#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fz9 s LEU 4 N 0.00 3.08 0.00 3.14 1.43 -1.26 -2.52 118.68 122.55 1fz9 s LEU 4 Ca 0.00 -1.06 0.00 0.00 -1.03 0.00 0.00 54.13 52.04 1fz9 s LEU 4 Cb 0.00 -1.51 0.00 0.00 0.03 0.00 0.00 46.19 44.71 1fz9 s LEU 4 CO 0.00 -0.67 0.00 0.61 0.23 0.00 0.00 176.35 176.52 1fz9 n GLY 5 N -1.39 3.98 0.30 -3.19 0.00 -1.24 -4.72 105.19 98.93 1fz9 n GLY 5 Ca -0.01 -0.79 -0.14 0.00 0.00 0.00 0.00 46.02 45.09 1fz9 n GLY 5 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1fz9 h ILE 6 N 5.00 0.29 0.00 -0.61 2.04 -2.00 -3.36 117.51 118.86 1fz9 h ILE 6 Ca 0.00 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.43 1fz9 h ILE 6 Cb 0.00 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 36.49 1fz9 h ILE 6 CO 0.00 0.05 -0.87 1.41 0.00 0.00 0.00 178.15 178.74 1fz9 n HIS 7 N -5.28 0.34 -3.71 1.37 8.25 -1.26 -4.89 115.22 110.05 1fz9 n HIS 7 Ca -0.11 0.10 -0.12 0.00 -0.26 0.00 0.00 57.72 57.33 1fz9 n HIS 7 Cb 0.32 -0.49 -0.13 0.00 1.12 0.00 0.00 29.99 30.81 1fz9 n HIS 7 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1fz9 s SER 8 N -3.96 -0.18 0.33 0.41 0.15 -1.26 -5.09 113.70 104.10 1fz9 s SER 8 Ca 0.05 0.62 -0.18 0.00 0.70 0.00 0.00 55.95 57.14 1fz9 s SER 8 Cb 0.14 0.56 0.05 0.00 -1.71 0.00 0.00 66.02 65.07 1fz9 s SER 8 CO 0.77 -0.19 0.81 0.54 1.20 0.00 0.00 173.24 176.37 1fz9 s ASN 9 N 1.58 -0.07 0.20 5.45 2.20 -1.26 -3.60 114.94 119.44 1fz9 s ASN 9 Ca -0.07 -0.92 -0.10 0.00 -0.94 0.00 0.00 52.86 50.82 1fz9 s ASN 9 Cb -0.10 0.76 0.18 0.00 -2.00 0.00 0.00 41.25 40.09 1fz9 s ASN 9 CO -0.09 -1.49 1.84 0.44 -2.94 0.00 0.00 177.10 174.85 1fz9 h ASP 10 N 2.00 0.67 -0.43 3.54 3.32 -1.85 -0.98 116.42 122.68 1fz9 h ASP 10 Ca -0.28 0.00 0.03 0.00 0.02 0.00 0.00 57.03 56.80 1fz9 h ASP 10 Cb 1.25 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 40.62 1fz9 h ASP 10 CO 0.35 0.46 0.23 0.74 -1.72 0.00 0.00 179.24 179.30 1fz9 h THR 11 N 0.80 1.00 -0.23 0.35 2.02 -1.97 0.13 112.91 115.01 1fz9 h THR 11 Ca 0.27 -0.16 -0.09 0.00 0.77 0.00 0.00 66.41 67.20 1fz9 h THR 11 Cb 0.04 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 66.93 1fz9 h THR 11 CO -0.11 0.09 -0.23 0.03 0.37 0.00 0.00 175.52 175.66 1fz9 h ARG 12 N 0.47 0.43 -0.42 6.66 3.08 -1.87 -2.24 114.38 120.49 1fz9 h ARG 12 Ca 0.18 -0.15 -0.08 0.00 0.07 0.00 0.00 59.98 60.01 1fz9 h ARG 12 Cb 0.06 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 1fz9 h ARG 12 CO -0.11 0.63 -0.04 -0.44 -1.07 0.00 0.00 179.97 178.95 1fz9 h ASP 13 N 0.38 0.75 -0.00 7.04 3.32 -0.51 -2.35 116.42 125.05 1fz9 h ASP 13 Ca 0.06 -0.33 0.03 0.00 0.02 0.00 0.00 57.03 56.81 1fz9 h ASP 13 Cb 0.62 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.93 1fz9 h ASP 13 CO 0.04 0.90 -0.17 0.00 -1.72 0.00 0.00 179.24 178.29 1fz9 h ALA 14 N 0.88 -0.21 0.00 3.45 0.00 -0.42 -2.15 119.26 120.80 1fz9 h ALA 14 Ca 0.11 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1fz9 h ALA 14 Cb 0.54 0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1fz9 h ALA 14 CO 0.03 -0.67 -0.16 -1.49 0.00 0.00 0.00 179.25 176.96 1fz9 h TRP 15 N -0.28 0.00 -0.56 0.00 4.06 -1.37 -2.51 115.95 115.29 1fz9 h TRP 15 Ca 0.06 0.00 -0.11 0.00 2.06 0.00 0.00 58.89 60.90 1fz9 h TRP 15 Cb 0.35 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.50 1fz9 h TRP 15 CO -0.22 0.16 -0.08 0.28 -3.56 0.00 0.00 178.44 175.01 1fz9 h VAL 16 N 0.00 1.27 -0.14 1.49 2.07 -0.83 -1.77 116.25 118.34 1fz9 h VAL 16 Ca -0.00 -1.23 -0.10 0.00 0.82 0.00 0.00 66.70 66.19 1fz9 h VAL 16 Cb 0.50 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 1fz9 h VAL 16 CO 0.02 0.44 -0.30 -1.13 0.02 0.00 0.00 177.57 176.62 1fz9 h ASN 17 N 0.92 0.50 -0.90 0.57 -1.24 -1.18 -1.84 115.58 112.41 1fz9 h ASN 17 Ca 0.15 -0.57 0.13 0.00 0.71 0.00 0.00 56.30 56.72 1fz9 h ASN 17 Cb 0.64 -0.14 -0.09 0.00 0.73 0.00 0.00 38.32 39.46 1fz9 h ASN 17 CO 0.04 0.97 0.52 0.50 -1.29 0.00 0.00 177.43 178.17 1fz9 h LYS 18 N 0.04 0.78 -0.55 6.67 3.64 -1.40 -0.67 116.57 125.08 1fz9 h LYS 18 Ca 0.00 -0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.26 1fz9 h LYS 18 Cb 0.90 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.52 1fz9 h LYS 18 CO 0.07 0.51 0.04 0.82 -2.27 0.00 0.00 179.45 178.62 1fz9 h ILE 19 N 0.80 1.26 -0.05 2.00 2.04 -1.22 -2.36 117.51 119.98 1fz9 h ILE 19 Ca 0.46 -1.05 0.01 0.00 1.00 0.00 0.00 64.86 65.28 1fz9 h ILE 19 Cb 0.53 0.85 -0.00 0.00 -0.74 0.00 0.00 36.82 37.46 1fz9 h ILE 19 CO -0.30 0.38 0.07 0.00 0.00 0.00 0.00 178.15 178.30 1fz9 h ALA 20 N 0.97 1.48 -0.29 1.87 0.00 -0.26 -1.62 119.26 121.41 1fz9 h ALA 20 Ca 0.16 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1fz9 h ALA 20 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1fz9 h ALA 20 CO 0.02 -0.09 0.00 1.04 0.00 0.00 0.00 179.25 180.22 1fz9 n GLN 21 N -3.63 3.00 -3.86 0.00 1.13 -0.89 -4.71 117.38 108.42 1fz9 n GLN 21 Ca -0.02 -1.61 -0.35 0.00 -1.94 0.00 0.00 57.00 53.08 1fz9 n GLN 21 Cb 0.15 -1.89 -0.13 0.00 0.11 0.00 0.00 30.24 28.48 1fz9 n GLN 21 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1fz9 s LEU 22 N -1.41 4.37 -0.12 1.08 1.43 -0.61 -4.93 118.68 118.50 1fz9 s LEU 22 Ca 0.28 -1.52 0.18 0.00 -1.03 0.00 0.00 54.13 52.03 1fz9 s LEU 22 Cb 0.21 -1.76 0.27 0.00 0.03 0.00 0.00 46.19 44.94 1fz9 s LEU 22 CO 0.08 -0.35 1.14 0.59 0.23 0.00 0.00 176.35 178.03 1fz9 n ASN 23 N 4.61 2.28 -4.05 2.29 3.02 -1.26 -4.90 115.26 117.25 1fz9 n ASN 23 Ca -0.09 -3.00 -0.23 0.00 -0.03 0.00 0.00 54.58 51.23 1fz9 n ASN 23 Cb 0.43 -0.40 -0.16 0.00 -0.61 0.00 0.00 39.78 39.04 1fz9 n ASN 23 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1fz9 s THR 24 N -2.71 1.03 0.21 3.41 2.01 -1.26 -5.04 115.64 113.29 1fz9 s THR 24 Ca 0.30 -0.49 -0.10 0.00 0.31 0.00 0.00 61.69 61.70 1fz9 s THR 24 Cb 0.26 -0.90 0.14 0.00 0.01 0.00 0.00 72.50 72.01 1fz9 s THR 