#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 4.09 -0.05 3.14 2.01 -1.26 -2.61 118.68 124.00 1fz9 s LEU 4 Ca 0.00 1.35 -0.31 0.00 0.01 0.00 0.00 54.13 55.18 1fz9 s LEU 4 Cb 0.00 -4.06 0.12 0.00 0.01 0.00 0.00 46.19 42.26 1fz9 s LEU 4 CO 0.00 -0.19 1.17 -0.83 1.01 0.00 0.00 176.35 177.51 1fz9 s GLY 5 N -2.16 -0.35 -0.21 -3.19 0.00 -1.25 -4.81 107.32 95.34 1fz9 s GLY 5 Ca 0.53 0.98 0.03 0.00 0.00 0.00 0.00 44.72 46.26 1fz9 s GLY 5 CO 0.18 0.28 -0.17 1.39 0.00 0.00 0.00 173.10 174.77 1fz9 n ILE 6 N -0.31 1.24 -0.06 0.90 5.41 -1.26 -4.67 119.36 120.61 1fz9 n ILE 6 Ca -0.05 -0.50 -0.05 0.00 1.00 0.00 0.00 62.75 63.16 1fz9 n ILE 6 Cb 0.61 -1.20 -0.10 0.00 -0.71 0.00 0.00 39.64 38.23 1fz9 n ILE 6 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 1fz9 n HIS 7 N -3.09 0.00 -3.74 1.39 8.25 -1.26 -4.92 115.22 111.85 1fz9 n HIS 7 Ca -0.37 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 56.83 1fz9 n HIS 7 Cb 0.92 -0.59 -0.17 0.00 1.12 0.00 0.00 29.99 31.27 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 -4.45 2.27 0.09 0.41 0.15 -1.26 -5.08 113.70 105.82 1fz9 s SER 8 Ca -0.06 -0.47 -0.17 0.00 0.70 0.00 0.00 55.95 55.95 1fz9 s SER 8 Cb 0.04 -0.49 0.04 0.00 -1.71 0.00 0.00 66.02 63.90 1fz9 s SER 8 CO 0.53 -0.26 0.41 0.54 1.20 0.00 0.00 173.24 175.66 1fz9 s ASN 9 N 1.94 -0.25 0.20 5.45 2.20 -1.26 -3.77 114.94 119.44 1fz9 s ASN 9 Ca 0.02 -0.19 -0.16 0.00 -0.94 0.00 0.00 52.86 51.59 1fz9 s ASN 9 Cb -0.15 0.45 0.18 0.00 -2.00 0.00 0.00 41.25 39.74 1fz9 s ASN 9 CO -0.07 -0.77 1.62 0.44 -2.94 0.00 0.00 177.10 175.38 1fz9 h ASP 10 N 2.63 -0.73 -0.09 3.54 3.32 -1.87 0.20 116.42 123.42 1fz9 h ASP 10 Ca -0.33 0.19 0.03 0.00 0.02 0.00 0.00 57.03 56.94 1fz9 h ASP 10 Cb 1.23 0.42 -0.00 0.00 0.22 0.00 0.00 39.33 41.20 1fz9 h ASP 10 CO 0.46 -0.24 0.23 0.00 -1.72 0.00 0.00 179.24 177.97 1fz9 h THR 11 N -0.07 0.17 0.04 0.35 1.03 -1.98 0.23 112.91 112.69 1fz9 h THR 11 Ca 0.26 0.00 -0.26 0.00 -0.01 0.00 0.00 66.41 66.41 1fz9 h THR 11 Cb 0.48 0.79 -0.02 0.00 -1.07 0.00 0.00 68.15 68.32 1fz9 h THR 11 CO -0.62 0.00 -1.38 0.03 -0.01 0.00 0.00 175.52 173.54 1fz9 h ARG 12 N 0.00 0.09 -0.24 0.00 3.08 -1.10 -3.30 114.38 112.91 1fz9 h ARG 12 Ca 0.04 -0.16 0.07 0.00 0.07 0.00 0.00 59.98 60.00 1fz9 h ARG 12 Cb 0.50 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.60 1fz9 h ARG 12 CO -0.00 1.08 0.18 -0.44 -1.07 0.00 0.00 179.97 179.71 1fz9 h ASP 13 N -0.67 0.00 -0.42 7.04 3.32 -0.18 -1.79 116.42 123.73 1fz9 h ASP 13 Ca -0.34 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.69 1fz9 h ASP 13 Cb 1.51 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.05 1fz9 h ASP 13 CO -0.10 0.00 0.18 0.00 -1.72 0.00 0.00 179.24 177.61 1fz9 h ALA 14 N 1.87 0.54 -0.04 3.45 0.00 -0.69 -2.44 119.26 121.95 1fz9 h ALA 14 Ca 0.11 -0.13 -0.15 0.00 0.00 0.00 0.00 54.91 54.74 1fz9 h ALA 14 Cb 0.47 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1fz9 h ALA 14 CO -0.00 0.12 -0.67 -1.49 0.00 0.00 0.00 179.25 177.21 1fz9 h TRP 15 N 0.53 0.22 -0.18 0.00 4.06 -1.41 -1.43 115.95 117.75 1fz9 h TRP 15 Ca 0.14 -0.09 -0.11 0.00 2.06 0.00 0.00 58.89 60.89 1fz9 h TRP 15 Cb 0.15 -0.03 -0.01 0.00 -1.00 0.00 0.00 29.16 28.27 1fz9 h TRP 15 CO -0.01 0.78 -0.36 -0.39 -3.56 0.00 0.00 178.44 174.90 1fz9 h VAL 16 N 0.11 1.29 -0.35 1.49 -1.51 -1.45 1.69 116.25 117.52 1fz9 h VAL 16 Ca -0.01 -1.45 -0.04 0.00 -1.23 0.00 0.00 66.70 63.97 1fz9 h VAL 16 Cb 1.19 1.56 -0.01 0.00 -2.13 0.00 0.00 31.29 31.90 1fz9 h VAL 16 CO 0.10 0.44 0.07 -1.13 -1.23 0.00 0.00 177.57 175.82 1fz9 h ASN 17 N 0.32 0.55 -0.02 4.19 -1.24 -1.28 0.03 115.58 118.12 1fz9 h ASN 17 Ca 0.04 -0.25 -0.01 0.00 0.71 0.00 0.00 56.30 56.79 1fz9 h ASN 17 Cb 0.79 -0.14 -0.00 0.00 0.73 0.00 0.00 38.32 39.69 1fz9 h ASN 17 CO 0.06 0.65 -0.02 0.50 -1.29 0.00 0.00 177.43 177.34 1fz9 h LYS 18 N 0.42 0.05 -0.06 6.67 3.64 -0.72 -3.10 116.57 123.47 1fz9 h LYS 18 Ca 0.11 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.48 1fz9 h LYS 18 Cb 0.33 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.15 1fz9 h LYS 18 CO 0.00 0.51 0.04 0.82 -2.27 0.00 0.00 179.45 178.55 1fz9 h ILE 19 N -0.41 0.98 -0.76 2.00 2.04 0.26 -2.25 117.51 119.37 1fz9 h ILE 19 Ca 0.00 -0.01 -0.03 0.00 1.00 0.00 0.00 64.86 65.83 1fz9 h ILE 19 Cb 0.49 0.96 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 1fz9 h ILE 19 CO 0.00 0.00 0.34 0.00 0.00 0.00 0.00 178.15 178.50 1fz9 h ALA 20 N 1.97 1.18 -0.06 1.87 0.00 -0.90 -2.32 119.26 120.99 1fz9 h ALA 20 Ca 0.03 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.80 1fz9 h ALA 20 Cb 0.09 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 1fz9 h ALA 20 CO -0.00 0.61 0.10 -0.56 0.00 0.00 0.00 179.25 179.41 1fz9 h GLN 21 N 1.08 0.00 -6.77 0.00 3.07 -1.42 -3.42 115.11 107.65 1fz9 h GLN 21 Ca 0.26 0.00 -0.53 0.00 0.09 0.00 0.00 58.65 58.47 1fz9 h GLN 21 Cb 0.14 0.00 0.06 0.00 0.08 0.00 0.00 27.48 27.75 1fz9 h GLN 21 CO -0.03 0.00 0.72 -0.51 0.09 0.00 0.00 178.83 179.10 1fz9 s LEU 22 N -7.11 4.40 0.00 0.06 1.43 -0.88 -4.88 118.68 111.70 1fz9 s LEU 22 Ca -0.05 2.65 0.03 0.00 -1.03 0.00 0.00 54.13 55.73 1fz9 s LEU 22 Cb 0.14 -3.63 0.04 0.00 0.03 0.00 0.00 46.19 42.78 1fz9 s LEU 22 CO 0.49 -0.65 0.89 -0.46 0.23 0.00 0.00 176.35 176.85 1fz9 n ASN 23 N 1.99 -0.50 -3.64 2.29 6.94 -1.26 -5.08 115.26 116.00 1fz9 n ASN 23 Ca 0.05 -1.74 -0.10 0.00 -0.02 0.00 0.00 54.58 52.77 1fz9 n ASN 23 Cb 0.41 0.14 -0.10 0.00 -2.36 0.00 0.00 39.78 37.87 1fz9 n ASN 23 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1fz9 s THR 24 N 0.00 -0.59 -0.19 5.53 -4.23 -1.26 -5.01 115.64 109.89 1fz9 s THR 24 Ca 0.03 0.18 0.09 0.00 -1.18 0.00 0.00 61.69 60.81 1fz9 s THR 24 Cb 0.04 -0.62 0.09 0.00 1.34 0.00 0.00 72.50 73.35 1fz9 s THR 24 CO -0.02 