#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hf9 h ILE 13 N 0.00 1.35 -0.20 5.18 6.09 -2.05 -3.15 117.51 124.73 2hf9 h ILE 13 Ca 0.00 -2.97 -0.18 0.00 -1.37 0.00 0.00 64.86 60.34 2hf9 h ILE 13 Cb 0.00 2.85 -0.00 0.00 0.47 0.00 0.00 36.82 40.14 2hf9 h ILE 13 CO 0.00 0.86 -0.61 -0.07 -3.07 0.00 0.00 178.15 175.26 2hf9 h LEU 14 N 0.06 0.76 -0.46 2.19 3.38 -1.99 -1.93 115.31 117.32 2hf9 h LEU 14 Ca -0.17 -0.43 -0.03 0.00 0.09 0.00 0.00 57.88 57.33 2hf9 h LEU 14 Cb 1.98 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 42.49 2hf9 h LEU 14 CO 0.18 1.19 0.15 0.50 0.09 0.00 0.00 178.44 180.55 2hf9 h LYS 15 N 0.50 0.71 -0.42 1.13 3.64 -1.99 -2.48 116.57 117.66 2hf9 h LYS 15 Ca -0.00 -0.15 -0.05 0.00 -1.27 0.00 0.00 60.65 59.18 2hf9 h LYS 15 Cb 1.19 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.88 2hf9 h LYS 15 CO 0.12 0.67 0.04 0.00 -2.27 0.00 0.00 179.45 178.02 2hf9 h ALA 16 N 1.01 1.29 -0.11 5.00 0.00 -1.49 -2.65 119.26 122.31 2hf9 h ALA 16 Ca 0.15 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2hf9 h ALA 16 Cb 0.25 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 2hf9 h ALA 16 CO -0.01 0.49 -0.01 -0.97 0.00 0.00 0.00 179.25 178.75 2hf9 h ASN 17 N 0.63 0.20 -0.75 0.00 -1.24 -1.22 -2.80 115.58 110.39 2hf9 h ASN 17 Ca 0.13 -0.34 0.07 0.00 0.71 0.00 0.00 56.30 56.87 2hf9 h ASN 17 Cb 0.33 -0.05 -0.06 0.00 0.73 0.00 0.00 38.32 39.27 2hf9 h ASN 17 CO 0.01 0.49 0.44 0.50 -1.29 0.00 0.00 177.43 177.58 2hf9 h LYS 18 N -0.10 0.76 -0.27 6.67 3.64 -1.34 0.31 116.57 126.24 2hf9 h LYS 18 Ca 0.03 -0.05 0.06 0.00 -1.27 0.00 0.00 60.65 59.43 2hf9 h LYS 18 Cb 0.40 -0.17 -0.07 0.00 -0.41 0.00 0.00 32.23 31.98 2hf9 h LYS 18 CO 0.01 0.50 -0.21 -0.09 -2.27 0.00 0.00 179.45 177.39 2hf9 h ARG 19 N 0.79 -0.19 0.00 1.90 2.43 -1.48 -0.64 114.38 117.19 2hf9 h ARG 19 Ca 0.34 0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.42 2hf9 h ARG 19 Cb 0.22 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 2hf9 h ARG 19 CO -0.19 -0.13 -0.49 -0.07 -1.51 0.00 0.00 179.97 177.58 2hf9 h LEU 20 N -0.20 0.00 -0.07 3.80 3.38 -1.02 -2.39 115.31 118.82 2hf9 h LEU 20 Ca 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 2hf9 h LEU 20 Cb 0.42 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 2hf9 h LEU 20 CO -0.39 0.49 0.01 0.00 0.09 0.00 0.00 178.44 178.64 2hf9 h ALA 21 N 1.51 0.09 -0.91 1.53 0.00 0.07 0.35 119.26 121.90 2hf9 h ALA 21 Ca -0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 2hf9 h ALA 21 Cb 0.91 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.63 2hf9 h ALA 21 CO 0.06 -0.27 0.53 -0.44 0.00 0.00 0.00 179.25 179.13 2hf9 h ASP 22 N -0.13 1.10 -0.06 0.00 3.32 -1.11 0.24 116.42 119.78 2hf9 h ASP 22 Ca 0.02 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.99 2hf9 h ASP 22 Cb 0.27 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.54 2hf9 h ASP 22 CO 0.00 0.86 0.04 0.50 -1.72 0.00 0.00 179.24 178.92 2hf9 h LYS 23 N 1.25 0.08 -0.35 3.56 3.64 -1.30 0.65 116.57 124.10 2hf9 h LYS 23 Ca 0.32 -0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.75 2hf9 h LYS 23 Cb -0.03 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.73 2hf9 h LYS 23 CO -0.06 0.06 0.08 -0.91 -2.27 0.00 0.00 179.45 176.35 2hf9 h ASN 24 N 0.08 0.03 -0.79 4.20 2.35 -0.58 -1.57 115.58 119.31 2hf9 h ASN 24 Ca 0.02 0.05 -0.05 0.00 -0.55 0.00 0.00 56.30 55.78 2hf9 h ASN 24 Cb -0.00 0.07 -0.03 0.00 0.05 0.00 0.00 38.32 38.40 2hf9 h ASN 24 CO -0.00 0.06 0.29 -0.09 -1.65 0.00 0.00 177.43 176.03 2hf9 h ARG 25 N 0.20 1.19 -0.78 0.81 2.43 -0.76 -1.28 114.38 116.20 2hf9 h ARG 25 Ca 0.16 -0.23 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2hf9 h ARG 25 Cb 0.18 -0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 29.50 2hf9 h ARG 25 CO -0.21 0.98 0.50 -0.22 -1.51 0.00 0.00 179.97 179.50 2hf9 h LYS 26 N 1.15 1.04 -0.39 0.20 3.64 -0.60 -1.35 116.57 120.26 2hf9 h LYS 26 Ca 0.26 -0.08 -0.07 0.00 -1.27 0.00 0.00 60.65 59.49 2hf9 h LYS 26 Cb 0.25 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 2hf9 h LYS 26 CO -0.02 0.71 -0.04 1.25 -2.27 0.00 0.00 179.45 179.08 2hf9 h LEU 27 N 1.06 0.72 -0.63 5.20 5.85 -0.86 -2.21 115.31 124.44 2hf9 h LEU 27 Ca 0.28 -0.33 -0.05 0.00 0.84 0.00 0.00 57.88 58.62 2hf9 h LEU 27 Cb -0.08 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.73 2hf9 h LEU 27 CO -0.06 0.88 0.19 -0.07 -0.34 0.00 0.00 178.44 179.05 2hf9 h LEU 28 N 0.54 0.92 -1.00 2.25 3.38 -1.07 -2.69 115.31 117.64 2hf9 h LEU 28 Ca 0.11 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 2hf9 h LEU 28 Cb 0.54 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.01 2hf9 h LEU 28 CO 0.03 0.88 0.40 0.78 0.09 0.00 0.00 178.44 180.62 2hf9 h ASN 29 N 0.90 1.00 -0.47 -0.43 -0.26 -1.22 0.20 115.58 115.30 2hf9 h ASN 29 Ca 0.20 -0.10 -0.02 0.00 -0.56 0.00 0.00 56.30 55.82 2hf9 h ASN 29 Cb 0.30 -0.26 -0.03 0.00 -1.06 0.00 0.00 38.32 37.28 2hf9 h ASN 29 CO -0.01 0.82 0.23 0.50 -1.06 0.00 0.00 177.43 177.92 2hf9 h LYS 30 N 1.11 0.72 -0.74 0.81 3.64 -1.13 -2.65 116.57 118.33 2hf9 h LYS 30 Ca 0.27 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 2hf9 h LYS 30 Cb 0.07 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 2hf9 h LYS 30 CO -0.04 0.58 0.00 0.72 -2.27 0.00 0.00 179.45 178.44 2hf9 n HIS 31 N -4.36 1.05 -2.53 1.91 8.25 -1.04 -4.96 115.22 113.53 2hf9 n HIS 31 Ca 0.04 -0.51 -0.15 0.00 -0.26 0.00 0.00 57.72 56.84 2hf9 n HIS 31 Cb 0.14 -0.02 0.01 0.00 1.12 0.00 0.00 29.99 31.23 2hf9 n HIS 31 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2hf9 n GLY 32 N 1.64 -0.17 3.76 -1.41 0.00 -0.67 -4.62 105.19 103.71 2hf9 n GLY 32 Ca 0.25 -0.22 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 2hf9 n GLY 32 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2hf9 s VAL 33 N -2.85 5.20 -0.20 1.61 1.01 0.62 -4.72 120.40 121.07 2hf9 s VAL 33 Ca 0.11 0.11 -0.06 0.00 0.00 0.00 0.00 61.98 62.13 2hf9 s VAL 33 Cb -0.05 -3.31 -0.03 0.00 0.00 0.00 0.00 36.38 32.99 2hf9 s VAL 33 CO 0.13 0.53 0.04 -0.69 0.00 0.00 0.00 175.10 175.11 2hf9 s VAL 34 N -0.28 4.37 -0.02 2.92 1.01 -0.59 -4.26 120.40 123.55 2hf9 s VAL 34 Ca 0.10 -0.17 0.05 0.00 0.00 0.00 0.00 61.98 61.96 2hf9 s VAL 34 Cb -0.12 -2.98 -0.03 0.00 0.00 0.00 0.00 36.38 33.25 2hf9 s VAL 34 CO 0.01 0.43 -0.18 0.00 0.00 0.00 0.00 175.10 175.36 2hf9 s ALA 35 N 0.80 2.54 -0.06 5.51 0.00 -1.26 -0.73 121.76 128.56 2hf9 s ALA 35 Ca 0.02 -1.06 0.04 0.00 0.00 0.00 0.00 51.96 50.96 2hf9 s ALA 35 Cb -0.14 -0.82 0.00 0.00 0.00 0.00 0.00 23.12 22.16 2hf9 s ALA 35 CO 0.02 0.55 -0.17 -0.06 0.00 0.00 0.00 175.76 176.10 2hf9 s PHE 36 N -0.75 1.82 -0.41 0.00 0.40 0.61 -0.95 117.98 118.69 2hf9 s PHE 36 Ca 0.12 -0.61 -0.14 0.00 -0.60 0.00 0.00 56.93 55.70 2hf9 s PHE 36 Cb -0.10 -1.24 0.03 0.00 0.51 0.00 0.00 43.02 42.22 2hf9 s PHE 36 CO 0.01 -0.24 0.29 0.34 0.70 0.00 0.00 175.22 176.33 2hf9 s ASP 37 N 0.25 6.01 -0.49 1.36 2.15 -0.44 -0.40 116.67 125.11 2hf9 s ASP 37 Ca -0.09 -1.03 -0.19 0.00 0.43 0.00 0.00 52.55 51.66 2hf9 s ASP 37 Cb -0.14 -2.12 0.05 0.00 -0.30 0.00 0.00 42.92 40.41 2hf9 s ASP 37 CO 0.04 -0.48 0.62 -0.36 -0.17 0.00 0.00 175.17 174.82 2hf9 s PHE 38 N 1.63 3.06 0.36 -5.34 0.40 0.69 -0.36 117.98 118.41 2hf9 s PHE 38 Ca 0.04 -0.47 0.07 0.00 -0.60 0.00 0.00 56.93 55.98 2hf9 s PHE 38 Cb -0.20 -3.48 -0.02 0.00 0.51 0.00 0.00 43.02 39.83 2hf9 s PHE 38 CO 0.08 -0.99 0.35 -1.64 0.70 0.00 0.00 175.22 173.72 2hf9 s MET 39 N 2.63 2.74 0.00 0.44 -1.94 0.44 -0.91 119.30 122.71 2hf9 s MET 39 Ca 0.16 -1.30 0.00 0.00 -1.71 0.00 0.00 55.69 52.84 2hf9 s MET 39 Cb -0.18 -2.52 0.00 0.00 2.01 0.00 0.00 34.83 34.14 2hf9 s MET 39 CO 0.13 0.01 0.00 0.41 -0.01 0.00 0.00 175.02 175.56 2hf9 n GLY 40 N -1.47 -1.31 0.00 -0.03 0.00 -1.26 -0.58 105.19 100.54 2hf9 n GLY 40 Ca 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.98 2hf9 n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hf9 n ALA 41 N 0.00 0.00 -2.64 4.61 0.00 -1.21 0.14 120.51 121.42 2hf9 n ALA 41 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.03 2hf9 n ALA 41 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 2hf9 n ALA 41 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2hf9 s ILE 42 N -0.42 4.95 -0.11 0.00 1.09 -1.26 -3.96 121.20 121.48 2hf9 s ILE 42 Ca 0.00 1.25 0.00 0.00 -1.10 0.00 0.00 60.65 60.80 2hf9 s ILE 42 Cb 0.00 -3.98 0.00 0.00 -1.06 0.00 0.00 42.46 37.42 2hf9 s ILE 42 CO 0.00 0.02 0.00 0.61 -0.10 0.00 0.00 174.94 175.47 2hf9 n GLY 43 N 4.00 0.49 0.28 6.18 0.00 -1.26 -4.93 105.19 109.95 2hf9 n GLY 43 Ca 0.01 -0.29 0.10 0.00 0.00 0.00 0.00 46.02 45.84 2hf9 n GLY 43 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2hf9 h SER 44 N 0.00 0.00 0.00 1.61 0.02 -1.87 -3.46 113.55 109.85 2hf9 h SER 44 Ca -0.02 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 2hf9 h SER 44 Cb 0.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.72 2hf9 h SER 44 CO 0.03 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.33 2hf9 n GLY 45 N -1.54 1.58 0.10 -3.77 0.00 -1.26 -4.56 105.19 95.74 2hf9 n GLY 45 Ca -0.01 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.92 2hf9 n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2hf9 h LYS 46 N 0.00 -0.03 -0.12 1.61 1.57 -1.92 -1.13 116.57 116.56 2hf9 h LYS 46 Ca 0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 2hf9 h LYS 46 Cb 0.00 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 2hf9 h LYS 46 CO 0.00 -0.02 0.01 1.15 -0.57 0.00 0.00 179.45 180.02 2hf9 h THR 47 N -0.03 1.24 -0.87 -0.16 2.02 -1.98 -1.11 112.91 112.02 2hf9 h THR 47 Ca 0.07 -0.75 0.04 0.00 0.77 0.00 0.00 66.41 66.55 2hf9 h THR 47 Cb 0.14 1.51 -0.05 0.00 -1.74 0.00 0.00 68.15 68.00 2hf9 h THR 47 CO -0.16 0.22 0.57 0.25 0.37 0.00 0.00 175.52 176.76 2hf9 h LEU 48 N -0.05 0.91 -0.27 2.58 5.85 -1.97 0.41 115.31 122.77 2hf9 h LEU 48 Ca 0.03 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 2hf9 h LEU 48 Cb 0.33 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 2hf9 h LEU 48 CO 0.00 0.62 0.08 0.25 -0.34 0.00 0.00 178.44 179.05 2hf9 h LEU 49 N 1.05 0.40 -0.50 2.25 5.85 -0.94 -1.66 115.31 121.76 2hf9 h LEU 49 Ca 0.35 -0.21 -0.01 0.00 0.84 0.00 0.00 57.88 58.85 2hf9 h LEU 49 Cb 0.07 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 40.97 2hf9 h LEU 49 CO -0.11 0.50 0.27 0.40 -0.34 0.00 0.00 178.44 179.16 2hf9 h ILE 50 N 0.28 1.17 -0.53 4.05 2.04 -0.51 -0.38 117.51 123.63 2hf9 h ILE 50 Ca 0.09 -0.45 0.09 0.00 1.00 0.00 0.00 64.86 65.59 2hf9 h ILE 50 Cb 0.24 0.55 -0.07 0.00 -0.74 0.00 0.00 36.82 36.81 2hf9 h ILE 50 CO -0.00 0.19 0.14 -0.33 0.00 0.00 0.00 178.15 178.14 2hf9 h GLU 51 N 0.67 0.28 -0.52 2.37 5.08 -0.04 0.01 114.58 122.42 2hf9 h GLU 51 Ca 0.18 -0.02 -0.11 0.00 -1.00 0.00 0.00 59.36 58.41 2hf9 h GLU 51 Cb 0.05 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 2hf9 h GLU 51 CO -0.03 0.19 -0.12 0.87 -1.00 0.00 0.00 179.01 178.92 2hf9 h LYS 52 N 0.29 1.00 -0.72 2.33 1.79 -1.03 -2.32 116.57 117.92 2hf9 h LYS 52 Ca 0.26 -0.38 -0.03 0.00 -2.18 0.00 0.00 60.65 58.32 2hf9 h LYS 52 Cb 0.34 -0.06 -0.03 0.00 -1.58 0.00 0.00 32.23 30.90 2hf9 h LYS 52 CO -0.31 1.06 0.33 -0.07 -1.08 0.00 0.00 179.45 179.38 2hf9 h LEU 53 N 0.87 0.95 0.17 2.94 3.38 -0.62 -2.01 115.31 121.00 2hf9 h LEU 53 Ca 0.13 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2hf9 h LEU 53 Cb 0.69 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 2hf9 h LEU 53 CO 0.05 0.83 -0.12 0.40 0.09 0.00 0.00 178.44 179.69 2hf9 h ILE 54 N 1.01 0.74 -0.95 1.22 2.04 -0.89 -0.80 117.51 119.87 2hf9 h ILE 54 Ca 0.24 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.24 2hf9 h ILE 54 Cb 0.15 0.74 -0.08 0.00 -0.74 0.00 0.00 36.82 36.88 2hf9 h ILE 54 CO -0.03 0.00 0.60 0.44 0.00 0.00 0.00 178.15 179.17 2hf9 h ASP 55 N -0.29 0.79 1.07 1.72 3.32 -1.23 -0.65 116.42 121.15 2hf9 h ASP 55 Ca -0.01 0.05 -0.17 0.00 0.02 0.00 0.00 57.03 56.92 2hf9 h ASP 55 Cb 0.26 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.68 2hf9 h ASP 55 CO -0.00 0.40 -0.98 0.78 -1.72 0.00 0.00 179.24 177.72 2hf9 h ASN 56 N 0.83 0.00 0.00 6.45 4.21 -1.16 -3.39 115.58 122.52 2hf9 h ASN 56 Ca 0.48 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.99 2hf9 h ASN 56 Cb 0.63 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.83 2hf9 h ASN 56 CO -0.25 0.71 -0.97 0.18 -1.29 0.00 0.00 177.43 175.82 2hf9 n LEU 57 N -3.16 0.46 0.27 1.61 4.77 -0.32 -4.62 117.00 116.01 2hf9 n LEU 57 Ca -0.03 -0.35 0.15 0.00 -0.03 0.00 0.00 56.01 55.74 2hf9 n LEU 57 Cb 0.85 0.00 0.76 0.00 -2.33 0.00 0.00 43.42 42.70 2hf9 n LEU 57 CO 0.43 0.12 0.99 0.07 -1.33 0.00 0.00 177.39 177.67 2hf9 h LYS 58 N 0.00 0.00 -0.24 3.23 2.10 -1.30 0.22 116.57 120.58 2hf9 h LYS 58 Ca 0.00 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.52 2hf9 h LYS 58 Cb 0.43 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.75 2hf9 h LYS 58 CO 0.00 0.09 -0.38 -0.44 -2.00 0.00 0.00 179.45 176.73 2hf9 h ASP 59 N 0.00 0.58 0.13 7.07 3.32 -1.84 -3.34 116.42 122.34 2hf9 h ASP 59 Ca -0.00 -0.25 -0.36 0.00 0.02 0.00 0.00 57.03 56.44 2hf9 h ASP 59 Cb 0.36 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.72 2hf9 h ASP 59 CO 0.01 0.90 -2.10 1.17 -1.72 0.00 0.00 179.24 177.50 2hf9 n LYS 60 N -4.04 0.72 -4.43 3.56 4.81 -0.59 -4.99 118.16 113.19 2hf9 n LYS 60 Ca -0.01 0.23 -0.27 0.00 -0.87 0.00 0.00 58.31 57.38 2hf9 n LYS 60 Cb 0.50 -1.66 -0.13 0.00 0.02 0.00 0.00 35.03 33.75 2hf9 n LYS 60 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 2hf9 s TYR 61 N -2.55 2.08 -0.27 5.64 1.51 0.68 -5.10 117.35 119.34 2hf9 s TYR 61 Ca -0.23 -0.40 -0.26 0.00 -1.01 0.00 0.00 57.07 55.17 2hf9 s TYR 61 Cb 0.07 -1.15 0.00 0.00 -0.11 0.00 0.00 41.96 40.77 2hf9 s TYR 61 CO 0.74 0.25 0.92 0.15 -1.11 0.00 0.00 175.55 176.49 2hf9 s LYS 62 N -1.83 4.14 -0.11 -0.62 1.02 -1.26 -4.23 119.74 116.84 2hf9 s LYS 62 Ca 0.10 1.00 0.00 0.00 0.02 0.00 0.00 55.97 57.10 2hf9 s LYS 62 Cb -0.10 -3.68 -0.02 0.00 -0.52 0.00 0.00 37.83 33.51 2hf9 s LYS 62 CO 0.05 -0.65 -0.11 0.42 -0.92 0.00 0.00 175.35 174.13 2hf9 s ILE 63 N 3.11 3.26 0.21 2.17 1.01 -1.26 0.02 121.20 129.73 2hf9 s ILE 63 Ca 0.39 -0.60 0.11 0.00 0.00 0.00 0.00 60.65 60.54 2hf9 s ILE 63 Cb -0.14 -2.36 -0.05 0.00 0.01 0.00 0.00 42.46 