24 CO 0.03 0.31 1.86 0.25 -0.69 0.00 0.00 174.62 176.37 1fz9 h LEU 25 N 6.36 0.75 0.13 4.42 5.85 -1.94 -0.81 115.31 130.08 1fz9 h LEU 25 Ca -0.33 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.38 1fz9 h LEU 25 Cb 1.17 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 42.03 1fz9 h LEU 25 CO 0.48 0.53 -0.06 -0.08 -0.34 0.00 0.00 178.44 178.97 1fz9 h GLU 26 N 0.89 -0.17 0.31 1.25 4.81 -1.96 0.26 114.58 119.97 1fz9 h GLU 26 Ca 0.28 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.52 1fz9 h GLU 26 Cb -0.02 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.37 1fz9 h GLU 26 CO -0.10 0.14 -0.45 -0.22 -0.73 0.00 0.00 179.01 177.66 1fz9 h LYS 27 N -0.49 -0.79 -0.29 1.92 3.11 -1.96 -0.28 116.57 117.79 1fz9 h LYS 27 Ca -0.02 0.05 0.04 0.00 -2.81 0.00 0.00 60.65 57.92 1fz9 h LYS 27 Cb 0.39 0.18 -0.04 0.00 -1.00 0.00 0.00 32.23 31.76 1fz9 h LYS 27 CO 0.03 -0.52 0.05 0.00 -2.81 0.00 0.00 179.45 176.19 1fz9 h ALA 28 N -0.49 0.29 -0.54 5.00 0.00 -1.17 -1.37 119.26 120.99 1fz9 h ALA 28 Ca -0.02 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1fz9 h ALA 28 Cb 0.76 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 1fz9 h ALA 28 CO -0.15 -0.36 0.27 0.00 0.00 0.00 0.00 179.25 179.01 1fz9 h ALA 29 N 1.22 0.69 -0.16 0.00 0.00 -0.33 -1.11 119.26 119.57 1fz9 h ALA 29 Ca 0.13 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1fz9 h ALA 29 Cb 0.15 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1fz9 h ALA 29 CO -0.19 0.24 -0.10 1.49 0.00 0.00 0.00 179.25 180.70 1fz9 h GLU 30 N 0.72 0.24 -0.36 0.00 4.57 -0.86 -1.89 114.58 117.00 1fz9 h GLU 30 Ca 0.19 -0.05 -0.15 0.00 -1.18 0.00 0.00 59.36 58.17 1fz9 h GLU 30 Cb 0.09 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.63 1fz9 h GLU 30 CO -0.03 0.35 -0.36 1.98 -1.18 0.00 0.00 179.01 179.77 1fz9 h MET 31 N 0.23 0.83 -0.49 1.92 4.05 -0.45 -1.83 114.93 119.20 1fz9 h MET 31 Ca 0.05 -0.41 -0.09 0.00 -0.28 0.00 0.00 59.70 58.96 1fz9 h MET 31 Cb 0.32 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.11 1fz9 h MET 31 CO 0.02 1.05 -0.06 1.25 0.23 0.00 0.00 176.91 179.40 1fz9 h LEU 32 N 0.69 0.91 -0.80 3.39 5.85 -0.60 -1.02 115.31 123.72 1fz9 h LEU 32 Ca 0.06 -0.34 -0.08 0.00 0.84 0.00 0.00 57.88 58.36 1fz9 h LEU 32 Cb 0.92 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.68 1fz9 h LEU 32 CO 0.08 1.03 0.01 0.50 -0.34 0.00 0.00 178.44 179.72 1fz9 h LYS 33 N 0.77 0.91 -0.33 1.25 3.64 -1.28 -1.92 116.57 119.60 1fz9 h LYS 33 Ca 0.13 -0.26 -0.03 0.00 -1.27 0.00 0.00 60.65 59.22 1fz9 h LYS 33 Cb 0.60 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 1fz9 h LYS 33 CO 0.04 0.90 0.08 0.37 -2.27 0.00 0.00 179.45 178.57 1fz9 h GLN 34 N 0.85 0.52 -0.53 1.90 5.75 -1.15 -2.39 115.11 120.06 1fz9 h GLN 34 Ca 0.16 -0.12 0.09 0.00 -0.15 0.00 0.00 58.65 58.62 1fz9 h GLN 34 Cb 0.49 -0.07 -0.07 0.00 1.07 0.00 0.00 27.48 28.90 1fz9 h GLN 34 CO 0.02 0.58 0.15 0.35 -2.65 0.00 0.00 178.83 177.28 1fz9 h PHE 35 N 0.38 0.25 0.00 3.99 3.57 -0.82 0.53 116.94 124.83 1fz9 h PHE 35 Ca 0.10 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.59 1fz9 h PHE 35 Cb 0.29 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.99 1fz9 h PHE 35 CO 0.01 0.04 -0.23 0.00 -2.23 0.00 0.00 178.31 175.90 1fz9 h ARG 36 N 0.30 0.00 0.04 1.11 3.08 -1.24 0.44 114.38 118.11 1fz9 h ARG 36 Ca 0.27 0.00 -0.28 0.00 0.07 0.00 0.00 59.98 60.04 1fz9 h ARG 36 Cb 0.34 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.42 1fz9 h ARG 36 CO -0.31 0.23 -1.10 0.52 -1.07 0.00 0.00 179.97 178.23 1fz9 h MET 37 N 0.00 0.66 0.00 0.04 2.86 -0.59 -2.86 114.93 115.03 1fz9 h MET 37 Ca -0.00 -0.76 -0.17 0.00 -2.06 0.00 0.00 59.70 56.71 1fz9 h MET 37 Cb 0.48 0.23 -0.02 0.00 0.06 0.00 0.00 31.60 32.35 1fz9 h MET 37 CO 0.03 1.33 -0.80 -0.44 1.06 0.00 0.00 176.91 178.10 1fz9 h ASP 38 N 0.35 0.00 0.00 1.22 3.45 -0.44 -2.41 116.42 118.59 1fz9 h ASP 38 Ca -0.15 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.31 1fz9 h ASP 38 Cb 1.76 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.53 1fz9 h ASP 38 CO 0.21 0.78 0.00 1.41 -1.57 0.00 0.00 179.24 180.07 1fz9 n HIS 39 N -3.29 0.00 -4.25 4.55 8.25 0.15 -2.41 115.22 118.22 1fz9 n HIS 39 Ca 0.01 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.22 1fz9 n HIS 39 Cb 0.85 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.89 1fz9 n HIS 39 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1fz9 s THR 40 N -0.37 3.60 0.41 1.59 -4.23 -1.08 -4.87 115.64 110.69 1fz9 s THR 40 Ca 0.00 -1.68 0.00 0.00 -1.18 0.00 0.00 61.69 58.83 1fz9 s THR 40 Cb 0.00 -2.88 0.00 0.00 1.34 0.00 0.00 72.50 70.96 1fz9 s THR 40 CO 0.00 -0.26 0.00 0.35 -0.54 0.00 0.00 174.62 174.17 1fz9 n THR 41 N -0.57 -0.86 0.48 3.99 -2.24 -1.26 -2.70 114.28 111.12 1fz9 n THR 41 Ca -0.08 0.69 0.01 0.00 -2.27 0.00 0.00 64.05 62.40 1fz9 n THR 41 Cb 0.57 -1.07 0.05 0.00 -2.10 0.00 0.00 70.33 67.78 1fz9 n THR 41 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1fz9 n PRO 42 N -3.33 0.24 -0.11 -0.78 -0.04 -1.26 -0.47 135.00 129.26 1fz9 n PRO 42 Ca -0.05 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.45 1fz9 n PRO 42 Cb 0.43 -1.11 0.10 0.00 -0.04 0.00 0.00 33.50 32.88 1fz9 n PRO 42 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1fz9 n PHE 43 N -0.61 0.29 -1.54 0.54 3.72 -1.26 -5.03 117.46 113.56 1fz9 n PHE 43 Ca 0.01 -0.42 -0.40 0.00 -0.05 0.00 0.00 57.45 56.60 1fz9 n PHE 43 Cb 0.01 -0.03 0.03 0.00 -0.94 0.00 0.00 39.48 38.54 1fz9 n PHE 43 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 176.76 179.60 1fz9 n ARG 44 N 0.28 0.88 0.26 -1.08 1.85 0.38 -4.84 116.66 114.39 1fz9 n ARG 44 Ca 0.08 0.33 0.11 0.00 -1.00 0.00 0.00 57.85 57.37 1fz9 n ARG 44 Cb 0.35 -1.87 0.69 0.00 -1.05 0.00 0.00 32.46 30.58 1fz9 n ARG 44 CO 0.00 0.00 0.00 -0.91 -0.01 0.00 0.00 177.63 176.71 1fz9 h ASN 