0.07 1.13 -0.11 -0.54 0.00 0.00 174.62 175.16 1fz9 n LEU 25 N 5.38 0.23 0.00 4.79 7.94 -1.26 -2.85 117.00 131.23 1fz9 n LEU 25 Ca -0.08 0.47 0.00 0.00 -1.11 0.00 0.00 56.01 55.29 1fz9 n LEU 25 Cb 0.49 -0.44 0.00 0.00 0.53 0.00 0.00 43.42 44.01 1fz9 n LEU 25 CO 0.01 -0.55 0.24 -0.62 -1.11 0.00 0.00 177.39 175.36 1fz9 n GLU 26 N -1.80 0.00 0.22 1.96 -0.58 -1.26 -2.21 120.64 116.98 1fz9 n GLU 26 Ca -0.01 0.05 0.08 0.00 -0.42 0.00 0.00 57.16 56.86 1fz9 n GLU 26 Cb 0.28 -0.97 0.51 0.00 -0.57 0.00 0.00 31.44 30.69 1fz9 n GLU 26 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 1fz9 h LYS 27 N 0.00 0.00 0.37 3.49 1.57 -1.98 -2.86 116.57 117.17 1fz9 h LYS 27 Ca 0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1fz9 h LYS 27 Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 1fz9 h LYS 27 CO 0.00 0.25 -0.33 0.00 -0.57 0.00 0.00 179.45 178.80 1fz9 h ALA 28 N 1.75 -0.73 -0.79 3.86 0.00 -1.61 0.93 119.26 122.67 1fz9 h ALA 28 Ca -0.00 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.81 1fz9 h ALA 28 Cb 0.57 0.46 -0.04 0.00 0.00 0.00 0.00 17.79 18.77 1fz9 h ALA 28 CO 0.03 -0.94 0.51 0.00 0.00 0.00 0.00 179.25 178.86 1fz9 h ALA 29 N -0.22 1.02 -0.58 0.00 0.00 -1.37 -1.91 119.26 116.20 1fz9 h ALA 29 Ca -0.03 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 1fz9 h ALA 29 Cb 0.63 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1fz9 h ALA 29 CO -0.04 0.36 0.18 1.49 0.00 0.00 0.00 179.25 181.25 1fz9 h GLU 30 N 1.03 0.90 -0.04 0.00 4.57 -1.20 -2.90 114.58 116.93 1fz9 h GLU 30 Ca 0.30 -0.20 -0.06 0.00 -1.18 0.00 0.00 59.36 58.23 1fz9 h GLU 30 Cb -0.05 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.40 1fz9 h GLU 30 CO -0.09 0.81 -0.26 1.98 -1.18 0.00 0.00 179.01 180.27 1fz9 h MET 31 N 0.82 0.07 -0.01 1.92 4.05 0.14 -2.56 114.93 119.37 1fz9 h MET 31 Ca 0.19 -0.02 -0.00 0.00 -0.28 0.00 0.00 59.70 59.58 1fz9 h MET 31 Cb 0.29 -0.01 -0.00 0.00 -0.80 0.00 0.00 31.60 31.08 1fz9 h MET 31 CO -0.01 0.34 0.00 1.25 0.23 0.00 0.00 176.91 178.72 1fz9 h LEU 32 N 0.07 0.01 -1.42 3.39 5.85 -1.16 -1.00 115.31 121.05 1fz9 h LEU 32 Ca 0.01 -0.25 0.05 0.00 0.84 0.00 0.00 57.88 58.53 1fz9 h LEU 32 Cb 0.50 -0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 1fz9 h LEU 32 CO 0.04 0.26 0.44 0.50 -0.34 0.00 0.00 178.44 179.34 1fz9 h LYS 33 N -0.24 0.71 -0.01 1.25 3.64 -1.40 -1.27 116.57 119.25 1fz9 h LYS 33 Ca 0.00 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1fz9 h LYS 33 Cb 0.25 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.91 1fz9 h LYS 33 CO 0.00 0.47 -0.01 1.96 -2.27 0.00 0.00 179.45 179.60 1fz9 h GLN 34 N 0.73 0.03 -0.73 1.90 1.08 -1.29 -2.13 115.11 114.70 1fz9 h GLN 34 Ca 0.28 -0.02 0.16 0.00 -1.45 0.00 0.00 58.65 57.62 1fz9 h GLN 34 Cb 0.19 0.00 -0.11 0.00 -0.05 0.00 0.00 27.48 27.51 1fz9 h GLN 34 CO -0.09 0.50 0.17 0.35 -0.95 0.00 0.00 178.83 178.81 1fz9 h PHE 35 N -0.44 0.26 -0.48 2.96 3.57 -0.66 -0.02 116.94 122.14 1fz9 h PHE 35 Ca 0.00 0.04 -0.08 0.00 3.53 0.00 0.00 57.97 61.46 1fz9 h PHE 35 Cb 0.49 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.21 1fz9 h PHE 35 CO 0.09 -0.09 -0.04 0.00 -2.23 0.00 0.00 178.31 176.05 1fz9 h ARG 36 N 0.26 0.83 -0.30 1.11 3.08 -1.20 -0.21 114.38 117.95 1fz9 h ARG 36 Ca 0.41 -0.25 -0.11 0.00 0.07 0.00 0.00 59.98 60.11 1fz9 h ARG 36 Cb 0.70 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.65 1fz9 h ARG 36 CO -0.51 0.86 -0.26 0.52 -1.07 0.00 0.00 179.97 179.51 1fz9 h MET 37 N 0.77 0.60 0.09 0.04 2.86 -0.33 -2.71 114.93 116.25 1fz9 h MET 37 Ca 0.14 -0.24 -0.34 0.00 -2.06 0.00 0.00 59.70 57.20 1fz9 h MET 37 Cb 0.51 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.12 1fz9 h MET 37 CO 0.03 0.80 -1.87 -0.44 1.06 0.00 0.00 176.91 176.49 1fz9 h ASP 38 N 0.53 0.31 -0.06 1.22 3.32 -1.22 -2.78 116.42 117.73 1fz9 h ASP 38 Ca 0.07 -0.66 0.00 0.00 0.02 0.00 0.00 57.03 56.47 1fz9 h ASP 38 Cb 0.72 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.17 1fz9 h ASP 38 CO 0.06 1.59 0.00 1.41 -1.72 0.00 0.00 179.24 180.57 1fz9 n HIS 39 N -3.36 0.05 -4.22 4.55 8.25 -0.10 0.06 115.22 120.45 1fz9 n HIS 39 Ca -0.26 -0.04 -0.19 0.00 -0.26 0.00 0.00 57.72 56.97 1fz9 n HIS 39 Cb 1.05 -0.00 -0.12 0.00 1.12 0.00 0.00 29.99 32.04 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 -1.23 1.30 0.18 1.59 -4.23 -1.02 -4.86 115.64 107.37 1fz9 s THR 40 Ca 0.19 -1.56 0.00 0.00 -1.18 0.00 0.00 61.69 59.13 1fz9 s THR 40 Cb 0.13 -1.38 0.00 0.00 1.34 0.00 0.00 72.50 72.58 1fz9 s THR 40 CO 0.19 -0.31 0.00 0.35 -0.54 0.00 0.00 174.62 174.31 1fz9 n THR 41 N 0.84 -0.23 0.33 3.99 -2.24 -1.26 -3.12 114.28 112.59 1fz9 n THR 41 Ca -0.18 0.26 0.22 0.00 -2.27 0.00 0.00 64.05 62.09 1fz9 n THR 41 Cb 0.56 -0.41 1.17 0.00 -2.10 0.00 0.00 70.33 69.55 1fz9 n THR 41 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 1fz9 h PRO 42 N -0.44 0.00 -0.45 -0.78 0.11 -2.00 -0.74 132.00 127.70 1fz9 h PRO 42 Ca -0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.06 1fz9 h PRO 42 Cb 0.43 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.54 1fz9 h PRO 42 CO 0.02 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 179.00 1fz9 n PHE 43 N -3.02 0.59 -0.85 0.65 3.72 -1.26 -4.97 117.46 112.32 1fz9 n PHE 43 Ca -0.03 -0.30 -0.33 0.00 -0.05 0.00 0.00 57.45 56.74 1fz9 n PHE 43 Cb 0.08 0.00 0.11 0.00 -0.94 0.00 0.00 39.48 38.73 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 0.94 -0.22 0.18 -1.08 1.85 -0.29 -4.90 116.66 113.14 1fz9 n ARG 44 Ca 0.17 -0.02 0.10 0.00 -1.00 0.00 0.00 57.85 57.09 1fz9 n ARG 44 Cb 0.43 -1.83 0.11 0.00 -1.05 0.00 0.00 32.46 30.12 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 -1.43 0.00 -5.06 2.89 -0.26 -0.08 -3.48 115.58 108.17 1fz9 h ASN 45 Ca -0.44 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 55.29 1fz9 h ASN 45 Cb 1.29 0.00 -0.10 0.00 -1.06 0.00 0.00 38.32 38.45 1fz9 h ASN 45 CO 0.35 0.12 0.09 -0.55 -1.06 0.00 0.00 177.43 176.38 1fz9 s SER 46 N -6.15 -0.32 -0.13 5.81 0.15 0.09 -5.04 113.70 108.10 1fz9 s SER 46 Ca 0.05 -0.39 0.17 0.00 0.70 0.00 0.00 55.95 56.49 1fz9 s SER 46 Cb 0.06 0.60 0.29 0.00 -1.71 0.00 0.00 66.02 65.25 1fz9 s SER 46 CO 0.70 -1.06 1.15 -1.22 1.20 0.00 0.00 173.24 174.01 1fz9 n TYR 47 N -0.36 0.00 0.33 3.44 4.02 -1.26 -4.49 117.16 118.84 1fz9 n TYR 47 Ca -0.11 -0.99 0.15 0.00 -0.01 0.00 0.00 57.90 56.94 1fz9 n TYR 47 Cb 0.63 -0.15 0.55 0.00 -0.02 0.00 0.00 39.34 40.34 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 0.08 0.00 -0.27 -0.72 4.11 -1.96 -2.75 114.58 113.08 1fz9 h GLU 48 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1fz9 h GLU 48 Cb 1.