68 1nf6 h ASP 100 N 0.94 0.44 -0.66 1.42 1.82 -1.11 -0.74 116.42 118.53 1nf6 h ASP 100 Ca 0.24 -0.39 -0.03 0.00 -0.39 0.00 0.00 57.03 56.47 1nf6 h ASP 100 Cb 0.00 -0.12 -0.03 0.00 0.68 0.00 0.00 39.33 39.86 1nf6 h ASP 100 CO -0.04 0.73 0.31 0.00 -1.61 0.00 0.00 179.24 178.63 1nf6 h ALA 101 N 0.73 0.85 -0.07 -0.78 0.00 -0.21 -1.15 119.26 118.63 1nf6 h ALA 101 Ca 0.05 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.84 1nf6 h ALA 101 Cb 0.55 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1nf6 h ALA 101 CO 0.03 0.42 -0.04 1.15 0.00 0.00 0.00 179.25 180.80 1nf6 h THR 102 N 0.91 0.86 -0.33 0.00 2.02 0.33 0.16 112.91 116.87 1nf6 h THR 102 Ca 0.23 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.47 1nf6 h THR 102 Cb 0.12 0.86 -0.06 0.00 -1.74 0.00 0.00 68.15 67.33 1nf6 h THR 102 CO -0.03 0.00 -0.07 0.40 0.37 0.00 0.00 175.52 176.19 1nf6 h ILE 103 N -0.05 0.68 -0.67 3.11 2.04 -0.98 0.49 117.51 122.13 1nf6 h ILE 103 Ca 0.05 -0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.00 1nf6 h ILE 103 Cb 0.11 0.67 -0.08 0.00 -0.74 0.00 0.00 36.82 36.79 1nf6 h ILE 103 CO -0.10 0.00 0.28 -0.33 0.00 0.00 0.00 178.15 178.00 1nf6 h GLU 104 N 0.01 0.46 0.31 2.37 4.39 -0.77 -1.69 114.58 119.67 1nf6 h GLU 104 Ca 0.16 -0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.82 1nf6 h GLU 104 Cb 0.24 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 1nf6 h GLU 104 CO -0.33 0.31 -0.15 0.00 -1.16 0.00 0.00 179.01 177.68 1nf6 h ALA 105 N 1.44 -0.41 -0.64 3.43 0.00 0.82 -2.86 119.26 121.04 1nf6 h ALA 105 Ca 0.34 -0.16 0.09 0.00 0.00 0.00 0.00 54.91 55.17 1nf6 h ALA 105 Cb 0.41 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 1nf6 h ALA 105 CO -0.31 -0.61 0.42 1.88 0.00 0.00 0.00 179.25 180.64 1nf6 h TYR 106 N -0.66 0.54 -0.35 0.00 -1.99 0.17 0.30 116.97 114.98 1nf6 h TYR 106 Ca -0.04 0.01 -0.08 0.00 2.00 0.00 0.00 58.73 60.62 1nf6 h TYR 106 Cb 0.46 -0.18 -0.02 0.00 2.00 0.00 0.00 36.73 39.00 1nf6 h TYR 106 CO 0.01 0.27 -0.12 0.77 -0.00 0.00 0.00 178.16 179.08 1nf6 h SER 107 N 0.52 0.59 -0.42 3.88 0.02 -1.29 0.14 113.55 116.99 1nf6 h SER 107 Ca 0.29 -0.16 -0.10 0.00 -0.84 0.00 0.00 61.79 60.97 1nf6 h SER 107 Cb 0.45 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 1nf6 h SER 107 CO -0.09 0.74 -0.13 1.56 -1.14 0.00 0.00 176.83 177.78 1nf6 h GLN 108 N 0.55 0.84 -0.66 3.45 4.20 -0.27 -2.71 115.11 120.50 1nf6 h GLN 108 Ca 0.10 -0.33 -0.04 0.00 0.06 