39.92 2hf9 s ILE 63 CO 0.09 0.54 -0.22 0.00 0.00 0.00 0.00 174.94 175.35 2hf9 s ALA 64 N 0.01 2.53 0.06 9.38 0.00 -0.30 -2.99 121.76 130.45 2hf9 s ALA 64 Ca -0.03 -1.69 0.04 0.00 0.00 0.00 0.00 51.96 50.29 2hf9 s ALA 64 Cb -0.14 -0.29 -0.03 0.00 0.00 0.00 0.00 23.12 22.66 2hf9 s ALA 64 CO 0.04 0.36 -0.13 0.00 0.00 0.00 0.00 175.76 176.03 2hf9 s ILE 66 N -1.22 2.56 -0.31 0.00 1.01 -0.26 -0.84 121.20 122.14 2hf9 s ILE 66 Ca -0.03 -0.78 -0.06 0.00 0.00 0.00 0.00 60.65 59.79 2hf9 s ILE 66 Cb -0.10 -2.11 0.03 0.00 0.01 0.00 0.00 42.46 40.29 2hf9 s ILE 66 CO 0.02 0.50 0.07 0.00 0.00 0.00 0.00 174.94 175.53 2hf9 s ALA 67 N 1.24 3.00 -0.23 9.38 0.00 -0.60 -0.37 121.76 134.18 2hf9 s ALA 67 Ca 0.03 -1.62 -0.06 0.00 0.00 0.00 0.00 51.96 50.32 2hf9 s ALA 67 Cb -0.14 -2.14 -0.02 0.00 0.00 0.00 0.00 23.12 20.82 2hf9 s ALA 67 CO -0.07 -1.14 0.01 0.20 0.00 0.00 0.00 175.76 174.77 2hf9 s GLY 68 N 1.42 1.69 0.23 0.00 0.00 -0.61 -0.62 107.32 109.43 2hf9 s GLY 68 Ca -0.00 -1.14 -0.22 0.00 0.00 0.00 0.00 44.72 43.36 2hf9 s GLY 68 CO 0.02 0.47 0.86 -0.35 0.00 0.00 0.00 173.10 174.10 2hf9 s ASP 69 N 1.52 -0.16 0.14 1.64 2.15 -0.89 -3.82 116.67 117.25 2hf9 s ASP 69 Ca 0.06 -0.60 -0.23 0.00 0.43 0.00 0.00 52.55 52.20 2hf9 s ASP 69 Cb -0.15 0.62 0.01 0.00 -0.30 0.00 0.00 42.92 43.10 2hf9 s ASP 69 CO 0.00 -1.17 1.63 0.58 -0.17 0.00 0.00 175.17 176.05 2hf9 h VAL 70 N 2.00 0.39 -3.52 1.11 2.07 -1.85 0.09 116.25 116.54 2hf9 h VAL 70 Ca -0.24 0.00 -0.69 0.00 0.82 0.00 0.00 66.70 66.60 2hf9 h VAL 70 Cb 1.24 0.39 -0.36 0.00 -1.52 0.00 0.00 31.29 31.04 2hf9 h VAL 70 CO 0.28 0.00 -0.41 -0.63 0.02 0.00 0.00 177.57 176.82 2hf9 s ILE 71 N -6.07 3.52 0.07 4.57 1.01 -1.26 -4.14 121.20 118.89 2hf9 s ILE 71 Ca -0.15 -2.98 0.33 0.00 0.00 0.00 0.00 60.65 57.85 2hf9 s ILE 71 Cb 0.11 -3.32 0.36 0.00 0.01 0.00 0.00 42.46 39.63 2hf9 s ILE 71 CO 0.67 -0.86 1.98 0.00 0.00 0.00 0.00 174.94 176.74 2hf9 h ALA 72 N 6.98 1.00 -0.41 9.38 0.00 -1.81 -3.23 119.26 131.18 2hf9 h ALA 72 Ca -0.03 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2hf9 h ALA 72 Cb 0.95 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 2hf9 h ALA 72 CO 0.71 0.00 0.11 1.57 0.00 0.00 0.00 179.25 181.64 2hf9 h LYS 73 N 0.00 0.59 0.03 0.00 2.10 -1.92 -1.66 116.57 115.72 2hf9 h LYS 73 Ca 0.00 -0.10 0.03 0.00 -2.00 0.00 0.00 60.65 58.58 2hf9 h LYS 73 Cb 0.36 -0.10 -0.05 0.00 -0.90 0.00 0.00 32.23 31.54 2hf9 h LYS 73 CO 0.00 0.53 -0.37 0.74 -2.00 0.00 0.00 179.45 178.36 2hf9 h PHE 74 N 0.58 -1.02 0.07 0.07 -1.00 -2.00 -0.64 116.94 113.00 2hf9 h PHE 74 Ca 0.14 0.03 -0.24 0.00 2.81 0.00 0.00 57.97 60.71 2hf9 h PHE 74 Cb 0.20 0.45 -0.00 0.00 3.61 0.00 0.00 35.95 40.20 2hf9 h PHE 74 CO 0.01 -0.46 -1.09 -0.44 -1.61 0.00 0.00 178.31 174.72 2hf9 h ASP 75 N -0.54 0.37 -0.39 2.17 3.32 -1.80 -2.83 116.42 116.72 2hf9 h ASP 75 Ca 0.05 -0.36 0.04 0.00 0.02 0.00 0.00 57.03 56.78 2hf9 h ASP 75 Cb 0.61 -0.12 -0.04 0.00 0.22 0.00 0.00 39.33 40.00 2hf9 h ASP 75 CO -0.27 1.23 0.15 0.00 -1.72 0.00 0.00 179.24 178.62 2hf9 h ALA 76 N 0.73 0.46 -0.57 3.45 0.00 -1.19 -0.88 119.26 121.25 2hf9 h ALA 76 Ca -0.09 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 2hf9 h ALA 76 Cb 1.79 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.56 2hf9 h ALA 76 CO 0.18 -0.24 0.02 0.93 0.00 0.00 0.00 179.25 180.14 2hf9 h GLU 77 N 0.31 0.97 -0.82 0.00 5.08 -1.17 -0.42 114.58 118.53 2hf9 h GLU 77 Ca 0.17 -0.28 -0.00 0.00 -1.00 0.00 0.00 59.36 58.25 2hf9 h GLU 77 Cb 0.14 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.25 2hf9 h GLU 77 CO -0.17 0.94 0.50 0.00 -1.00 0.00 0.00 179.01 179.29 2hf9 h ARG 78 N 0.90 1.10 -0.02 2.33 3.08 -1.22 -2.93 114.38 117.62 2hf9 h ARG 78 Ca 0.17 -0.09 -0.25 0.00 0.07 0.00 0.00 59.98 59.88 2hf9 h ARG 78 Cb 0.50 -0.24 0.02 0.00 0.08 0.00 0.00 29.97 30.33 2hf9 h ARG 78 CO 0.02 0.76 -0.96 0.52 -1.07 0.00 0.00 179.97 179.25 2hf9 h MET 79 N 1.12 0.68 -0.98 0.04 2.86 -0.93 -3.35 114.93 114.38 2hf9 h MET 79 Ca 0.30 -0.71 0.07 0.00 -2.06 0.00 0.00 59.70 57.30 2hf9 h MET 79 Cb -0.07 0.20 -0.07 0.00 0.06 0.00 0.00 31.60 31.72 2hf9 h MET 79 CO -0.06 1.29 0.63 0.93 1.06 0.00 0.00 176.91 180.76 2hf9 h GLU 80 N 0.35 1.09 0.00 1.72 5.08 -0.91 -2.30 114.58 119.61 2hf9 h GLU 80 Ca -0.11 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 2hf9 h GLU 80 Cb 1.61 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 30.62 2hf9 h GLU 80 CO 0.19 0.72 0.00 1.57 -1.00 0.00 0.00 179.01 180.49 2hf9 h LYS 81 N 1.12 0.00 -0.00 2.33 2.10 -1.65 -1.98 116.57 118.49 2hf9 h LYS 81 Ca 0.43 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.08 2hf9 h LYS 81 Cb 0.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.52 2hf9 h LYS 81 CO -0.18 0.00 -0.09 0.72 -2.00 0.00 0.00 179.45 177.90 2hf9 n HIS 82 N -2.92 0.00 0.00 0.07 8.25 -0.87 -4.90 115.22 114.85 2hf9 n HIS 82 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2hf9 n HIS 82 Cb 0.22 -0.26 0.00 0.00 1.12 0.00 0.00 29.99 31.07 2hf9 n HIS 82 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2hf9 n GLY 83 N 1.32 1.77 3.66 -1.41 0.00 -0.74 -4.68 105.19 105.11 2hf9 n GLY 83 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 2hf9 n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hf9 s ALA 84 N -2.00 3.21 -0.03 4.61 0.00 -1.23 -4.84 121.76 121.48 2hf9 s ALA 84 Ca 0.00 -0.91 -0.30 0.00 0.00 0.00 0.00 51.96 50.75 2hf9 s ALA 84 Cb 0.00 -1.34 -0.04 0.00 0.00 0.00 0.00 23.12 21.74 2hf9 s ALA 84 CO 0.00 0.62 1.22 0.21 0.00 0.00 0.00 175.76 177.81 2hf9 s LYS 85 N -1.26 4.36 -0.05 0.00 2.47 -1.16 -4.36 119.74 119.74 2hf9 s LYS 85 Ca 0.17 1.72 0.02 0.00 -1.56 0.00 0.00 55.97 56.31 2hf9 s LYS 85 Cb -0.11 -3.53 0.01 0.00 -1.46 0.00 0.00 37.83 32.73 2hf9 s LYS 85 CO 0.07 -0.43 -0.11 0.08 0.16 0.00 0.00 175.35 175.11 2hf9 s VAL 86 N 2.08 1.00 -0.32 4.02 1.01 -1.26 0.14 120.40 127.07 2hf9 s VAL 86 Ca 0.57 -0.43 -0.09 0.00 0.00 0.00 0.00 61.98 62.03 2hf9 s VAL 86 Cb -0.26 -0.91 0.00 0.00 0.00 0.00 0.00 36.38 35.21 2hf9 s VAL 86 CO 0.23 0.32 0.15 -0.69 0.00 0.00 0.00 175.10 175.12 2hf9 s VAL 87 N 0.52 4.50 0.24 2.92 1.01 -0.02 -4.97 120.40 124.59 2hf9 s VAL 87 Ca -0.10 -0.56 -0.30 0.00 0.00 0.00 0.00 61.98 61.01 2hf9 s VAL 87 Cb -0.13 -3.35 -0.09 0.00 0.00 0.00 0.00 36.38 32.81 2hf9 s VAL 87 CO 0.02 -0.00 1.01 -2.16 0.00 0.00 0.00 175.10 173.97 2hf9 s PRO 88 N 1.58 4.75 -0.28 2.72 0.04 -1.26 -1.56 135.00 140.99 2hf9 s PRO 88 Ca 0.04 1.61 0.01 0.00 0.04 0.00 0.00 61.00 62.69 2hf9 s PRO 88 Cb -0.18 -3.26 0.08 0.00 0.04 0.00 0.00 34.50 31.19 2hf9 s PRO 88 CO 0.06 0.35 0.03 -0.51 0.04 0.00 0.00 177.00 176.97 2hf9 s LEU 89 N -1.08 2.83 -0.20 -3.56 1.43 0.21 -4.91 118.68 113.39 2hf9 s LEU 89 Ca 0.43 -1.53 -0.29 0.00 -1.03 0.00 0.00 54.13 51.71 2hf9 s LEU 89 Cb -0.28 -1.12 -0.02 0.00 0.03 0.00 0.00 46.19 44.80 2hf9 s LEU 89 CO 0.35 -0.34 1.46 0.20 0.23 0.00 0.00 176.35 178.26 2hf9 s ASN 90 N 1.40 6.62 0.00 2.29 0.01 -1.26 -2.10 114.94 121.90 2hf9 s ASN 90 Ca 0.04 1.62 0.24 0.00 -0.71 0.00 0.00 52.86 54.05 2hf9 s ASN 90 Cb -0.18 -2.54 0.19 0.00 0.41 0.00 0.00 41.25 39.13 2hf9 s ASN 90 