#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fz8 s LEU 4 N 0.00 3.07 0.00 -0.35 1.43 -1.26 -1.54 118.68 120.03 1fz8 s LEU 4 Ca 0.00 0.06 0.00 0.00 -1.03 0.00 0.00 54.13 53.16 1fz8 s LEU 4 Cb 0.00 -2.76 0.00 0.00 0.03 0.00 0.00 46.19 43.46 1fz8 s LEU 4 CO 0.00 -1.44 0.00 0.61 0.23 0.00 0.00 176.35 175.75 1fz8 n GLY 5 N -2.63 3.46 0.09 -3.19 0.00 -1.24 -4.69 105.19 96.99 1fz8 n GLY 5 Ca 0.09 -0.66 -0.10 0.00 0.00 0.00 0.00 46.02 45.35 1fz8 n GLY 5 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1fz8 h ILE 6 N 3.76 1.15 0.00 -0.61 2.04 -1.99 -3.39 117.51 118.46 1fz8 h ILE 6 Ca 0.00 -1.61 -0.12 0.00 1.00 0.00 0.00 64.86 64.13 1fz8 h ILE 6 Cb 0.00 2.06 -0.02 0.00 -0.74 0.00 0.00 36.82 38.12 1fz8 h ILE 6 CO 0.00 0.35 -1.76 1.41 0.00 0.00 0.00 178.15 178.15 1fz8 n HIS 7 N -4.76 0.42 -3.78 1.37 8.25 -1.26 -4.85 115.22 110.61 1fz8 n HIS 7 Ca -0.07 0.13 -0.26 0.00 -0.26 0.00 0.00 57.72 57.26 1fz8 n HIS 7 Cb 0.31 -0.83 -0.17 0.00 1.12 0.00 0.00 29.99 30.41 1fz8 n HIS 7 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1fz8 s SER 8 N -5.19 2.26 0.17 0.41 0.15 -1.26 -5.08 113.70 105.16 1fz8 s SER 8 Ca -0.06 -0.44 -0.12 0.00 0.70 0.00 0.00 55.95 56.03 1fz8 s SER 8 Cb 0.10 -0.58 0.01 0.00 -1.71 0.00 0.00 66.02 63.84 1fz8 s SER 8 CO 0.85 -0.23 0.38 0.54 1.20 0.00 0.00 173.24 175.97 1fz8 s ASN 9 N 1.87 -0.08 0.24 5.45 2.20 -1.26 -3.60 114.94 119.76 1fz8 s ASN 9 Ca 0.02 -0.70 -0.05 0.00 -0.94 0.00 0.00 52.86 51.19 1fz8 s ASN 9 Cb -0.14 0.49 0.38 0.00 -2.00 0.00 0.00 41.25 39.98 1fz8 s ASN 9 CO -0.07 -0.95 1.78 0.44 -2.94 0.00 0.00 177.10 175.36 1fz8 h ASP 10 N 2.41 0.48 0.20 3.54 3.32 -1.62 -1.77 116.42 122.99 1fz8 h ASP 10 Ca -0.31 0.07 -0.04 0.00 0.02 0.00 0.00 57.03 56.77 1fz8 h ASP 10 Cb 1.24 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.77 1fz8 h ASP 10 CO 0.44 0.26 -0.19 0.00 -1.72 0.00 0.00 179.24 178.03 1fz8 h THR 11 N 0.61 1.12 0.01 0.35 1.03 -1.98 0.02 112.91 114.07 1fz8 h THR 11 Ca 0.38 -0.65 -0.16 0.00 -0.01 0.00 0.00 66.41 65.97 1fz8 h THR 11 Cb 0.44 1.35 0.01 0.00 -1.07 0.00 0.00 68.15 68.88 1fz8 h THR 11 CO -0.29 0.18 -0.65 0.03 -0.01 0.00 0.00 175.52 174.79 1fz8 h ARG 12 N 0.00 0.42 0.00 0.00 3.08 -1.77 -2.61 114.38 113.50 1fz8 h ARG 12 Ca -0.00 -0.46 -0.02 0.00 0.07 0.00 0.00 59.98 59.57 1fz8 h ARG 12 Cb 0.34 0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.52 1fz8 h ARG 12 CO 0.02 1.13 -0.07 -0.44 -1.07 0.00 0.00 179.97 179.54 1fz8 h ASP 13 N -0.10 0.00 -0.00 7.04 3.32 -1.08 -1.56 116.42 124.04 1fz8 h ASP 13 Ca -0.08 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.97 1fz8 h ASP 13 Cb 1.36 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.91 1fz8 h ASP 13 CO 0.13 0.07 -0.00 0.00 -1.72 0.00 0.00 179.24 177.72 1fz8 h ALA 14 N 1.93 0.00 0.00 3.45 0.00 -0.87 -3.05 119.26 120.72 1fz8 h ALA 14 Ca -0.00 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 1fz8 h ALA 14 Cb 0.17 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1fz8 h ALA 14 CO 0.01 -0.30 -0.24 -1.49 0.00 0.00 0.00 179.25 177.23 1fz8 h TRP 15 N -0.38 0.00 -0.43 0.00 4.06 -1.01 -2.67 115.95 115.52 1fz8 h TRP 15 Ca 0.00 0.00 -0.14 0.00 2.06 0.00 0.00 58.89 60.81 1fz8 h TRP 15 Cb 0.39 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.54 1fz8 h TRP 15 CO 0.06 0.24 -0.27 -0.39 -3.56 0.00 0.00 178.44 174.52 1fz8 h VAL 16 N 0.00 1.27 0.00 1.49 -1.51 -1.28 -0.64 116.25 115.58 1fz8 h VAL 16 Ca -0.00 -1.43 -0.07 0.00 -1.23 0.00 0.00 66.70 63.96 1fz8 h VAL 16 Cb 0.63 1.26 -0.01 0.00 -2.13 0.00 0.00 31.29 31.04 1fz8 h VAL 16 CO 0.03 0.49 -0.34 0.78 -1.23 0.00 0.00 177.57 177.30 1fz8 h ASN 17 N 0.77 0.00 -0.15 4.19 4.21 -1.42 -1.77 115.58 121.41 1fz8 h ASN 17 Ca 0.09 0.00 -0.19 0.00 1.21 0.00 0.00 56.30 57.41 1fz8 h ASN 17 Cb 0.85 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 38.06 1fz8 h ASN 17 CO 0.08 0.34 -0.64 0.50 -1.29 0.00 0.00 177.43 176.42 1fz8 h LYS 18 N 0.00 0.70 -0.02 0.81 3.64 -1.10 -3.16 116.57 117.44 1fz8 h LYS 18 Ca -0.00 -0.55 -0.15 0.00 -1.27 0.00 0.00 60.65 58.68 1fz8 h LYS 18 Cb 0.72 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.63 1fz8 h LYS 18 CO 0.04 1.17 -0.68 -0.84 -2.27 0.00 0.00 179.45 176.87 1fz8 h ILE 19 N 0.39 1.46 0.00 2.00 3.07 -1.00 -2.77 117.51 120.65 1fz8 h ILE 19 Ca -0.04 -2.25 0.00 0.00 1.55 0.00 0.00 64.86 64.12 1fz8 h ILE 19 Cb 1.27 2.20 0.00 0.00 -0.27 0.00 0.00 36.82 40.02 1fz8 h ILE 19 CO 0.13 0.65 0.00 0.00 -1.05 0.00 0.00 178.15 177.88 1fz8 h ALA 20 N 1.24 1.00 0.00 0.16 0.00 -1.30 -0.10 119.26 120.26 1fz8 h ALA 20 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1fz8 h ALA 20 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1fz8 h ALA 20 CO 0.10 0.00 -0.41 1.96 0.00 0.00 0.00 179.25 180.90 1fz8 h GLN 21 N 0.00 0.00 -6.59 0.00 1.08 -1.45 -3.46 115.11 104.69 1fz8 h GLN 21 Ca 0.00 0.00 -0.53 0.00 -1.45 0.00 0.00 58.65 56.67 1fz8 h GLN 21 Cb 0.10 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 27.55 1fz8 h GLN 21 CO 0.00 0.00 0.62 -0.51 -0.95 0.00 0.00 178.83 177.99 1fz8 s LEU 22 N -4.58 4.40 -0.32 1.46 1.43 -0.05 -4.92 118.68 116.10 1fz8 s LEU 22 Ca 0.07 2.24 0.17 0.00 -1.03 0.00 0.00 54.13 55.58 1fz8 s LEU 22 Cb 0.12 -3.60 0.45 0.00 0.03 0.00 0.00 46.19 43.20 1fz8 s LEU 22 CO 0.68 -0.51 1.18 -0.46 0.23 0.00 0.00 176.35 177.47 1fz8 n ASN 23 N 3.28 0.38 -3.47 2.29 0.23 -1.26 -5.04 115.26 111.67 1fz8 n ASN 23 Ca 0.08 -2.37 0.01 0.00 -0.53 0.00 0.00 54.58 51.77 1fz8 n ASN 23 Cb 0.44 -0.03 -0.05 0.00 -2.08 0.00 0.00 39.78 38.07 1fz8 n ASN 23 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 1fz8 s THR 24 N -2.18 -0.37 0.50 5.53 2.01 -1.26 -5.01 115.64 114.87 1fz8 s THR 24 Ca 0.23 0.00 0.26 0.00 0.31 0.00 0.00 61.69 62.49 1fz8 s THR 24 Cb 0.40 -1.00 0.43 0.00 0.01 0.00 0.00 72.50 72.34 1fz8 s THR 24 CO -0.04 0.00 1.91 0.25 -0.69 0.00 0.00 