0.00 0.00 58.65 58.44 1nf6 h GLN 108 Cb 0.54 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.25 1nf6 h GLN 108 CO 0.03 0.96 0.26 0.74 -0.67 0.00 0.00 178.83 180.16 1nf6 h PHE 109 N 0.66 1.01 -0.54 2.96 0.05 -0.23 -2.82 116.94 118.04 1nf6 h PHE 109 Ca 0.10 -0.08 0.09 0.00 3.82 0.00 0.00 57.97 61.91 1nf6 h PHE 109 Cb 0.67 -0.30 -0.08 0.00 2.00 0.00 0.00 35.95 38.24 1nf6 h PHE 109 CO 0.05 0.79 0.12 1.25 -0.18 0.00 0.00 178.31 180.35 1nf6 h LEU 110 N 0.94 0.02 -1.06 1.54 6.46 -0.70 -1.56 115.31 120.95 1nf6 h LEU 110 Ca 0.22 0.10 0.05 0.00 -0.12 0.00 0.00 57.88 58.12 1nf6 h LEU 110 Cb 0.21 0.13 -0.06 0.00 -0.73 0.00 0.00 40.66 40.21 1nf6 h LEU 110 CO -0.02 0.03 0.63 0.50 -0.62 0.00 0.00 178.44 178.97 1nf6 h LYS 111 N 0.26 1.15 -0.57 1.25 3.64 -1.23 -1.14 116.57 119.92 1nf6 h LYS 111 Ca 0.28 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.55 1nf6 h LYS 111 Cb 0.38 -0.26 -0.03 0.00 -0.41 0.00 0.00 32.23 31.92 1nf6 h LYS 111 CO -0.35 0.76 0.18 0.28 -2.27 0.00 0.00 179.45 178.05 1nf6 h VAL 112 N 1.18 1.22 -0.31 2.00 2.07 -1.14 -0.51 116.25 120.76 1nf6 h VAL 112 Ca 0.40 -0.74 -0.07 0.00 0.82 0.00 0.00 66.70 67.11 1nf6 h VAL 112 Cb 0.07 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 1nf6 h VAL 112 CO -0.13 0.28 -0.07 0.00 0.02 0.00 0.00 177.57 177.67 1nf6 h LYS 114 N 0.37 0.36 -0.01 0.00 1.57 -0.98 0.17 116.57 118.05 1nf6 h LYS 114 Ca 0.08 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.79 1nf6 h LYS 114 Cb 0.56 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.78 1nf6 h LYS 114 CO 0.03 0.24 -0.23 0.93 -0.57 0.00 0.00 179.45 179.85 1nf6 h GLU 115 N 0.37 0.02 -0.15 3.15 5.08 -0.93 -1.79 114.58 120.33 1nf6 h GLU 115 Ca 0.11 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1nf6 h GLU 115 Cb -0.03 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.22 1nf6 h GLU 115 CO -0.03 0.25 0.00 1.04 -1.00 0.00 0.00 179.01 179.27 1nf6 n GLN 116 N -4.26 1.66 -2.59 2.33 1.13 0.56 -4.94 117.38 111.28 1nf6 n GLN 116 Ca -0.02 -0.99 -0.11 0.00 -1.94 0.00 0.00 57.00 53.94 1nf6 n GLN 116 Cb 0.29 -1.38 0.02 0.00 0.11 0.00 0.00 30.24 29.28 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 1.09 0.04 3.05 1.08 0.00 -0.50 -4.88 105.19 105.07 1nf6 n GLY 117 Ca 0.16 -0.33 -0.34 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.80 5.31 0.31 1.61 -1.08 0.48 -4.92 116.67 115.58 1nf6 s ASP 118 Ca 0.14 -3.36 0.03 0.00 -0.52 0.00 0.00 52.55 48.83 