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.27 1fz9 h GLU 48 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 179.01 180.36 1fz9 n LEU 49 N -2.79 3.57 -0.27 3.06 4.77 -1.26 -4.74 117.00 119.33 1fz9 n LEU 49 Ca 0.02 -2.76 0.04 0.00 -0.03 0.00 0.00 56.01 53.28 1fz9 n LEU 49 Cb 0.32 -0.46 0.13 0.00 -2.33 0.00 0.00 43.42 41.08 1fz9 n LEU 49 CO 0.26 0.69 0.76 -0.78 -1.33 0.00 0.00 177.39 176.98 1fz9 h ASP 50 N 1.76 -0.57 0.99 -1.43 3.58 -1.82 0.60 116.42 119.53 1fz9 h ASP 50 Ca 0.00 0.22 0.00 0.00 0.42 0.00 0.00 57.03 57.67 1fz9 h ASP 50 Cb 1.24 0.43 0.00 0.00 1.72 0.00 0.00 39.33 42.72 1fz9 h ASP 50 CO 0.16 -0.24 0.00 0.59 -2.88 0.00 0.00 179.24 176.87 1fz9 n ASN 51 N -5.45 0.56 0.00 2.28 3.02 -1.26 -4.16 115.26 110.26 1fz9 n ASN 51 Ca 0.13 0.60 0.00 0.00 -0.03 0.00 0.00 54.58 55.27 1fz9 n ASN 51 Cb 0.45 -0.73 0.00 0.00 -0.61 0.00 0.00 39.78 38.89 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 -2.07 0.24 -0.25 6.41 8.00 0.14 -4.88 116.55 124.15 1fz9 n ASP 52 Ca 0.04 -0.71 -0.06 0.00 0.71 0.00 0.00 54.79 54.77 1fz9 n ASP 52 Cb 0.31 0.13 0.05 0.00 -0.02 0.00 0.00 41.12 41.59 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 0.94 -0.80 1.24 -0.00 -0.08 -2.17 116.97 116.10 1fz9 h TYR 53 Ca 0.00 -0.02 0.09 0.00 0.00 0.00 0.00 58.73 58.80 1fz9 h TYR 53 Cb 0.20 -0.30 -0.07 0.00 0.00 0.00 0.00 36.73 36.56 1fz9 h TYR 53 CO 0.00 0.67 0.45 -0.07 -0.00 0.00 0.00 178.16 179.21 1fz9 h LEU 54 N 0.94 0.65 -0.11 0.10 3.38 -1.85 0.55 115.31 118.96 1fz9 h LEU 54 Ca 0.24 0.05 -0.06 0.00 0.09 0.00 0.00 57.88 58.19 1fz9 h LEU 54 Cb 0.04 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 1fz9 h LEU 54 CO -0.04 0.37 -0.18 -0.25 0.09 0.00 0.00 178.44 178.44 1fz9 h TRP 55 N 0.77 0.40 -0.44 1.13 7.01 -1.88 -2.99 115.95 119.94 1fz9 h TRP 55 Ca 0.39 -0.14 -0.05 0.00 2.11 0.00 0.00 58.89 61.21 1fz9 h TRP 55 Cb 0.35 -0.08 -0.02 0.00 -2.10 0.00 0.00 29.16 27.31 1fz9 h TRP 55 CO -0.07 0.78 0.10 0.82 -2.79 0.00 0.00 178.44 177.29 1fz9 h ILE 56 N -0.10 1.24 -0.69 2.65 2.04 -0.98 -1.49 117.51 120.19 1fz9 h ILE 56 Ca 0.01 -0.83 0.13 0.00 1.00 0.00 0.00 64.86 65.17 1fz9 h ILE 56 Cb 0.74 0.93 -0.09 0.00 -0.74 0.00 0.00 36.82 37.66 1fz9 h ILE 56 CO 0.04 0.29 0.24 -0.08 0.00 0.00 0.00 178.15 178.64 1fz9 h GLU 57 N 0.59 0.37 -0.47 2.37 4.81 0.05 0.22 114.58 122.51 1fz9 h GLU 57 Ca 0.14 -0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 59.22 1fz9 h GLU 57 Cb 0.33 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.62 1fz9 h GLU 57 CO 0.00 0.25 -0.18 0.00 -0.73 0.00 0.00 179.01 178.35 1fz9 h ALA 58 N 1.51 0.66 0.00 2.92 0.00 -1.34 0.69 119.26 123.70 1fz9 h ALA 58 Ca 0.37 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1fz9 h ALA 58 Cb 0.54 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 1fz9 h ALA 58 CO -0.39 0.62 -0.09 0.87 0.00 0.00 0.00 179.25 180.27 1fz9 h LYS 59 N 0.81 0.00 0.00 0.00 1.79 -0.12 -1.00 116.57 118.05 1fz9 h LYS 59 Ca 0.11 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.57 1fz9 h LYS 59 Cb 0.75 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.40 1fz9 h LYS 59 CO 0.06 0.09 -0.04 1.25 -1.08 0.00 0.00 179.45 179.73 1fz9 h LEU 60 N 0.00 0.00 -1.52 2.94 5.85 -0.12 -3.28 115.31 119.18 1fz9 h LEU 60 Ca -0.00 -0.92 0.17 0.00 0.84 0.00 0.00 57.88 57.97 1fz9 h LEU 60 Cb 0.31 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.28 1fz9 h LEU 60 CO 0.01 0.98 0.55 -0.33 -0.34 0.00 0.00 178.44 179.32 1fz9 h GLU 61 N -1.00 0.43 0.77 1.25 5.08 -0.39 -1.85 114.58 118.85 1fz9 h GLU 61 Ca -0.01 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 1fz9 h GLU 61 Cb 0.94 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.10 1fz9 h GLU 61 CO -0.01 0.28 -0.41 0.93 -1.00 0.00 0.00 179.01 178.80 1fz9 h GLU 62 N 0.44 -1.05 -0.91 2.33 5.08 -1.29 -0.52 114.58 118.66 1fz9 h GLU 62 Ca 0.42 0.07 0.11 0.00 -1.00 0.00 0.00 59.36 58.97 1fz9 h GLU 62 Cb 0.98 0.24 -0.07 0.00 0.50 0.00 0.00 28.75 30.40 1fz9 h GLU 62 CO -0.15 -0.70 0.59 -0.22 -1.00 0.00 0.00 179.01 177.53 1fz9 h LYS 63 N -1.09 0.83 0.00 2.33 1.63 -1.42 0.54 116.57 119.39 1fz9 h LYS 63 Ca -0.10 -0.05 -0.09 0.00 -0.85 0.00 0.00 60.65 59.56 1fz9 h LYS 63 Cb 0.85 -0.19 -0.01 0.00 -0.60 0.00 0.00 32.23 32.28 1fz9 h LYS 63 CO 0.14 0.55 -0.42 0.28 -3.45 0.00 0.00 179.45 176.54 1fz9 h VAL 64 N 0.85 1.30 -0.01 2.00 2.07 -1.11 -2.54 116.25 118.81 1fz9 h VAL 64 Ca 0.44 -1.46 -0.01 0.00 0.82 0.00 0.00 66.70 66.49 1fz9 h VAL 64 Cb 0.51 1.79 0.00 0.00 -1.52 0.00 0.00 31.29 32.07 1fz9 h VAL 64 CO -0.20 0.42 -0.04 0.00 0.02 0.00 0.00 177.57 177.76 1fz9 h ALA 65 N 1.58 0.02 -0.63 1.67 0.00 0.73 -1.81 119.26 120.81 1fz9 h ALA 65 Ca -0.00 -0.35 0.06 0.00 0.00 0.00 0.00 54.91 54.61 1fz9 h ALA 65 Cb 0.75 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.49 1fz9 h ALA 65 CO 0.06 -0.12 0.33 0.28 0.00 0.00 0.00 179.25 179.79 1fz9 h VAL 66 N -0.61 0.94 -0.17 0.00 2.07 -1.21 -1.04 116.25 