174.62 176.05 1fz8 h LEU 25 N 7.09 0.12 0.62 4.42 5.85 -1.94 0.14 115.31 131.61 1fz8 h LEU 25 Ca -0.19 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.51 1fz8 h LEU 25 Cb 1.14 -0.01 0.01 0.00 0.37 0.00 0.00 40.66 42.16 1fz8 h LEU 25 CO 0.11 0.05 -0.30 -0.08 -0.34 0.00 0.00 178.44 177.89 1fz8 h GLU 26 N 0.12 -0.80 0.11 1.25 4.81 -1.95 0.25 114.58 118.38 1fz8 h GLU 26 Ca 0.39 0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.67 1fz8 h GLU 26 Cb 1.36 0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.92 1fz8 h GLU 26 CO -0.05 -0.49 -0.06 0.87 -0.73 0.00 0.00 179.01 178.56 1fz8 h LYS 27 N -1.00 -0.15 0.20 1.92 1.57 -1.65 -1.98 116.57 115.49 1fz8 h LYS 27 Ca -0.08 0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.72 1fz8 h LYS 27 Cb 0.68 0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.99 1fz8 h LYS 27 CO 0.14 -0.06 -0.41 0.00 -0.57 0.00 0.00 179.45 178.55 1fz8 h ALA 28 N 0.68 -0.78 -0.64 3.86 0.00 -0.79 0.37 119.26 121.97 1fz8 h ALA 28 Ca -0.02 -0.09 0.10 0.00 0.00 0.00 0.00 54.91 54.90 1fz8 h ALA 28 Cb 0.16 0.66 -0.08 0.00 0.00 0.00 0.00 17.79 18.53 1fz8 h ALA 28 CO 0.03 -1.00 0.23 0.00 0.00 0.00 0.00 179.25 178.51 1fz8 h ALA 29 N -0.25 0.83 -0.52 0.00 0.00 -0.50 -1.59 119.26 117.24 1fz8 h ALA 29 Ca 0.00 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1fz8 h ALA 29 Cb 0.69 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 1fz8 h ALA 29 CO -0.19 -0.20 0.26 1.49 0.00 0.00 0.00 179.25 180.61 1fz8 h GLU 30 N 0.41 0.74 0.00 0.00 4.57 -0.98 -1.65 114.58 117.66 1fz8 h GLU 30 Ca 0.33 -0.10 -0.04 0.00 -1.18 0.00 0.00 59.36 58.36 1fz8 h GLU 30 Cb 0.43 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.88 1fz8 h GLU 30 CO -0.33 0.60 -0.21 1.98 -1.18 0.00 0.00 179.01 179.86 1fz8 h MET 31 N 0.69 0.00 0.01 1.92 4.05 -0.18 -1.32 114.93 120.10 1fz8 h MET 31 Ca 0.18 0.00 -0.22 0.00 -0.28 0.00 0.00 59.70 59.38 1fz8 h MET 31 Cb 0.10 0.00 0.02 0.00 -0.80 0.00 0.00 31.60 30.92 1fz8 h MET 31 CO -0.02 0.21 -0.87 1.25 0.23 0.00 0.00 176.91 177.71 1fz8 h LEU 32 N 0.00 0.75 -0.20 3.39 5.85 -0.99 -0.85 115.31 123.25 1fz8 h LEU 32 Ca -0.00 -0.76 0.01 0.00 0.84 0.00 0.00 57.88 57.97 1fz8 h LEU 32 Cb 0.39 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 1fz8 h LEU 32 CO 0.03 1.41 0.10 0.50 -0.34 0.00 0.00 178.44 180.13 1fz8 h LYS 33 N 0.17 0.20 -0.37 1.25 1.63 -0.97 -1.15 116.57 117.33 1fz8 h LYS 33 Ca -0.11 -0.01 -0.14 0.00 -0.85 0.00 0.00 60.65 59.54 1fz8 h LYS 33 Cb 1.55 -0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 33.12 1fz8 h LYS 33 CO 0.17 0.13 -0.32 0.37 -3.45 0.00 0.00 179.45 176.35 1fz8 h GLN 34 N 0.21 0.82 -0.77 1.90 5.75 -1.31 -2.51 115.11 119.20 1fz8 h GLN 34 Ca 0.08 -0.39 0.02 0.00 -0.15 0.00 0.00 58.65 58.22 1fz8 h GLN 34 Cb 0.02 -0.01 -0.04 0.00 1.07 0.00 0.00 27.48 28.52 1fz8 h GLN 34 CO -0.06 1.02 0.51 0.35 -2.65 0.00 0.00 178.83 178.00 1fz8 h PHE 35 N 0.69 0.94 0.00 3.99 3.57 -0.76 -0.86 116.94 124.51 1fz8 h PHE 35 Ca 0.07 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.48 1fz8 h PHE 35 Cb 0.87 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 39.28 1fz8 h PHE 35 CO 0.05 0.57 -0.57 0.00 -2.23 0.00 0.00 178.31 176.13 1fz8 h ARG 36 N 1.00 0.00 -0.09 1.11 3.08 -1.05 -1.25 114.38 117.17 1fz8 h ARG 36 Ca 0.30 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 60.14 1fz8 h ARG 36 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.01 1fz8 h ARG 36 CO -0.08 0.57 -0.77 0.52 -1.07 0.00 0.00 179.97 179.14 1fz8 h MET 37 N 0.00 0.54 0.11 0.04 2.86 -0.81 -3.03 114.93 114.64 1fz8 h MET 37 Ca -0.01 -0.45 -0.30 0.00 -2.06 0.00 0.00 59.70 56.88 1fz8 h MET 37 Cb 1.17 0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.92 1fz8 h MET 37 CO 0.07 1.08 -1.52 -0.44 1.06 0.00 0.00 176.91 177.16 1fz8 h ASP 38 N 0.36 0.36 -0.01 1.22 3.32 -1.15 -3.01 116.42 117.51 1fz8 h ASP 38 Ca -0.04 -0.50 0.00 0.00 0.02 0.00 0.00 57.03 56.50 1fz8 h ASP 38 Cb 1.37 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.80 1fz8 h ASP 38 CO 0.14 1.42 0.00 1.41 -1.72 0.00 0.00 179.24 180.49 1fz8 n HIS 39 N -3.43 0.01 -4.42 4.55 8.25 -0.48 -1.28 115.22 118.41 1fz8 n HIS 39 Ca -0.16 -0.05 -0.23 0.00 -0.26 0.00 0.00 57.72 57.02 1fz8 n HIS 39 Cb 1.04 -0.00 -0.10 0.00 1.12 0.00 0.00 29.99 32.04 1fz8 n HIS 39 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1fz8 s THR 40 N -0.33 2.25 0.20 1.59 -4.23 -1.14 -4.89 115.64 109.09 1fz8 s THR 40 Ca 0.04 -2.25 0.00 0.00 -1.18 0.00 0.00 61.69 58.30 1fz8 s THR 40 Cb 0.03 -2.17 0.00 0.00 1.34 0.00 0.00 72.50 71.69 1fz8 s THR 40 CO 0.04 -0.37 0.00 0.41 -0.54 0.00 0.00 174.62 174.16 1fz8 n THR 41 N -0.32 -0.65 0.15 3.99 -1.04 -1.26 -3.13 114.28 112.02 1fz8 n THR 41 Ca -0.08 0.41 0.02 0.00 -2.04 0.00 0.00 64.05 62.36 1fz8 n THR 41 Cb 0.59 -0.65 0.08 0.00 -1.82 0.00 0.00 70.33 68.53 1fz8 n THR 41 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1fz8 n PRO 42 N -2.32 0.03 -0.53 -2.82 -0.02 -1.26 -1.29 135.00 126.79 1fz8 n PRO 42 Ca -0.02 0.31 0.10 0.00 -2.02 0.00 0.00 63.50 61.87 1fz8 n PRO 42 Cb 0.20 -1.50 0.34 0.00 -0.02 0.00 0.00 33.50 32.51 1fz8 n PRO 42 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1fz8 n PHE 43 N -1.35 1.31 -1.67 6.00 3.72 -1.26 -5.01 117.46 119.20 1fz8 n PHE 43 Ca 0.01 -0.59 -0.37 0.00 -0.05 0.00 0.00 57.45 56.45 1fz8 n PHE 43 Cb 0.03 -0.18 0.06 0.00 -0.94 0.00 0.00 39.48 38.45 1fz8 n PHE 43 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 176.76 179.60 1fz8 n ARG 44 N 1.16 0.97 0.28 -1.08 1.85 -0.41 -4.88 116.66 114.55 1fz8 n ARG 44 Ca 0.25 0.38 0.16 0.00 -1.00 0.00 0.00 57.85 57.64 1fz8 n ARG 44 Cb 0.81 -2.33 0.81 0.00 -1.05 0.00 0.00 32.46 30.70 1fz8 n ARG 44 CO 0.00 0.00 0.00 -0.91 -0.01 0.00 0.00 177.63 176.71 1fz8 h ASN 45 N 0.47 0.00 -5.17 2.89 -0.26 -1.05 -3.46 115.58 109.00 1fz8 h ASN 45 Ca -0.50 0.00 0.14 