1nf6 s ASP 118 Cb -0.06 -1.81 0.51 0.00 -1.46 0.00 0.00 42.92 40.10 1nf6 s ASP 118 CO 0.17 -0.24 1.81 0.40 0.52 0.00 0.00 175.17 177.83 1nf6 h ILE 119 N 4.72 1.22 -0.18 4.11 1.08 -1.95 -1.88 117.51 124.64 1nf6 h ILE 119 Ca 0.07 -0.96 -0.05 0.00 -0.39 0.00 0.00 64.86 63.53 1nf6 h ILE 119 Cb 0.86 1.06 -0.00 0.00 -3.07 0.00 0.00 36.82 35.66 1nf6 h ILE 119 CO 0.76 0.32 -0.09 0.58 -0.69 0.00 0.00 178.15 179.03 1nf6 h VAL 120 N 0.51 1.31 -0.54 1.67 2.07 -1.97 -1.37 116.25 117.93 1nf6 h VAL 120 Ca 0.10 -1.15 -0.11 0.00 0.82 0.00 0.00 66.70 66.36 1nf6 h VAL 120 Cb 0.45 1.69 -0.02 0.00 -1.52 0.00 0.00 31.29 31.89 1nf6 h VAL 120 CO 0.02 0.34 -0.10 0.74 0.02 0.00 0.00 177.57 178.60 1nf6 h THR 121 N 0.07 1.27 -0.91 2.57 2.02 -1.94 -2.23 112.91 113.76 1nf6 h THR 121 Ca 0.04 -1.24 0.02 0.00 0.77 0.00 0.00 66.41 65.99 1nf6 h THR 121 Cb 0.58 0.95 -0.05 0.00 -1.74 0.00 0.00 68.15 67.89 1nf6 h THR 121 CO 0.03 0.44 0.60 0.00 0.37 0.00 0.00 175.52 176.96 1nf6 h ALA 122 N 0.98 1.38 -0.56 6.16 0.00 -1.29 -1.37 119.26 124.56 1nf6 h ALA 122 Ca 0.14 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1nf6 h ALA 122 Cb 0.65 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1nf6 h ALA 122 CO 0.05 0.56 0.33 0.00 0.00 0.00 0.00 179.25 180.19 1nf6 h ARG 123 N 1.20 0.76 -0.76 0.00 2.47 -0.95 -0.44 114.38 116.66 1nf6 h ARG 123 Ca 0.34 -0.07 0.02 0.00 -1.26 0.00 0.00 59.98 59.01 1nf6 h ARG 123 Cb -0.09 -0.16 -0.04 0.00 -1.65 0.00 0.00 29.97 28.03 1nf6 h ARG 123 CO -0.08 0.56 0.49 1.25 0.56 0.00 0.00 179.97 182.75 1nf6 h LEU 124 N 0.75 0.84 -0.70 3.04 5.85 -0.83 -1.26 115.31 123.01 1nf6 h LEU 124 Ca 0.20 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.84 1nf6 h LEU 124 Cb -0.00 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.80 1nf6 h LEU 124 CO -0.04 0.60 0.17 -0.26 -0.34 0.00 0.00 178.44 178.57 1nf6 h PHE 125 N 0.99 1.17 -0.24 1.25 -1.00 -0.82 -1.67 116.94 116.62 1nf6 h PHE 125 Ca 0.29 -0.14 0.00 0.00 2.81 0.00 0.00 57.97 60.93 1nf6 h PHE 125 Cb -0.06 -0.33 -0.01 0.00 3.61 0.00 0.00 35.95 39.16 1nf6 h PHE 125 CO -0.03 0.95 0.16 0.93 -1.61 0.00 0.00 178.31 178.71 1nf6 h GLU 126 N 1.05 0.32 -0.21 1.51 5.08 -0.61 -0.97 114.58 120.74 1nf6 h GLU 126 Ca 0.22 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.55 1nf6 h GLU 126 Cb 0.37 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 1nf6 h GLU 126 CO 0.00 0.22 0.11 0.00 -1.00 0.00 0.00 179.01 178.35 1nf6 h ARG 