CO -0.13 -1.05 1.21 0.35 -1.51 0.00 0.00 177.10 175.96 2hf9 n THR 91 N 5.99 0.00 0.00 1.60 -2.24 0.01 -4.94 114.28 114.70 2hf9 n THR 91 Ca 0.16 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 2hf9 n THR 91 Cb 0.45 1.04 0.00 0.00 -2.10 0.00 0.00 70.33 69.72 2hf9 n THR 91 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2hf9 n GLY 92 N 1.40 4.11 1.37 3.38 0.00 -1.26 -1.49 105.19 112.70 2hf9 n GLY 92 Ca 0.10 0.13 0.10 0.00 0.00 0.00 0.00 46.02 46.35 2hf9 n GLY 92 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2hf9 n LYS 93 N 14.00 3.26 -2.74 1.61 5.02 -1.26 -4.61 118.16 133.44 2hf9 n LYS 93 Ca 0.00 -2.72 -0.40 0.00 -2.02 0.00 0.00 58.31 53.17 2hf9 n LYS 93 Cb 0.00 -1.71 -0.06 0.00 -0.02 0.00 0.00 35.03 33.25 2hf9 n LYS 93 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2hf9 s GLU 94 N -1.49 4.82 0.40 1.97 2.56 -0.56 -4.94 118.70 121.46 2hf9 s GLU 94 Ca 0.47 1.49 0.22 0.00 0.00 0.00 0.00 54.97 57.15 2hf9 s GLU 94 Cb 0.28 -3.30 0.49 0.00 2.00 0.00 0.00 34.13 33.61 2hf9 s GLU 94 CO 0.26 0.45 1.65 0.00 -0.56 0.00 0.00 175.26 177.06 2hf9 s HIS 96 N -3.28 -0.09 0.68 0.00 -3.43 -1.26 -4.63 115.29 103.29 2hf9 s HIS 96 Ca 0.04 -0.15 -0.12 0.00 -0.80 0.00 0.00 55.06 54.03 2hf9 s HIS 96 Cb 0.07 0.11 0.00 0.00 -1.43 0.00 0.00 32.58 31.34 2hf9 s HIS 96 CO 0.67 -0.57 1.06 -0.51 -2.00 0.00 0.00 174.74 173.39 2hf9 s LEU 97 N -2.43 3.20 0.28 5.38 1.43 -1.26 -4.91 118.68 120.37 2hf9 s LEU 97 Ca -0.01 1.67 0.02 0.00 -1.03 0.00 0.00 54.13 54.79 2hf9 s LEU 97 Cb 0.01 -4.50 -0.06 0.00 0.03 0.00 0.00 46.19 41.67 2hf9 s LEU 97 CO -0.07 -1.42 0.08 1.51 0.23 0.00 0.00 176.35 176.67 2hf9 s ASP 98 N -3.57 1.67 0.50 2.29 1.47 -1.26 -4.91 116.67 112.86 2hf9 s ASP 98 Ca 0.59 -1.37 0.23 0.00 1.18 0.00 0.00 52.55 53.18 2hf9 s ASP 98 Cb -0.15 0.06 1.34 0.00 -0.34 0.00 0.00 42.92 43.83 2hf9 s ASP 98 CO 0.51 -0.67 2.07 0.00 0.68 0.00 0.00 175.17 177.76 2hf9 h ALA 99 N 2.29 1.48 0.73 2.11 0.00 -1.82 -2.08 119.26 121.98 2hf9 h ALA 99 Ca -0.39 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.37 2hf9 h ALA 99 Cb 1.24 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 19.02 2hf9 h ALA 99 CO 0.64 0.16 -0.35 1.25 0.00 0.00 0.00 179.25 180.95 2hf9 h HIS 100 N 0.00 -0.91 -0.99 0.00 -0.00 -1.90 0.30 115.15 111.65 2hf9 h HIS 100 Ca -0.00 -0.02 0.01 0.00 -0.00 0.00 0.00 60.37 60.35 2hf9 h HIS 100 Cb 0.28 0.30 -0.05 0.00 -0.00 0.00 0.00 27.41 27.94 2hf9 h HIS 100 CO 0.00 -0.54 0.64 -0.07 -0.00 0.00 0.00 177.93 177.96 2hf9 h LEU 101 N -1.13 1.15 -0.69 0.26 3.38 -1.95 -2.31 115.31 114.01 2hf9 h LEU 101 Ca -0.10 -0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 2hf9 h LEU 101 Cb 0.78 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 2hf9 h LEU 101 CO 0.17 0.84 0.22 0.58 0.09 0.00 0.00 178.44 180.34 2hf9 h VAL 102 N 1.35 1.25 -0.48 1.22 2.07 -1.38 -2.29 116.25 117.99 2hf9 h VAL 102 Ca 0.36 -0.87 0.07 0.00 0.82 0.00 0.00 66.70 67.08 2hf9 h VAL 102 Cb -0.13 0.52 -0.06 0.00 -1.52 0.00 0.00 31.29 30.10 2hf9 h VAL 102 CO -0.08 0.34 0.15 1.23 0.02 0.00 0.00 177.57 179.24 2hf9 h GLY 103 N 1.01 0.63 1.37 2.17 0.00 -0.38 -0.82 103.07 107.05 2hf9 h GLY 103 Ca 0.22 -0.08 -0.06 0.00 0.00 0.00 0.00 47.33 47.42 2hf9 h GLY 103 CO -0.01 -0.01 0.06 0.45 0.00 0.00 0.00 176.54 177.04 2hf9 h HIS 104 N 0.32 0.81 -0.42 5.60 -0.00 -1.38 -2.62 115.15 117.46 2hf9 h HIS 104 Ca 0.23 -0.09 -0.05 0.00 -0.00 0.00 0.00 60.37 60.47 2hf9 h HIS 104 Cb 0.26 -0.23 -0.02 0.00 -0.00 0.00 0.00 27.41 27.42 2hf9 h HIS 104 CO -0.18 0.72 0.06 0.00 -0.00 0.00 0.00 177.93 178.54 2hf9 h ALA 105 N 1.33 1.33 0.00 2.45 0.00 -0.75 -2.21 119.26 121.40 2hf9 h ALA 105 Ca 0.16 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2hf9 h ALA 105 Cb 0.36 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2hf9 h ALA 105 CO 0.01 0.47 -0.18 -0.07 0.00 0.00 0.00 179.25 179.48 2hf9 h LEU 106 N 0.62 0.00 -0.91 0.00 3.38 -0.81 -2.30 115.31 115.29 2hf9 h LEU 106 Ca 0.14 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 2hf9 h LEU 106 Cb 0.29 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 2hf9 h LEU 106 CO 0.00 0.18 -0.13 1.05 0.09 0.00 0.00 178.44 179.64 2hf9 h GLU 107 N 0.00 0.00 -0.58 1.13 4.11 -1.20 -2.77 114.58 115.27 2hf9 h GLU 107 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2hf9 h GLU 107 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 2hf9 h GLU 107 CO 0.02 0.13 0.00 -0.25 0.07 0.00 0.00 179.01 178.98 2hf9 n ASP 108 N -3.21 3.09 -4.41 3.06 8.00 -0.87 -4.89 116.55 117.32 2hf9 n ASP 108 Ca 0.01 -2.01 -0.32 0.00 0.71 0.00 0.00 54.79 53.19 2hf9 n ASP 108 Cb 0.43 -0.39 -0.14 0.00 -0.02 0.00 0.00 41.12 41.01 2hf9 n ASP 108 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2hf9 s LEU 109 N -1.01 2.46 -0.88 0.64 1.43 -1.05 -5.03 118.68 115.24 2hf9 s LEU 109 Ca 0.38 -0.33 -0.20 0.00 -1.03 0.00 0.00 54.13 52.95 2hf9 s LEU 109 Cb 0.20 -1.47 0.11 0.00 0.03 0.00 0.00 46.19 45.06 2hf9 s LEU 109 CO 0.26 0.32 1.13 0.21 0.23 0.00 0.00 176.35 178.50 2hf9 s ASN 110 N -0.81 6.50 0.00 2.29 3.84 -1.26 -4.89 114.94 120.62 2hf9 s ASN 110 Ca 0.11 -1.71 0.17 0.00 0.21 0.00 0.00 52.86 51.65 2hf9 s ASN 110 Cb -0.10 -2.43 0.80 0.00 -0.55 0.00 0.00 41.25 38.97 2hf9 s ASN 110 CO 0.01 -1.21 1.54 0.18 -2.79 0.00 0.00 177.10 174.82 2hf9 n LEU 111 N 7.14 0.00 0.04 3.21 4.77 -1.26 -1.10 117.00 129.79 2hf9 n LEU 111 Ca 0.18 0.41 0.12 0.00 -0.03 0.00 0.00 56.01 56.70 2hf9 n LEU 111 Cb 0.48 -0.41 0.29 0.00 -2.33 0.00 0.00 43.42 41.45 2hf9 n LEU 111 CO 0.56 -0.17 0.53 0.47 -1.33 0.00 0.00 177.39 177.45 2hf9 n ASP 112 N -1.41 0.56 -1.20 -1.43 8.00 -1.26 -3.70 116.55 116.11 2hf9 n ASP 112 Ca 0.06 0.12 0.05 0.00 0.71 0.00 0.00 54.79 55.73 2hf9 n ASP 112 Cb 0.18 -0.02 0.27 0.00 -0.02 0.00 0.00 41.12 41.53 2hf9 n ASP 112 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2hf9 n GLU 113 N -1.86 3.10 -3.92 -1.24 -0.58 -0.26 -4.97 120.64 110.91 2hf9 n GLU 113 Ca 0.05 -2.96 -0.15 0.00 -0.42 0.00 0.00 57.16 53.67 2hf9 n GLU 113 Cb 0.39 -1.94 -0.15 0.00 -0.57 0.00 0.00 31.44 29.17 2hf9 n GLU 113 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2hf9 s ILE 114 N -2.91 0.13 -0.15 -3.67 1.01 -1.22 -4.78 121.20 109.60 2hf9 s ILE 114 Ca 0.46 0.06 0.04 0.00 0.00 0.00 0.00 60.65 61.21 2hf9 s ILE 114 Cb 0.37 -0.19 -0.12 0.00 0.01 0.00 0.00 42.46 42.53 2hf9 s ILE 114 CO 0.09 0.10 -0.08 0.47 0.00 0.00 0.00 174.94 175.52 2hf9 n ASP 115 N 3.79 2.49 -4.19 3.58 8.00 0.10 -4.53 116.55 125.79 2hf9 n ASP 115 Ca -0.23 -0.06 -0.28 0.00 0.71 0.00 0.00 54.79 54.94 2hf9 n ASP 115 Cb 0.53 0.08 -0.16 0.00 -0.02 0.00 0.00 41.12 41.55 2hf9 n ASP 115 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2hf9 s LEU 116 N -5.62 2.00 -0.18 0.64 1.43 -0.70 -1.54 118.68 114.71 2hf9 s LEU 116 Ca -0.17 -0.39 0.01 0.00 -1.03 0.00 0.00 54.13 52.55 2hf9 s LEU 116 Cb 0.05 -1.09 0.03 0.00 0.03 0.00 0.00 46.19 45.21 2hf9 s LEU 116 CO 0.42 0.21 -0.16 -0.22 0.23 0.00 0.00 176.35 176.83 2hf9 s LEU 117 N -0.21 2.15 -0.30 1.79 2.96 0.09 -1.15 118.68 124.01 2hf9 s LEU 117 Ca 0.01 -0.71 -0.10 0.00 -0.22 0.00 0.00 54.13 53.12 2hf9 s LEU 117 Cb -0.10 -1.37 -0.01 0.00 0.50 0.00 0.00 46.19 45.20 2hf9 s LEU 117 CO 0.01 -0.05 0.15 -0.36 -1.32 0.00 0.00 176.35 174.78 2hf9 s PHE 118 N 1.34 3.17 -0.28 5.38 2.99 -0.25 -0.29 117.98 130.05 2hf9 s PHE 118 Ca 0.03 -0.47 -0.08 0.00 0.00 0.00 0.00 56.93 56.41 2hf9 s PHE 118 Cb -0.14 -2.35 -0.01 0.00 0.00 0.00 0.00 43.02 40.52 2hf9 s PHE 118 CO -0.11 -0.41 0.09 0.42 -0.00 0.00 0.00 175.22 175.21 2hf9 s ILE 119 N 1.63 4.29 -0.43 0.64 1.01 0.47 -1.10 121.20 127.71 2hf9 s ILE 119 Ca 0.05 -0.36 -0.20 0.00 0.00 0.00 0.00 60.65 60.14 2hf9 s ILE 119 Cb -0.17 -3.10 0.02 0.00 0.01 0.00 0.00 42.46 39.22 2hf9 s ILE 119 CO 0.07 0.21 0.60 -0.70 0.00 0.00 0.00 174.94 175.11 2hf9 s GLU 120 N 1.59 3.27 0.88 2.79 2.12 0.50 -0.22 118.70 129.62 2hf9 s GLU 120 Ca 0.05 -0.43 -0.12 0.00 0.36 0.00 0.00 54.97 54.83 2hf9 s GLU 120 Cb -0.16 -3.94 0.12 0.00 0.26 0.00 0.00 34.13 30.40 2hf9 s GLU 120 CO 0.04 -0.96 1.11 1.21 -0.54 0.00 0.00 175.26 176.12 2hf9 s ASN 121 N 1.95 3.73 0.24 -1.70 3.84 -0.08 -1.57 114.94 121.35 2hf9 s ASN 121 Ca 0.20 1.24 -0.30 0.00 0.21 0.00 0.00 52.86 54.21 2hf9 s ASN 121 Cb -0.15 -1.91 -0.10 0.00 -0.55 0.00 0.00 41.25 38.54 2hf9 s ASN 121 CO 0.18 -2.44 1.49 -0.69 -2.79 0.00 0.00 177.10 172.85 2hf9 s VAL 122 N -3.11 2.53 -0.18 -5.21 1.01 -1.25 -4.77 120.40 109.43 2hf9 s VAL 122 Ca 0.63 0.43 -0.29 0.00 0.00 0.00 0.00 61.98 62.76 2hf9 s VAL 122 Cb -0.16 -3.28 -0.05 0.00 0.00 0.00 0.00 36.38 32.89 2hf9 s VAL 122 CO 0.55 0.06 2.02 -0.83 0.00 0.00 0.00 175.10 176.90 2hf9 s GLY 123 N 0.52 0.86 0.00 4.51 0.00 -1.26 -4.63 107.32 107.33 2hf9 s GLY 123 Ca 0.62 0.79 0.00 0.00 0.00 0.00 0.00 44.72 46.13 2hf9 s GLY 123 CO 0.42 3.54 0.00 0.70 0.00 0.00 0.00 173.10 177.76 2hf9 n ASN 124 N 10.09 0.00 -0.93 1.64 3.02 0.12 -4.58 115.26 124.62 2hf9 n ASN 124 Ca 0.25 0.00 0.09 0.00 -0.03 0.00 0.00 54.58 54.89 2hf9 n ASN 124 Cb 0.44 0.00 0.18 0.00 -0.61 0.00 0.00 39.78 39.80 2hf9 n ASN 124 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2hf9 n LEU 125 N 0.00 3.15 -0.03 3.41 4.77 -1.26 -4.42 117.00 122.62 2hf9 n LEU 125 Ca 0.00 -1.61 -0.03 0.00 -0.03 0.00 0.00 56.01 54.33 2hf9 n LEU 125 Cb 0.00 -0.24 -0.01 0.00 -2.33 0.00 0.00 43.42 40.84 2hf9 n LEU 125 CO 0.00 0.71 -0.24 -0.38 -1.33 0.00 0.00 177.39 176.15 2hf9 n ILE 126 N 1.12 0.69 -0.16 -0.08 2.08 -1.26 -4.58 119.36 117.18 2hf9 n ILE 126 Ca 0.16 0.29 -0.09 0.00 0.56 0.00 0.00 62.75 63.68 2hf9 n ILE 126 Cb 0.51 -1.74 0.05 0.00 -0.75 0.00 0.00 39.64 37.71 2hf9 n ILE 126 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2hf9 h PRO 128 N 0.86 0.00 -6.19 0.00 0.11 -1.82 -3.39 132.00 121.58 2hf9 h PRO 128 Ca 0.14 0.00 -0.56 0.00 0.11 0.00 0.00 66.00 65.69 2hf9 h PRO 128 Cb 0.63 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.71 2hf9 h PRO 128 CO 0.04 0.00 0.97 0.00 -0.21 0.00 0.00 178.00 178.80 2hf9 s ALA 129 N -3.56 3.64 0.00 -0.75 0.00 -1.15 -2.53 121.76 117.41 2hf9 s ALA 129 Ca 0.01 0.61 0.00 0.00 0.00 0.00 0.00 51.96 52.58 2hf9 s ALA 129 Cb 0.09 -3.67 0.00 0.00 0.00 0.00 0.00 23.12 19.54 2hf9 s ALA 129 CO 0.38 -1.28 0.00 -0.25 0.00 0.00 0.00 175.76 174.61 2hf9 n ASP 130 N 6.84 0.00 -4.01 0.00 10.43 -1.26 -4.98 116.55 123.57 2hf9 n ASP 130 Ca 0.15 0.00 -0.33 0.00 2.57 0.00 0.00 54.79 57.18 2hf9 n ASP 130 Cb 0.44 0.00 -0.10 0.00 1.84 0.00 0.00 41.12 43.30 2hf9 n ASP 130 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 2hf9 s PHE 131 N -2.22 3.57 0.14 1.24 0.40 -1.05 -5.00 117.98 115.06 2hf9 s PHE 131 Ca 0.00 -3.09 -0.31 0.00 -0.60 0.00 0.00 56.93 52.93 2hf9 s PHE 131 Cb 0.00 -3.00 -0.10 0.00 0.51 0.00 0.00 43.02 40.43 2hf9 s PHE 131 CO 0.00 -0.70 1.75 0.34 0.70 0.00 0.00 175.22 177.31 2hf9 s ASP 132 N -0.41 6.46 0.01 1.36 2.15 -1.26 -4.85 116.67 120.13 2hf9 s ASP 132 Ca 0.23 2.72 0.24 0.00 0.43 0.00 0.00 52.55 56.17 2hf9 s ASP 132 Cb -0.12 -2.58 0.34 0.00 -0.30 0.00 0.00 42.92 40.26 2hf9 s ASP 132 CO -0.10 -0.96 1.29 0.18 -0.17 0.00 0.00 175.17 175.41 2hf9 n LEU 133 N 5.13 0.60 0.00 -1.34 4.77 -1.26 -3.97 117.00 120.93 2hf9 n LEU 133 Ca 0.17 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 2hf9 n LEU 133 Cb 0.38 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 2hf9 n LEU 133 CO 0.64 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.44 2hf9 n GLY 134 N 1.48 1.47 3.95 -0.72 0.00 -1.26 -4.61 105.19 105.50 2hf9 n GLY 134 Ca 0.05 -0.05 -0.23 0.00 0.00 0.00 0.00 46.02 45.78 2hf9 n GLY 134 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2hf9 s THR 135 N -2.00 3.57 -0.04 2.61 -4.23 -1.26 -3.56 115.64 110.73 2hf9 s THR 135 Ca 0.00 -0.44 0.00 0.00 -1.18 0.00 0.00 61.69 60.07 2hf9 s THR 135 Cb 0.00 -3.35 -0.26 0.00 1.34 0.00 0.00 72.50 70.23 2hf9 s THR 135 CO 0.00 -0.27 0.68 0.45 -0.54 0.00 0.00 174.62 174.94 2hf9 h HIS 136 N 0.19 0.34 -3.95 3.99 3.86 -1.43 -3.48 115.15 114.66 2hf9 h HIS 136 Ca -0.45 -0.25 -0.23 0.00 -1.16 0.00 0.00 60.37 58.28 2hf9 h HIS 136 Cb 1.27 -0.01 -0.22 0.00 1.06 0.00 0.00 27.41 29.50 2hf9 h HIS 136 CO 0.43 1.39 -0.72 0.15 0.86 0.00 0.00 177.93 180.04 2hf9 s LYS 137 N -2.60 0.40 -0.13 2.45 -0.14 -1.10 -5.05 119.74 113.57 2hf9 s LYS 137 Ca -0.11 -0.62 0.01 0.00 -1.36 0.00 0.00 55.97 53.89 2hf9 s LYS 137 Cb 0.07 -0.12 -0.01 0.00 -1.68 0.00 0.00 37.83 36.09 2hf9 s LYS 137 CO 0.82 0.01 -0.15 1.03 -0.76 0.00 0.00 175.35 176.30 2hf9 s ARG 138 N -1.34 3.28 -0.15 1.68 0.52 -1.26 -1.33 118.95 120.35 2hf9 s ARG 138 Ca -0.11 -0.73 -0.00 0.00 -0.52 0.00 0.00 55.73 54.36 2hf9 s ARG 138 Cb -0.09 -2.58 -0.01 0.00 0.52 0.00 0.00 34.95 32.79 2hf9 s ARG 138 CO -0.00 0.14 -0.13 0.42 0.02 0.00 0.00 175.30 175.75 2hf9 s ILE 139 N 0.50 2.99 -0.27 1.52 1.01 0.51 -0.05 121.20 127.40 2hf9 s ILE 139 Ca -0.10 -0.67 -0.06 0.00 0.00 0.00 0.00 60.65 59.82 2hf9 s ILE 139 Cb -0.16 -2.27 0.01 0.00 0.01 0.00 0.00 42.46 40.05 2hf9 s ILE 139 CO 0.04 0.51 0.04 -0.69 0.00 0.00 0.00 174.94 174.85 2hf9 s VAL 140 N 0.59 3.75 -0.34 2.92 1.01 -0.43 -0.42 120.40 127.48 2hf9 s VAL 140 Ca -0.08 -0.68 -0.12 0.00 0.00 0.00 0.00 61.98 61.10 2hf9 s VAL 140 Cb -0.16 -2.89 -0.01 0.00 0.00 0.00 0.00 36.38 33.32 2hf9 s VAL 140 CO 0.03 0.16 0.22 -0.69 0.00 0.00 0.00 175.10 174.83 2hf9 s VAL 141 N 1.48 5.12 0.38 2.92 1.01 0.25 -0.94 120.40 130.61 2hf9 s VAL 141 Ca 0.03 -0.30 0.08 0.00 0.00 0.00 0.00 61.98 61.78 2hf9 s VAL 141 Cb -0.17 -3.64 -0.05 0.00 0.00 0.00 0.00 36.38 32.52 2hf9 s VAL 141 CO 0.01 -0.02 0.12 0.27 0.00 0.00 0.00 175.10 175.48 2hf9 s ILE 142 N 1.69 2.50 0.07 2.22 -0.00 -0.55 -3.32 121.20 123.82 2hf9 s ILE 142 Ca 0.06 -1.79 0.06 0.00 -0.00 0.00 0.00 60.65 58.97 2hf9 s ILE 142 Cb -0.17 -2.94 -0.03 0.00 -0.00 0.00 0.00 42.46 39.32 2hf9 s ILE 142 CO 0.09 -0.09 -0.15 -0.94 -0.00 0.00 0.00 174.94 173.85 2hf9 s SER 143 N -3.83 1.81 0.48 4.36 1.04 -1.26 -0.49 113.70 115.81 2hf9 s SER 143 Ca 0.38 -0.61 0.20 0.00 0.48 0.00 0.00 55.95 56.40 2hf9 s SER 143 Cb 0.02 -0.07 1.22 0.00 0.10 0.00 0.00 66.02 67.30 2hf9 s SER 143 CO 0.21 -0.05 1.99 0.71 0.98 0.00 0.00 173.24 177.09 2hf9 h THR 144 N 4.28 0.81 0.00 2.02 1.35 -1.44 -1.74 112.91 118.18 2hf9 h THR 144 Ca -0.41 -0.06 