0.00 -0.56 0.00 0.00 56.30 55.39 1fz8 h ASN 45 Cb 1.35 0.00 -0.09 0.00 -1.06 0.00 0.00 38.32 38.53 1fz8 h ASN 45 CO 0.52 0.06 0.44 -0.94 -1.06 0.00 0.00 177.43 176.44 1fz8 s SER 46 N -5.77 -0.23 -0.17 5.81 1.04 -0.96 -5.04 113.70 108.37 1fz8 s SER 46 Ca -0.02 -0.36 0.17 0.00 0.48 0.00 0.00 55.95 56.22 1fz8 s SER 46 Cb 0.11 0.51 0.45 0.00 0.10 0.00 0.00 66.02 67.20 1fz8 s SER 46 CO 0.53 -0.93 1.33 -1.22 0.98 0.00 0.00 173.24 173.94 1fz8 n TYR 47 N -0.43 0.64 -0.03 5.02 4.02 -1.26 -4.60 117.16 120.52 1fz8 n TYR 47 Ca -0.07 -0.94 0.01 0.00 -0.01 0.00 0.00 57.90 56.89 1fz8 n TYR 47 Cb 0.61 -0.27 0.33 0.00 -0.02 0.00 0.00 39.34 39.99 1fz8 n TYR 47 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 176.86 176.90 1fz8 h GLU 48 N 1.19 0.59 -0.56 -0.72 4.11 -1.96 -2.64 114.58 114.59 1fz8 h GLU 48 Ca 0.01 -0.08 0.00 0.00 0.07 0.00 0.00 59.36 59.35 1fz8 h GLU 48 Cb 1.31 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1fz8 h GLU 48 CO 0.15 0.50 0.00 1.28 0.07 0.00 0.00 179.01 181.02 1fz8 n LEU 49 N -4.36 5.40 -0.33 3.06 4.77 -1.26 -4.70 117.00 119.58 1fz8 n LEU 49 Ca 0.03 -2.86 0.23 0.00 -0.03 0.00 0.00 56.01 53.38 1fz8 n LEU 49 Cb 0.16 -0.65 0.46 0.00 -2.33 0.00 0.00 43.42 41.05 1fz8 n LEU 49 CO 0.37 0.67 1.06 -0.78 -1.33 0.00 0.00 177.39 177.38 1fz8 h ASP 50 N 3.79 0.35 -0.07 -1.43 3.58 -1.81 0.40 116.42 121.22 1fz8 h ASP 50 Ca 0.00 0.21 0.00 0.00 0.42 0.00 0.00 57.03 57.66 1fz8 h ASP 50 Cb 1.84 0.20 0.00 0.00 1.72 0.00 0.00 39.33 43.09 1fz8 h ASP 50 CO 0.42 -0.21 0.00 0.59 -2.88 0.00 0.00 179.24 177.16 1fz8 n ASN 51 N -5.14 1.27 0.00 2.28 3.02 -1.26 -4.33 115.26 111.11 1fz8 n ASN 51 Ca 0.31 -1.53 0.00 0.00 -0.03 0.00 0.00 54.58 53.33 1fz8 n ASN 51 Cb 0.99 -0.04 0.00 0.00 -0.61 0.00 0.00 39.78 40.12 1fz8 n ASN 51 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1fz8 n ASP 52 N 0.03 0.00 -0.27 6.41 8.00 0.03 -4.89 116.55 125.85 1fz8 n ASP 52 Ca 0.18 0.00 0.13 0.00 0.71 0.00 0.00 54.79 55.81 1fz8 n ASP 52 Cb 0.29 0.00 0.39 0.00 -0.02 0.00 0.00 41.12 41.78 1fz8 n ASP 52 CO 0.00 0.00 0.00 0.10 -0.39 0.00 0.00 177.20 176.91 1fz8 h TYR 53 N 0.00 0.80 -0.12 1.24 -0.00 -0.51 -0.75 116.97 117.62 1fz8 h TYR 53 Ca 0.00 0.02 -0.00 0.00 0.00 0.00 0.00 58.73 58.75 1fz8 h TYR 53 Cb 0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 36.73 36.47 1fz8 h TYR 53 CO 0.00 0.28 0.08 -0.07 -0.00 0.00 0.00 178.16 178.44 1fz8 h LEU 54 N 0.66 0.14 -0.37 0.10 3.38 -1.86 0.95 115.31 118.32 1fz8 h LEU 54 Ca 0.46 -0.03 -0.09 0.00 0.09 0.00 0.00 57.88 58.31 1fz8 h LEU 54 Cb 0.79 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 1fz8 h LEU 54 CO -0.21 0.14 -0.11 -0.25 0.09 0.00 0.00 178.44 178.09 1fz8 h TRP 55 N 0.14 0.83 -0.43 1.13 7.01 -1.74 -2.99 115.95 119.89 1fz8 h TRP 55 Ca 0.04 -0.18 -0.05 0.00 2.11 0.00 0.00 58.89 60.81 1fz8 h TRP 55 Cb 0.02 -0.20 -0.02 0.00 -2.10 0.00 0.00 29.16 26.86 1fz8 h TRP 55 CO -0.06 0.89 0.07 0.82 -2.79 0.00 0.00 178.44 177.37 1fz8 h ILE 56 N 0.53 1.24 -0.57 2.65 2.04 -1.03 -2.39 117.51 119.99 1fz8 h ILE 56 Ca 0.09 -0.89 0.09 0.00 1.00 0.00 0.00 64.86 65.16 1fz8 h ILE 56 Cb 0.63 0.98 -0.07 0.00 -0.74 0.00 0.00 36.82 37.62 1fz8 h ILE 56 CO 0.04 0.31 0.18 -0.08 0.00 0.00 0.00 178.15 178.60 1fz8 h GLU 57 N 0.58 0.34 -0.65 2.37 4.81 -0.81 -0.64 114.58 120.57 1fz8 h GLU 57 Ca 0.13 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.30 1fz8 h GLU 57 Cb 0.38 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.65 1fz8 h GLU 57 CO 0.01 0.23 0.26 0.00 -0.73 0.00 0.00 179.01 178.77 1fz8 h ALA 58 N 1.41 0.85 0.00 2.92 0.00 -1.37 0.16 119.26 123.23 1fz8 h ALA 58 Ca 0.29 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1fz8 h ALA 58 Cb 0.36 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1fz8 h ALA 58 CO -0.31 0.47 0.00 0.87 0.00 0.00 0.00 179.25 180.28 1fz8 h LYS 59 N 0.92 0.00 0.10 0.00 1.79 -0.82 -1.68 116.57 116.88 1fz8 h LYS 59 Ca 0.22 0.00 -0.32 0.00 -2.18 0.00 0.00 60.65 58.36 1fz8 h LYS 59 Cb 0.21 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.85 1fz8 h LYS 59 CO -0.02 0.00 -1.72 1.25 -1.08 0.00 0.00 179.45 177.88 1fz8 h LEU 60 N 0.00 0.33 -1.00 2.94 5.85 -0.01 -3.31 115.31 120.12 1fz8 h LEU 60 Ca 0.00 -0.58 -0.05 0.00 0.84 0.00 0.00 57.88 58.09 1fz8 h LEU 60 Cb 0.30 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.20 1fz8 h LEU 60 CO 0.00 1.50 0.14 -0.33 -0.34 0.00 0.00 178.44 179.41 1fz8 h GLU 61 N 0.06 0.87 0.29 1.25 5.08 0.09 -2.50 114.58 119.70 1fz8 h GLU 61 Ca -0.31 -0.18 -0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1fz8 h GLU 61 Cb 2.03 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 31.14 1fz8 h GLU 61 CO 0.12 0.78 -0.22 0.93 -1.00 0.00 0.00 179.01 179.62 1fz8 h GLU 62 N 0.83 -0.49 -0.38 2.33 5.08 -1.46 0.16 114.58 120.66 1fz8 h GLU 62 Ca 0.18 0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.64 1fz8 h GLU 62 Cb 0.30 0.11 -0.05 0.00 0.50 0.00 0.00 28.75 29.61 1fz8 h GLU 62 CO -0.00 -0.33 0.05 -0.22 -1.00 0.00 0.00 179.01 177.52 1fz8 h LYS 63 N -0.51 0.17 -0.75 2.33 1.63 -1.61 -0.59 116.57 117.24 1fz8 h LYS 63 Ca -0.02 -0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 59.77 1fz8 h LYS 63 Cb 0.44 -0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 32.00 1fz8 h LYS 63 CO -0.00 0.11 0.45 0.28 -3.45 0.00 0.00 179.45 176.84 1fz8 h VAL 64 N 0.17 1.21 -0.02 2.00 2.07 -1.21 -1.94 116.25 118.54 1fz8 h VAL 64 Ca 0.18 -0.47 -0.00 0.00 0.82 0.00 0.00 66.70 67.23 1fz8 h VAL 64 Cb 0.23 0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 30.16 1fz8 h VAL 64 CO -0.26 0.22 0.01 0.00 0.02 0.00 0.00 177.57 177.56 1fz8 h ALA 65 N 1.24 0.02 0.43 1.67 0.00 0.12 -0.49 119.26 122.25 1fz8 h ALA 65 Ca 0.27 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1fz8 h ALA 65 Cb -0.04 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1fz8 h ALA 65 CO -0.05 -0.44 -0.36 0.28 0.00 0.00 0.00 179.25 178.69 1fz8 h VAL 66 N -0.07 0.27 -0.90 0.00 2.07 -1.00 -1.44 116.25 115.18 1fz8 h VAL 66 Ca 0.01 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.67 1fz8 h VAL 66 Cb 0.09 0.27 -0.07 0.00 -1.52 0.00 0.00 31.29 30.06 1fz8 h VAL 66 CO -0.00 0.00 0.58 -0.07 0.02 0.00 0.00 177.57 178.10 1fz8 h LEU 67 N -0.79 0.68 -1.26 2.57 3.38 -1.33 0.57 115.31 119.13 1fz8 h LEU 67 Ca -0.04 0.04 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 1fz8 h LEU 67 Cb 0.68 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1fz8 h LEU 67 CO -0.02 0.35 -0.36 0.50 0.09 0.00 0.00 178.44 179.00 1fz8 h LYS 68 N 0.72 0.02 0.10 1.13 3.64 -0.59 -1.97 116.57 119.62 1fz8 h LYS 68 Ca 0.45 -0.01 -0.29 0.00 -1.27 0.00 0.00 60.65 59.53 1fz8 h LYS 68 Cb 0.69 -0.00 0.03 0.00 -0.41 0.00 0.00 32.23 32.54 1fz8 h LYS 68 CO -0.21 0.38 -1.21 0.00 -2.27 0.00 0.00 179.45 176.14 1fz8 h ALA 69 N 1.63 0.01 0.00 5.00 0.00 0.13 -0.99 119.26 125.03 1fz8 h ALA 69 Ca -0.00 -0.76 0.00 0.00 0.00 0.00 0.00 54.91 54.15 1fz8 h ALA 69 Cb 0.64 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1fz8 h ALA 69 CO 0.05 0.68 0.00 0.54 0.00 0.00 0.00 179.25 180.51 1fz8 n ARG 70 N -3.81 0.10 -0.03 0.00 1.74 -0.51 -4.20 116.66 109.95 1fz8 n ARG 70 Ca -0.13 0.10 -0.05 0.00 -0.77 0.00 0.00 57.85 57.00 1fz8 n ARG 70 Cb 0.97 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.89 1fz8 n ARG 70 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1fz8 n ALA 71 N -1.43 1.80 -1.05 7.54 0.00 -0.76 -5.04 120.51 121.56 1fz8 n ALA 71 Ca 0.07 -0.44 -0.33 0.00 0.00 0.00 0.00 53.44 52.74 1fz8 n ALA 71 Cb 0.24 0.12 0.13 0.00 0.00 0.00 0.00 19.45 19.94 1fz8 n ALA 71 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1fz8 s PHE 72 N -2.44 1.84 0.28 0.00 2.99 -0.38 -5.05 117.98 115.21 1fz8 s PHE 72 Ca -0.15 1.69 0.01 0.00 0.00 0.00 0.00 56.93 58.47 1fz8 s PHE 72 Cb 0.02 -3.42 0.05 0.00 0.00 0.00 0.00 43.02 39.67 1fz8 s PHE 72 CO 0.23 -2.74 0.38 0.27 -0.00 0.00 0.00 175.22 173.36 1fz8 n ASN 73 N -3.45 0.61 -0.04 1.36 0.23 -1.26 -4.79 115.26 107.92 1fz8 n ASN 73 Ca 0.13 -1.49 -0.11 0.00 -0.53 0.00 0.00 54.58 52.57 1fz8 n ASN 73 Cb 0.51 -0.24 -0.05 0.00 -2.08 0.00 0.00 39.78 37.92 1fz8 n ASN 73 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1fz8 h GLU 74 N 0.00 0.23 -0.26 -3.83 5.08 -1.97 -0.51 114.58 113.33 1fz8 h GLU 74 Ca -0.13 -0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.10 1fz8 h GLU 74 Cb 0.49 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1fz8 h GLU 74 CO 0.15 0.31 -0.24 0.28 -1.00 0.00 0.00 179.01 178.50 1fz8 h VAL 75 N 0.10 1.26 0.04 3.13 2.07 -1.99 -2.93 116.25 117.93 1fz8 h VAL 75 Ca 0.05 -1.26 -0.00 0.00 0.82 0.00 0.00 66.70 66.31 1fz8 h VAL 75 Cb 0.17 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 1fz8 h VAL 75 CO -0.00 0.40 -0.02 0.44 0.02 0.00 0.00 177.57 178.41 1fz8 h ASP 76 N 0.43 -0.04 -0.45 0.57 3.32 -1.92 -1.00 116.42 117.33 1fz8 h ASP 76 Ca 0.06 -0.61 0.13 0.00 0.02 0.00 0.00 57.03 56.63 1fz8 h ASP 76 Cb 0.66 0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.20 1fz8 h ASP 76 CO 0.05 0.62 0.46 0.15 -1.72 0.00 0.00 179.24 178.80 1fz8 h PHE 77 N -0.75 0.00 0.00 4.55 3.04 -1.11 0.65 116.94 123.32 1fz8 h PHE 77 Ca -0.01 0.00 -0.22 0.00 3.98 0.00 0.00 57.97 61.72 1fz8 h PHE 77 Cb 0.65 0.00 -0.04 0.00 2.56 0.00 0.00 35.95 39.12 1fz8 h PHE 77 CO 0.15 0.00 -1.82 0.54 -2.02 0.00 0.00 178.31 175.16 1fz8 n ARG 78 N -3.79 0.65 0.00 1.11 1.74 -1.11 -4.67 116.66 110.59 1fz8 n ARG 78 Ca 0.08 0.11 0.00 0.00 -0.77 0.00 0.00 57.85 57.28 1fz8 n ARG 78 Cb 0.64 -1.69 0.00 0.00 -1.02 0.00 0.00 32.46 30.40 1fz8 n ARG 78 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1fz8 n HIS 79 N -2.79 0.00 -4.36 -1.55 8.25 -0.14 -4.86 115.22 109.77 1fz8 n HIS 79 Ca -0.17 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.02 1fz8 n HIS 79 Cb 0.93 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.91 1fz8 n HIS 79 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1fz8 s LYS 80 N -0.80 1.32 0.69 -0.41 1.02 0.21 -0.72 119.74 121.05 1fz8 s LYS 80 Ca 0.00 -1.30 -0.11 0.00 0.02 0.00 0.00 55.97 54.59 1fz8 s LYS 80 Cb 0.00 -1.74 0.01 0.00 -0.52 0.00 0.00 37.83 35.58 1fz8 s LYS 80 CO 0.00 0.41 1.06 0.95 -0.92 0.00 0.00 175.35 176.85 1fz8 s THR 81 N -1.11 4.02 0.24 2.17 -4.23 0.55 -4.64 115.64 112.64 1fz8 s THR 81 Ca 0.12 0.65 0.30 0.00 -1.18 0.00 0.00 61.69 61.58 1fz8 s THR 81 Cb -0.10 -3.45 0.30 0.00 1.34 0.00 0.00 72.50 70.59 1fz8 s THR 81 CO 0.06 -0.86 1.90 0.00 -0.54 0.00 0.00 174.62 175.18 1fz8 h ALA 82 N -0.69 1.06 0.00 3.99 0.00 -1.32 0.13 119.26 122.44 1fz8 h ALA 82 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1fz8 h ALA 82 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1fz8 h ALA 82 CO 0.58 -0.06 -0.94 1.19 0.00 0.00 0.00 179.25 180.02 1fz8 n PHE 83 N -2.60 0.76 0.00 0.00 0.99 -1.26 -4.85 117.46 110.49 1fz8 n PHE 83 Ca -0.02 0.22 0.00 0.00 -0.00 0.00 0.00 57.45 57.65 1fz8 n PHE 83 Cb 0.12 -0.81 0.00 0.00 -1.00 0.00 0.00 39.48 37.80 1fz8 n PHE 83 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1fz8 n GLY 84 N 1.25 2.22 3.59 1.37 0.00 0.47 -5.09 105.19 109.00 1fz8 n GLY 84 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 1fz8 n GLY 84 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1fz8 n GLU 85 N -0.50 0.46 -3.09 1.61 1.02 -1.26 -4.60 120.64 114.28 1fz8 n GLU 85 Ca 0.00 0.21 -0.42 0.00 -0.02 0.00 0.00 57.16 56.93 1fz8 n GLU 85 Cb 0.00 -2.16 -0.06 0.00 -0.02 0.00 0.00 31.44 29.19 1fz8 n GLU 85 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1fz8 s ASP 86 N -1.62 6.39 0.13 1.62 -1.08 -1.26 -0.33 116.67 120.51 1fz8 s ASP 86 Ca 0.72 -0.03 -0.25 0.00 -0.52 0.00 0.00 52.55 52.47 1fz8 s ASP 86 Cb -0.34 -2.33 -0.06 0.00 -1.46 0.00 0.00 42.92 38.73 1fz8 s ASP 86 CO 0.52 -0.69 1.43 