127 N 0.32 0.30 0.00 2.33 3.08 -1.11 -2.79 114.38 116.51 1nf6 h ARG 127 Ca 0.09 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 60.05 1nf6 h ARG 127 Cb -0.02 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 1nf6 h ARG 127 CO -0.02 0.28 -0.25 0.82 -1.07 0.00 0.00 179.97 179.74 1nf6 h ILE 128 N 0.23 0.76 -0.03 2.04 2.04 -1.17 -2.56 117.51 118.82 1nf6 h ILE 128 Ca 0.07 -1.03 -0.13 0.00 1.00 0.00 0.00 64.86 64.77 1nf6 h ILE 128 Cb 0.07 1.64 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 1nf6 h ILE 128 CO -0.01 0.24 -0.59 0.40 0.00 0.00 0.00 178.15 178.19 1nf6 h ILE 129 N 0.00 1.41 -0.24 -0.67 2.04 -0.92 -1.24 117.51 117.89 1nf6 h ILE 129 Ca -0.00 -2.00 -0.17 0.00 1.00 0.00 0.00 64.86 63.69 1nf6 h ILE 129 Cb 0.62 2.05 -0.00 0.00 -0.74 0.00 0.00 36.82 38.74 1nf6 h ILE 129 CO 0.03 0.58 -0.54 -0.33 0.00 0.00 0.00 178.15 177.89 1nf6 h GLU 130 N 0.07 0.72 -0.26 2.37 5.08 -1.24 -1.38 114.58 119.94 1nf6 h GLU 130 Ca -0.01 -0.45 -0.00 0.00 -1.00 0.00 0.00 59.36 57.90 1nf6 h GLU 130 Cb 1.06 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.35 1nf6 h GLU 130 CO 0.08 1.08 0.16 0.93 -1.00 0.00 0.00 179.01 180.26 1nf6 h GLU 131 N 0.56 0.36 -0.84 2.33 5.08 -1.45 -1.36 114.58 119.26 1nf6 h GLU 131 Ca 0.01 -0.03 0.13 0.00 -1.00 0.00 0.00 59.36 58.47 1nf6 h GLU 131 Cb 1.12 -0.08 -0.06 0.00 0.50 0.00 0.00 28.75 30.23 1nf6 h GLU 131 CO 0.11 0.28 0.54 0.93 -1.00 0.00 0.00 179.01 179.88 1nf6 h GLU 132 N 0.33 0.64 -0.39 2.33 4.39 -1.08 0.16 114.58 120.96 1nf6 h GLU 132 Ca 0.09 -0.04 -0.09 0.00 0.34 0.00 0.00 59.36 59.67 1nf6 h GLU 132 Cb 0.01 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.50 1nf6 h GLU 132 CO -0.02 0.42 -0.13 0.37 -1.16 0.00 0.00 179.01 178.49 1nf6 h GLN 133 N 0.66 0.70 -0.60 2.33 5.75 -0.67 0.21 115.11 123.48 1nf6 h GLN 133 Ca 0.41 -0.23 -0.06 0.00 -0.15 0.00 0.00 58.65 58.61 1nf6 h GLN 133 Cb 0.66 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 29.12 1nf6 h GLN 133 CO -0.17 0.80 0.12 0.00 -2.65 0.00 0.00 178.83 176.93 1nf6 h ALA 134 N 1.22 1.08 -0.29 3.38 0.00 0.33 -1.00 119.26 124.00 1nf6 h ALA 134 Ca 0.11 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 1nf6 h ALA 134 Cb 0.59 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1nf6 h ALA 134 CO 0.04 0.60 -0.16 0.45 0.00 0.00 0.00 179.25 180.18 1nf6 h HIS 135 N 0.90 0.73 -0.55 0.00 3.86 -0.64 -2.36 115.15 117.09 1nf6 h HIS 135 Ca 0.19 -0.19 