116.23 1fz9 h VAL 66 Ca -0.00 -0.21 -0.04 0.00 0.82 0.00 0.00 66.70 67.27 1fz9 h VAL 66 Cb 0.71 0.28 -0.00 0.00 -1.52 0.00 0.00 31.29 30.76 1fz9 h VAL 66 CO 0.01 0.11 -0.06 -0.07 0.02 0.00 0.00 177.57 177.58 1fz9 h LEU 67 N 0.61 0.34 -2.25 2.57 3.38 -1.53 -2.62 115.31 115.82 1fz9 h LEU 67 Ca 0.28 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1fz9 h LEU 67 Cb 0.20 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 1fz9 h LEU 67 CO -0.19 0.66 -0.05 0.50 0.09 0.00 0.00 178.44 179.44 1fz9 h LYS 68 N 0.02 0.00 0.17 1.13 3.64 -1.09 0.13 116.57 120.57 1fz9 h LYS 68 Ca 0.04 0.00 -0.30 0.00 -1.27 0.00 0.00 60.65 59.12 1fz9 h LYS 68 Cb 0.52 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.37 1fz9 h LYS 68 CO 0.02 0.05 -1.31 0.00 -2.27 0.00 0.00 179.45 175.94 1fz9 h ALA 69 N 1.95 -0.01 0.00 5.00 0.00 -1.03 -3.09 119.26 122.08 1fz9 h ALA 69 Ca -0.00 -0.83 -0.20 0.00 0.00 0.00 0.00 54.91 53.88 1fz9 h ALA 69 Cb 0.16 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1fz9 h ALA 69 CO 0.01 0.79 -0.96 0.00 0.00 0.00 0.00 179.25 179.09 1fz9 h ARG 70 N 0.16 0.00 -1.17 0.00 3.08 -1.04 -3.34 114.38 112.08 1fz9 h ARG 70 Ca -0.19 0.00 -0.65 0.00 0.07 0.00 0.00 59.98 59.21 1fz9 h ARG 70 Cb 2.00 0.00 -0.34 0.00 0.08 0.00 0.00 29.97 31.71 1fz9 h ARG 70 CO 0.24 0.91 0.24 0.00 -1.07 0.00 0.00 179.97 180.28 1fz9 n ALA 71 N -2.34 5.85 -3.41 0.04 0.00 0.41 -4.95 120.51 116.11 1fz9 n ALA 71 Ca -0.00 -3.78 -0.14 0.00 0.00 0.00 0.00 53.44 49.51 1fz9 n ALA 71 Cb 0.91 -1.25 -0.08 0.00 0.00 0.00 0.00 19.45 19.03 1fz9 n ALA 71 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1fz9 s PHE 72 N -3.77 -0.52 0.29 0.00 0.40 -1.17 -4.88 117.98 108.33 1fz9 s PHE 72 Ca 0.57 1.14 -0.07 0.00 -0.60 0.00 0.00 56.93 57.96 1fz9 s PHE 72 Cb 0.46 0.22 -0.06 0.00 0.51 0.00 0.00 43.02 44.15 1fz9 s PHE 72 CO -0.09 -0.37 0.59 0.54 0.70 0.00 0.00 175.22 176.60 1fz9 s ASN 73 N -0.33 6.51 0.28 1.36 4.22 -1.26 -4.82 114.94 120.89 1fz9 s ASN 73 Ca -0.05 0.85 -0.02 0.00 -2.14 0.00 0.00 52.86 51.51 1fz9 s ASN 73 Cb -0.03 -2.20 0.61 0.00 1.28 0.00 0.00 41.25 40.91 1fz9 s ASN 73 CO 0.03 -0.20 1.63 -0.33 -2.04 0.00 0.00 177.10 176.19 1fz9 h GLU 74 N 1.84 0.12 -0.79 3.55 5.08 -1.98 0.24 114.58 122.64 1fz9 h GLU 74 Ca -0.47 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 57.86 1fz9 h GLU 74 Cb 1.18 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 30.37 1fz9 h GLU 74 CO 0.66 0.08 0.43 0.28 -1.00 0.00 0.00 179.01 179.47 1fz9 h VAL 75 N 0.12 1.24 -0.02 3.13 2.07 -1.99 -3.03 116.25 117.76 1fz9 h VAL 75 Ca 0.51 -0.59 -0.17 0.00 0.82 0.00 0.00 66.70 67.26 1fz9 h VAL 75 Cb 0.98 0.18 0.01 0.00 -1.52 0.00 0.00 31.29 30.95 1fz9 h VAL 75 CO -0.72 0.26 -0.67 0.44 0.02 0.00 0.00 177.57 176.91 1fz9 h ASP 76 N 1.09 0.63 -0.04 0.57 3.32 -1.47 -2.95 116.42 117.58 1fz9 h ASP 76 Ca 0.28 -0.73 0.01 0.00 0.02 0.00 0.00 57.03 56.61 1fz9 h ASP 76 Cb 0.03 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 39.39 1fz9 h ASP 76 CO -0.04 1.27 0.56 0.15 -1.72 0.00 0.00 179.24 179.46 1fz9 h PHE 77 N 0.05 0.00 0.00 4.55 3.04 -0.48 0.82 116.94 124.91 1fz9 h PHE 77 Ca -0.08 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.87 1fz9 h PHE 77 Cb 1.35 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.86 1fz9 h PHE 77 CO 0.13 0.00 0.00 2.89 -2.02 0.00 0.00 178.31 179.31 1fz9 n ARG 78 N -2.81 2.49 0.00 1.11 1.85 -1.19 -4.75 116.66 113.35 1fz9 n ARG 78 Ca -0.00 -1.33 0.00 0.00 -1.00 0.00 0.00 57.85 55.51 1fz9 n ARG 78 Cb 0.60 -0.92 0.00 0.00 -1.05 0.00 0.00 32.46 31.09 1fz9 n ARG 78 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 1fz9 n HIS 79 N -0.42 0.00 -4.88 2.89 8.25 0.21 -4.93 115.22 116.34 1fz9 n HIS 79 Ca 0.00 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.13 1fz9 n HIS 79 Cb 0.29 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.26 1fz9 n HIS 79 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 1fz9 s LYS 80 N 0.00 3.01 0.94 -0.41 2.20 0.26 0.78 119.74 126.52 1fz9 s LYS 80 Ca 0.00 -0.72 -0.12 0.00 -0.36 0.00 0.00 55.97 54.77 1fz9 s LYS 80 Cb 0.00 -2.49 0.15 0.00 -1.51 0.00 0.00 37.83 33.98 1fz9 s LYS 80 CO 0.00 0.36 1.10 0.95 -0.36 0.00 0.00 175.35 177.40 1fz9 s THR 81 N -0.04 2.29 -0.61 3.43 -4.23 0.27 -4.57 115.64 112.18 1fz9 s THR 81 Ca -0.04 0.10 0.17 0.00 -1.18 0.00 0.00 61.69 60.74 1fz9 s THR 81 Cb -0.14 -2.66 0.16 0.00 1.34 0.00 0.00 72.50 71.20 1fz9 s THR 81 CO 0.04 -0.12 1.51 0.00 -0.54 0.00 0.00 174.62 175.51 1fz9 n ALA 82 N -3.95 1.36 0.01 3.99 0.00 -0.85 -1.73 120.51 119.33 1fz9 n ALA 82 Ca 0.06 0.07 -0.13 0.00 0.00 0.00 0.00 53.44 53.44 1fz9 n ALA 82 Cb 0.57 -1.26 -0.14 0.00 0.00 0.00 0.00 19.45 18.62 1fz9 n ALA 82 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1fz9 h PHE 83 N 0.00 0.20 0.00 0.00 0.05 -1.90 -3.48 116.94 111.81 1fz9 h PHE 83 Ca 0.00 -0.15 0.00 0.00 3.82 0.00 0.00 57.97 61.64 1fz9 h PHE 83 Cb 0.17 -0.01 0.00 0.00 2.00 0.00 0.00 35.95 38.11 1fz9 h PHE 83 CO 0.00 1.26 0.00 0.41 -0.18 0.00 0.00 178.31 179.80 1fz9 n GLY 84 N 1.66 1.24 3.62 -1.45 0.00 -0.71 -5.12 105.19 104.43 1fz9 n GLY 84 Ca -0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.53 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 0.00 0.49 -0.46 1.61 2.02 -1.26 -4.64 118.70 116.46 1fz9 s GLU 85 Ca 0.00 1.32 -0.18 0.00 0.02 0.00 0.00 54.97 56.13 1fz9 s GLU 85 Cb 0.00 -1.68 0.04 0.00 0.10 0.00 0.00 34.13 32.59 1fz9 s GLU 85 CO 0.00 -2.92 0.51 0.34 0.02 0.00 0.00 175.26 173.21 1fz9 s ASP 86 N -2.66 6.21 0.06 -0.19 -1.08 -1.26 -0.57 116.67 117.17 1fz9 s ASP 86 Ca 0.67 -0.83 -0.11 0.00 -0.52 0.00 0.00 52.55 51.76 1fz9 s ASP 86 Cb -0.23 -2.25 -0.03 0.00 -1.46 0.00 0.00 42.92 38.96 1fz9 s ASP 86 CO 0.60 -0.71 0.90 0.00 0.52 0.00 0.00 175.17 176.48 1fz9 n ALA 87 N 5.78 -0.24 0.02 3.66 0.00 0.23 -1.90 120.51 128.06 1fz9 n ALA 87 Ca -0.07 0.31 -0.11 0.00 0.00 0.00 0.00 53.44 53.57 1fz9 n ALA 87 Cb 0.46 0.12 -0.04 0.00 0.00 0.00 0.00 19.45 19.98 1fz9 n ALA 87 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1fz9 h LYS 88 N 0.00 -0.41 -0.90 0.00 3.64 -1.94 -2.25 116.57 114.70 1fz9 h LYS 88 Ca 0.06 0.03 0.25 0.00 -1.27 0.00 0.00 60.65 59.71 1fz9 h LYS 88 Cb 0.15 0.09 -0.14 0.00 -0.41 0.00 0.00 32.23 31.92 1fz9 h LYS 88 CO -0.35 -0.27 0.31 0.66 -2.27 0.00 0.00 179.45 177.53 1fz9 h SER 89 N -0.42 0.12 0.39 4.20 4.64 -1.76 -0.37 113.55 120.35 1fz9 h SER 89 Ca 0.09 0.19 -0.02 0.00 -0.47 0.00 0.00 61.79 61.58 1fz9 h SER 89 Cb 0.56 0.23 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 1fz9 h SER 89 CO -0.34 -0.14 -0.19 0.58 -0.87 0.00 0.00 176.83 175.88 1fz9 h VAL 90 N 0.25 0.60 -0.50 0.95 2.07 -1.20 -1.32 116.25 117.09 1fz9 h VAL 90 Ca 0.58 -0.38 0.10 0.00 0.82 0.00 0.00 66.70 67.83 1fz9 h VAL 90 Cb 1.20 0.78 -0.10 0.00 -1.52 0.00 0.00 31.29 31.65 1fz9 h VAL 90 CO -0.63 0.07 -0.20 0.25 0.02 0.00 0.00 177.57 177.08 1fz9 h LEU 91 N -0.75 -0.70 -1.52 2.57 5.85 -0.62 0.80 115.31 120.95 1fz9 h LEU 91 Ca -0.05 0.17 -0.05 0.00 0.84 0.00 0.00 57.88 58.79 1fz9 h LEU 91 Cb 0.52 0.40 -0.01 0.00 0.37 0.00 0.00 40.66 41.94 1fz9 h LEU 91 CO 0.09 -0.23 -0.25 0.44 -0.34 0.00 0.00 178.44 178.15 1fz9 h ASP 92 N -0.08 0.00 -0.05 1.25 5.19 -1.11 -1.71 116.42 119.91 1fz9 h ASP 92 Ca 0.24 0.00 -0.09 0.00 -0.62 0.00 0.00 57.03 56.56 1fz9 h ASP 92 Cb 0.45 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.97 1fz9 h ASP 92 CO -0.56 0.25 -0.32 1.23 -3.12 0.00 0.00 179.24 176.72 1fz9 h GLY 93 N 0.99 0.33 1.79 2.75 0.00 0.20 -1.56 103.07 107.57 1fz9 h GLY 93 Ca -0.00 -0.48 -0.05 0.00 0.00 0.00 0.00 47.33 46.80 1fz9 h GLY 93 CO 0.03 0.43 -0.12 -0.84 0.00 0.00 0.00 176.54 176.05 1fz9 h THR 94 N -0.24 1.18 0.01 4.70 2.02 -0.80 -0.88 112.91 118.90 1fz9 h THR 94 Ca -0.03 -0.77 -0.21 0.00 0.77 0.00 0.00 66.41 66.17 1fz9 h THR 94 Cb 0.99 1.19 -0.02 0.00 -1.74 0.00 0.00 68.15 68.57 1fz9 h THR 94 CO 0.06 0.24 -0.98 0.58 0.37 0.00 0.00 175.52 175.80 1fz9 h VAL 95 N 0.25 1.65 -0.36 3.16 2.07 -1.34 -1.59 116.25 120.09 1fz9 h VAL 95 Ca 0.05 -3.20 -0.04 0.00 0.82 0.00 0.00 66.70 64.34 1fz9 h VAL 95 Cb 0.36 2.76 -0.01 0.00 -1.52 0.00 0.00 31.29 32.88 1fz9 h VAL 95 CO 0.02 0.92 0.08 0.00 0.02 0.00 0.00 177.57 178.61 1fz9 h ALA 96 N 0.99 0.47 -0.28 1.67 0.00 -0.55 -2.08 119.26 119.48 1fz9 h ALA 96 Ca -0.03 -0.19 -0.17 0.00 0.00 0.00 0.00 54.91 54.53 1fz9 h ALA 96 Cb 1.71 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 19.35 1fz9 h ALA 96 CO 0.13 0.15 -0.49 -0.22 0.00 0.00 0.00 179.25 178.82 1fz9 h LYS 97 N 0.43 0.77 -0.80 0.00 3.64 -1.21 -3.11 116.57 116.29 1fz9 h LYS 97 Ca 0.11 -0.46 -0.01 0.00 -1.27 0.00 0.00 60.65 59.03 1fz9 h LYS 97 Cb 0.31 0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.14 1fz9 h LYS 97 CO 0.00 1.08 0.48 1.98 -2.27 0.00 0.00 179.45 180.73 1fz9 h MET 98 N 0.61 1.09 0.00 1.90 4.05 -1.16 0.74 114.93 122.16 1fz9 h MET 98 Ca 0.03 -0.10 0.00 0.00 -0.28 0.00 0.00 59.70 59.34 1fz9 h MET 98 Cb 1.07 -0.23 0.00 0.00 -0.80 0.00 0.00 31.60 31.64 1fz9 h MET 98 CO 0.11 0.77 0.00 0.09 0.23 0.00 0.00 176.91 178.11 1fz9 n ASN 99 N -4.46 0.00 -0.06 1.39 3.02 -0.80 -2.87 115.26 111.49 1fz9 n ASN 99 Ca 0.08 -0.40 -0.20 0.00 -0.03 0.00 0.00 54.58 54.03 1fz9 n ASN 99 Cb 0.06 -0.13 -0.13 0.00 -0.61 0.00 0.00 39.78 38.97 1fz9 n ASN 99 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1fz9 n ALA 100 N -1.13 1.11 -0.98 5.41 0.00 0.17 -4.98 120.51 120.11 1fz9 n ALA 100 Ca 0.14 -0.81 -0.37 0.00 0.00 0.00 0.00 53.44 52.40 1fz9 n ALA 100 Cb 0.12 -0.42 -0.04 0.00 0.00 0.00 0.00 19.45 19.11 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 -3.16 -2.51 1.60 0.00 0.00 -0.70 -4.83 120.51 110.90 1fz9 n ALA 101 Ca -0.38 0.37 0.14 0.00 0.00 0.00 0.00 53.44 53.57 1fz9 n ALA 101 Cb 1.01 -1.15 0.61 0.00 0.00 0.00 0.00 19.45 19.92 1fz9 n ALA 101 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1fz9 n LYS 102 N 0.91 1.48 -3.72 0.00 4.76 -1.26 -4.93 118.16 115.41 1fz9 n LYS 102 Ca 0.13 -0.73 -0.01 0.00 -2.87 0.00 0.00 58.31 54.83 1fz9 n LYS 102 Cb 0.08 -1.48 -0.01 0.00 -1.84 0.00 0.00 35.03 31.78 1fz9 n LYS 102 CO 0.00 0.00 0.00 0.16 -1.37 0.00 0.00 177.40 176.19 1fz9 s ASP 103 N -2.03 -0.11 0.29 4.39 3.84 -1.26 -5.03 116.67 116.76 1fz9 s ASP 103 Ca 0.40 -0.31 0.00 0.00 -0.00 0.00 0.00 52.55 52.63 1fz9 s ASP 103 Cb 0.21 0.35 0.51 0.00 -1.38 0.00 0.00 42.92 42.61 1fz9 s ASP 103 CO 0.35 -0.66 1.89 0.07 -0.00 0.00 0.00 175.17 176.82 1fz9 h LYS 104 N 2.00 1.03 -0.95 2.11 2.10 -1.93 -0.93 116.57 120.01 1fz9 h LYS 104 Ca -0.27 -0.06 -0.01 0.00 -2.00 0.00 0.00 60.65 58.31 1fz9 h LYS 104 Cb 1.22 -0.23 -0.05 0.00 -0.90 0.00 0.00 32.23 32.27 1fz9 h LYS 104 CO 0.27 0.68 0.56 -1.49 -2.00 0.00 0.00 179.45 177.48 1fz9 h TRP 105 N 1.06 1.26 0.10 0.07 4.06 -1.98 0.22 115.95 120.73 1fz9 h TRP 105 Ca 0.43 -0.01 -0.00 0.00 2.06 0.00 0.00 58.89 61.36 1fz9 h TRP 105 Cb 0.26 -0.41 0.00 0.00 -1.00 0.00 0.00 29.16 28.01 1fz9 h TRP 105 CO -0.00 0.84 -0.05 1.49 -3.56 0.00 0.00 178.44 177.16 1fz9 h GLU 106 N 1.31 -0.13 -0.68 0.49 4.81 -1.82 -3.19 114.58 115.36 1fz9 h GLU 106 Ca 0.34 0.01 0.15 0.00 -0.13 0.00 0.00 59.36 59.72 1fz9 h GLU 106 Cb -0.04 0.03 -0.12 0.00 0.63 0.00 0.00 28.75 29.25 1fz9 h GLU 106 CO -0.06 0.38 -0.02 0.00 -0.73 0.00 0.00 179.01 178.58 1fz9 h ALA 107 N -0.21 0.65 -0.56 2.92 0.00 -1.06 -0.82 119.26 120.18 1fz9 h ALA 107 Ca -0.01 0.22 0.11 0.00 0.00 0.00 0.00 54.91 55.23 1fz9 h ALA 107 Cb 0.57 0.39 -0.10 0.00 0.00 0.00 0.00 17.79 18.66 1fz9 h ALA 107 CO 0.02 -0.41 -0.06 1.49 0.00 0.00 0.00 179.25 180.30 1fz9 h GLU 108 N 0.09 0.06 0.00 0.00 