#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fqo s LEU 2 N 0.00 3.07 0.13 -4.42 2.96 -1.26 -1.17 118.68 117.99 3fqo s LEU 2 Ca 0.00 -0.76 0.08 0.00 -0.22 0.00 0.00 54.13 53.23 3fqo s LEU 2 Cb 0.00 -1.67 -0.04 0.00 0.50 0.00 0.00 46.19 44.98 3fqo s LEU 2 CO 0.00 -0.10 -0.19 -0.44 -1.32 0.00 0.00 176.35 174.30 3fqo s SER 3 N 1.36 2.52 0.11 3.68 0.01 -0.20 -0.73 113.70 120.45 3fqo s SER 3 Ca 0.02 -0.78 -0.20 0.00 1.31 0.00 0.00 55.95 56.30 3fqo s SER 3 Cb -0.16 -0.14 -0.07 0.00 0.21 0.00 0.00 66.02 65.86 3fqo s SER 3 CO -0.05 -0.01 0.62 -0.63 0.41 0.00 0.00 173.24 173.58 3fqo s ILE 4 N -1.68 4.67 -0.14 1.44 1.01 -0.39 0.28 121.20 126.39 3fqo s ILE 4 Ca 0.11 1.26 -0.00 0.00 0.00 0.00 0.00 60.65 62.01 3fqo s ILE 4 Cb -0.07 -3.92 0.03 0.00 0.01 0.00 0.00 42.46 38.51 3fqo s ILE 4 CO 0.05 0.47 -0.06 -0.22 0.00 0.00 0.00 174.94 175.18 3fqo s LEU 5 N -1.32 1.40 -0.09 2.97 2.96 -0.23 0.14 118.68 124.52 3fqo s LEU 5 Ca 0.33 -0.49 -0.19 0.00 -0.22 0.00 0.00 54.13 53.55 3fqo s LEU 5 Cb -0.19 -0.87 0.04 0.00 0.50 0.00 0.00 46.19 45.67 3fqo s LEU 5 CO 0.20 -0.15 0.47 0.54 -1.32 0.00 0.00 176.35 176.09 3fqo s VAL 6 N 1.67 0.02 -0.16 1.68 0.11 -0.57 -4.37 120.40 118.78 3fqo s VAL 6 Ca 0.03 -0.18 -0.01 0.00 -2.93 0.00 0.00 61.98 58.89 3fqo s VAL 6 Cb -0.14 -0.73 -0.01 0.00 -1.53 0.00 0.00 36.38 33.97 3fqo s VAL 6 CO -0.08 -0.10 -0.12 0.00 -3.33 0.00 0.00 175.10 171.48 3fqo s ALA 7 N -0.68 2.62 0.05 1.54 0.00 -1.26 -0.26 121.76 123.78 3fqo s ALA 7 Ca -0.08 -1.01 0.01 0.00 0.00 0.00 0.00 51.96 50.88 3fqo s ALA 7 Cb -0.03 -1.34 -0.03 0.00 0.00 0.00 0.00 23.12 21.72 3fqo s ALA 7 CO 0.04 -0.02 -0.05 -3.38 0.00 0.00 0.00 175.76 172.35 3fqo s HIS 8 N 0.79 0.60 0.00 0.00 -3.43 -0.29 -4.57 115.29 108.39 3fqo s HIS 8 Ca -0.04 -0.74 0.00 0.00 -0.80 0.00 0.00 55.06 53.48 3fqo s HIS 8 Cb -0.15 -0.38 0.00 0.00 -1.43 0.00 0.00 32.58 30.62 3fqo s HIS 8 CO 0.01 -0.19 0.00 -0.40 -2.00 0.00 0.00 174.74 172.16 3fqo n ASP 9 N 0.81 0.00 0.27 7.38 5.75 -0.62 -0.21 116.55 129.93 3fqo n ASP 9 Ca -0.18 -0.76 0.18 0.00 -0.01 0.00 0.00 54.79 54.02 3fqo n ASP 9 Cb 0.58 0.00 0.87 0.00 -1.03 0.00 0.00 41.12 41.53 3fqo n ASP 9 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 3fqo h LEU 10 N 0.00 0.00 -3.08 -2.12 3.38 -1.11 -1.20 115.31 111.18 3fqo h LEU 10 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3fqo h LEU 10 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3fqo h LEU 10 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.53 3fqo n GLN 11 N -2.91 2.45 -1.27 1.13 10.64 -1.26 -4.97 117.38 121.19 3fqo n GLN 11 Ca -0.01 -2.44 -0.09 0.00 -1.83 0.00 0.00 57.00 52.62 3fqo n GLN 11 Cb 0.18 -1.53 -0.04 0.00 -0.86 0.00 0.00 30.24 27.99 3fqo n GLN 11 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.06 175.77 3fqo n ARG 12 N -0.60 -0.73 -1.85 2.61 1.74 -0.45 -4.93 116.66 112.45 3fqo n ARG 12 Ca 0.15 0.81 -0.42 0.00 -0.77 0.00 0.00 57.85 57.63 3fqo n ARG 12 Cb 0.65 -4.73 -0.02 0.00 -1.02 0.00 0.00 32.46 27.34 3fqo n ARG 12 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3fqo s VAL 13 N -2.31 2.28 -0.01 1.55 