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 1nf6 h HIS 135 Cb 0.36 -0.17 -0.03 0.00 1.06 0.00 0.00 27.41 28.64 1nf6 h HIS 135 CO 0.02 0.87 0.31 1.25 0.86 0.00 0.00 177.93 181.25 1nf6 h LEU 136 N 0.38 0.68 -1.08 2.43 5.85 -0.40 -2.21 115.31 120.95 1nf6 h LEU 136 Ca 0.06 -0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.73 1nf6 h LEU 136 Cb 0.69 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.50 1nf6 h LEU 136 CO 0.05 0.57 0.62 0.74 -0.34 0.00 0.00 178.44 180.08 1nf6 h THR 137 N 0.74 1.17 0.01 1.05 2.02 -1.18 -2.39 112.91 114.32 1nf6 h THR 137 Ca 0.20 -0.41 -0.00 0.00 0.77 0.00 0.00 66.41 66.96 1nf6 h THR 137 Cb 0.03 -0.13 0.00 0.00 -1.74 0.00 0.00 68.15 66.31 1nf6 h THR 137 CO -0.03 0.22 -0.00 0.22 0.37 0.00 0.00 175.52 176.29 1nf6 h TYR 138 N 1.20 -0.01 -0.22 3.16 3.20 -0.87 -2.45 116.97 120.98 1nf6 h TYR 138 Ca 0.37 -0.00 -0.12 0.00 3.14 0.00 0.00 58.73 62.12 1nf6 h TYR 138 Cb -0.01 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.25 1nf6 h TYR 138 CO -0.00 0.17 -0.37 1.88 -1.64 0.00 0.00 178.16 178.20 1nf6 h TYR 139 N -0.18 0.57 -0.45 -3.82 0.99 -1.26 -2.06 116.97 110.76 1nf6 h TYR 139 Ca -0.00 -0.15 -0.02 0.00 2.00 0.00 0.00 58.73 60.56 1nf6 h TYR 139 Cb 0.18 -0.13 -0.02 0.00 1.00 0.00 0.00 36.73 37.76 1nf6 h TYR 139 CO -0.02 0.79 0.21 0.93 -0.00 0.00 0.00 178.16 180.08 1nf6 h GLU 140 N 0.41 0.66 0.56 4.88 5.08 -1.47 0.84 114.58 125.54 1nf6 h GLU 140 Ca 0.04 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1nf6 h GLU 140 Cb 0.83 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.97 1nf6 h GLU 140 CO 0.07 0.57 -0.31 -0.91 -1.00 0.00 0.00 179.01 177.43 1nf6 h ASN 141 N 0.59 -0.76 -0.29 1.42 2.35 -1.15 0.29 115.58 118.04 1nf6 h ASN 141 Ca 0.16 0.04 0.01 0.00 -0.55 0.00 0.00 56.30 55.96 1nf6 h ASN 141 Cb 0.13 0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.70 1nf6 h ASN 141 CO -0.02 -0.50 0.16 0.40 -1.65 0.00 0.00 177.43 175.82 1nf6 h ILE 142 N -0.81 1.02 -1.00 2.81 1.08 -1.40 0.24 117.51 119.45 1nf6 h ILE 142 Ca -0.07 -0.11 0.16 0.00 -0.39 0.00 0.00 64.86 64.45 1nf6 h ILE 142 Cb 0.64 0.66 -0.10 0.00 -3.07 0.00 0.00 36.82 34.96 1nf6 h ILE 142 CO 0.09 0.06 0.62 1.23 -0.69 0.00 0.00 178.15 179.46 1nf6 h GLY 143 N 0.33 1.71 0.93 5.37 0.00 -0.70 -0.54 103.07 110.17 1nf6 h GLY 143 Ca 0.11 -0.39 -0.06 0.00 0.00 0.00 0.00 47.33 47.00 1nf6 h GLY 143 CO -0.06 0.03 -0.03 0.23 0.00 0.00 0.00 176.54 176.71 1nf6 h SER 144 N 0.86 0.65 -0.31 