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 2hf9 h THR 144 Cb 1.19 0.60 0.00 0.00 -1.73 0.00 0.00 68.15 68.21 2hf9 h THR 144 CO 0.40 0.03 0.00 0.35 -0.25 0.00 0.00 175.52 176.06 2hf9 n THR 145 N -4.43 0.98 1.21 6.82 -2.24 -1.26 -1.35 114.28 114.00 2hf9 n THR 145 Ca 0.10 0.25 0.14 0.00 -2.27 0.00 0.00 64.05 62.27 2hf9 n THR 145 Cb 0.49 -1.02 0.67 0.00 -2.10 0.00 0.00 70.33 68.38 2hf9 n THR 145 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2hf9 n GLU 146 N -1.57 0.22 0.00 -0.78 1.02 -0.65 -5.03 120.64 113.84 2hf9 n GLU 146 Ca 0.03 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 2hf9 n GLU 146 Cb 0.18 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.10 2hf9 n GLU 146 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2hf9 n GLY 147 N 1.40 1.79 0.02 0.62 0.00 -0.46 -4.70 105.19 103.85 2hf9 n GLY 147 Ca 0.11 -1.67 0.07 0.00 0.00 0.00 0.00 46.02 44.52 2hf9 n GLY 147 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2hf9 n ASP 148 N -0.11 0.05 -0.51 1.61 5.68 -1.26 -2.46 116.55 119.56 2hf9 n ASP 148 Ca 0.00 -1.58 0.12 0.00 -0.50 0.00 0.00 54.79 52.83 2hf9 n ASP 148 Cb 0.00 -0.00 0.22 0.00 -1.14 0.00 0.00 41.12 40.20 2hf9 n ASP 148 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2hf9 n ASP 149 N -0.68 1.82 0.10 -1.12 8.00 -1.26 -4.55 116.55 118.87 2hf9 n ASP 149 Ca 0.10 -1.42 0.05 0.00 0.71 0.00 0.00 54.79 54.23 2hf9 n ASP 149 Cb 0.05 0.20 0.48 0.00 -0.02 0.00 0.00 41.12 41.84 2hf9 n ASP 149 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 2hf9 h THR 150 N 2.49 1.09 -0.00 -3.53 2.02 -1.76 0.74 112.91 113.96 2hf9 h THR 150 Ca 0.00 -0.28 -0.01 0.00 0.77 0.00 0.00 66.41 66.89 2hf9 h THR 150 Cb 0.68 0.82 0.00 0.00 -1.74 0.00 0.00 68.15 67.92 2hf9 h THR 150 CO 0.00 0.11 -0.04 0.40 0.37 0.00 0.00 175.52 176.36 2hf9 h ILE 151 N 0.31 1.55 0.00 3.11 2.04 -1.85 -3.23 117.51 119.45 2hf9 h ILE 151 Ca 0.08 -1.67 -0.03 0.00 1.00 0.00 0.00 64.86 64.24 2hf9 h ILE 151 Cb 0.06 2.66 -0.00 0.00 -0.74 0.00 0.00 36.82 38.80 2hf9 h ILE 151 CO -0.01 0.44 -0.14 1.05 0.00 0.00 0.00 178.15 179.49 2hf9 h GLU 152 N -0.65 0.00 0.00 2.37 4.11 -1.73 -2.60 114.58 116.08 2hf9 h GLU 152 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2hf9 h GLU 152 Cb 0.74 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.99 2hf9 h GLU 152 CO 0.01 0.14 0.00 0.87 0.07 0.00 0.00 179.01 180.10 2hf9 h LYS 153 N 0.00 0.00 -2.02 1.06 1.57 -0.96 -3.37 116.57 112.85 2hf9 h LYS 153 Ca -0.00 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.27 2hf9 h LYS 153 Cb 0.59 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 32.50 2hf9 h LYS 153 CO 0.02 0.00 -1.05 0.72 -0.57 0.00 0.00 179.45 178.57 2hf9 n HIS 154 N -2.33 1.28 -0.04 -1.35 8.25 -0.98 -4.96 115.22 115.09 2hf9 n HIS 154 Ca 0.05 -3.81 -0.01 0.00 -0.26 0.00 0.00 57.72 53.69 2hf9 n HIS 154 Cb 0.40 -0.43 0.27 0.00 1.12 0.00 0.00 29.99 31.35 2hf9 n HIS 154 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2hf9 h PRO 155 N 2.99 0.62 0.21 -0.41 0.13 -1.74 -3.08 132.00 130.72 2hf9 h PRO 155 Ca 0.10 -0.13 0.01 0.00 -0.87 0.00 0.00 66.00 65.12 2hf9 h PRO 155 Cb 0.86 -0.09 -0.04 0.00 0.13 0.00 0.00 31.00 31.85 2hf9 h PRO 155 CO 0.59 0.60 -0.50 0.78 -0.23 0.00 0.00 178.00 179.25 2hf9 h GLY 156 N 0.86 -1.09 1.22 1.56 0.00 -1.93 -1.58 103.07 102.11 2hf9 h GLY 156 Ca 0.13 0.59 -0.03 0.00 0.00 0.00 0.00 47.33 48.02 2hf9 h GLY 156 CO 0.00 -0.29 0.30 1.19 0.00 0.00 0.00 176.54 177.75 2hf9 h ILE 157 N -0.79 1.23 -0.68 2.60 2.10 -1.80 -2.84 117.51 117.33 2hf9 h ILE 157 Ca -0.01 -0.68 -0.00 0.00 1.08 0.00 0.00 64.86 65.25 2hf9 h ILE 157 Cb 0.77 0.37 -0.03 0.00 -1.09 0.00 0.00 36.82 36.84 2hf9 h ILE 157 CO -0.23 0.28 0.42 0.24 -1.08 0.00 0.00 178.15 177.79 2hf9 h MET 158 N 0.99 0.92 0.00 2.19 2.86 -1.39 -1.96 114.93 118.54 2hf9 h MET 158 Ca 0.24 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.79 2hf9 h MET 158 Cb 0.15 -0.20 -0.00 0.00 0.06 0.00 0.00 31.60 31.60 2hf9 h MET 158 CO -0.03 0.63 -0.07 0.87 1.06 0.00 0.00 176.91 179.37 2hf9 h LYS 159 N 0.94 0.00 -0.00 1.72 1.57 -1.04 -2.55 116.57 117.20 2hf9 h LYS 159 Ca 0.25 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 2hf9 h LYS 159 Cb -0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.25 2hf9 h LYS 159 CO -0.05 0.07 -0.23 0.25 -0.57 0.00 0.00 179.45 178.93 2hf9 n THR 160 N -3.27 0.00 -2.75 -0.16 -2.24 -0.74 -4.91 114.28 100.20 2hf9 n THR 160 Ca -0.01 -0.01 -0.39 0.00 -2.27 0.00 0.00 64.05 61.38 2hf9 n THR 160 Cb 0.28 -0.12 -0.06 0.00 -2.10 0.00 0.00 70.33 68.33 2hf9 n THR 160 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2hf9 s ALA 161 N -2.92 3.28 -0.11 6.98 0.00 -0.96 -4.70 121.76 123.33 2hf9 s ALA 161 Ca 0.15 0.59 0.12 0.00 0.00 0.00 0.00 51.96 52.82 2hf9 s ALA 161 Cb 0.19 -3.20 -0.24 0.00 0.00 0.00 0.00 23.12 19.87 2hf9 s ALA 161 CO 0.59 0.18 0.42 -0.25 0.00 0.00 0.00 175.76 176.70 2hf9 n ASP 162 N 1.05 0.78 -4.01 0.00 8.00 0.93 -4.57 116.55 118.73 2hf9 n ASP 162 Ca -0.00 0.25 -0.25 0.00 0.71 0.00 0.00 54.79 55.50 2hf9 n ASP 162 Cb 0.48 0.16 -0.17 0.00 -0.02 0.00 0.00 41.12 41.58 2hf9 n ASP 162 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2hf9 s LEU 163 N -6.02 1.60 -0.25 0.64 2.96 -1.02 -1.10 118.68 115.49 2hf9 s LEU 163 Ca -0.09 -0.30 -0.06 0.00 -0.22 0.00 0.00 54.13 53.46 2hf9 s LEU 163 Cb 0.07 -0.82 -0.01 0.00 0.50 0.00 0.00 46.19 45.93 2hf9 s LEU 163 CO 0.81 0.02 0.04 -0.63 -1.32 0.00 0.00 176.35 175.27 2hf9 s ILE 164 N 0.75 3.90 -0.26 6.68 1.01 0.12 -1.31 121.20 132.10 2hf9 s ILE 164 Ca -0.13 -0.43 -0.10 0.00 0.00 0.00 0.00 60.65 60.00 2hf9 s ILE 164 Cb -0.16 -2.87 -0.04 0.00 0.01 0.00 0.00 42.46 39.40 2hf9 s ILE 164 CO 0.03 0.29 0.14 -0.69 0.00 0.00 0.00 174.94 174.71 2hf9 s VAL 165 N 1.54 4.99 -0.59 2.92 1.01 -0.12 -1.32 120.40 128.82 2hf9 s VAL 165 Ca 0.05 0.06 -0.15 0.00 0.00 0.00 0.00 61.98 61.94 2hf9 s VAL 165 Cb -0.15 -3.35 0.15 0.00 0.00 0.00 0.00 36.38 33.03 2hf9 s VAL 165 CO 0.01 0.31 0.54 -0.63 0.00 0.00 0.00 175.10 175.33 2hf9 s ILE 166 N 1.49 5.20 0.48 2.22 1.01 0.07 -1.48 121.20 130.19 2hf9 s ILE 166 Ca 0.07 -1.72 0.01 0.00 0.00 0.00 0.00 60.65 59.01 2hf9 s ILE 166 Cb -0.15 -4.31 0.01 0.00 0.01 0.00 0.00 42.46 38.02 2hf9 s ILE 166 CO 0.07 -0.89 0.70 0.21 0.00 0.00 0.00 174.94 175.02 2hf9 s ASN 167 N 3.23 5.63 -1.33 3.58 3.04 0.36 -0.31 114.94 129.15 2hf9 s ASN 167 Ca 0.06 0.14 -0.06 0.00 0.04 0.00 0.00 52.86 53.04 2hf9 s ASN 167 Cb -0.26 -1.26 0.01 0.00 -1.54 0.00 0.00 41.25 38.20 2hf9 s ASN 167 CO 0.00 -0.85 0.83 0.29 -3.04 0.00 0.00 177.10 174.34 2hf9 n LYS 168 N -2.15 -5.95 0.25 0.43 5.02 -0.37 -1.33 118.16 114.05 2hf9 n LYS 168 Ca 0.04 0.79 0.17 0.00 -2.02 0.00 0.00 58.31 57.30 2hf9 n LYS 168 Cb 0.58 -5.56 0.90 0.00 -0.02 0.00 0.00 35.03 30.93 2hf9 n LYS 168 CO 0.00 0.00 0.00 -0.84 -0.52 0.00 0.00 177.40 176.04 2hf9 h ILE 169 N -1.90 0.37 0.00 -0.18 3.07 -1.50 -0.61 117.51 116.76 2hf9 h ILE 169 Ca -0.50 0.00 0.00 0.00 1.55 0.00 0.00 64.86 65.91 2hf9 h ILE 169 Cb 1.34 0.87 0.00 0.00 -0.27 0.00 0.00 36.82 38.76 2hf9 h ILE 169 CO 0.52 0.00 0.00 -0.90 -1.05 0.00 0.00 178.15 176.72 2hf9 n ASP 170 N -3.63 0.63 -0.55 2.16 5.75 -1.26 -2.58 116.55 117.07 2hf9 n ASP 170 Ca -0.00 0.68 0.07 0.00 -0.01 0.00 0.00 54.79 55.53 2hf9 n ASP 170 Cb 0.26 -0.81 0.07 0.00 -1.03 0.00 0.00 41.12 39.61 2hf9 n ASP 170 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2hf9 n LEU 171 N -2.23 2.21 -0.10 -2.12 4.77 -0.24 -4.75 117.00 114.54 2hf9 n LEU 171 Ca 0.01 -1.12 -0.06 0.00 -0.03 0.00 0.00 56.01 54.82 2hf9 n LEU 171 Cb 0.18 -0.03 0.02 0.00 -2.33 0.00 0.00 43.42 41.26 2hf9 n LEU 171 CO 0.17 0.43 0.88 0.00 -1.33 0.00 0.00 177.39 177.55 2hf9 h ALA 172 N 2.56 0.36 -0.70 -1.18 0.00 -1.51 -2.43 119.26 116.36 2hf9 h ALA 172 Ca 0.00 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 2hf9 h ALA 172 Cb 0.57 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 2hf9 h ALA 172 CO 0.00 -0.36 0.30 -0.44 0.00 0.00 0.00 179.25 178.76 2hf9 h ASP 173 N 0.16 0.92 0.13 0.00 3.32 -1.82 -0.13 116.42 119.00 2hf9 h ASP 173 Ca 0.17 -0.12 -0.04 0.00 0.02 0.00 0.00 57.03 57.07 2hf9 h ASP 173 Cb 0.21 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 2hf9 h ASP 173 CO -0.25 0.80 -0.16 0.00 -1.72 0.00 0.00 179.24 177.92 2hf9 h ALA 174 N 1.34 1.66 -0.02 3.45 0.00 -1.78 -2.35 119.26 121.56 2hf9 h ALA 174 Ca 0.24 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2hf9 h ALA 174 Cb 0.15 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2hf9 h ALA 174 CO -0.03 0.25 -0.45 1.33 0.00 0.00 0.00 179.25 180.35 2hf9 n VAL 175 N -4.32 0.00 -1.05 0.00 0.24 -1.08 -4.97 118.33 107.15 2hf9 n VAL 175 Ca -0.02 -0.26 -0.02 0.00 -2.04 0.00 0.00 64.34 62.00 2hf9 n VAL 175 Cb 0.24 1.22 -0.01 0.00 -1.47 0.00 0.00 33.84 33.82 2hf9 n VAL 175 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2hf9 n GLY 176 N 1.41 0.53 3.74 7.63 0.00 -0.46 -4.99 105.19 113.05 2hf9 n GLY 176 Ca 0.10 -0.51 -0.41 0.00 0.00 0.00 0.00 46.02 45.19 2hf9 n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hf9 s ALA 177 N -2.00 3.46 -0.49 4.61 0.00 -0.19 -4.94 121.76 122.21 2hf9 s ALA 177 Ca 0.00 0.98 -0.20 0.00 0.00 0.00 0.00 51.96 52.75 2hf9 s ALA 177 Cb 0.00 -3.43 0.05 0.00 0.00 0.00 0.00 23.12 19.74 2hf9 s ALA 177 CO 0.00 -0.42 0.64 0.34 0.00 0.00 0.00 175.76 176.32 2hf9 s ASP 178 N 0.24 6.24 0.41 0.00 -1.08 -1.26 -4.50 116.67 116.72 2hf9 s ASP 178 Ca 0.54 -0.78 0.22 0.00 -0.52 0.00 0.00 52.55 52.01 2hf9 s ASP 178 Cb -0.33 -2.30 0.78 0.00 -1.46 0.00 0.00 42.92 39.61 2hf9 s ASP 178 CO 0.36 -0.88 1.77 0.16 0.52 0.00 0.00 175.17 177.10 2hf9 h ILE 179 N 5.87 0.65 -0.10 4.11 3.07 -1.95 -2.32 117.51 126.83 2hf9 h ILE 179 Ca -0.27 -1.31 -0.21 0.00 1.55 0.00 0.00 64.86 64.63 2hf9 h ILE 179 Cb 1.09 1.86 0.00 0.00 -0.27 0.00 0.00 36.82 39.51 2hf9 h ILE 179 CO 0.95 0.27 -0.78 0.07 -1.05 0.00 0.00 178.15 177.62 2hf9 h LYS 180 N 0.00 0.59 -0.14 0.16 -0.00 -1.99 -1.02 116.57 114.17 2hf9 h LYS 180 Ca -0.00 -0.50 0.01 0.00 -0.00 0.00 0.00 60.65 60.17 2hf9 h LYS 180 Cb 0.84 0.11 -0.01 0.00 -0.00 0.00 0.00 32.23 33.16 2hf9 h LYS 180 CO 0.04 1.12 0.05 -0.22 -0.00 0.00 0.00 179.45 180.43 2hf9 h LYS 181 N 0.39 0.11 -0.60 0.07 3.64 -1.91 -0.25 116.57 118.02 2hf9 h LYS 181 Ca -0.05 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2hf9 h LYS 181 Cb 1.38 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 33.15 2hf9 h LYS 181 CO 0.15 0.07 0.39 0.52 -2.27 0.00 0.00 179.45 178.31 2hf9 h MET 182 N 0.12 0.80 -0.23 1.90 2.86 -1.35 0.20 114.93 119.24 2hf9 h MET 182 Ca 0.06 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.65 2hf9 h MET 182 Cb 0.04 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.51 2hf9 h MET 182 CO -0.06 0.54 0.14 1.49 1.06 0.00 0.00 176.91 180.08 2hf9 h GLU 183 N 0.82 0.31 -0.80 1.72 4.81 -1.02 -1.40 114.58 119.02 2hf9 h GLU 183 Ca 0.22 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.38 2hf9 h GLU 183 Cb -0.08 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.20 2hf9 h GLU 183 CO -0.05 0.24 0.32 -0.91 -0.73 0.00 0.00 179.01 177.88 2hf9 h ASN 184 N 0.28 1.11 -0.30 1.04 2.35 -0.71 -2.15 115.58 117.20 2hf9 h ASN 184 Ca 0.08 -0.17 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 2hf9 h ASN 184 Cb 0.02 -0.29 -0.01 0.00 0.05 0.00 0.00 38.32 38.08 2hf9 h ASN 184 CO -0.02 0.98 0.20 0.44 -1.65 0.00 0.00 177.43 177.38 2hf9 h ASP 185 N 1.17 0.35 -0.57 5.81 3.45 -0.41 -0.74 116.42 125.47 2hf9 h ASP 185 Ca 0.27 -0.01 -0.01 0.00 0.43 0.00 0.00 57.03 57.70 2hf9 h ASP 185 Cb 0.22 -0.09 -0.03 0.00 -0.56 0.00 0.00 39.33 38.88 2hf9 h ASP 185 CO -0.02 0.26 0.31 0.00 -1.57 0.00 0.00 179.24 178.21 2hf9 h ALA 186 N 1.11 0.73 -0.15 3.45 0.00 -1.11 -1.49 119.26 121.80 2hf9 h ALA 186 Ca 0.11 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 2hf9 h ALA 186 Cb -0.04 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 2hf9 h ALA 186 CO -0.02 0.26 -0.44 0.87 0.00 0.00 0.00 179.25 179.92 2hf9 h LYS 187 N 0.77 0.35 -0.21 0.00 1.57 -1.27 -0.44 116.57 117.34 2hf9 h LYS 187 Ca 0.20 -0.18 -0.09 0.00 -1.87 0.00 0.00 60.65 58.71 2hf9 h LYS 187 Cb 0.06 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.37 2hf9 h LYS 187 CO -0.03 0.73 -0.20 -0.09 -0.57 0.00 0.00 179.45 179.29 2hf9 h ARG 188 N 0.29 0.51 -0.00 3.15 2.43 -0.90 -2.71 114.38 117.15 2hf9 h ARG 188 Ca 0.02 -0.27 -0.21 0.00 -0.81 0.00 0.00 59.98 58.71 2hf9 h ARG 188 Cb 0.89 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.44 2hf9 h ARG 188 CO 0.07 0.84 -0.91 0.82 -1.51 0.00 0.00 179.97 179.29 2hf9 h ILE 189 N 0.20 1.44 -2.56 1.20 2.04 -1.23 -3.39 117.51 115.21 2hf9 h ILE 189 Ca 0.04 -2.51 -0.59 0.00 1.00 0.00 0.00 64.86 62.80 2hf9 h ILE 189 Cb 0.74 2.43 -0.39 0.00 -0.74 0.00 0.00 36.82 38.86 2hf9 h ILE 189 CO 0.05 0.74 -0.88 0.21 0.00 0.00 0.00 178.15 178.27 2hf9 s ASN 190 N -7.02 2.46 0.60 1.72 3.84 -0.18 -4.74 114.94 111.62 2hf9 s ASN 190 Ca -0.05 -2.74 0.37 0.00 0.21 0.00 0.00 52.86 50.65 2hf9 s ASN 190 Cb 0.09 -0.57 1.87 0.00 -0.55 0.00 0.00 41.25 42.10 2hf9 s ASN 190 CO 0.85 -0.23 2.18 -0.65 -2.79 0.00 0.00 177.10 176.47 2hf9 h PRO 191 N 6.25 0.00 0.00 0.43 0.11 -1.69 -2.91 132.00 134.19 2hf9 h PRO 191 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 2hf9 h PRO 191 Cb 0.92 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.03 2hf9 h PRO 191 CO 0.37 0.03 -0.64 -0.44 -0.21 0.00 0.00 178.00 177.10 2hf9 h ASP 192 N 0.00 0.00 -4.07 -2.05 3.32 -1.94 -3.47 116.42 108.21 2hf9 h ASP 192 Ca -0.00 -0.01 -0.44 0.00 0.02 0.00 0.00 57.03 56.59 2hf9 h ASP 192 Cb 0.23 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.77 2hf9 h ASP 192 CO 0.00 0.01 0.34 0.00 -1.72 0.00 0.00 179.24 177.87 2hf9 s ALA 193 N -3.30 3.04 0.32 3.45 0.00 -1.10 -5.02 121.76 119.15 2hf9 s ALA 193 Ca 0.03 0.39 -0.27 0.00 0.00 0.00 0.00 51.96 52.11 2hf9 s ALA 193 Cb 0.08 -3.15 -0.09 0.00 0.00 0.00 0.00 23.12 19.96 2hf9 s ALA 193 CO 0.74 0.09 1.00 -1.21 0.00 0.00 0.00 175.76 176.39 2hf9 s GLU 194 N -3.25 4.52 -0.09 0.00 0.41 -0.26 -4.91 118.70 115.12 2hf9 s GLU 194 Ca 0.62 1.50 0.01 0.00 -0.41 0.00 0.00 54.97 56.69 2hf9 s GLU 194 Cb -0.09 -2.88 0.02 0.00 -1.78 0.00 0.00 34.13 29.39 2hf9 s GLU 194 CO 0.15 0.19 -0.10 0.08 -0.49 0.00 0.00 175.26 175.08 2hf9 s VAL 