45 N 0.83 0.00 -5.00 2.89 -0.26 -1.09 -3.45 115.58 109.50 1fz9 h ASN 45 Ca -0.45 0.00 -0.02 0.00 -0.56 0.00 0.00 56.30 55.27 1fz9 h ASN 45 Cb 1.37 0.00 -0.13 0.00 -1.06 0.00 0.00 38.32 38.51 1fz9 h ASN 45 CO 0.52 0.12 0.20 -0.94 -1.06 0.00 0.00 177.43 176.27 1fz9 s SER 46 N -6.40 -0.57 -0.22 5.81 1.04 -1.01 -5.05 113.70 107.29 1fz9 s SER 46 Ca -0.04 0.06 0.15 0.00 0.48 0.00 0.00 55.95 56.60 1fz9 s SER 46 Cb 0.14 0.59 0.70 0.00 0.10 0.00 0.00 66.02 67.55 1fz9 s SER 46 CO 0.61 -0.94 1.62 -1.22 0.98 0.00 0.00 173.24 174.30 1fz9 n TYR 47 N -0.26 1.65 0.21 5.02 4.02 -1.26 -4.60 117.16 121.93 1fz9 n TYR 47 Ca -0.17 -0.84 0.05 0.00 -0.01 0.00 0.00 57.90 56.93 1fz9 n TYR 47 Cb 0.64 -0.45 0.45 0.00 -0.02 0.00 0.00 39.34 39.96 1fz9 n TYR 47 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 176.86 176.90 1fz9 h GLU 48 N 2.98 0.00 -0.60 -0.72 4.11 -1.96 -2.84 114.58 115.55 1fz9 h GLU 48 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.45 1fz9 h GLU 48 Cb 1.80 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.05 1fz9 h GLU 48 CO 0.40 0.28 0.00 1.28 0.07 0.00 0.00 179.01 181.05 1fz9 n LEU 49 N -4.08 5.04 -0.35 3.06 4.77 -1.26 -4.71 117.00 119.47 1fz9 n LEU 49 Ca -0.02 -2.63 0.05 0.00 -0.03 0.00 0.00 56.01 53.38 1fz9 n LEU 49 Cb 0.34 -0.61 0.12 0.00 -2.33 0.00 0.00 43.42 40.95 1fz9 n LEU 49 CO 0.37 0.75 0.66 -0.78 -1.33 0.00 0.00 177.39 177.05 1fz9 h ASP 50 N 3.93 -0.96 0.00 -1.43 3.58 -1.83 0.31 116.42 120.02 1fz9 h ASP 50 Ca 0.00 0.29 0.00 0.00 0.42 0.00 0.00 57.03 57.74 1fz9 h ASP 50 Cb 1.62 0.61 0.00 0.00 1.72 0.00 0.00 39.33 43.29 1fz9 h ASP 50 CO 0.32 -0.32 0.00 0.59 -2.88 0.00 0.00 179.24 176.95 1fz9 n ASN 51 N -5.60 0.00 0.00 2.28 3.02 -1.26 -3.95 115.26 109.75 1fz9 n ASN 51 Ca 0.15 -1.02 0.00 0.00 -0.03 0.00 0.00 54.58 53.68 1fz9 n ASN 51 Cb 0.47 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.64 1fz9 n ASN 51 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1fz9 n ASP 52 N -0.88 0.00 -0.25 6.41 8.00 0.51 -4.92 116.55 125.42 1fz9 n ASP 52 Ca 0.15 -0.14 0.01 0.00 0.71 0.00 0.00 54.79 55.51 1fz9 n ASP 52 Cb 0.07 0.00 0.13 0.00 -0.02 0.00 0.00 41.12 41.30 1fz9 n ASP 52 CO 0.00 0.00 0.00 0.10 -0.39 0.00 0.00 177.20 176.91 1fz9 h TYR 53 N 0.00 0.70 -0.64 1.24 -0.00 -0.67 -0.65 116.97 116.95 1fz9 h TYR 53 Ca 0.00 0.03 0.05 0.00 0.00 0.00 0.00 58.73 58.81 1fz9 h TYR 53 Cb 0.07 -0.21 -0.05 0.00 0.00 0.00 0.00 36.73 36.54 1fz9 h TYR 53 CO 0.00 0.29 0.35 -0.07 -0.00 0.00 0.00 178.16 178.74 1fz9 h LEU 54 N 0.68 0.53 -0.16 0.10 3.38 -1.84 0.31 115.31 118.31 1fz9 h LEU 54 Ca 0.34 0.03 -0.06 0.00 0.09 0.00 0.00 57.88 58.28 1fz9 h LEU 54 Cb 0.30 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 1fz9 h LEU 54 CO -0.23 0.35 -0.15 -0.25 0.09 0.00 0.00 178.44 178.25 1fz9 h TRP 55 N 0.66 0.45 -0.55 1.13 7.01 -1.75 -2.97 115.95 119.93 1fz9 h TRP 55 Ca 0.28 -0.13 -0.08 0.00 2.11 0.00 0.00 58.89 61.07 1fz9 h TRP 55 Cb 0.16 -0.09 -0.02 0.00 -2.10 0.00 0.00 29.16 27.10 1fz9 h TRP 55 CO -0.08 0.75 0.04 0.82 -2.79 0.00 0.00 178.44 177.18 1fz9 h ILE 56 N 0.01 1.26 -0.12 2.65 2.04 -0.83 -2.50 117.51 120.02 1fz9 h ILE 56 Ca 0.03 -1.06 0.04 0.00 1.00 0.00 0.00 64.86 64.87 1fz9 h ILE 56 Cb 0.67 0.86 -0.05 0.00 -0.74 0.00 0.00 36.82 37.57 1fz9 h ILE 56 CO 0.04 0.38 -0.16 -0.08 0.00 0.00 0.00 178.15 178.33 1fz9 h GLU 57 N 0.83 -0.20 -0.95 2.37 4.81 -0.42 0.74 114.58 121.77 1fz9 h GLU 57 Ca 0.16 0.01 0.11 0.00 -0.13 0.00 0.00 59.36 59.51 1fz9 h GLU 57 Cb 0.49 0.04 -0.07 0.00 0.63 0.00 0.00 28.75 29.84 1fz9 h GLU 57 CO 0.02 -0.13 0.61 0.00 -0.73 0.00 0.00 179.01 178.78 1fz9 h ALA 58 N 0.83 1.58 -0.20 2.92 0.00 -1.38 0.21 119.26 123.22 1fz9 h ALA 58 Ca 0.09 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 1fz9 h ALA 58 Cb 0.33 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1fz9 h ALA 58 CO -0.24 0.21 -0.21 0.87 0.00 0.00 0.00 179.25 179.89 1fz9 h LYS 59 N 0.95 0.35 -0.22 0.00 1.79 -0.82 -1.53 116.57 117.09 1fz9 h LYS 59 Ca 0.45 -0.11 -0.08 0.00 -2.18 0.00 0.00 60.65 58.73 1fz9 h LYS 59 Cb 0.44 -0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 31.05 1fz9 h LYS 59 CO -0.21 0.55 -0.16 -0.07 -1.08 0.00 0.00 179.45 178.47 1fz9 h LEU 60 N 0.32 0.52 -0.55 2.94 3.38 0.16 -3.15 115.31 118.93 1fz9 h LEU 60 Ca 0.05 -0.45 0.06 0.00 0.09 0.00 0.00 57.88 57.64 1fz9 h LEU 60 Cb 0.55 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 41.10 1fz9 h LEU 60 CO 0.04 0.86 0.25 -0.33 0.09 0.00 0.00 178.44 179.34 1fz9 h GLU 61 N 0.19 0.45 -0.80 1.13 5.08 -0.47 -1.99 114.58 118.17 1fz9 h GLU 61 Ca 0.04 -0.03 0.15 0.00 -1.00 0.00 0.00 59.36 58.53 1fz9 h GLU 61 Cb 0.69 -0.10 -0.10 0.00 0.50 0.00 0.00 28.75 29.74 1fz9 h GLU 61 CO 0.04 0.30 0.35 0.93 -1.00 0.00 0.00 179.01 179.63 1fz9 h GLU 62 N 0.47 0.47 -0.25 2.33 5.08 -1.25 0.15 114.58 121.58 1fz9 h GLU 62 Ca 0.26 -0.03 -0.10 0.00 -1.00 0.00 0.00 59.36 58.49 1fz9 h GLU 62 Cb 0.23 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 1fz9 h GLU 62 CO -0.22 0.31 -0.23 -0.22 -1.00 0.00 0.00 179.01 177.65 1fz9 h LYS 63 N 0.49 0.59 -0.20 2.33 1.63 -1.37 -2.02 116.57 118.01 1fz9 h LYS 63 Ca 0.45 -0.31 0.00 0.00 -0.85 0.00 0.00 60.65 59.94 1fz9 h LYS 63 Cb 0.69 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.32 1fz9 h LYS 63 CO -0.41 0.90 0.13 0.28 -3.45 0.00 0.00 179.45 176.90 1fz9 h VAL 64 N 0.30 1.07 0.60 2.00 2.07 -0.77 -1.54 116.25 119.97 1fz9 h VAL 64 Ca 0.04 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 67.38 1fz9 h VAL 64 Cb 0.79 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 1fz9 h VAL 64 CO 0.06 0.07 -0.43 0.00 0.02 0.00 0.00 177.57 177.29 1fz9 h ALA 65 N 1.05 -1.03 -0.79 1.67 0.00 -1.00 0.20 119.26 119.35 1fz9 h ALA 65 Ca 0.07 -0.19 0.18 0.00 0.00 0.00 0.00 54.91 54.97 1fz9 h ALA 65 Cb 0.00 0.56 -0.12 0.00 0.00 0.00 0.00 17.79 18.22 