0.19 0.87 0.83 -2.35 113.55 114.29 1nf6 h SER 144 Ca 0.54 -0.33 -0.10 0.00 -1.23 0.00 0.00 61.79 60.68 1nf6 h SER 144 Cb 0.73 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.50 1nf6 h SER 144 CO -0.33 0.82 -0.14 0.45 -0.53 0.00 0.00 176.83 177.10 1nf6 h HIS 145 N 0.46 0.83 -0.28 2.24 -0.00 0.59 -1.47 115.15 117.52 1nf6 h HIS 145 Ca 0.10 -0.16 -0.11 0.00 -0.00 0.00 0.00 60.37 60.20 1nf6 h HIS 145 Cb 0.50 -0.21 -0.01 0.00 -0.00 0.00 0.00 27.41 27.69 1nf6 h HIS 145 CO 0.04 0.84 -0.28 0.82 -0.00 0.00 0.00 177.93 179.36 1nf6 h ILE 146 N 0.67 1.28 -0.09 2.45 2.04 -1.05 0.17 117.51 122.98 1nf6 h ILE 146 Ca 0.11 -1.36 -0.24 0.00 1.00 0.00 0.00 64.86 64.37 1nf6 h ILE 146 Cb 0.62 1.36 0.01 0.00 -0.74 0.00 0.00 36.82 38.08 1nf6 h ILE 146 CO 0.04 0.44 -0.89 0.11 0.00 0.00 0.00 178.15 177.85 1nf6 h LYS 147 N 0.50 0.75 0.04 2.37 1.57 -1.24 0.72 116.57 121.29 1nf6 h LYS 147 Ca 0.07 -0.69 -0.25 0.00 -1.87 0.00 0.00 60.65 57.90 1nf6 h LYS 147 Cb 0.74 0.17 -0.02 0.00 0.08 0.00 0.00 32.23 33.19 1nf6 h LYS 147 CO 0.06 1.28 -1.28 -0.91 -0.57 0.00 0.00 179.45 178.03 1nf6 h ASN 148 N 0.48 0.14 0.00 0.86 2.35 -1.20 -3.40 115.58 114.81 1nf6 h ASN 148 Ca -0.08 -0.17 0.00 0.00 -0.55 0.00 0.00 56.30 55.49 1nf6 h ASN 148 Cb 1.53 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 39.85 1nf6 h ASN 148 CO 0.18 1.14 -0.74 0.18 -1.65 0.00 0.00 177.43 176.54 1nf6 n LEU 149 N -3.34 0.07 0.00 1.61 4.77 0.60 -5.07 117.00 115.64 1nf6 n LEU 149 Ca -0.08 -0.21 0.00 0.00 -0.03 0.00 0.00 56.01 55.69 1nf6 n LEU 149 Cb 0.99 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.08 1nf6 n LEU 149 CO 0.48 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.17 1nf6 n GLY 150 N 1.79 2.87 0.30 -0.72 0.00 0.25 -2.09 105.19 107.58 1nf6 n GLY 150 Ca -0.00 -0.04 0.17 0.00 0.00 0.00 0.00 46.02 46.15 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 0.18 0.00 -0.58 1.61 5.19 -1.94 -1.90 116.42 118.99 1nf6 h ASP 151 Ca 0.00 0.00 -0.09 0.00 -0.62 0.00 0.00 57.03 56.32 1nf6 h ASP 151 Cb 0.00 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.49 1nf6 h ASP 151 CO 0.00 0.04 0.01 0.74 -3.12 0.00 0.00 179.24 176.90 1nf6 h THR 152 N 0.00 1.26 -0.39 0.35 2.02 -1.84 -0.69 112.91 113.63 1nf6 h THR 152 Ca -0.00 -1.13 -0.06 0.00 0.77 0.00 0.00 66.41 65.99 1nf6 h THR 152 Cb 0.16 0.79 -0.01 0.00 -1.74 0.00 0.00 68.15 67.35 1nf6 h THR 152 CO 0.00 0.41 -0.01 0.22 0.37 0.00 0.00 175.52 176.52 1nf6 h TYR 