0.00 0.52 0.00 0.00 175.17 176.94 1fz8 h ALA 87 N 8.65 -0.44 -0.71 3.66 0.00 -1.25 0.14 119.26 129.31 1fz8 h ALA 87 Ca -0.26 0.09 0.14 0.00 0.00 0.00 0.00 54.91 54.89 1fz8 h ALA 87 Cb 1.10 1.30 -0.04 0.00 0.00 0.00 0.00 17.79 20.14 1fz8 h ALA 87 CO 0.87 -0.77 0.48 -0.22 0.00 0.00 0.00 179.25 179.61 1fz8 h LYS 88 N -0.00 0.36 0.91 0.00 3.64 -1.94 -0.17 116.57 119.36 1fz8 h LYS 88 Ca 0.13 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.44 1fz8 h LYS 88 Cb 0.33 -0.08 0.01 0.00 -0.41 0.00 0.00 32.23 32.08 1fz8 h LYS 88 CO -0.74 0.23 -0.44 0.77 -2.27 0.00 0.00 179.45 177.01 1fz8 h SER 89 N 0.37 -1.03 -0.33 4.20 0.02 -1.36 0.53 113.55 115.95 1fz8 h SER 89 Ca 0.35 0.04 0.07 0.00 -0.84 0.00 0.00 61.79 61.40 1fz8 h SER 89 Cb 0.83 0.27 -0.07 0.00 0.14 0.00 0.00 62.40 63.57 1fz8 h SER 89 CO -0.10 -0.73 -0.17 0.58 -1.14 0.00 0.00 176.83 175.28 1fz8 h VAL 90 N -1.24 0.50 -0.17 2.27 2.07 -0.93 0.24 116.25 118.99 1fz8 h VAL 90 Ca -0.12 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.45 1fz8 h VAL 90 Cb 0.94 0.50 -0.06 0.00 -1.52 0.00 0.00 31.29 31.14 1fz8 h VAL 90 CO 0.21 0.00 -0.28 0.25 0.02 0.00 0.00 177.57 177.77 1fz8 h LEU 91 N -0.12 -0.86 -1.44 2.57 5.85 -0.95 -0.13 115.31 120.24 1fz8 h LEU 91 Ca 0.17 0.14 -0.06 0.00 0.84 0.00 0.00 57.88 58.97 1fz8 h LEU 91 Cb 0.37 0.38 -0.01 0.00 0.37 0.00 0.00 40.66 41.78 1fz8 h LEU 91 CO -0.40 -0.32 -0.24 0.44 -0.34 0.00 0.00 178.44 177.59 1fz8 h ASP 92 N -0.33 0.07 -0.09 1.25 5.19 -0.36 -2.67 116.42 119.48 1fz8 h ASP 92 Ca 0.11 -0.02 -0.11 0.00 -0.62 0.00 0.00 57.03 56.40 1fz8 h ASP 92 Cb 0.50 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 39.99 1fz8 h ASP 92 CO -0.35 0.31 -0.36 1.23 -3.12 0.00 0.00 179.24 176.94 1fz8 h GLY 93 N 0.79 0.45 1.18 2.75 0.00 -0.17 -2.88 103.07 105.19 1fz8 h GLY 93 Ca 0.01 -0.61 -0.02 0.00 0.00 0.00 0.00 47.33 46.71 1fz8 h GLY 93 CO 0.03 0.55 0.42 -0.84 0.00 0.00 0.00 176.54 176.69 1fz8 h THR 94 N -0.03 1.23 -0.18 4.70 2.02 -0.95 -1.85 112.91 117.85 1fz8 h THR 94 Ca -0.02 -0.59 -0.09 0.00 0.77 0.00 0.00 66.41 66.49 1fz8 h THR 94 Cb 1.00 0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.59 1fz8 h THR 94 CO 0.08 0.26 -0.28 0.58 0.37 0.00 0.00 175.52 176.52 1fz8 h VAL 95 N 1.08 1.26 -0.15 3.16 2.07 -1.53 -1.40 116.25 120.75 1fz8 h VAL 95 Ca 0.27 -1.26 -0.02 0.00 0.82 0.00 0.00 66.70 66.52 1fz8 h VAL 95 Cb 0.04 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.25 1fz8 h VAL 95 CO -0.04 0.39 0.02 0.00 0.02 0.00 0.00 177.57 177.95 1fz8 h ALA 96 N 1.41 0.20 -0.80 1.67 0.00 -1.13 -0.79 119.26 119.82 1fz8 h ALA 96 Ca 0.04 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1fz8 h ALA 96 Cb 0.66 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 1fz8 h ALA 96 CO 0.05 -0.13 0.46 0.87 0.00 0.00 0.00 179.25 180.49 1fz8 h LYS 97 N 0.02 1.09 -0.15 0.00 1.57 -1.17 -2.11 116.57 115.83 1fz8 h LYS 97 Ca 0.04 -0.11 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 1fz8 h LYS 97 Cb 0.32 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 1fz8 h LYS 97 CO 0.00 0.78 0.01 1.98 -0.57 0.00 0.00 179.45 181.65 1fz8 h MET 98 N 1.10 0.26 0.00 3.15 4.05 -1.07 -0.03 114.93 122.40 1fz8 h MET 98 Ca 0.28 -0.08 0.00 0.00 -0.28 0.00 0.00 59.70 59.62 1fz8 h MET 98 Cb -0.01 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 30.77 1fz8 h MET 98 CO -0.05 0.47 0.00 0.09 0.23 0.00 0.00 176.91 177.66 1fz8 n ASN 99 N -4.77 0.00 -0.02 1.39 3.02 -0.32 -1.70 115.26 112.86 1fz8 n ASN 99 Ca -0.05 0.42 0.08 0.00 -0.03 0.00 0.00 54.58 55.01 1fz8 n ASN 99 Cb 0.21 -0.46 -0.17 0.00 -0.61 0.00 0.00 39.78 38.75 1fz8 n ASN 99 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1fz8 n ALA 100 N -1.46 2.65 -1.55 5.41 0.00 -0.81 -4.98 120.51 119.77 1fz8 n ALA 100 Ca 0.04 -0.62 -0.55 0.00 0.00 0.00 0.00 53.44 52.31 1fz8 n ALA 100 Cb 0.15 -0.68 -0.07 0.00 0.00 0.00 0.00 19.45 18.85 1fz8 n ALA 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fz8 n ALA 101 N -2.32 -2.06 0.09 0.00 0.00 -0.07 -4.86 120.51 111.30 1fz8 n ALA 101 Ca -0.07 0.55 -0.04 0.00 0.00 0.00 0.00 53.44 53.88 1fz8 n ALA 101 Cb 0.64 -1.95 -0.02 0.00 0.00 0.00 0.00 19.45 18.12 1fz8 n ALA 101 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1fz8 h LYS 102 N 3.93 0.00 -4.01 0.00 1.79 -1.90 -3.48 116.57 112.90 1fz8 h LYS 102 Ca -0.49 0.00 -0.20 0.00 -2.18 0.00 0.00 60.65 57.78 1fz8 h LYS 102 Cb 1.37 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 31.93 1fz8 h LYS 102 CO 0.73 0.81 -0.22 0.16 -1.08 0.00 0.00 179.45 179.85 1fz8 s ASP 103 N -6.68 0.47 0.39 0.86 3.84 -1.26 -5.05 116.67 109.25 1fz8 s ASP 103 Ca 0.01 -1.29 0.07 0.00 -0.00 0.00 0.00 52.55 51.35 1fz8 s ASP 103 Cb 0.10 0.60 0.79 0.00 -1.38 0.00 0.00 42.92 43.03 1fz8 s ASP 103 CO 0.79 -1.19 1.98 0.07 -0.00 0.00 0.00 175.17 176.81 1fz8 h LYS 104 N 2.22 0.43 -0.72 2.11 2.10 -1.92 0.19 116.57 120.98 1fz8 h LYS 104 Ca -0.29 -0.06 -0.06 0.00 -2.00 0.00 0.00 60.65 58.24 1fz8 h LYS 104 Cb 1.24 -0.08 -0.03 0.00 -0.90 0.00 0.00 32.23 32.46 1fz8 h LYS 104 CO 0.39 0.40 0.20 -1.49 -2.00 0.00 0.00 179.45 176.96 1fz8 h TRP 105 N 0.43 1.18 -0.09 0.07 4.06 -1.98 0.23 115.95 119.86 1fz8 h TRP 105 Ca 0.10 -0.13 -0.16 0.00 2.06 0.00 0.00 58.89 60.76 1fz8 h TRP 105 Cb 0.16 -0.34 0.01 0.00 -1.00 0.00 0.00 29.16 27.99 1fz8 h TRP 105 CO 0.00 0.95 -0.58 1.49 -3.56 0.00 0.00 178.44 176.74 1fz8 h GLU 106 N 1.09 0.55 -0.90 0.49 4.81 -1.84 -3.14 114.58 115.64 1fz8 h GLU 106 Ca 0.23 -0.47 -0.01 0.00 -0.13 0.00 0.00 59.36 58.97 1fz8 h GLU 106 Cb 0.34 0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.78 1fz8 h GLU 106 CO -0.00 1.10 0.51 0.00 -0.73 0.00 0.00 179.01 179.89 1fz8 h ALA 107 N 0.46 1.15 -0.26 2.92 0.00 -0.69 -2.52 119.26 120.32 1fz8 h ALA 107 Ca -0.05 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.66 1fz8 h ALA 107 Cb 1.23 