4.81 -0.64 -1.12 114.58 117.79 1fz9 h GLU 108 Ca 0.36 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.52 1fz9 h GLU 108 Cb 0.60 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.95 1fz9 h GLU 108 CO -0.61 0.04 -0.30 -0.22 -0.73 0.00 0.00 179.01 177.19 1fz9 h LYS 109 N 0.07 0.00 -0.09 1.92 1.63 -1.15 -2.50 116.57 116.45 1fz9 h LYS 109 Ca 0.28 0.00 -0.22 0.00 -0.85 0.00 0.00 60.65 59.87 1fz9 h LYS 109 Cb 0.44 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.08 1fz9 h LYS 109 CO -0.52 0.30 -0.82 0.82 -3.45 0.00 0.00 179.45 175.79 1fz9 h ILE 110 N 0.00 1.33 0.08 2.00 2.04 -0.75 -2.32 117.51 119.90 1fz9 h ILE 110 Ca -0.00 -2.13 -0.00 0.00 1.00 0.00 0.00 64.86 63.73 1fz9 h ILE 110 Cb 0.66 2.13 0.00 0.00 -0.74 0.00 0.00 36.82 38.87 1fz9 h ILE 110 CO 0.04 0.66 -0.04 -0.74 0.00 0.00 0.00 178.15 178.06 1fz9 h HIS 111 N 0.39 -0.10 -0.63 1.37 2.76 -1.29 -2.12 115.15 115.53 1fz9 h HIS 111 Ca -0.06 -0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.09 1fz9 h HIS 111 Cb 1.43 0.03 -0.03 0.00 1.55 0.00 0.00 27.41 30.40 1fz9 h HIS 111 CO 0.07 0.41 0.34 0.82 -1.30 0.00 0.00 177.93 178.27 1fz9 h ILE 112 N -0.71 1.21 -0.54 6.26 2.04 -1.57 -1.80 117.51 122.40 1fz9 h ILE 112 Ca -0.01 -0.54 -0.06 0.00 1.00 0.00 0.00 64.86 65.25 1fz9 h ILE 112 Cb 0.56 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 1fz9 h ILE 112 CO 0.02 0.23 0.09 1.23 0.00 0.00 0.00 178.15 179.71 1fz9 h GLY 113 N 0.87 0.92 0.73 5.37 0.00 -1.51 -2.47 103.07 106.97 1fz9 h GLY 113 Ca 0.22 -0.56 0.03 0.00 0.00 0.00 0.00 47.33 47.02 1fz9 h GLY 113 CO -0.03 0.52 0.08 -2.75 0.00 0.00 0.00 176.54 174.36 1fz9 h PHE 114 N 0.81 0.14 0.14 5.60 3.57 -0.68 -2.12 116.94 124.40 1fz9 h PHE 114 Ca 0.17 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.68 1fz9 h PHE 114 Cb 0.36 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.08 1fz9 h PHE 114 CO 0.02 0.05 -0.07 0.00 -2.23 0.00 0.00 178.31 176.08 1fz9 h ARG 115 N 0.19 -0.19 -0.84 1.11 3.08 -1.06 -1.16 114.38 115.52 1fz9 h ARG 115 Ca 0.13 0.01 0.16 0.00 0.07 0.00 0.00 59.98 60.35 1fz9 h ARG 115 Cb 0.11 0.04 -0.06 0.00 0.08 0.00 0.00 29.97 30.14 1fz9 h ARG 115 CO -0.15 -0.12 0.55 1.96 -1.07 0.00 0.00 179.97 181.14 1fz9 h GLN 116 N -0.19 0.49 0.00 0.04 4.20 -1.23 -2.04 115.11 116.37 1fz9 h GLN 116 Ca -0.02 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.66 1fz9 h GLN 116 Cb 0.15 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.82 1fz9 h GLN 116 CO 0.03 0.33 -0.17 0.00 -0.67 0.00 0.00 178.83 178.35 1fz9 h ALA 117 N 1.62 0.00 -0.17 3.87 0.00 -1.11 -3.43 119.26 120.04 1fz9 h ALA 117 Ca 0.42 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1fz9 h ALA 117 Cb 0.89 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1fz9 h ALA 117 CO -0.17 0.17 0.00 0.66 0.00 0.00 0.00 179.25 179.91 1fz9 n TYR 118 N -4.34 0.21 -1.62 0.00 4.02 -0.46 -4.87 117.16 110.10 1fz9 n TYR 118 Ca -0.02 -0.11 -0.48 0.00 -0.01 0.00 0.00 57.90 57.28 1fz9 n TYR 118 Cb 0.09 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.37 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 0.88 1.57 -1.07 -0.72 4.81 -0.77 -1.00 118.16 121.86 1fz9 n LYS 119 Ca 0.17 0.56 -0.34 0.00 -0.87 0.00 0.00 58.31 57.83 1fz9 n LYS 119 Cb 0.48 -2.17 0.10 0.00 0.02 0.00 0.00 35.03 33.46 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 2.20 0.08 0.00 1.64 -0.02 -1.25 -2.09 135.00 135.55 1fz9 n PRO 120 Ca 0.15 0.08 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 1fz9 n PRO 120 Cb 0.26 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 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 -1.65 0.65 -0.00 0.52 -0.04 -1.26 -4.89 135.00 128.32 1fz9 n PRO 121 Ca 0.10 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.56 1fz9 n PRO 121 Cb 0.51 -1.28 -0.00 0.00 -0.04 0.00 0.00 33.50 32.69 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 0.00 0.00 -3.54 0.52 5.03 -1.62 -3.42 117.51 114.49 1fz9 h ILE 122 Ca 0.00 -0.14 -0.51 0.00 -0.12 0.00 0.00 64.86 64.08 1fz9 h ILE 122 Cb 0.28 0.00 -0.02 0.00 -3.03 0.00 0.00 36.82 34.06 1fz9 h ILE 122 CO 0.00 0.00 -0.00 -0.32 -0.68 0.00 0.00 178.15 177.15 1fz9 s MET 123 N -1.19 3.82 0.22 2.37 1.75 -0.17 -2.00 119.30 124.09 1fz9 s MET 123 Ca -0.00 0.38 -0.30 0.00 -1.25 0.00 0.00 55.69 54.52 1fz9 s MET 123 Cb 0.00 -2.52 -0.10 0.00 2.84 0.00 0.00 34.83 35.05 1fz9 s MET 123 CO 0.00 0.16 1.46 -2.14 -0.65 0.00 0.00 175.02 173.86 1fz9 s PRO 124 N -3.26 4.27 0.31 4.11 0.02 -1.26 -3.95 135.00 135.23 1fz9 s PRO 124 Ca 0.50 2.29 0.07 0.00 0.02 0.00 0.00 61.00 63.87 1fz9 s PRO 124 Cb -0.11 -3.13 0.84 0.00 0.02 0.00 0.00 34.50 32.12 1fz9 s PRO 124 CO 0.24 -0.45 1.67 -0.39 -0.33 0.00 0.00 177.00 177.74 1fz9 h VAL 125 N 3.71 0.37 -0.55 3.83 -1.51 -1.95 -1.36 116.25 118.79 1fz9 h VAL 125 Ca -0.45 -0.11 0.09 0.00 -1.23 0.00 0.00 66.70 65.01 1fz9 h VAL 125 Cb 1.21 0.02 -0.07 0.00 -2.13 0.00 0.00 31.29 30.32 1fz9 h VAL 125 CO 0.81 0.06 0.14 0.78 -1.23 0.00 0.00 177.57 178.13 1fz9 h ASN 126 N 0.32 0.05 0.15 4.19 2.35 -1.97 -1.18 115.58 119.49 1fz9 h ASN 126 Ca 0.61 0.09 -0.25 0.00 -0.55 0.00 0.00 56.30 56.20 1fz9 h ASN 126 Cb 1.27 0.12 0.01 0.00 0.05 0.00 0.00 38.32 39.77 1fz9 h ASN 126 CO -0.60 0.05 -1.01 1.88 -1.65 0.00 0.00 177.43 176.10 1fz9 h TYR 127 N 0.28 0.87 0.07 1.19 -1.99 -1.66 -2.75 116.97 112.98 1fz9 h TYR 127 Ca 0.28 -0.48 0.02 0.00 2.00 0.00 0.00 58.73 60.56 1fz9 h TYR 127 Cb 0.38 -0.10 -0.04 0.00 2.00 0.00 0.00 36.73 38.98 1fz9 h TYR 127 CO -0.22 1.31 -0.26 0.35 -0.00 0.00 0.00 178.16 179.34 1fz9 h PHE 128 N 0.32 -0.70 0.00 4.88 3.57 -0.67 0.25 116.94 124.59 1fz9 h PHE 128 Ca -0.11 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.34 1fz9 h PHE 128 Cb 1.66 0.30 -0.01 0.00 2.79 0.00 0.00 35.95 40.69 1fz9 h PHE 128 CO 