153 N 0.95 0.75 -0.37 3.16 3.20 -1.42 -3.09 116.97 120.15 1nf6 h TYR 153 Ca 0.17 -0.13 -0.10 0.00 3.14 0.00 0.00 58.73 61.81 1nf6 h TYR 153 Cb 0.53 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.59 1nf6 h TYR 153 CO 0.04 0.78 -0.17 -0.07 -1.64 0.00 0.00 178.16 177.10 1nf6 h LEU 154 N 0.51 0.68 -1.77 2.82 3.38 -1.34 -1.73 115.31 117.86 1nf6 h LEU 154 Ca 0.11 -0.22 0.07 0.00 0.09 0.00 0.00 57.88 57.94 1nf6 h LEU 154 Cb 0.48 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1nf6 h LEU 154 CO 0.02 0.86 0.30 0.00 0.09 0.00 0.00 178.44 179.71 1nf6 h ALA 155 N 1.20 2.05 0.00 1.53 0.00 -1.08 0.32 119.26 123.29 1nf6 h ALA 155 Ca 0.10 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 1nf6 h ALA 155 Cb 0.63 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1nf6 h ALA 155 CO 0.04 -0.15 -0.52 -0.22 0.00 0.00 0.00 179.25 178.41 1nf6 h LYS 156 N 0.27 0.00 0.00 0.00 3.64 -1.25 -3.27 116.57 115.96 1nf6 h LYS 156 Ca 0.20 0.00 -0.26 0.00 -1.27 0.00 0.00 60.65 59.31 1nf6 h LYS 156 Cb 0.43 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.20 1nf6 h LYS 156 CO -0.04 0.52 -1.60 0.82 -2.27 0.00 0.00 179.45 176.88 1nf6 h ILE 157 N 0.00 0.85 -1.77 2.00 1.08 -0.21 -3.45 117.51 116.00 1nf6 h ILE 157 Ca -0.01 -2.63 -0.68 0.00 -0.39 0.00 0.00 64.86 61.16 1nf6 h ILE 157 Cb 1.10 2.38 0.04 0.00 -3.07 0.00 0.00 36.82 37.27 1nf6 h ILE 157 CO 0.07 0.48 0.72 0.00 -0.69 0.00 0.00 178.15 178.73 1nf6 n ALA 158 N -2.51 -0.16 -0.99 1.87 0.00 0.45 -1.29 120.51 117.88 1nf6 n ALA 158 Ca -0.14 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.74 1nf6 n ALA 158 Cb 1.01 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 18.24 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 3.39 0.46 3.80 0.00 0.00 -0.00 -4.98 105.19 107.86 1nf6 n GLY 159 Ca 0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.03 3.81 0.40 2.61 -4.23 -0.41 -4.94 115.64 110.85 1nf6 s THR 160 Ca 0.00 0.64 -0.26 0.00 -1.18 0.00 0.00 61.69 60.88 1nf6 s THR 160 Cb 0.00 -3.28 -0.10 0.00 1.34 0.00 0.00 72.50 70.46 1nf6 s THR 160 CO 0.00 -0.72 1.37 -2.65 -0.54 0.00 0.00 174.62 172.07 1nf6 n PRO 161 N -3.02 2.22 -0.03 3.99 -0.02 -1.26 -3.63 135.00 133.25 1nf6 n PRO 161 Ca 0.08 0.79 0.08 0.00 -2.02 0.00 0.00 63.50 62.42 1nf6 n PRO 161 Cb 0.53 -2.50 0.08 0.00 -0.02 0.00 0.00 33.50 31.59 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 0.27 2.38 -4.76 2.55 3.41 -1.26 -2.82 113.62 113.39 1nf6 n SER 