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1fz8 h ALA 107 CO 0.12 0.64 -0.20 1.05 0.00 0.00 0.00 179.25 180.86 1fz8 h GLU 108 N 1.25 0.48 -0.21 0.00 4.11 -0.60 -2.51 114.58 117.11 1fz8 h GLU 108 Ca 0.32 -0.16 -0.16 0.00 0.07 0.00 0.00 59.36 59.43 1fz8 h GLU 108 Cb -0.00 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 1fz8 h GLU 108 CO -0.05 0.66 -0.51 -0.22 0.07 0.00 0.00 179.01 178.95 1fz8 h LYS 109 N 0.43 0.58 -0.24 1.06 1.63 -1.42 -2.02 116.57 116.58 1fz8 h LYS 109 Ca 0.07 -0.35 -0.02 0.00 -0.85 0.00 0.00 60.65 59.51 1fz8 h LYS 109 Cb 0.60 0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.25 1fz8 h LYS 109 CO 0.04 0.95 0.08 0.82 -3.45 0.00 0.00 179.45 177.90 1fz8 h ILE 110 N 0.45 1.18 0.49 2.00 2.04 -1.23 -1.58 117.51 120.87 1fz8 h ILE 110 Ca 0.02 -0.58 -0.02 0.00 1.00 0.00 0.00 64.86 65.27 1fz8 h ILE 110 Cb 1.05 1.12 0.00 0.00 -0.74 0.00 0.00 36.82 38.25 1fz8 h ILE 110 CO 0.10 0.19 -0.24 -0.74 0.00 0.00 0.00 178.15 177.46 1fz8 h HIS 111 N 0.23 -0.61 -0.49 1.37 2.76 -1.43 -1.83 115.15 115.14 1fz8 h HIS 111 Ca 0.08 -0.01 0.08 0.00 -2.20 0.00 0.00 60.37 58.31 1fz8 h HIS 111 Cb 0.21 0.20 -0.06 0.00 1.55 0.00 0.00 27.41 29.31 1fz8 h HIS 111 CO -0.00 -0.29 0.14 0.82 -1.30 0.00 0.00 177.93 177.29 1fz8 h ILE 112 N -0.91 0.78 -0.22 6.26 2.04 -1.42 -0.92 117.51 123.12 1fz8 h ILE 112 Ca -0.07 -0.10 -0.03 0.00 1.00 0.00 0.00 64.86 65.67 1fz8 h ILE 112 Cb 0.59 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 1fz8 h ILE 112 CO 0.11 0.05 0.02 1.23 0.00 0.00 0.00 178.15 179.56 1fz8 h GLY 113 N 0.29 0.34 1.02 5.37 0.00 -1.31 -2.21 103.07 106.57 1fz8 h GLY 113 Ca 0.24 -0.17 -0.03 0.00 0.00 0.00 0.00 47.33 47.37 1fz8 h GLY 113 CO -0.28 0.16 0.31 -2.75 0.00 0.00 0.00 176.54 173.98 1fz8 h PHE 114 N 0.31 1.04 -0.19 5.60 3.57 -0.29 -2.60 116.94 124.39 1fz8 h PHE 114 Ca 0.07 -0.07 -0.06 0.00 3.53 0.00 0.00 57.97 61.45 1fz8 h PHE 114 Cb 0.18 -0.32 -0.00 0.00 2.79 0.00 0.00 35.95 38.60 1fz8 h PHE 114 CO 0.00 0.79 -0.09 0.00 -2.23 0.00 0.00 178.31 176.78 1fz8 h ARG 115 N 0.99 0.41 0.00 1.11 3.08 -0.90 -0.21 114.38 118.86 1fz8 h ARG 115 Ca 0.24 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 1fz8 h ARG 115 Cb 0.17 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.20 1fz8 h ARG 115 CO -0.02 0.70 -0.05 1.96 -1.07 0.00 0.00 179.97 181.48 1fz8 h GLN 116 N 0.10 0.00 0.07 0.04 4.20 -1.38 -2.08 115.11 116.06 1fz8 h GLN 116 Ca 0.04 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.43 1fz8 h GLN 116 Cb 0.58 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.33 1fz8 h GLN 116 CO 0.03 0.05 -1.79 0.00 -0.67 0.00 0.00 178.83 176.46 1fz8 n ALA 117 N -2.44 0.89 0.19 3.87 0.00 -0.99 -4.69 120.51 117.34 1fz8 n ALA 117 Ca -0.03 -0.60 0.04 0.00 0.00 0.00 0.00 53.44 52.85 1fz8 n ALA 117 Cb 0.14 -0.57 0.07 0.00 0.00 0.00 0.00 19.45 19.08 1fz8 n ALA 117 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1fz8 n TYR 118 N -3.85 0.13 -1.64 0.00 4.02 -0.10 -4.84 117.16 110.89 1fz8 n TYR 118 Ca -0.34 -0.18 -0.48 0.00 -0.01 0.00 0.00 57.90 56.89 1fz8 n TYR 118 Cb 0.91 -0.01 -0.05 0.00 -0.02 0.00 0.00 39.34 40.17 1fz8 n TYR 118 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 1fz8 n LYS 119 N 0.43 1.73 -1.06 -0.72 4.81 -0.78 -1.46 118.16 121.11 1fz8 n LYS 119 Ca 0.07 0.62 -0.36 0.00 -0.87 0.00 0.00 58.31 57.78 1fz8 n LYS 119 Cb 0.28 -2.32 0.07 0.00 0.02 0.00 0.00 35.03 33.08 1fz8 n LYS 119 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1fz8 n PRO 120 N 2.84 0.02 0.00 1.64 -0.02 -1.25 -2.43 135.00 135.80 1fz8 n PRO 120 Ca 0.17 0.04 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 1fz8 n PRO 120 Cb 0.26 -1.53 0.00 0.00 -0.02 0.00 0.00 33.50 32.21 1fz8 n PRO 120 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1fz8 n PRO 121 N 0.08 0.79 0.00 0.52 -0.02 -1.26 -4.90 135.00 130.22 1fz8 n PRO 121 Ca 0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.54 1fz8 n PRO 121 Cb 0.52 -1.26 0.00 0.00 -0.02 0.00 0.00 33.50 32.74 1fz8 n PRO 121 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1fz8 n ILE 122 N -0.11 0.00 -2.91 4.25 2.08 -1.02 -4.42 119.36 117.24 1fz8 n ILE 122 Ca 0.00 0.83 -0.29 0.00 0.56 0.00 0.00 62.75 63.85 1fz8 n ILE 122 Cb 0.13 -1.64 -0.03 0.00 -0.75 0.00 0.00 39.64 37.36 1fz8 n ILE 122 CO 0.00 0.00 0.00 -0.32 0.56 0.00 0.00 176.55 176.79 1fz8 s MET 123 N -1.43 3.71 0.28 0.38 1.75 -0.54 -1.09 119.30 122.37 1fz8 s MET 123 Ca 0.00 0.33 -0.29 0.00 -1.25 0.00 0.00 55.69 54.48 1fz8 s MET 123 Cb 0.00 -2.44 -0.10 0.00 2.84 0.00 0.00 34.83 35.13 1fz8 s MET 123 CO 0.00 -0.02 1.31 -2.14 -0.65 0.00 0.00 175.02 173.52 1fz8 s PRO 124 N -3.95 4.37 0.25 4.11 0.02 -1.26 -3.96 135.00 134.59 1fz8 s PRO 124 Ca 0.49 2.16 -0.04 0.00 0.02 0.00 0.00 61.00 63.63 1fz8 s PRO 124 Cb -0.10 -3.11 0.50 0.00 0.02 0.00 0.00 34.50 31.80 1fz8 s PRO 124 CO 0.33 -0.20 1.69 -0.39 -0.33 0.00 0.00 177.00 178.10 1fz8 h VAL 125 N 3.28 0.53 -0.61 3.83 -1.51 -1.95 -0.37 116.25 119.45 1fz8 h VAL 125 Ca -0.47 -0.11 0.08 0.00 -1.23 0.00 0.00 66.70 64.96 1fz8 h VAL 125 Cb 1.22 0.19 -0.06 0.00 -2.13 0.00 0.00 31.29 30.51 1fz8 h VAL 125 CO 0.70 0.06 0.29 0.78 -1.23 0.00 0.00 177.57 178.16 1fz8 h ASN 126 N 0.31 0.37 -0.11 4.19 2.35 -1.95 0.21 115.58 120.95 1fz8 h ASN 126 Ca 0.43 0.05 -0.23 0.00 -0.55 0.00 0.00 56.30 56.01 1fz8 h ASN 126 Cb 0.74 -0.01 0.01 0.00 0.05 0.00 0.00 38.32 39.12 1fz8 h ASN 126 CO -0.50 0.23 -0.83 1.88 -1.65 0.00 0.00 177.43 176.56 1fz8 h TYR 127 N 0.52 1.05 0.23 1.19 -1.99 -1.79 -2.61 116.97 113.58 1fz8 h TYR 127 Ca 0.29 -0.49 0.00 0.00 2.00 0.00 0.00 58.73 60.53 1fz8 h TYR 127 Cb 0.28 -0.15 -0.02 0.00 2.00 0.00 0.00 36.73 38.84 1fz8 h TYR 127 CO -0.12 1.33 -0.22 0.35 -0.00 0.00 0.00 178.16 179.50 1fz8 h PHE 128 N 0.48 -0.57 0.00 4.88 3.57 -0.31 0.34 116.94 125.33 1fz8 h PHE 128 Ca -0.07 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.43 