0.09 -0.36 -0.31 -0.07 -2.23 0.00 0.00 178.31 175.43 1fz9 h LEU 129 N -0.45 0.00 -0.73 0.59 3.38 -1.36 0.18 115.31 116.93 1fz9 h LEU 129 Ca 0.04 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 1fz9 h LEU 129 Cb 0.49 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1fz9 h LEU 129 CO -0.18 0.31 -0.03 -0.78 0.09 0.00 0.00 178.44 177.84 1fz9 h ASP 130 N 0.00 0.92 0.04 -0.43 3.58 -1.02 -0.74 116.42 118.77 1fz9 h ASP 130 Ca -0.00 -0.26 -0.00 0.00 0.42 0.00 0.00 57.03 57.18 1fz9 h ASP 130 Cb 0.72 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 41.52 1fz9 h ASP 130 CO 0.04 1.00 -0.02 1.23 -2.88 0.00 0.00 179.24 178.61 1fz9 h GLY 131 N 0.99 -0.06 -0.78 -0.78 0.00 0.34 -2.95 103.07 99.82 1fz9 h GLY 131 Ca 0.15 0.02 0.40 0.00 0.00 0.00 0.00 47.33 47.90 1fz9 h GLY 131 CO 0.03 -0.02 0.96 -2.09 0.00 0.00 0.00 176.54 175.42 1fz9 h GLU 132 N -0.54 0.06 0.24 4.80 4.57 -0.32 0.47 114.58 123.86 1fz9 h GLU 132 Ca -0.01 -0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.16 1fz9 h GLU 132 Cb 0.49 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.07 1fz9 h GLU 132 CO 0.01 0.04 -0.12 -0.09 -1.18 0.00 0.00 179.01 177.67 1fz9 h ARG 133 N 0.06 -0.32 -0.13 1.92 2.43 -0.97 -2.13 114.38 115.24 1fz9 h ARG 133 Ca 0.68 0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 59.76 1fz9 h ARG 133 Cb 2.54 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 32.17 1fz9 h ARG 133 CO -0.09 0.05 -0.35 1.96 -1.51 0.00 0.00 179.97 180.02 1fz9 h GLN 134 N -0.79 0.47 -0.32 0.20 4.20 -0.76 -2.18 115.11 115.94 1fz9 h GLN 134 Ca -0.03 -0.33 -0.01 0.00 0.06 0.00 0.00 58.65 58.34 1fz9 h GLN 134 Cb 0.51 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.33 1fz9 h GLN 134 CO 0.06 0.95 0.17 -0.07 -0.67 0.00 0.00 178.83 179.26 1fz9 h LEU 135 N 0.07 0.40 -1.27 1.46 3.38 -0.34 -1.84 115.31 117.16 1fz9 h LEU 135 Ca -0.01 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.82 1fz9 h LEU 135 Cb 0.96 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.59 1fz9 h LEU 135 CO 0.08 0.38 0.02 1.23 0.09 0.00 0.00 178.44 180.24 1fz9 h GLY 136 N 0.39 0.55 1.33 0.83 0.00 -1.44 -1.66 103.07 103.07 1fz9 h GLY 136 Ca 0.11 -0.31 -0.11 0.00 0.00 0.00 0.00 47.33 47.02 1fz9 h GLY 136 CO -0.02 0.29 -0.22 -0.84 0.00 0.00 0.00 176.54 175.76 1fz9 h THR 137 N 0.50 1.27 0.19 4.70 2.02 -0.89 -2.00 112.91 118.70 1fz9 h THR 137 Ca 0.11 -1.32 -0.01 0.00 0.77 0.00 0.00 66.41 65.96 1fz9 h THR 137 Cb 0.29 1.20 0.00 0.00 -1.74 0.00 0.00 68.15 67.91 1fz9 h THR 137 CO 0.01 0.44 -0.09 -0.09 0.37 0.00 0.00 175.52 176.16 1fz9 h ARG 138 N 0.67 -0.25 -0.44 6.66 9.65 -1.02 -2.18 114.38 127.48 1fz9 h ARG 138 Ca 0.09 0.02 0.09 0.00 -1.10 0.00 0.00 59.98 59.08 1fz9 h ARG 138 Cb 0.72 0.06 -0.10 0.00 -1.39 0.00 0.00 29.97 29.26 1fz9 h ARG 138 CO 0.06 0.15 -0.26 1.25 2.80 0.00 0.00 179.97 183.96 1fz9 h LEU 139 N -0.75 -0.89 -0.29 3.80 5.85 -1.29 -1.86 115.31 119.89 1fz9 h LEU 139 Ca -0.03 0.18 0.01 0.00 0.84 0.00 0.00 57.88 58.88 1fz9 h LEU 139 Cb 0.51 0.45 -0.02 0.00 0.37 0.00 0.00 40.66 41.97 1fz9 h LEU 139 CO 0.04 -0.28 0.18 0.24 -0.34 0.00 0.00 178.44 178.29 1fz9 h MET 140 N -0.17 0.36 -0.56 1.25 2.86 -1.42 -1.12 114.93 116.13 1fz9 h MET 140 Ca 0.20 -0.02 0.10 0.00 -2.06 0.00 0.00 59.70 57.92 1fz9 h MET 140 Cb 0.50 -0.08 -0.08 0.00 0.06 0.00 0.00 31.60 31.99 1fz9 h MET 140 CO -0.54 0.24 0.10 0.93 1.06 0.00 0.00 176.91 178.70 1fz9 h GLU 141 N 0.37 0.23 0.20 1.72 5.08 -0.68 0.13 114.58 121.62 1fz9 h GLU 141 Ca 0.11 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 1fz9 h GLU 141 Cb -0.03 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.17 1fz9 h GLU 141 CO -0.03 0.15 -0.09 -0.07 -1.00 0.00 0.00 179.01 177.96 1fz9 h LEU 142 N 0.23 -0.22 -0.32 1.33 3.38 -1.26 -3.24 115.31 115.21 1fz9 h LEU 142 Ca 0.29 -0.30 0.07 0.00 0.09 0.00 0.00 57.88 58.03 1fz9 h LEU 142 Cb 0.42 0.06 -0.07 0.00 0.09 0.00 0.00 40.66 41.15 1fz9 h LEU 142 CO -0.38 0.24 -0.18 0.03 0.09 0.00 0.00 178.44 178.24 1fz9 h ARG 143 N -0.75 -0.13 0.00 1.13 3.08 -0.93 -2.05 114.38 114.73 1fz9 h ARG 143 Ca -0.03 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1fz9 h ARG 143 Cb 0.51 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.59 1fz9 h ARG 143 CO 0.04 -0.09 0.00 0.09 -1.07 0.00 0.00 179.97 178.95 1fz9 n ASN 144 N -5.35 0.00 -4.57 7.04 5.03 0.42 -4.39 115.26 113.44 1fz9 n ASN 144 Ca 0.01 -1.07 -0.42 0.00 0.87 0.00 0.00 54.58 53.96 1fz9 n ASN 144 Cb 0.26 0.00 -0.06 0.00 -1.02 0.00 0.00 39.78 38.96 1fz9 n ASN 144 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 1fz9 s LEU 145 N -1.42 4.22 -1.21 3.41 2.96 -0.77 -4.05 118.68 121.82 1fz9 s LEU 145 Ca 0.14 0.18 -0.06 0.00 -0.22 0.00 0.00 54.13 54.16 1fz9 s LEU 145 Cb 0.06 -2.88 -0.02 0.00 0.50 0.00 0.00 46.19 43.86 1fz9 s LEU 145 CO 0.11 -0.68 0.78 0.59 -1.32 0.00 0.00 176.35 175.84 1fz9 n ASN 146 N 6.24 -3.30 -0.02 3.68 3.02 -1.26 -4.89 115.26 118.73 1fz9 n ASN 146 Ca 0.01 -0.83 0.06 0.00 -0.03 0.00 0.00 54.58 53.79 1fz9 n ASN 146 Cb 0.48 -4.20 0.45 0.00 -0.61 0.00 0.00 39.78 35.91 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 -1.72 0.48 -0.01 3.10 3.20 -1.77 -3.23 116.97 117.03 1fz9 h TYR 147 Ca -0.62 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.26 1fz9 h TYR 147 Cb 1.35 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 39.46 1fz9 h TYR 147 CO 0.40 0.28 -0.46 0.66 -1.64 0.00 0.00 178.16 177.40 1fz9 n TYR 148 N -4.48 0.00 0.05 -3.82 4.02 -1.26 -4.60 117.16 107.07 1fz9 n TYR 148 Ca 0.05 0.00 0.03 0.00 -0.01 0.00 0.00 57.90 57.97 1fz9 n TYR 148 Cb 0.15 0.00 0.41 0.00 -0.02 0.00 0.00 39.34 39.88 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 1.24 0.38 -3.59 7.72 3.32 -1.95 -3.41 116.42 120.13 1fz9 h ASP 149 Ca 0.00 -0.04 -0.56 0.00 0.02 0.00 0.00 