1fz9 h ALA 65 CO -0.01 -1.10 0.17 0.28 0.00 0.00 0.00 179.25 178.58 1fz9 h VAL 66 N -0.99 0.42 -0.47 0.00 2.07 -1.31 -0.58 116.25 115.40 1fz9 h VAL 66 Ca -0.07 -0.08 -0.12 0.00 0.82 0.00 0.00 66.70 67.25 1fz9 h VAL 66 Cb 0.82 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.75 1fz9 h VAL 66 CO 0.04 0.04 -0.18 -0.07 0.02 0.00 0.00 177.57 177.41 1fz9 h LEU 67 N 0.23 0.97 -0.51 2.57 3.38 -0.88 -2.99 115.31 118.07 1fz9 h LEU 67 Ca 0.46 -0.39 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1fz9 h LEU 67 Cb 0.83 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 1fz9 h LEU 67 CO -0.58 1.14 0.22 0.50 0.09 0.00 0.00 178.44 179.81 1fz9 h LYS 68 N 0.79 0.75 -0.17 1.13 3.64 0.57 -1.57 116.57 121.70 1fz9 h LYS 68 Ca 0.11 -0.12 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 1fz9 h LYS 68 Cb 0.75 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.43 1fz9 h LYS 68 CO 0.06 0.65 0.03 0.00 -2.27 0.00 0.00 179.45 177.91 1fz9 h ALA 69 N 1.06 1.73 0.14 5.00 0.00 -1.14 0.13 119.26 126.18 1fz9 h ALA 69 Ca 0.17 -0.09 -0.29 0.00 0.00 0.00 0.00 54.91 54.70 1fz9 h ALA 69 Cb 0.16 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 17.90 1fz9 h ALA 69 CO -0.02 0.21 -1.26 0.00 0.00 0.00 0.00 179.25 178.19 1fz9 h ARG 70 N 0.24 0.49 0.00 0.00 3.08 -1.33 -3.38 114.38 113.48 1fz9 h ARG 70 Ca 0.06 -0.71 -0.00 0.00 0.07 0.00 0.00 59.98 59.40 1fz9 h ARG 70 Cb 0.13 0.24 0.00 0.00 0.08 0.00 0.00 29.97 30.42 1fz9 h ARG 70 CO -0.00 1.31 -0.00 0.00 -1.07 0.00 0.00 179.97 180.21 1fz9 h ALA 71 N 0.40 -0.01 -2.60 0.04 0.00 -0.92 -3.47 119.26 112.72 1fz9 h ALA 71 Ca -0.17 -0.43 -0.49 0.00 0.00 0.00 0.00 54.91 53.81 1fz9 h ALA 71 Cb 1.94 0.00 0.04 0.00 0.00 0.00 0.00 17.79 19.77 1fz9 h ALA 71 CO 0.23 -0.06 0.45 -0.06 0.00 0.00 0.00 179.25 179.81 1fz9 s PHE 72 N -2.64 3.08 0.85 0.00 0.40 0.42 -5.06 117.98 115.04 1fz9 s PHE 72 Ca -0.18 1.59 -0.12 0.00 -0.60 0.00 0.00 56.93 57.62 1fz9 s PHE 72 Cb -0.02 -3.25 0.13 0.00 0.51 0.00 0.00 43.02 40.39 1fz9 s PHE 72 CO 0.66 -1.05 1.21 0.54 0.70 0.00 0.00 175.22 177.28 1fz9 s ASN 73 N -1.45 3.98 0.22 1.36 2.20 -1.26 -4.79 114.94 115.20 1fz9 s ASN 73 Ca 0.60 0.47 -0.08 0.00 -0.94 0.00 0.00 52.86 52.91 1fz9 s ASN 73 Cb -0.25 -0.80 0.27 0.00 -2.00 0.00 0.00 41.25 38.46 1fz9 s ASN 73 CO 0.31 -2.19 1.81 -0.33 -2.94 0.00 0.00 177.10 173.76 1fz9 h GLU 74 N -1.20 0.69 -0.44 3.55 5.08 -1.97 -1.36 114.58 118.93 1fz9 h GLU 74 Ca -0.45 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 57.85 1fz9 h GLU 74 Cb 1.29 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 30.36 1fz9 h GLU 74 CO 0.53 0.45 0.17 0.28 -1.00 0.00 0.00 179.01 179.44 1fz9 h VAL 75 N 0.71 1.21 -0.34 3.13 2.07 -1.99 -2.33 116.25 118.70 1fz9 h VAL 75 Ca 0.32 -0.64 -0.14 0.00 0.82 0.00 0.00 66.70 67.06 1fz9 h VAL 75 Cb 0.22 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 1fz9 h VAL 75 CO -0.20 0.24 -0.33 0.44 0.02 0.00 0.00 177.57 177.74 1fz9 h ASP 76 N 0.56 0.80 -0.37 0.57 3.32 -1.88 0.86 116.42 120.28 1fz9 h ASP 76 Ca 0.14 -0.33 0.00 0.00 0.02 0.00 0.00 57.03 56.86 1fz9 h ASP 76 Cb 0.21 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.52 1fz9 h ASP 76 CO -0.01 1.06 0.23 0.15 -1.72 0.00 0.00 179.24 178.95 1fz9 h PHE 77 N 0.64 0.48 0.19 4.55 3.04 -1.08 0.37 116.94 125.13 1fz9 h PHE 77 Ca 0.07 0.01 -0.31 0.00 3.98 0.00 0.00 57.97 61.72 1fz9 h PHE 77 Cb 0.87 -0.16 0.02 0.00 2.56 0.00 0.00 35.95 39.24 1fz9 h PHE 77 CO 0.05 0.31 -1.35 0.00 -2.02 0.00 0.00 178.31 175.29 1fz9 h ARG 78 N 0.51 0.41 -0.00 1.11 3.08 -1.02 -3.42 114.38 115.05 1fz9 h ARG 78 Ca 0.14 -0.70 0.00 0.00 0.07 0.00 0.00 59.98 59.49 1fz9 h ARG 78 Cb -0.04 0.26 0.00 0.00 0.08 0.00 0.00 29.97 30.27 1fz9 h ARG 78 CO -0.03 1.33 -0.05 0.72 -1.07 0.00 0.00 179.97 180.88 1fz9 n HIS 79 N -3.63 0.00 -4.20 3.04 8.25 0.26 -4.80 115.22 114.14 1fz9 n HIS 79 Ca -0.13 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.07 1fz9 n HIS 79 Cb 1.06 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 32.10 1fz9 n HIS 79 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1fz9 s LYS 80 N -0.82 2.47 0.71 -0.41 1.02 0.13 -1.07 119.74 121.77 1fz9 s LYS 80 Ca 0.01 -1.10 -0.08 0.00 0.02 0.00 0.00 55.97 54.82 1fz9 s LYS 80 Cb 0.01 -2.38 0.05 0.00 -0.52 0.00 0.00 37.83 34.99 1fz9 s LYS 80 CO 0.05 0.45 1.04 0.95 -0.92 0.00 0.00 175.35 176.92 1fz9 s THR 81 N -1.80 2.49 0.55 2.17 -4.23 -0.02 -4.48 115.64 110.32 1fz9 s THR 81 Ca 0.28 -0.12 0.34 0.00 -1.18 0.00 0.00 61.69 61.02 1fz9 s THR 81 Cb -0.09 -3.10 0.34 0.00 1.34 0.00 0.00 72.50 70.99 1fz9 s THR 81 CO 0.19 -0.11 2.04 0.00 -0.54 0.00 0.00 174.62 176.21 1fz9 h ALA 82 N -0.64 1.16 -0.20 3.99 0.00 -0.45 0.56 119.26 123.68 1fz9 h ALA 82 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1fz9 h ALA 82 Cb 1.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1fz9 h ALA 82 CO 0.62 -0.16 0.00 1.19 0.00 0.00 0.00 179.25 180.90 1fz9 n PHE 83 N -2.86 0.24 -0.52 0.00 0.99 -1.26 -4.84 117.46 109.22 1fz9 n PHE 83 Ca -0.02 -0.12 0.00 0.00 -0.00 0.00 0.00 57.45 57.31 1fz9 n PHE 83 Cb 0.22 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.70 1fz9 n PHE 83 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1fz9 n GLY 84 N 1.32 0.85 3.83 1.37 0.00 0.19 -5.05 105.19 107.70 1fz9 n GLY 84 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 1fz9 n GLY 84 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fz9 s GLU 85 N -0.44 3.15 -0.56 1.61 2.02 -1.26 -4.76 118.70 118.46 1fz9 s GLU 85 Ca 0.00 0.92 -0.24 0.00 0.02 0.00 0.00 54.97 55.66 1fz9 s GLU 85 Cb 0.00 -2.02 0.04 0.00 0.10 0.00 0.00 34.13 32.25 1fz9 s GLU 85 CO 0.00 -0.93 0.97 0.34 0.02 0.00 0.00 175.26 175.66 1fz9 s ASP 86 N -3.82 6.34 0.35 -0.19 -1.08 -1.26 -0.84 116.67 116.17 1fz9 s ASP 86 Ca 0.58 -0.33 0.15 0.00 -0.52 0.00 0.00 52.55 52.42 1fz9 s ASP 86 Cb -0.13 -2.45 1.08 0.00 -1.46 0.00 0.00 42.92 39.96 1fz9 s ASP 86 CO 0.53 -1.26 1.68 0.00 0.52 0.00 0.00 175.17 176.63 1fz9 h ALA 87 N 9.35 1.99 -0.43 3.66 0.00 -1.41 -0.17 119.26 132.26 1fz9 h ALA 87 Ca -0.26 0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1fz9 h ALA 87 Cb 1.07 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 1fz9 h ALA 87 CO 1.10 -0.57 0.15 -0.22 0.00 0.00 0.00 179.25 179.71 1fz9 h LYS 88 N 0.36 0.65 -0.07 0.00 3.64 -1.92 -1.46 116.57 117.78 1fz9 h LYS 88 Ca 0.72 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.97 1fz9 h LYS 88 Cb 1.65 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 33.36 1fz9 h LYS 88 CO -0.56 0.63 0.03 0.77 -2.27 0.00 0.00 179.45 178.05 1fz9 h SER 89 N 0.55 0.04 -0.81 4.20 0.02 -1.43 0.30 113.55 116.41 1fz9 h SER 89 Ca 0.14 0.00 0.06 0.00 -0.84 0.00 0.00 61.79 61.16 1fz9 h SER 89 Cb 0.24 -0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.71 1fz9 h SER 89 CO -0.01 0.03 0.49 0.58 -1.14 0.00 0.00 176.83 176.79 1fz9 h VAL 90 N 0.07 1.02 0.29 2.27 2.07 -1.35 0.50 116.25 121.12 1fz9 h VAL 90 Ca 0.03 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.23 1fz9 h VAL 90 Cb 0.01 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 29.82 1fz9 h VAL 90 CO -0.02 0.16 -0.14 0.25 0.02 0.00 0.00 177.57 177.84 1fz9 h LEU 91 N 0.90 -0.33 -0.35 2.57 5.85 -0.54 0.12 115.31 123.52 1fz9 h LEU 91 Ca 0.36 -0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.94 1fz9 h LEU 91 Cb 0.18 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 1fz9 h LEU 91 CO -0.18 -0.03 0.23 0.44 -0.34 0.00 0.00 178.44 178.55 1fz9 h ASP 92 N -0.63 0.39 -0.81 1.25 3.45 -0.21 0.11 116.42 119.97 1fz9 h ASP 92 Ca -0.04 -0.01 0.01 0.00 0.43 0.00 0.00 57.03 57.42 1fz9 h ASP 92 Cb 0.45 -0.09 -0.04 0.00 -0.56 0.00 0.00 39.33 39.09 1fz9 h ASP 92 CO 0.07 0.28 0.53 1.23 -1.57 0.00 0.00 179.24 179.78 1fz9 h GLY 93 N 0.46 1.14 1.24 2.75 0.00 0.05 -0.47 103.07 108.24 1fz9 h GLY 93 Ca 0.13 -0.43 -0.15 0.00 0.00 0.00 0.00 47.33 46.88 1fz9 h GLY 93 CO -0.03 0.42 -0.38 -0.84 0.00 0.00 0.00 176.54 175.70 1fz9 h THR 94 N 1.10 1.28 -0.50 4.70 2.02 -0.46 -2.29 112.91 118.75 1fz9 h THR 94 Ca 0.30 -1.56 -0.04 0.00 0.77 0.00 0.00 66.41 65.88 1fz9 h THR 94 Cb -0.12 1.42 -0.02 0.00 -1.74 0.00 0.00 68.15 67.69 1fz9 h THR 94 CO -0.06 0.51 0.18 0.58 0.37 0.00 0.00 175.52 177.10 1fz9 h VAL 95 N 0.68 1.22 -0.30 3.16 2.07 -0.67 -1.38 116.25 121.04 1fz9 h VAL 95 Ca 0.06 -0.72 0.02 0.00 0.82 0.00 0.00 66.70 66.88 1fz9 h VAL 95 Cb 0.95 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 1fz9 h VAL 95 CO 0.09 0.27 0.13 0.00 0.02 0.00 0.00 177.57 178.08 1fz9 h ALA 96 N 1.03 0.35 -0.56 1.67 0.00 -0.99 -0.50 119.26 120.26 1fz9 h ALA 96 Ca 0.17 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1fz9 h ALA 96 Cb 0.24 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1fz9 h ALA 96 CO -0.01 -0.26 0.36 0.87 0.00 0.00 0.00 179.25 180.20 1fz9 h LYS 97 N 0.28 0.74 -0.33 0.00 1.57 -1.16 -1.85 116.57 115.81 1fz9 h LYS 97 Ca 0.13 -0.05 -0.11 0.00 -1.87 0.00 0.00 60.65 58.75 1fz9 h LYS 97 Cb 0.07 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 1fz9 h LYS 97 CO -0.11 0.50 -0.25 1.98 -0.57 0.00 0.00 179.45 181.00 1fz9 h MET 98 N 0.76 0.66 0.00 3.15 4.05 -0.19 -2.41 114.93 120.95 1fz9 h MET 98 Ca 0.20 -0.27 -0.07 0.00 -0.28 0.00 0.00 59.70 59.28 1fz9 h MET 98 Cb -0.07 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 30.69 1fz9 h MET 98 CO -0.04 0.85 -0.36 -0.91 0.23 0.00 0.00 176.91 176.68 1fz9 h ASN 99 N 0.57 0.00 0.80 1.39 2.35 -0.43 -3.01 115.58 117.26 1fz9 h ASN 99 Ca 0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 1fz9 h ASN 99 Cb 0.74 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.11 1fz9 h ASN 99 CO 0.06 0.36 -0.40 0.00 -1.65 0.00 0.00 177.43 175.79 1fz9 n ALA 100 N -2.27 2.99 -1.66 -0.83 0.00 -0.76 -4.91 120.51 113.07 1fz9 n ALA 100 Ca 0.00 -0.24 -0.46 0.00 0.00 0.00 0.00 53.44 52.74 1fz9 n ALA 100 Cb 0.52 -1.24 -0.04 0.00 0.00 0.00 0.00 19.45 18.69 1fz9 n ALA 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fz9 n ALA 101 N -1.63 1.19 -0.07 0.00 0.00 -0.93 -4.90 120.51 114.18 1fz9 n ALA 101 Ca 0.05 0.44 -0.13 0.00 0.00 0.00 0.00 53.44 53.80 1fz9 n ALA 101 Cb 0.38 -2.34 -0.06 0.00 0.00 0.00 0.00 19.45 17.43 1fz9 n ALA 101 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1fz9 h LYS 102 N 6.03 0.46 -4.88 0.00 1.79 -1.90 -3.48 116.57 114.59 1fz9 h LYS 102 Ca -0.45 -0.24 -0.44 0.00 -2.18 0.00 0.00 60.65 57.34 1fz9 h LYS 102 Cb 1.26 0.01 -0.14 0.00 -1.58 0.00 0.00 32.23 31.78 1fz9 h LYS 102 CO 0.88 0.80 -0.52 0.16 -1.08 0.00 0.00 179.45 179.70 1fz9 s ASP 103 N -6.23 1.62 0.57 0.86 1.47 -1.26 -5.03 116.67 108.67 1fz9 s ASP 103 Ca -0.14 -1.67 0.38 0.00 1.18 0.00 0.00 52.55 52.30 1fz9 s ASP 103 Cb 0.06 0.50 1.86 0.00 -0.34 0.00 0.00 42.92 45.01 1fz9 s ASP 103 CO 0.77 -0.99 2.14 0.07 0.68 0.00 0.00 175.17 177.84 1fz9 h LYS 104 N 2.16 0.00 -0.05 2.11 2.10 -1.92 -2.04 116.57 118.94 1fz9 h LYS 104 Ca -0.29 0.00 -0.21 0.00 -2.00 0.00 0.00 60.65 58.15 1fz9 h LYS 104 Cb 1.24 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 32.59 1fz9 h LYS 104 CO 0.44 0.00 -0.78 -1.49 -2.00 0.00 0.00 179.45 175.61 1fz9 h TRP 105 N 0.00 0.88 -0.01 0.07 4.06 -1.96 -2.03 115.95 116.96 1fz9 h TRP 105 Ca 0.00 -0.44 -0.23 0.00 2.06 0.00 0.00 58.89 60.27 1fz9 h TRP 105 Cb 0.21 -0.11 0.01 0.00 -1.00 0.00 0.00 29.16 28.26 1fz9 h TRP 105 CO 0.00 1.27 -0.95 0.93 -3.56 0.00 0.00 178.44 176.13 1fz9 h GLU 106 N 0.24 0.48 -0.65 0.49 5.08 -1.92 -3.15 114.58 115.15 1fz9 h GLU 106 Ca -0.08 -0.51 0.05 0.00 -1.00 0.00 0.00 59.36 57.82 1fz9 h GLU 106 Cb 1.45 0.14 -0.05 0.00 0.50 0.00 0.00 28.75 30.79 1fz9 h GLU 106 CO 0.16 1.15 0.36 0.00 -1.00 0.00 0.00 179.01 179.68 1fz9 h ALA 107 N 0.68 0.86 0.00 3.43 0.00 -1.39 -0.93 119.26 