162 Ca 0.05 -1.67 -0.41 0.00 -0.26 0.00 0.00 58.87 56.57 1nf6 n SER 162 Cb 0.39 -0.03 -0.01 0.00 -0.26 0.00 0.00 64.21 64.30 1nf6 n SER 162 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1nf6 s SER 163 N -1.24 6.36 0.00 4.04 0.15 -1.26 -4.20 113.70 117.54 1nf6 s SER 163 Ca 0.19 2.99 0.16 0.00 0.70 0.00 0.00 55.95 60.00 1nf6 s SER 163 Cb 0.13 -2.65 0.43 0.00 -1.71 0.00 0.00 66.02 62.22 1nf6 s SER 163 CO 0.19 -0.90 1.35 0.35 1.20 0.00 0.00 173.24 175.43 1nf6 n THR 164 N 1.54 0.90 0.00 6.45 -2.24 -1.26 -4.90 114.28 114.76 1nf6 n THR 164 Ca 0.05 -0.95 0.00 0.00 -2.27 0.00 0.00 64.05 60.89 1nf6 n THR 164 Cb 0.38 0.59 0.00 0.00 -2.10 0.00 0.00 70.33 69.20 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 1.02 -1.02 3.63 3.38 0.00 -1.26 -5.01 105.19 105.93 1nf6 n GLY 165 Ca 0.17 -2.09 -0.36 0.00 0.00 0.00 0.00 46.02 43.74 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 0.00 3.44 -1.49 2.61 5.66 -1.26 -4.94 114.28 118.30 1nf6 n THR 166 Ca 0.00 -0.43 -0.32 0.00 -3.05 0.00 0.00 64.05 60.25 1nf6 n THR 166 Cb 0.00 -1.17 0.07 0.00 -1.55 0.00 0.00 70.33 67.68 1nf6 n THR 166 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1nf6 s ALA 167 N -1.66 2.32 -0.50 1.79 0.00 -1.26 -4.90 121.76 117.55 1nf6 s ALA 167 Ca 0.76 0.45 -0.44 0.00 0.00 0.00 0.00 51.96 52.73 1nf6 s ALA 167 Cb -0.37 -3.31 -0.19 0.00 0.00 0.00 0.00 23.12 19.25 1nf6 s ALA 167 CO 0.48 -1.58 2.14 -1.13 0.00 0.00 0.00 175.76 175.67 1nf6 n SER 168 N -2.97 0.76 -4.61 0.00 3.41 -1.26 -4.90 113.62 104.06 1nf6 n SER 168 Ca 0.10 0.67 -0.43 0.00 -0.26 0.00 0.00 58.87 58.95 1nf6 n SER 168 Cb 0.52 -0.90 -0.03 0.00 -0.26 0.00 0.00 64.21 63.54 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 6.02 3.40 0.00 4.33 -2.85 -1.26 -4.91 119.74 124.47 1nf6 s LYS 169 Ca 1.20 1.77 0.00 0.00 -1.00 0.00 0.00 55.97 57.94 1nf6 s LYS 169 Cb -1.49 -4.23 0.00 0.00 -2.06 0.00 0.00 37.83 30.05 1nf6 s LYS 169 CO 0.66 -1.78 0.00 0.41 0.10 0.00 0.00 175.35 174.73 1nf6 n GLY 170 N 5.35 5.88 0.12 0.59 0.00 -1.26 -5.09 105.19 110.79 1nf6 n GLY 170 Ca 0.24 -1.97 -0.21 0.00 0.00 0.00 0.00 46.02 44.09 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 0.44 0.50 -0.00 1.61 3.57 -2.06 -3.56 116.94 117.43 1nf6 h PHE 171 Ca 0.00 -0.37 0.00 0.00 3.53 0.00 0.00 57.97 61.13 1nf6 h PHE 171 Cb 0.00 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.72 1nf6 h PHE 171 CO 0.00 1.45 0.00 1.33 -2.23 0.00 0.00 178.31 178.86