1fz8 h PHE 128 Cb 1.47 0.22 0.00 0.00 2.79 0.00 0.00 35.95 40.43 1fz8 h PHE 128 CO 0.09 -0.32 0.00 -0.07 -2.23 0.00 0.00 178.31 175.78 1fz8 h LEU 129 N -0.47 0.00 -0.21 0.59 3.38 -0.71 -1.19 115.31 116.70 1fz8 h LEU 129 Ca -0.01 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.75 1fz8 h LEU 129 Cb 0.44 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.19 1fz8 h LEU 129 CO -0.04 0.00 -0.73 -0.78 0.09 0.00 0.00 178.44 176.97 1fz8 h ASP 130 N 0.00 0.92 0.67 -0.43 3.58 -0.94 -2.71 116.42 117.51 1fz8 h ASP 130 Ca 0.00 -0.58 -0.13 0.00 0.42 0.00 0.00 57.03 56.74 1fz8 h ASP 130 Cb 0.47 -0.27 -0.02 0.00 1.72 0.00 0.00 39.33 41.23 1fz8 h ASP 130 CO 0.00 1.38 -0.62 1.23 -2.88 0.00 0.00 179.24 178.35 1fz8 h GLY 131 N 0.64 0.00 1.02 -0.78 0.00 -0.26 -3.05 103.07 100.64 1fz8 h GLY 131 Ca -0.04 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.29 1fz8 h GLY 131 CO 0.15 0.00 0.54 -2.09 0.00 0.00 0.00 176.54 175.15 1fz8 h GLU 132 N 0.00 1.20 -0.15 4.80 4.57 -1.06 0.30 114.58 124.25 1fz8 h GLU 132 Ca -0.01 -0.10 -0.15 0.00 -1.18 0.00 0.00 59.36 57.92 1fz8 h GLU 132 Cb 1.12 -0.25 -0.01 0.00 -0.16 0.00 0.00 28.75 29.45 1fz8 h GLU 132 CO 0.08 0.84 -0.55 0.07 -1.18 0.00 0.00 179.01 178.27 1fz8 h ARG 133 N 1.22 0.45 0.03 1.92 0.11 -1.40 -2.17 114.38 114.55 1fz8 h ARG 133 Ca 0.32 -0.29 -0.04 0.00 0.10 0.00 0.00 59.98 60.07 1fz8 h ARG 133 Cb -0.06 0.03 0.00 0.00 1.11 0.00 0.00 29.97 31.05 1fz8 h ARG 133 CO -0.06 0.89 -0.17 1.96 0.10 0.00 0.00 179.97 182.68 1fz8 h GLN 134 N 0.35 0.06 0.10 0.08 4.20 -1.37 -3.03 115.11 115.50 1fz8 h GLN 134 Ca 0.01 -0.10 -0.00 0.00 0.06 0.00 0.00 58.65 58.61 1fz8 h GLN 134 Cb 1.08 0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.89 1fz8 h GLN 134 CO 0.10 1.05 -0.05 -0.07 -0.67 0.00 0.00 178.83 179.19 1fz8 h LEU 135 N -0.87 -0.11 -1.22 1.46 3.38 -0.52 -2.61 115.31 114.83 1fz8 h LEU 135 Ca -0.03 -0.05 0.09 0.00 0.09 0.00 0.00 57.88 57.98 1fz8 h LEU 135 Cb 1.13 0.03 -0.06 0.00 0.09 0.00 0.00 40.66 41.85 1fz8 h LEU 135 CO 0.03 -0.02 0.57 1.23 0.09 0.00 0.00 178.44 180.34 1fz8 h GLY 136 N -0.19 1.25 0.96 0.83 0.00 -1.55 -0.25 103.07 104.12 1fz8 h GLY 136 Ca -0.01 -0.36 -0.01 0.00 0.00 0.00 0.00 47.33 46.94 1fz8 h GLY 136 CO 0.02 0.22 0.18 -0.84 0.00 0.00 0.00 176.54 176.13 1fz8 h THR 137 N 0.89 1.15 -0.37 4.70 2.02 -1.37 -1.44 112.91 118.49 1fz8 h THR 137 Ca 0.40 -0.40 -0.12 0.00 0.77 0.00 0.00 66.41 67.05 1fz8 h THR 137 Cb 0.37 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 1fz8 h THR 137 CO -0.16 0.15 -0.27 -0.09 0.37 0.00 0.00 175.52 175.52 1fz8 h ARG 138 N 0.44 0.76 -0.29 6.66 9.65 -1.02 -2.36 114.38 128.22 1fz8 h ARG 138 Ca 0.12 -0.33 -0.01 0.00 -1.10 0.00 0.00 59.98 58.66 1fz8 h ARG 138 Cb 0.08 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.62 1fz8 h ARG 138 CO -0.02 0.94 0.13 1.25 2.80 0.00 0.00 179.97 185.07 1fz8 h LEU 139 N 0.65 0.39 -0.67 3.80 5.85 -0.80 -2.84 115.31 121.69 1fz8 h LEU 139 Ca 0.08 -0.15 -0.12 0.00 0.84 0.00 0.00 57.88 58.54 1fz8 h LEU 139 Cb 0.79 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 1fz8 h LEU 139 CO 0.07 0.43 -0.22 0.24 -0.34 0.00 0.00 178.44 178.61 1fz8 h MET 140 N 0.32 0.80 -0.81 1.25 2.86 -1.24 -2.24 114.93 115.87 1fz8 h MET 140 Ca 0.10 -0.32 0.04 0.00 -2.06 0.00 0.00 59.70 57.45 1fz8 h MET 140 Cb 0.15 -0.04 -0.05 0.00 0.06 0.00 0.00 31.60 31.73 1fz8 h MET 140 CO -0.01 0.94 0.51 0.93 1.06 0.00 0.00 176.91 180.35 1fz8 h GLU 141 N 0.70 0.96 -0.07 1.72 5.08 -1.34 0.37 114.58 122.01 1fz8 h GLU 141 Ca 0.10 -0.06 -0.12 0.00 -1.00 0.00 0.00 59.36 58.28 1fz8 h GLU 141 Cb 0.74 -0.22 0.01 0.00 0.50 0.00 0.00 28.75 29.78 1fz8 h GLU 141 CO 0.06 0.64 -0.41 -0.07 -1.00 0.00 0.00 179.01 178.23 1fz8 h LEU 142 N 0.99 0.48 -0.13 1.33 3.38 -1.43 -3.29 115.31 116.64 1fz8 h LEU 142 Ca 0.33 -0.66 -0.02 0.00 0.09 0.00 0.00 57.88 57.62 1fz8 h LEU 142 Cb 0.03 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1fz8 h LEU 142 CO -0.12 1.06 0.02 0.03 0.09 0.00 0.00 178.44 179.52 1fz8 h ARG 143 N -0.07 0.22 0.00 1.13 3.08 -1.22 -3.21 114.38 114.31 1fz8 h ARG 143 Ca -0.03 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.96 1fz8 h ARG 143 Cb 1.06 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.09 1fz8 h ARG 143 CO 0.08 0.42 0.00 0.09 -1.07 0.00 0.00 179.97 179.49 1fz8 n ASN 144 N -4.81 0.00 -4.62 7.04 3.02 0.10 -4.38 115.26 111.61 1fz8 n ASN 144 Ca -0.05 -0.47 -0.43 0.00 -0.03 0.00 0.00 54.58 53.60 1fz8 n ASN 144 Cb 0.18 -0.09 -0.02 0.00 -0.61 0.00 0.00 39.78 39.24 1fz8 n ASN 144 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1fz8 s LEU 145 N -2.17 3.88 -1.26 3.41 2.96 -1.21 -3.63 118.68 120.65 1fz8 s LEU 145 Ca 0.28 0.80 -0.01 0.00 -0.22 0.00 0.00 54.13 54.98 1fz8 s LEU 145 Cb 0.14 -3.48 -0.00 0.00 0.50 0.00 0.00 46.19 43.35 1fz8 s LEU 145 CO 0.27 -0.96 0.78 0.59 -1.32 0.00 0.00 176.35 175.71 1fz8 n ASN 146 N 7.07 -1.90 -0.34 3.68 3.02 -1.26 -4.88 115.26 120.65 1fz8 n ASN 146 Ca 0.11 -0.78 0.10 0.00 -0.03 0.00 0.00 54.58 53.98 1fz8 n ASN 146 Cb 0.48 -4.33 0.30 0.00 -0.61 0.00 0.00 39.78 35.62 1fz8 n ASN 146 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 1fz8 h TYR 147 N -1.83 1.04 -0.02 3.10 3.20 -1.76 -2.87 116.97 117.84 1fz8 h TYR 147 Ca -0.61 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.29 1fz8 h TYR 147 Cb 1.35 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 39.30 1fz8 h TYR 147 CO 0.44 0.34 -0.28 0.66 -1.64 0.00 0.00 178.16 177.68 1fz8 n TYR 148 N -4.65 0.00 -0.10 -3.82 4.02 -1.26 -4.57 117.16 106.77 1fz8 n TYR 148 Ca 0.20 0.00 -0.06 0.00 -0.01 0.00 0.00 57.90 58.04 1fz8 n TYR 148 Cb 0.46 -0.02 0.01 0.00 -0.02 0.00 0.00 39.34 39.77 1fz8 n TYR 148 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 1fz8 h ASP 149 N 2.86 -0.41 -2.90 7.72 5.19 -1.88 -3.41 116.42 123.59 1fz8 h ASP 