121.90 1fz9 h ALA 107 Ca -0.09 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 1fz9 h ALA 107 Cb 1.59 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 1fz9 h ALA 107 CO 0.17 0.06 -0.34 1.05 0.00 0.00 0.00 179.25 180.18 1fz9 h GLU 108 N 0.69 0.00 -0.28 0.00 4.11 -1.39 -2.01 114.58 115.70 1fz9 h GLU 108 Ca 0.28 0.00 -0.12 0.00 0.07 0.00 0.00 59.36 59.59 1fz9 h GLU 108 Cb 0.15 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.39 1fz9 h GLU 108 CO -0.16 0.34 -0.29 0.87 0.07 0.00 0.00 179.01 179.84 1fz9 h LYS 109 N 0.00 0.69 0.20 1.06 1.57 -1.18 -2.11 116.57 116.80 1fz9 h LYS 109 Ca -0.00 -0.37 -0.01 0.00 -1.87 0.00 0.00 60.65 58.39 1fz9 h LYS 109 Cb 0.64 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.97 1fz9 h LYS 109 CO 0.04 0.99 -0.10 0.82 -0.57 0.00 0.00 179.45 180.63 1fz9 h ILE 110 N 0.43 0.88 0.59 1.86 2.04 -0.98 -1.00 117.51 121.34 1fz9 h ILE 110 Ca 0.04 -0.46 -0.02 0.00 1.00 0.00 0.00 64.86 65.43 1fz9 h ILE 110 Cb 0.87 1.15 -0.01 0.00 -0.74 0.00 0.00 36.82 38.08 1fz9 h ILE 110 CO 0.07 0.10 -0.45 -0.74 0.00 0.00 0.00 178.15 177.14 1fz9 h HIS 111 N -0.50 -1.22 -0.68 1.37 2.76 -1.42 -0.48 115.15 114.98 1fz9 h HIS 111 Ca -0.03 -0.00 0.07 0.00 -2.20 0.00 0.00 60.37 58.21 1fz9 h HIS 111 Cb 0.38 0.45 -0.06 0.00 1.55 0.00 0.00 27.41 29.73 1fz9 h HIS 111 CO 0.00 -0.64 0.37 0.82 -1.30 0.00 0.00 177.93 177.18 1fz9 h ILE 112 N -1.01 0.94 -0.42 6.26 2.04 -1.46 -1.24 117.51 122.63 1fz9 h ILE 112 Ca -0.07 -0.23 -0.02 0.00 1.00 0.00 0.00 64.86 65.53 1fz9 h ILE 112 Cb 0.85 0.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 1fz9 h ILE 112 CO 0.02 0.12 0.16 1.23 0.00 0.00 0.00 178.15 179.68 1fz9 h GLY 113 N 0.67 0.64 0.97 5.37 0.00 -0.99 -2.15 103.07 107.59 1fz9 h GLY 113 Ca 0.31 -0.31 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1fz9 h GLY 113 CO -0.20 0.29 0.25 -2.75 0.00 0.00 0.00 176.54 174.13 1fz9 h PHE 114 N 0.59 0.66 0.08 5.60 3.57 0.09 -1.71 116.94 125.84 1fz9 h PHE 114 Ca 0.14 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.62 1fz9 h PHE 114 Cb 0.14 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 38.67 1fz9 h PHE 114 CO 0.01 0.51 -0.04 0.00 -2.23 0.00 0.00 178.31 176.56 1fz9 h ARG 115 N 0.62 -0.11 -0.12 1.11 3.08 -0.88 0.17 114.38 118.25 1fz9 h ARG 115 Ca 0.16 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.23 1fz9 h ARG 115 Cb 0.08 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 1fz9 h ARG 115 CO -0.02 0.03 0.08 1.96 -1.07 0.00 0.00 179.97 180.95 1fz9 h GLN 116 N -0.22 0.15 0.13 0.04 4.20 -1.30 -2.11 115.11 116.01 1fz9 h GLN 116 Ca -0.01 -0.01 -0.33 0.00 0.06 0.00 0.00 58.65 58.36 1fz9 h GLN 116 Cb 0.18 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 1fz9 h GLN 116 CO 0.02 0.10 -1.74 0.00 -0.67 0.00 0.00 178.83 176.54 1fz9 h ALA 117 N 1.92 0.27 -0.04 3.87 0.00 -1.06 -3.43 119.26 120.80 1fz9 h ALA 117 Ca 0.05 -1.23 0.00 0.00 0.00 0.00 0.00 54.91 53.72 1fz9 h ALA 117 Cb -0.00 0.58 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1fz9 h ALA 117 CO -0.01 1.07 0.00 0.66 0.00 0.00 0.00 179.25 180.97 1fz9 n TYR 118 N -3.69 0.05 -1.61 0.00 4.02 0.02 -4.87 117.16 111.09 1fz9 n TYR 118 Ca -0.28 -0.36 -0.46 0.00 -0.01 0.00 0.00 57.90 56.79 1fz9 n TYR 118 Cb 1.00 -0.03 -0.02 0.00 -0.02 0.00 0.00 39.34 40.26 1fz9 n TYR 118 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 1fz9 n LYS 119 N -0.22 1.51 -1.49 -0.72 4.81 -0.80 -1.41 118.16 119.85 1fz9 n LYS 119 Ca 0.02 0.53 -0.38 0.00 -0.87 0.00 0.00 58.31 57.61 1fz9 n LYS 119 Cb 0.21 -2.02 0.05 0.00 0.02 0.00 0.00 35.03 33.28 1fz9 n LYS 119 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1fz9 n PRO 120 N 1.30 0.59 -0.28 1.64 -0.02 -1.25 -1.87 135.00 135.11 1fz9 n PRO 120 Ca 0.11 0.24 -0.05 0.00 -2.02 0.00 0.00 63.50 61.77 1fz9 n PRO 120 Cb 0.30 -1.87 0.04 0.00 -0.02 0.00 0.00 33.50 31.95 1fz9 n PRO 120 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1fz9 n PRO 121 N -0.48 1.28 -0.03 0.52 -0.04 -1.26 -4.91 135.00 130.07 1fz9 n PRO 121 Ca 0.12 -0.67 -0.00 0.00 -0.04 0.00 0.00 63.50 62.90 1fz9 n PRO 121 Cb 0.48 -1.26 -0.00 0.00 -0.04 0.00 0.00 33.50 32.67 1fz9 n PRO 121 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1fz9 h ILE 122 N 0.23 0.00 -2.93 0.52 1.08 -1.55 -3.39 117.51 111.48 1fz9 h ILE 122 Ca 0.14 -0.64 -0.62 0.00 -0.39 0.00 0.00 64.86 63.35 1fz9 h ILE 122 Cb 1.41 0.00 -0.05 0.00 -3.07 0.00 0.00 36.82 35.11 1fz9 h ILE 122 CO 0.25 0.00 -0.34 -0.32 -0.69 0.00 0.00 178.15 177.05 1fz9 s MET 123 N -1.41 3.64 0.39 2.37 1.75 -0.50 0.19 119.30 125.74 1fz9 s MET 123 Ca -0.01 0.03 -0.27 0.00 -1.25 0.00 0.00 55.69 54.19 1fz9 s MET 123 Cb 0.00 -3.09 -0.11 0.00 2.84 0.00 0.00 34.83 34.47 1fz9 s MET 123 CO 0.02 0.65 1.35 -2.30 -0.65 0.00 0.00 175.02 174.09 1fz9 n PRO 124 N 1.27 2.22 -0.03 4.11 -0.02 -1.26 -3.85 135.00 137.44 1fz9 n PRO 124 Ca -0.12 0.78 0.06 0.00 -2.02 0.00 0.00 63.50 62.20 1fz9 n PRO 124 Cb 0.53 -2.47 0.44 0.00 -0.02 0.00 0.00 33.50 31.98 1fz9 n PRO 124 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 1fz9 h VAL 125 N 2.46 1.05 -0.15 -1.45 -1.51 -1.94 -2.10 116.25 112.61 1fz9 h VAL 125 Ca -0.48 -0.18 0.04 0.00 -1.23 0.00 0.00 66.70 64.85 1fz9 h VAL 125 Cb 1.27 0.48 -0.05 0.00 -2.13 0.00 0.00 31.29 30.87 1fz9 h VAL 125 CO 0.62 0.10 -0.14 0.78 -1.23 0.00 0.00 177.57 177.69 1fz9 h ASN 126 N 0.53 -0.44 -0.32 4.19 2.35 -1.95 0.88 115.58 120.82 1fz9 h ASN 126 Ca 0.19 0.09 -0.07 0.00 -0.55 0.00 0.00 56.30 55.95 1fz9 h ASN 126 Cb 0.10 0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.68 1fz9 h ASN 126 CO -0.05 -0.18 -0.09 1.88 -1.65 0.00 0.00 177.43 177.34 1fz9 h TYR 127 N -0.16 0.70 -0.71 1.19 -1.99 -1.86 -2.43 116.97 111.70 1fz9 h TYR 127 Ca 0.10 -0.15 0.03 0.00 2.00 0.00 0.00 58.73 60.71 1fz9 h TYR 127 Cb 0.31 -0.17 -0.04 0.00 2.00 0.00 0.00 36.73 38.82 