57.03 56.45 1fz9 h ASP 149 Cb 0.49 -0.10 -0.07 0.00 0.22 0.00 0.00 39.33 39.88 1fz9 h ASP 149 CO 0.00 0.36 0.96 -0.89 -1.72 0.00 0.00 179.24 177.95 1fz9 s THR 150 N -5.19 4.15 0.52 0.35 2.01 -1.26 -5.00 115.64 111.22 1fz9 s THR 150 Ca -0.07 1.18 -0.21 0.00 0.31 0.00 0.00 61.69 62.90 1fz9 s THR 150 Cb 0.17 -4.50 -0.08 0.00 0.01 0.00 0.00 72.50 68.09 1fz9 s THR 150 CO 0.73 -0.93 0.90 -2.65 -0.69 0.00 0.00 174.62 171.99 1fz9 n PRO 151 N 7.85 1.00 -0.25 4.92 -0.02 -1.26 -4.60 135.00 142.64 1fz9 n PRO 151 Ca 0.13 0.37 0.04 0.00 -2.02 0.00 0.00 63.50 62.03 1fz9 n PRO 151 Cb 0.49 -2.03 0.17 0.00 -0.02 0.00 0.00 33.50 32.11 1fz9 n PRO 151 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1fz9 h LEU 152 N 0.86 0.30 -0.16 2.45 3.38 -1.94 0.14 115.31 120.33 1fz9 h LEU 152 Ca -0.46 0.10 0.05 0.00 0.09 0.00 0.00 57.88 57.66 1fz9 h LEU 152 Cb 1.36 0.07 -0.07 0.00 0.09 0.00 0.00 40.66 42.11 1fz9 h LEU 152 CO 0.52 0.13 -0.36 -0.33 0.09 0.00 0.00 178.44 178.49 1fz9 h GLU 153 N 0.46 -0.40 -0.51 1.13 3.07 -2.00 0.34 114.58 116.66 1fz9 h GLU 153 Ca 0.40 0.03 -0.07 0.00 -0.50 0.00 0.00 59.36 59.21 1fz9 h GLU 153 Cb 0.58 0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 28.56 1fz9 h GLU 153 CO -0.38 -0.27 0.05 1.49 -1.40 0.00 0.00 179.01 178.50 1fz9 h GLU 154 N -0.42 0.88 -0.66 2.33 4.81 -1.73 -2.99 114.58 116.81 1fz9 h GLU 154 Ca 0.10 -0.26 0.05 0.00 -0.13 0.00 0.00 59.36 59.12 1fz9 h GLU 154 Cb 0.58 -0.09 -0.05 0.00 0.63 0.00 0.00 28.75 29.81 1fz9 h GLU 154 CO -0.39 0.88 0.38 1.25 -0.73 0.00 0.00 179.01 180.40 1fz9 h LEU 155 N 0.75 0.58 -1.48 1.64 5.85 -0.05 -2.00 115.31 120.60 1fz9 h LEU 155 Ca 0.15 0.02 0.07 0.00 0.84 0.00 0.00 57.88 58.97 1fz9 h LEU 155 Cb 0.46 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.35 1fz9 h LEU 155 CO 0.02 0.38 0.44 0.03 -0.34 0.00 0.00 178.44 178.96 1fz9 h ARG 156 N 0.71 0.60 -0.26 1.25 3.08 -0.21 -0.18 114.38 119.36 1fz9 h ARG 156 Ca 0.29 -0.04 -0.19 0.00 0.07 0.00 0.00 59.98 60.11 1fz9 h ARG 156 Cb 0.14 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1fz9 h ARG 156 CO -0.16 0.40 -0.58 0.87 -1.07 0.00 0.00 179.97 179.43 1fz9 h LYS 157 N 0.62 0.86 -0.67 0.04 1.57 -1.31 -0.43 116.57 117.25 1fz9 h LYS 157 Ca 0.29 -0.57 -0.02 0.00 -1.87 0.00 0.00 60.65 58.48 1fz9 h LYS 157 Cb 0.34 0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.69 1fz9 h LYS 157 CO -0.09 1.20 0.35 1.96 -0.57 0.00 0.00 179.45 182.30 1fz9 h GLN 158 N 0.64 0.95 -0.22 3.15 4.20 -0.73 -1.62 115.11 121.49 1fz9 h GLN 158 Ca 0.00 -0.12 -0.14 0.00 0.06 0.00 0.00 58.65 58.45 1fz9 h GLN 158 Cb 1.20 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.79 1fz9 h GLN 158 CO 0.13 0.73 -0.45 -0.09 -0.67 0.00 0.00 178.83 178.48 1fz9 h ARG 159 N 0.93 0.55 0.00 1.46 9.65 -1.04 -3.47 114.38 122.45 1fz9 h ARG 159 Ca 0.23 -0.30 0.00 0.00 -1.10 0.00 0.00 59.98 58.82 1fz9 h ARG 159 Cb 0.07 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 28.66 1fz9 h ARG 159 CO -0.03 0.89 0.00 0.41 2.80 0.00 0.00 179.97 184.03 1fz9 n GLY 160 N 0.06 0.63 3.83 2.80 0.00 -0.18 -5.06 105.19 107.26 1fz9 n GLY 160 Ca -0.02 -0.76 -0.32 0.00 0.00 0.00 0.00 46.02 44.92 1fz9 n GLY 160 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1fz9 s VAL 161 N -2.00 4.18 -0.70 1.61 -7.23 -1.13 -4.98 120.40 110.15 1fz9 s VAL 161 Ca 0.00 0.91 -0.19 0.00 -1.81 0.00 0.00 61.98 60.88 1fz9 s VAL 161 Cb 0.00 -3.55 0.11 0.00 0.56 0.00 0.00 36.38 33.50 1fz9 s VAL 161 CO 0.00 -0.73 0.87 -0.60 -0.31 0.00 0.00 175.10 174.33 1fz9 s ARG 162 N -4.47 3.23 -0.14 4.82 3.52 -1.26 -4.90 118.95 119.75 1fz9 s ARG 162 Ca 0.60 -1.39 -0.29 0.00 -0.13 0.00 0.00 55.73 54.52 1fz9 s ARG 162 Cb -0.13 -4.41 -0.06 0.00 -1.56 0.00 0.00 34.95 28.79 1fz9 s ARG 162 CO 0.42 -1.64 2.03 0.08 -0.81 0.00 0.00 175.30 175.38 1fz9 s VAL 163 N 2.83 3.13 -0.13 7.11 1.01 -1.26 -4.84 120.40 128.25 1fz9 s VAL 163 Ca 0.19 0.15 0.18 0.00 0.00 0.00 0.00 61.98 62.51 1fz9 s VAL 163 Cb -0.17 -3.14 -0.25 0.00 0.00 0.00 0.00 36.38 32.82 1fz9 s VAL 163 CO 0.03 -0.07 0.37 1.33 0.00 0.00 0.00 175.10 176.76 1fz9 n VAL 164 N 6.82 1.01 -3.64 2.92 0.24 -1.26 -5.00 118.33 119.42 1fz9 n VAL 164 Ca 0.25 -0.73 -0.11 0.00 -2.04 0.00 0.00 64.34 61.71 1fz9 n VAL 164 Cb 0.44 -0.44 -0.07 0.00 -1.47 0.00 0.00 33.84 32.30 1fz9 n VAL 164 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1fz9 s HIS 165 N -2.85 -0.65 -0.07 6.34 2.46 -1.26 -5.15 115.29 114.11 1fz9 s HIS 165 Ca -0.08 1.54 0.00 0.00 0.47 0.00 0.00 55.06 57.00 1fz9 s HIS 165 Cb 0.09 0.34 0.02 0.00 -0.13 0.00 0.00 32.58 32.90 1fz9 s HIS 165 CO 0.85 -0.31 -0.05 -0.51 -2.47 0.00 0.00 174.74 172.25 1fz9 s LEU 166 N 0.44 1.12 -0.10 8.88 1.43 -1.26 -5.12 118.68 124.07 1fz9 s LEU 166 Ca 0.00 -0.17 -0.01 0.00 -1.03 0.00 0.00 54.13 52.93 1fz9 s LEU 166 Cb -0.05 -0.56 0.03 0.00 0.03 0.00 0.00 46.19 45.64 1fz9 s LEU 166 CO -0.05 -0.10 -0.05 -1.58 0.23 0.00 0.00 176.35 174.81 1fz9 s GLN 167 N 1.34 1.22 -0.28 1.70 0.74 -1.26 -5.11 119.66 118.01 1fz9 s GLN 167 Ca -0.04 -0.15 -0.01 0.00 0.05 0.00 0.00 55.36 55.22 1fz9 s GLN 167 Cb -0.14 -1.41 0.17 0.00 1.10 0.00 0.00 33.01 32.74 1fz9 s GLN 167 CO -0.03 -0.29 0.53 0.45 -0.55 0.00 0.00 175.29 175.41 1fz9 s SER 168 N 1.79 -0.88 0.30 6.67 0.15 -1.26 -5.01 113.70 115.46 1fz9 s SER 168 Ca 0.05 0.57 0.26 0.00 0.70 0.00 0.00 55.95 57.53 1fz9 s SER 168 Cb -0.13 1.82 0.89 0.00 -1.71 0.00 0.00 66.02 66.90 1fz9 s SER 168 CO -0.07 -0.28 1.76 1.55 1.20 0.00 0.00 173.24 177.40 1fz9 h PRO 169 N 8.06 0.00 -0.02 5.44 0.13 -2.09 -3.58 132.00 139.94 1fz9 h PRO 169 Ca -0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.94 1fz9 h PRO 169 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1fz9 h PRO 169 CO 0.25 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 178.74