195 N -1.47 1.13 -0.08 2.63 1.01 -1.26 0.13 120.40 122.51 2hf9 s VAL 195 Ca 0.50 -0.41 0.03 0.00 0.00 0.00 0.00 61.98 62.09 2hf9 s VAL 195 Cb -0.23 -1.09 0.01 0.00 0.00 0.00 0.00 36.38 35.07 2hf9 s VAL 195 CO 0.30 0.37 -0.15 -0.69 0.00 0.00 0.00 175.10 174.93 2hf9 s VAL 196 N 1.20 1.39 -0.15 2.92 1.01 -0.44 -4.99 120.40 121.34 2hf9 s VAL 196 Ca -0.04 -0.62 -0.21 0.00 0.00 0.00 0.00 61.98 61.10 2hf9 s VAL 196 Cb -0.14 -1.24 -0.03 0.00 0.00 0.00 0.00 36.38 34.97 2hf9 s VAL 196 CO -0.03 0.41 0.64 -0.76 0.00 0.00 0.00 175.10 175.36 2hf9 s LEU 197 N 0.61 4.21 0.01 3.92 2.01 -1.26 -0.75 118.68 127.44 2hf9 s LEU 197 Ca -0.15 0.94 0.02 0.00 0.01 0.00 0.00 54.13 54.95 2hf9 s LEU 197 Cb -0.16 -2.93 -0.01 0.00 0.01 0.00 0.00 46.19 43.10 2hf9 s LEU 197 CO 0.05 -0.20 -0.06 -0.22 1.01 0.00 0.00 176.35 176.94 2hf9 s LEU 198 N 1.42 2.11 -0.11 1.79 2.96 0.58 -4.01 118.68 123.42 2hf9 s LEU 198 Ca 0.31 -0.27 0.00 0.00 -0.22 0.00 0.00 54.13 53.96 2hf9 s LEU 198 Cb -0.16 -0.19 0.02 0.00 0.50 0.00 0.00 46.19 46.36 2hf9 s LEU 198 CO 0.12 -0.06 -0.10 -0.55 -1.32 0.00 0.00 176.35 174.45 2hf9 s SER 199 N -0.70 2.19 0.00 3.68 0.15 -0.45 -1.24 113.70 117.34 2hf9 s SER 199 Ca -0.03 -0.33 0.29 0.00 0.70 0.00 0.00 55.95 56.58 2hf9 s SER 199 Cb -0.05 -0.90 1.34 0.00 -1.71 0.00 0.00 66.02 64.70 2hf9 s SER 199 CO -0.00 -0.08 1.96 0.18 1.20 0.00 0.00 173.24 176.50 2hf9 n LEU 200 N 4.69 0.08 -0.06 3.45 4.77 -1.26 -0.38 117.00 128.29 2hf9 n LEU 200 Ca -0.15 0.31 -0.05 0.00 -0.03 0.00 0.00 56.01 56.09 2hf9 n LEU 200 Cb 0.50 -0.35 -0.04 0.00 -2.33 0.00 0.00 43.42 41.21 2hf9 n LEU 200 CO 0.19 0.02 0.04 0.50 -1.33 0.00 0.00 177.39 176.81 2hf9 h LYS 201 N 0.07 0.00 0.00 3.23 3.64 -1.96 -3.38 116.57 118.17 2hf9 h LYS 201 Ca 0.00 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 2hf9 h LYS 201 Cb 0.38 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.20 2hf9 h LYS 201 CO 0.00 0.31 -0.20 1.79 -2.27 0.00 0.00 179.45 179.08 2hf9 h THR 202 N -1.00 0.20 0.00 1.00 1.35 -1.99 -3.47 112.91 109.00 2hf9 h THR 202 Ca -0.02 -1.29 0.00 0.00 -0.55 0.00 0.00 66.41 64.55 2hf9 h THR 202 Cb 0.38 2.06 0.00 0.00 -1.73 0.00 0.00 68.15 68.86 2hf9 h THR 202 CO -0.01 0.11 0.00 0.23 -0.25 0.00 0.00 175.52 175.60 2hf9 n MET 203 N -3.10 -0.07 -1.71 4.72 2.81 0.49 -5.02 117.12 115.25 2hf9 n MET 203 Ca 0.03 0.02 -0.43 0.00 -1.81 0.00 0.00 57.70 55.51 2hf9 n MET 203 Cb 0.58 -2.88 -0.03 0.00 -0.71 0.00 0.00 33.22 30.18 2hf9 n MET 203 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 2hf9 n GLU 204 N -2.14 2.64 -0.17 0.03 2.13 -1.18 -1.62 120.64 120.32 2hf9 n GLU 204 Ca 0.00 0.95 0.00 0.00 0.66 0.00 0.00 57.16 58.77 2hf9 n GLU 204 Cb 0.02 -2.79 0.00 0.00 0.27 0.00 0.00 31.44 28.94 2hf9 n GLU 204 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2hf9 n GLY 205 N 3.87 2.11 0.29 8.31 0.00 -1.26 -1.34 105.19 117.18 2hf9 n GLY 205 Ca 0.16 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.15 2hf9 n GLY 205 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2hf9 h PHE 206 N 0.00 0.79 -0.51 1.61 3.57 -1.59 -2.73 116.94 118.08 2hf9 h PHE 206 Ca 0.00 -0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.41 2hf9 h PHE 206 Cb 0.00 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 38.49 2hf9 h PHE 206 CO 0.00 0.72 0.33 0.38 -2.23 0.00 0.00 178.31 177.51 2hf9 h ASP 207 N 0.71 0.59 -0.31 0.41 2.03 -1.91 -0.62 116.42 117.32 2hf9 h ASP 207 Ca 0.14 -0.02 -0.14 0.00 -0.73 0.00 0.00 57.03 56.28 2hf9 h ASP 207 Cb 0.40 -0.15 -0.01 0.00 -0.83 0.00 0.00 39.33 38.74 2hf9 h ASP 207 CO 0.01 0.43 -0.34 0.11 -1.03 0.00 0.00 179.24 178.43 2hf9 h LYS 208 N 0.69 0.84 -0.26 4.15 1.57 -1.89 -0.73 116.57 120.95 2hf9 h LYS 208 Ca 0.19 -0.41 -0.03 0.00 -1.87 0.00 0.00 60.65 58.52 2hf9 h LYS 208 Cb -0.07 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 2hf9 h LYS 208 CO -0.04 1.05 0.03 0.28 -0.57 0.00 0.00 179.45 180.20 2hf9 h VAL 209 N 0.70 1.24 -0.73 0.50 2.07 -1.27 -2.12 116.25 116.64 2hf9 h VAL 209 Ca 0.07 -0.82 0.08 0.00 0.82 0.00 0.00 66.70 66.85 2hf9 h VAL 209 Cb 0.90 1.27 -0.06 0.00 -1.52 0.00 0.00 31.29 31.87 2hf9 h VAL 209 CO 0.08 0.26 0.40 0.25 0.02 0.00 0.00 177.57 178.58 2hf9 h LEU 210 N 0.24 0.58 -0.82 2.57 5.85 -1.04 -1.81 115.31 120.88 2hf9 h LEU 210 Ca 0.08 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.81 2hf9 h LEU 210 Cb 0.36 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.28 2hf9 h LEU 210 CO 0.01 0.35 0.39 -0.08 -0.34 0.00 0.00 178.44 178.77 2hf9 h GLU 211 N 0.71 1.19 -0.49 1.25 4.81 -1.02 -1.00 114.58 120.03 2hf9 h GLU 211 Ca 0.34 -0.18 -0.01 0.00 -0.13 0.00 0.00 59.36 59.38 2hf9 h GLU 211 Cb 0.27 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 2hf9 h GLU 211 CO -0.22 0.92 0.28 0.35 -0.73 0.00 0.00 179.01 179.61 2hf9 h PHE 212 N 1.17 0.65 0.38 0.92 3.57 -0.74 -0.72 116.94 122.18 2hf9 h PHE 212 Ca 0.28 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.76 2hf9 h PHE 212 Cb 0.13 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 38.66 2hf9 h PHE 212 CO 0.01 0.47 -0.19 0.82 -2.23 0.00 0.00 178.31 177.19 2hf9 h ILE 213 N 0.65 0.60 -0.69 1.41 1.08 -1.03 -1.10 117.51 118.42 2hf9 h ILE 213 Ca 0.17 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.65 2hf9 h ILE 213 Cb 0.02 0.60 -0.04 0.00 -3.07 0.00 0.00 36.82 34.33 2hf9 h ILE 213 CO -0.03 0.00 0.45 -0.33 -0.69 0.00 0.00 178.15 177.55 2hf9 h GLU 214 N -0.53 0.90 -0.42 2.37 4.39 -1.08 -1.90 114.58 118.31 2hf9 h GLU 214 Ca -0.05 -0.05 -0.07 0.00 0.34 0.00 0.00 59.36 59.53 2hf9 h GLU 214 Cb 0.41 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.85 2hf9 h GLU 214 CO 0.07 0.59 -0.01 0.87 -1.16 0.00 0.00 179.01 179.38 2hf9 h LYS 215 N 0.92 0.75 -1.01 2.33 1.57 -1.13 -2.64 116.57 117.36 2hf9 h LYS 215 Ca 0.26 -0.24 0.06 0.00 -1.87 0.00 0.00 60.65 58.86 2hf9 h LYS 215 Cb -0.08 -0.06 -0.07 0.00 0.08 0.00 0.00 32.23 32.09 2hf9 h LYS 215 CO -0.07 0.83 0.65 0.77 -0.57 0.00 0.00 179.45 181.07 2hf9 h SER 216 N 0.58 1.05 -0.23 0.86 0.02 -0.84 -0.64 113.55 114.35 2hf9 h SER 216 Ca 0.12 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 2hf9 h SER 216 Cb 0.50 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 2hf9 h SER 216 CO 0.02 0.67 0.10 0.58 -1.14 0.00 0.00 176.83 177.06 2hf9 h VAL 217 N 1.19 1.15 0.00 2.27 2.07 -1.27 -2.98 116.25 118.68 2hf9 h VAL 217 Ca 0.43 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2hf9 h VAL 217 Cb 0.16 1.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 2hf9 h VAL 217 CO -0.17 0.15 0.00 0.11 0.02 0.00 0.00 177.57 177.68 2hf9 h LYS 218 N 0.23 0.00 -0.00 1.57 1.57 -1.03 -3.11 116.57 115.79 2hf9 h LYS 218 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2hf9 h LYS 218 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.45 2hf9 h LYS 218 CO -0.01 0.00 -0.35 0.39 -0.57 0.00 0.00 179.45 178.91 2hf9 n GLU 219 N -3.01 0.08 0.00 3.15 1.02 -0.30 -5.10 120.64 116.48 2hf9 n GLU 219 Ca 0.01 -0.04 0.09 0.00 -0.02 0.00 0.00 57.16 57.20 2hf9 n GLU 219 Cb 0.32 -1.50 0.51 0.00 -0.02 0.00 0.00 31.44 30.75 2hf9 n GLU 219 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64