1fz9 h TYR 127 CO -0.27 0.80 0.44 0.35 -0.00 0.00 0.00 178.16 179.49 1fz9 h PHE 128 N 0.39 0.83 0.00 4.88 3.57 -1.00 0.16 116.94 125.77 1fz9 h PHE 128 Ca 0.08 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.58 1fz9 h PHE 128 Cb 0.58 -0.27 -0.00 0.00 2.79 0.00 0.00 35.95 39.05 1fz9 h PHE 128 CO 0.05 0.47 -0.09 -0.07 -2.23 0.00 0.00 178.31 176.44 1fz9 h LEU 129 N 0.86 0.00 -0.26 0.59 3.38 -0.85 -0.60 115.31 118.43 1fz9 h LEU 129 Ca 0.29 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 58.06 1fz9 h LEU 129 Cb 0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1fz9 h LEU 129 CO -0.11 0.09 -0.64 -0.78 0.09 0.00 0.00 178.44 177.09 1fz9 h ASP 130 N 0.00 0.95 -0.59 -0.43 1.82 -0.84 -1.99 116.42 115.34 1fz9 h ASP 130 Ca -0.00 -0.55 -0.06 0.00 -0.39 0.00 0.00 57.03 56.02 1fz9 h ASP 130 Cb 0.88 -0.27 -0.02 0.00 0.68 0.00 0.00 39.33 40.60 1fz9 h ASP 130 CO 0.01 1.35 0.12 1.23 -1.61 0.00 0.00 179.24 180.34 1fz9 h GLY 131 N 0.67 1.03 1.06 -0.78 0.00 -0.29 -2.48 103.07 102.29 1fz9 h GLY 131 Ca -0.01 -0.67 0.05 0.00 0.00 0.00 0.00 47.33 46.69 1fz9 h GLY 131 CO 0.14 0.62 0.51 0.83 0.00 0.00 0.00 176.54 178.64 1fz9 h GLU 132 N 0.86 0.88 0.85 4.80 4.39 -0.93 0.18 114.58 125.61 1fz9 h GLU 132 Ca 0.18 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 59.79 1fz9 h GLU 132 Cb 0.39 -0.20 0.01 0.00 -0.10 0.00 0.00 28.75 28.85 1fz9 h GLU 132 CO 0.01 0.58 -0.41 -0.09 -1.16 0.00 0.00 179.01 177.94 1fz9 h ARG 133 N 0.91 -1.10 0.27 2.33 2.43 -0.93 -2.14 114.38 116.16 1fz9 h ARG 133 Ca 0.32 0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.55 1fz9 h ARG 133 Cb 0.12 0.25 0.00 0.00 -0.42 0.00 0.00 29.97 29.93 1fz9 h ARG 133 CO -0.10 -0.72 -0.13 1.96 -1.51 0.00 0.00 179.97 179.47 1fz9 h GLN 134 N -1.23 -0.35 0.13 0.20 4.20 -1.20 -2.78 115.11 114.07 1fz9 h GLN 134 Ca -0.12 0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.61 1fz9 h GLN 134 Cb 0.88 0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.74 1fz9 h GLN 134 CO 0.19 -0.09 -0.07 -0.07 -0.67 0.00 0.00 178.83 178.12 1fz9 h LEU 135 N -0.59 -0.17 -2.01 1.46 3.38 -0.77 -2.53 115.31 114.08 1fz9 h LEU 135 Ca -0.04 0.01 0.03 0.00 0.09 0.00 0.00 57.88 57.98 1fz9 h LEU 135 Cb 0.43 0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.22 1fz9 h LEU 135 CO 0.06 -0.12 0.09 1.23 0.09 0.00 0.00 178.44 179.79 1fz9 h GLY 136 N -0.19 0.00 0.70 0.83 0.00 -1.47 -1.90 103.07 101.03 1fz9 h GLY 136 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.30 1fz9 h GLY 136 CO 0.02 0.00 -0.12 -0.84 0.00 0.00 0.00 176.54 175.59 1fz9 h THR 137 N 0.00 0.79 -0.47 4.70 2.02 -1.16 -2.33 112.91 116.46 1fz9 h THR 137 Ca 0.06 -0.57 0.02 0.00 0.77 0.00 0.00 66.41 66.68 1fz9 h THR 137 Cb 0.23 1.10 -0.03 0.00 -1.74 0.00 0.00 68.15 67.71 1fz9 h THR 137 CO -0.00 0.12 0.29 -0.09 0.37 0.00 0.00 175.52 176.21 1fz9 h ARG 138 N -0.66 0.56 -0.70 6.66 9.65 -1.19 -2.03 114.38 126.68 1fz9 h ARG 138 Ca -0.04 -0.03 0.10 0.00 -1.10 0.00 0.00 59.98 58.91 1fz9 h ARG 138 Cb 0.46 -0.13 -0.08 0.00 -1.39 0.00 0.00 29.97 28.84 1fz9 h ARG 138 CO 0.06 0.37 0.32 1.25 2.80 0.00 0.00 179.97 184.77 1fz9 h LEU 139 N 0.58 0.37 -0.23 3.80 5.85 -1.36 -1.26 115.31 123.07 1fz9 h LEU 139 Ca 0.18 0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.94 1fz9 h LEU 139 Cb -0.01 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 1fz9 h LEU 139 CO -0.07 0.20 0.01 0.24 -0.34 0.00 0.00 178.44 178.48 1fz9 h MET 140 N 0.53 0.40 0.10 1.25 2.86 -0.99 0.42 114.93 119.50 1fz9 h MET 140 Ca 0.35 -0.12 0.02 0.00 -2.06 0.00 0.00 59.70 57.89 1fz9 h MET 140 Cb 0.43 -0.04 -0.04 0.00 0.06 0.00 0.00 31.60 32.01 1fz9 h MET 140 CO -0.30 0.57 -0.28 0.93 1.06 0.00 0.00 176.91 178.88 1fz9 h GLU 141 N 0.17 -0.47 -0.46 1.72 5.08 -0.86 0.54 114.58 120.31 1fz9 h GLU 141 Ca 0.07 0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.49 1fz9 h GLU 141 Cb 0.39 0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.71 1fz9 h GLU 141 CO 0.01 -0.31 0.23 -0.07 -1.00 0.00 0.00 179.01 177.87 1fz9 h LEU 142 N -0.49 0.34 -0.64 1.33 3.38 -1.23 -3.08 115.31 114.91 1fz9 h LEU 142 Ca 0.04 0.02 -0.14 0.00 0.09 0.00 0.00 57.88 57.89 1fz9 h LEU 142 Cb 0.52 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 1fz9 h LEU 142 CO -0.18 0.24 -0.40 0.03 0.09 0.00 0.00 178.44 178.22 1fz9 h ARG 143 N 0.46 0.61 -0.33 1.13 3.08 -0.35 -3.27 114.38 115.71 1fz9 h ARG 143 Ca 0.20 -0.31 0.00 0.00 0.07 0.00 0.00 59.98 59.94 1fz9 h ARG 143 Cb 0.10 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.15 1fz9 h ARG 143 CO -0.13 0.90 0.00 0.09 -1.07 0.00 0.00 179.97 179.76 1fz9 n ASN 144 N -4.03 1.76 -4.61 7.04 3.02 0.18 -4.57 115.26 114.05 1fz9 n ASN 144 Ca -0.02 -2.00 -0.41 0.00 -0.03 0.00 0.00 54.58 52.12 1fz9 n ASN 144 Cb 0.52 -0.22 -0.06 0.00 -0.61 0.00 0.00 39.78 39.41 1fz9 n ASN 144 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1fz9 s LEU 145 N -1.00 4.11 -1.33 3.41 2.96 -1.18 -3.92 118.68 121.72 1fz9 s LEU 145 Ca 0.22 0.58 -0.05 0.00 -0.22 0.00 0.00 54.13 54.66 1fz9 s LEU 145 Cb 0.11 -2.93 0.02 0.00 0.50 0.00 0.00 46.19 43.90 1fz9 s LEU 145 CO 0.15 -0.51 0.96 0.59 -1.32 0.00 0.00 176.35 176.22 1fz9 n ASN 146 N 5.97 -3.37 -0.25 3.68 3.02 -1.26 -4.87 115.26 118.18 1fz9 n ASN 146 Ca 0.01 -0.69 0.26 0.00 -0.03 0.00 0.00 54.58 54.13 1fz9 n ASN 146 Cb 0.49 -4.56 0.62 0.00 -0.61 0.00 0.00 39.78 35.72 1fz9 n ASN 146 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 1fz9 h TYR 147 N -2.12 0.31 -0.12 3.10 3.20 -1.81 -2.16 116.97 117.36 1fz9 h TYR 147 Ca -0.59 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.29 1fz9 h TYR 147 Cb 1.36 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 39.54 1fz9 h TYR 147 CO 0.49 0.05 0.00 0.66 -1.64 0.00 0.00 178.16 177.72 1fz9 n TYR 148 N -4.41 0.14 0.04 -3.82 4.02 -1.26 -4.67 117.16 107.20 1fz9 n TYR 148 Ca 0.21 -0.11 -0.13 0.00 -0.01 0.00 0.00 57.90 57.87 1fz9 n TYR 148 Cb 0.91 -0.00 -0.08 0.00 -0.02 0.00 0.00 39.34 40.15 1fz9 n TYR 148 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 1fz9 h ASP 149 N 2.98 -0.03 -2.70 7.72 5.19 -1.76 -3.42 116.42 124.40 1fz9 h ASP 149 Ca 0.00 -0.17 -0.56 0.00 -0.62 0.00 0.00 57.03 55.68 1fz9 h ASP 149 Cb 0.68 0.01 -0.02 0.00 0.18 0.00 0.00 39.33 40.18 1fz9 h ASP 149 CO 0.00 0.15 1.11 -0.89 -3.12 0.00 0.00 179.24 176.49 1fz9 s THR 150 N -5.48 3.67 0.85 0.35 2.01 -1.26 -4.98 115.64 110.80 1fz9 s THR 150 Ca -0.14 0.78 -0.12 0.00 0.31 0.00 0.00 61.69 62.51 1fz9 s THR 150 Cb 0.04 -3.62 0.11 0.00 0.01 0.00 0.00 72.50 69.04 1fz9 s THR 150 CO 0.66 -0.20 1.19 -2.16 -0.69 0.00 0.00 174.62 173.42 1fz9 s PRO 151 N 4.45 1.41 0.30 4.92 0.04 -1.26 -4.65 135.00 140.20 1fz9 s PRO 151 Ca 0.72 1.69 0.02 0.00 0.04 0.00 0.00 61.00 63.48 1fz9 s PRO 151 Cb -0.28 -1.76 0.60 0.00 0.04 0.00 0.00 34.50 33.10 1fz9 s PRO 151 CO 0.29 -2.37 1.85 -0.07 0.04 0.00 0.00 177.00 176.73 1fz9 h LEU 152 N -1.25 0.89 -0.52 -3.56 3.38 -1.94 -0.22 115.31 112.09 1fz9 h LEU 152 Ca -0.45 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.55 1fz9 h LEU 152 Cb 1.29 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.88 1fz9 h LEU 152 CO 0.44 0.47 0.29 -0.33 0.09 0.00 0.00 178.44 179.41 1fz9 h GLU 153 N 0.95 0.72 -0.15 1.13 3.07 -2.00 -0.98 114.58 117.32 1fz9 h GLU 153 Ca 0.48 -0.08 -0.19 0.00 -0.50 0.00 0.00 59.36 59.08 1fz9 h GLU 153 Cb 0.51 -0.14 -0.00 0.00 -0.84 0.00 0.00 28.75 28.27 1fz9 h GLU 153 CO -0.25 0.55 -0.68 1.49 -1.40 0.00 0.00 179.01 178.72 1fz9 h GLU 154 N 0.69 0.59 -0.63 2.33 4.57 -1.74 -3.16 114.58 117.22 1fz9 h GLU 154 Ca 0.18 -0.44 -0.09 0.00 -1.18 0.00 0.00 59.36 57.83 1fz9 h GLU 154 Cb 0.03 0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.68 1fz9 h GLU 154 CO -0.03 1.06 0.03 1.25 -1.18 0.00 0.00 179.01 180.13 1fz9 h LEU 155 N 0.42 1.06 -0.59 1.64 5.85 -0.88 -1.32 115.31 121.50 1fz9 h LEU 155 Ca -0.02 -0.30 0.05 0.00 0.84 0.00 0.00 57.88 58.45 1fz9 h LEU 155 Cb 1.26 -0.29 -0.05 0.00 0.37 0.00 0.00 40.66 41.95 1fz9 h LEU 155 CO 0.13 1.10 0.32 0.03 -0.34 0.00 0.00 178.44 179.67 1fz9 h ARG 156 N 1.00 0.59 -0.46 1.25 3.08 -1.21 0.15 114.38 118.77 1fz9 h ARG 156 Ca 0.18 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.17 1fz9 h ARG 156 Cb 0.54 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 1fz9 h ARG 156 CO 0.03 0.39 0.20 0.87 -1.07 0.00 0.00 179.97 180.39 1fz9 h LYS 157 N 0.60 0.68 -0.35 0.04 1.57 -1.48 -0.69 116.57 116.95 1fz9 h LYS 157 Ca 0.26 -0.11 0.03 0.00 -1.87 0.00 0.00 60.65 58.96 1fz9 h LYS 157 Cb 0.15 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.31 1fz9 h LYS 157 CO -0.17 0.60 0.16 1.96 -0.57 0.00 0.00 179.45 181.43 1fz9 h GLN 158 N 0.60 0.32 0.00 3.15 4.20 -0.37 -0.97 115.11 122.05 1fz9 h GLN 158 Ca 0.16 -0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.80 1fz9 h GLN 158 Cb 0.16 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.86 1fz9 h GLN 158 CO -0.02 0.21 -0.23 -0.09 -0.67 0.00 0.00 178.83 178.03 1fz9 h ARG 159 N 0.33 0.00 -0.27 1.46 9.65 -0.51 -3.46 114.38 121.57 1fz9 h ARG 159 Ca 0.15 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 59.03 1fz9 h ARG 159 Cb 0.08 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.66 1fz9 h ARG 159 CO -0.12 0.23 -0.00 0.41 2.80 0.00 0.00 179.97 183.29 1fz9 n GLY 160 N -0.33 0.52 3.89 2.80 0.00 -0.30 -5.05 105.19 106.71 1fz9 n GLY 160 Ca -0.01 -0.83 -0.29 0.00 0.00 0.00 0.00 46.02 44.88 1fz9 n GLY 160 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fz9 s VAL 161 N -2.26 3.74 -0.33 1.61 0.11 -0.99 -5.04 120.40 117.23 1fz9 s VAL 161 Ca 0.00 0.42 -0.06 0.00 -2.93 0.00 0.00 61.98 59.41 1fz9 s VAL 161 Cb -0.00 -3.54 0.04 0.00 -1.53 0.00 0.00 36.38 31.35 1fz9 s VAL 161 CO 0.00 -0.67 0.09 -0.60 -3.33 0.00 0.00 175.10 170.59 1fz9 s ARG 162 N -5.23 2.59 -0.47 1.54 3.52 -1.26 -4.82 118.95 114.82 1fz9 s ARG 162 Ca 0.56 -1.19 -0.27 0.00 -0.13 0.00 0.00 55.73 54.70 1fz9 s ARG 162 Cb -0.11 -3.43 -0.02 0.00 -1.56 0.00 0.00 34.95 29.83 1fz9 s ARG 162 CO 0.50 -0.66 1.86 0.08 -0.81 0.00 0.00 175.30 176.27 1fz9 s VAL 163 N 1.38 3.40 -0.15 7.11 1.01 -1.26 -4.84 120.40 127.05 1fz9 s VAL 163 Ca -0.02 0.34 -0.16 0.00 0.00 0.00 0.00 61.98 62.13 1fz9 s VAL 163 Cb -0.20 -3.76 -0.13 0.00 0.00 0.00 0.00 36.38 32.30 1fz9 s VAL 163 CO 0.02 -0.62 0.23 0.58 0.00 0.00 0.00 175.10 175.31 1fz9 h VAL 164 N 6.89 0.75 -3.52 2.92 2.07 -2.06 -3.47 116.25 119.82 1fz9 h VAL 164 Ca -0.29 -1.70 -0.31 0.00 0.82 0.00 0.00 66.70 65.21 1fz9 h VAL 164 Cb 1.17 1.55 -0.34 0.00 -1.52 0.00 0.00 31.29 32.16 1fz9 h VAL 164 CO 1.13 0.25 -0.74 -2.28 0.02 0.00 0.00 177.57 175.96 1fz9 s HIS 165 N -2.12 0.12 -0.04 1.57 2.46 -1.26 -5.14 115.29 110.88 1fz9 s HIS 165 Ca -0.17 0.09 0.06 0.00 0.47 0.00 0.00 55.06 55.51 1fz9 s HIS 165 Cb 0.01 -0.29 -0.02 0.00 -0.13 0.00 0.00 32.58 32.16 1fz9 s HIS 165 CO 0.41 -0.10 -0.23 -0.51 -2.47 0.00 0.00 174.74 171.83 1fz9 s LEU 166 N 1.03 2.18 -0.23 8.88 2.01 -1.26 -5.11 118.68 126.18 1fz9 s LEU 166 Ca -0.09 -0.44 -0.03 0.00 0.01 0.00 0.00 54.13 53.58 1fz9 s LEU 166 Cb -0.13 -1.39 0.11 0.00 0.01 0.00 0.00 46.19 44.79 1fz9 s LEU 166 CO -0.03 0.29 0.26 -1.58 1.01 0.00 0.00 176.35 176.31 1fz9 s GLN 167 N -0.41 0.25 0.02 1.70 0.74 -1.26 -5.14 119.66 115.56 1fz9 s GLN 167 Ca 0.04 0.16 0.09 0.00 0.05 0.00 0.00 55.36 55.69 1fz9 s GLN 167 Cb -0.12 -0.95 -0.03 0.00 1.10 0.00 0.00 33.01 33.01 1fz9 s GLN 167 CO 0.01 -0.75 -0.26 0.45 -0.55 0.00 0.00 175.29 174.19 1fz9 s SER 168 N 2.37 3.11 0.00 6.67 0.15 -1.26 -5.34 113.70 119.39 1fz9 s SER 168 Ca 0.09 -0.55 0.11 0.00 0.70 0.00 0.00 55.95 56.30 1fz9 s SER 168 Cb -0.15 -0.30 0.66 0.00 -1.71 0.00 0.00 66.02 64.52 1fz9 s SER 168 CO -0.18 0.28 1.10 -0.81 1.20 0.00 0.00 173.24 174.82