149 Ca 0.00 0.12 -0.56 0.00 -0.62 0.00 0.00 57.03 55.96 1fz8 h ASP 149 Cb 0.77 0.25 -0.04 0.00 0.18 0.00 0.00 39.33 40.49 1fz8 h ASP 149 CO 0.00 -0.15 1.01 -0.89 -3.12 0.00 0.00 179.24 176.09 1fz8 s THR 150 N -6.20 3.99 0.56 0.35 2.01 -1.26 -5.00 115.64 110.09 1fz8 s THR 150 Ca -0.14 1.15 -0.20 0.00 0.31 0.00 0.00 61.69 62.81 1fz8 s THR 150 Cb 0.14 -3.89 -0.04 0.00 0.01 0.00 0.00 72.50 68.71 1fz8 s THR 150 CO 0.70 -0.27 1.26 -2.16 -0.69 0.00 0.00 174.62 173.47 1fz8 s PRO 151 N 4.09 3.10 0.28 4.92 0.04 -1.26 -4.66 135.00 141.51 1fz8 s PRO 151 Ca 0.62 1.99 0.02 0.00 0.04 0.00 0.00 61.00 63.67 1fz8 s PRO 151 Cb -0.23 -2.11 0.66 0.00 0.04 0.00 0.00 34.50 32.87 1fz8 s PRO 151 CO 0.23 -1.15 1.70 -0.07 0.04 0.00 0.00 177.00 177.75 1fz8 h LEU 152 N 1.23 0.26 -0.47 -3.56 3.38 -1.94 0.33 115.31 114.54 1fz8 h LEU 152 Ca -0.50 0.15 0.09 0.00 0.09 0.00 0.00 57.88 57.71 1fz8 h LEU 152 Cb 1.30 0.15 -0.08 0.00 0.09 0.00 0.00 40.66 42.11 1fz8 h LEU 152 CO 0.56 -0.00 -0.01 -0.33 0.09 0.00 0.00 178.44 178.75 1fz8 h GLU 153 N 0.38 0.10 -0.19 1.13 3.07 -2.00 0.11 114.58 117.18 1fz8 h GLU 153 Ca 0.53 -0.01 -0.20 0.00 -0.50 0.00 0.00 59.36 59.17 1fz8 h GLU 153 Cb 0.97 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.86 1fz8 h GLU 153 CO -0.52 0.06 -0.69 1.49 -1.40 0.00 0.00 179.01 177.95 1fz8 h GLU 154 N 0.10 0.76 -0.82 2.33 4.57 -1.62 -3.16 114.58 116.73 1fz8 h GLU 154 Ca 0.24 -0.57 0.01 0.00 -1.18 0.00 0.00 59.36 57.86 1fz8 h GLU 154 Cb 0.35 0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 29.00 1fz8 h GLU 154 CO -0.40 1.18 0.55 1.25 -1.18 0.00 0.00 179.01 180.41 1fz8 h LEU 155 N 0.54 0.94 -0.97 1.64 5.85 -0.17 -0.90 115.31 122.24 1fz8 h LEU 155 Ca -0.03 -0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.61 1fz8 h LEU 155 Cb 1.31 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 42.08 1fz8 h LEU 155 CO 0.14 0.68 0.10 0.03 -0.34 0.00 0.00 178.44 179.06 1fz8 h ARG 156 N 1.11 0.85 -0.29 1.25 3.08 -0.81 -0.69 114.38 118.88 1fz8 h ARG 156 Ca 0.30 -0.19 -0.13 0.00 0.07 0.00 0.00 59.98 60.03 1fz8 h ARG 156 Cb -0.12 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 29.80 1fz8 h ARG 156 CO -0.07 0.78 -0.37 0.87 -1.07 0.00 0.00 179.97 180.11 1fz8 h LYS 157 N 0.81 0.66 -0.28 0.04 1.57 -1.30 -0.13 116.57 117.93 1fz8 h LYS 157 Ca 0.17 -0.33 -0.05 0.00 -1.87 0.00 0.00 60.65 58.58 1fz8 h LYS 157 Cb 0.34 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 1fz8 h LYS 157 CO 0.00 0.93 -0.00 1.96 -0.57 0.00 0.00 179.45 181.77 1fz8 h GLN 158 N 0.55 0.49 0.00 3.15 4.20 -0.71 -2.51 115.11 120.28 1fz8 h GLN 158 Ca 0.05 -0.16 -0.06 0.00 0.06 0.00 0.00 58.65 58.54 1fz8 h GLN 158 Cb 0.89 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.62 1fz8 h GLN 158 CO 0.08 0.65 -0.30 -0.09 -0.67 0.00 0.00 178.83 178.50 1fz8 h ARG 159 N 0.28 0.00 -0.55 1.46 9.65 -1.06 -3.46 114.38 120.70 1fz8 h ARG 159 Ca 0.08 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.93 1fz8 h ARG 159 Cb 0.43 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.01 1fz8 h ARG 159 CO 0.01 0.30 -0.03 0.41 2.80 0.00 0.00 179.97 183.46 1fz8 n GLY 160 N -0.54 0.51 3.85 2.80 0.00 -0.12 -5.04 105.19 106.65 1fz8 n GLY 160 Ca -0.02 -0.77 -0.32 0.00 0.00 0.00 0.00 46.02 44.92 1fz8 n GLY 160 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fz8 s VAL 161 N -2.38 4.60 -0.55 1.61 0.11 -0.85 -5.01 120.40 117.93 1fz8 s VAL 161 Ca 0.01 1.06 -0.18 0.00 -2.93 0.00 0.00 61.98 59.94 1fz8 s VAL 161 Cb -0.01 -3.72 0.10 0.00 -1.53 0.00 0.00 36.38 31.22 1fz8 s VAL 161 CO 0.01 -0.62 0.60 -0.60 -3.33 0.00 0.00 175.10 171.16 1fz8 s ARG 162 N -3.97 3.04 -0.27 1.54 3.52 -1.26 -4.84 118.95 116.71 1fz8 s ARG 162 Ca 0.57 -1.33 -0.29 0.00 -0.13 0.00 0.00 55.73 54.55 1fz8 s ARG 162 Cb -0.10 -4.23 -0.03 0.00 -1.56 0.00 0.00 34.95 29.04 1fz8 s ARG 162 CO 0.31 -1.37 1.80 0.08 -0.81 0.00 0.00 175.30 175.31 1fz8 s VAL 163 N 2.30 3.47 -0.12 7.11 1.01 -1.26 -4.86 120.40 128.05 1fz8 s VAL 163 Ca 0.09 0.50 0.13 0.00 0.00 0.00 0.00 61.98 62.70 1fz8 s VAL 163 Cb -0.25 -3.57 -0.24 0.00 0.00 0.00 0.00 36.38 32.32 1fz8 s VAL 163 CO 0.07 -0.33 0.37 0.55 0.00 0.00 0.00 175.10 175.76 1fz8 n VAL 164 N 7.13 1.53 -3.63 2.92 3.14 -1.26 -4.99 118.33 123.17 1fz8 n VAL 164 Ca 0.22 -0.80 -0.11 0.00 -2.96 0.00 0.00 64.34 60.70 1fz8 n VAL 164 Cb 0.46 -0.88 -0.07 0.00 -1.06 0.00 0.00 33.84 32.29 1fz8 n VAL 164 CO 0.00 0.00 0.00 -2.28 -6.46 0.00 0.00 176.83 168.09 1fz8 s HIS 165 N -2.55 -0.90 -0.04 1.45 2.46 -1.26 -5.15 115.29 109.30 1fz8 s HIS 165 Ca -0.09 1.98 0.02 0.00 0.47 0.00 0.00 55.06 57.44 1fz8 s HIS 165 Cb 0.07 0.44 0.01 0.00 -0.13 0.00 0.00 32.58 32.97 1fz8 s HIS 165 CO 0.81 -0.44 -0.09 -0.51 -2.47 0.00 0.00 174.74 172.05 1fz8 s LEU 166 N 0.95 1.66 -0.11 8.88 1.43 -1.26 -5.13 118.68 125.10 1fz8 s LEU 166 Ca -0.04 -0.20 -0.04 0.00 -1.03 0.00 0.00 54.13 52.82 1fz8 s LEU 166 Cb -0.05 -0.59 0.05 0.00 0.03 0.00 0.00 46.19 45.64 1fz8 s LEU 166 CO -0.09 0.03 0.21 -1.58 0.23 0.00 0.00 176.35 175.16 1fz8 s GLN 167 N 0.43 0.10 -0.22 1.70 0.74 -1.26 -5.13 119.66 116.02 1fz8 s GLN 167 Ca -0.07 0.64 -0.04 0.00 0.05 0.00 0.00 55.36 55.94 1fz8 s GLN 167 Cb -0.11 -0.14 0.12 0.00 1.10 0.00 0.00 33.01 33.97 1fz8 s GLN 167 CO 0.01 -0.28 0.39 0.45 -0.55 0.00 0.00 175.29 175.31 1fz8 s SER 168 N 2.23 0.02 0.48 6.67 0.15 -1.26 -5.02 113.70 116.97 1fz8 s SER 168 Ca 0.01 0.55 0.28 0.00 0.70 0.00 0.00 55.95 57.49 1fz8 s SER 168 Cb -0.12 1.22 0.94 0.00 -1.71 0.00 0.00 66.02 66.35 1fz8 s SER 168 CO -0.07 -0.27 1.83 1.55 1.20 0.00 0.00 173.24 177.47 1fz8 h PRO 169 N 8.18 0.00 -0.01 5.44 0.13 -2.10 -3.58 132.00 140.06 1fz8 h PRO 169 Ca -0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.95 1fz8 h PRO 169 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1fz8 h PRO 169 CO 0.21 0.09 0.00 0.72 -0.23 0.00 0.00 178.00 178.79