1.01 -1.26 -0.55 120.40 121.11 3fqo s VAL 13 Ca 0.00 0.22 0.02 0.00 0.00 0.00 0.00 61.98 62.22 3fqo s VAL 13 Cb 0.00 -3.14 -0.03 0.00 0.00 0.00 0.00 36.38 33.21 3fqo s VAL 13 CO 0.00 0.03 0.05 2.30 0.00 0.00 0.00 175.10 177.48 3fqo n ILE 14 N 2.72 0.00 -3.56 2.22 -5.35 0.71 -1.59 119.36 114.51 3fqo n ILE 14 Ca 0.10 -0.08 -0.11 0.00 -0.27 0.00 0.00 62.75 62.39 3fqo n ILE 14 Cb 0.38 0.50 -0.04 0.00 -1.74 0.00 0.00 39.64 38.74 3fqo n ILE 14 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3fqo s GLY 15 N -2.15 -0.39 -0.14 3.28 0.00 -1.15 -4.58 107.32 102.19 3fqo s GLY 15 Ca -0.01 0.14 -0.06 0.00 0.00 0.00 0.00 44.72 44.80 3fqo s GLY 15 CO 0.08 -0.14 0.30 -0.12 0.00 0.00 0.00 173.10 173.22 3fqo s PHE 16 N -3.75 -0.48 -1.27 1.90 2.19 -0.26 -1.52 117.98 114.79 3fqo s PHE 16 Ca 0.02 1.05 -0.12 0.00 0.33 0.00 0.00 56.93 58.20 3fqo s PHE 16 Cb 0.01 0.07 -0.00 0.00 -1.31 0.00 0.00 43.02 41.79 3fqo s PHE 16 CO -0.12 -0.34 0.62 0.39 1.83 0.00 0.00 175.22 177.60 3fqo n GLU 17 N 4.93 -2.14 -0.91 10.12 1.02 -1.26 -1.55 120.64 130.85 3fqo n GLU 17 Ca -0.14 0.41 0.00 0.00 -0.02 0.00 0.00 57.16 57.41 3fqo n GLU 17 Cb 0.51 -4.20 0.00 0.00 -0.02 0.00 0.00 31.44 27.73 3fqo n GLU 17 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3fqo n ASN 18 N -2.78 -4.32 -4.50 1.62 3.02 -1.26 -4.97 115.26 102.08 3fqo n ASN 18 Ca -0.20 0.00 -0.24 0.00 -0.03 0.00 0.00 54.58 54.11 3fqo n ASN 18 Cb 0.63 -2.83 -0.10 0.00 -0.61 0.00 0.00 39.78 36.87 3fqo n ASN 18 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3fqo s GLN 19 N -1.51 1.76 0.15 3.52 -0.21 -0.60 -4.75 119.66 118.03 3fqo s GLN 19 Ca 0.00 -1.74 -0.30 0.00 0.02 0.00 0.00 55.36 53.34 3fqo s GLN 19 Cb 0.00 -1.81 -0.07 0.00 1.00 0.00 0.00 33.01 32.13 3fqo s GLN 19 CO 0.00 0.32 1.16 -0.51 -2.12 0.00 0.00 175.29 174.13 3fqo s LEU 20 N -3.54 4.45 0.34 2.90 1.43 -1.26 -1.10 118.68 121.90 3fqo s LEU 20 Ca 0.30 2.12 0.27 0.00 -1.03 0.00 0.00 54.13 55.79 3fqo s LEU 20 Cb -0.05 -3.60 1.05 0.00 0.03 0.00 0.00 46.19 43.63 3fqo s LEU 20 CO 0.16 -0.33 1.79 -0.65 0.23 0.00 0.00 176.35 177.55 3fqo h PRO 21 N 5.54 0.00 -5.89 1.29 0.11 -1.87 -3.46 132.00 127.72 3fqo h PRO 21 Ca -0.44 0.00 -0.54 0.00 0.11 0.00 0.00 66.00 65.13 3fqo h PRO 21 Cb 1.21 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.18 3fqo h PRO 21 CO 0.75 0.00 -0.74 1.67 -0.21 0.00 0.00 178.00 179.47 3fqo s TRP 22 N -3.39 2.05 -0.34 0.65 -2.14 -1.26 -5.05 118.94 109.45 3fqo s TRP 22 Ca 0.04 -0.46 -0.05 0.00 2.66 0.00 0.00 56.10 58.29 3fqo s TRP 22 Cb 0.09 -0.95 0.05 0.00 -3.10 0.00 0.00 33.47 29.57 3fqo s TRP 22 CO 0.47 0.54 0.10 -1.01 -2.66 0.00 0.00 176.95 174.39 3fqo s HIS 23 N -2.73 3.29 -0.39 1.66 3.76 -1.26 -5.05 115.29 114.57 3fqo s HIS 23 Ca 0.27 -1.59 0.02 0.00 -0.15 0.00 0.00 55.06 53.61 3fqo s HIS 23 Cb -0.02 -2.37 0.16 0.00 1.11 0.00 0.00 32.58 31.46 3fqo s HIS 23 CO 0.12 -0.77 0.30 -1.17 -0.85 0.00 0.00 174.74 172.37 3fqo s LEU 24 N 1.36 1.01 0.39 0.89 2.96 -1.26 -4.69 118.68 119.34 3fqo s LEU 24 Ca -0.01 -2.55 0.14 0.00 -0.22 0.00 0.00 54.13 51.48 3fqo s LEU 24 Cb -0.20 -0.26 0.97 0.00 0.50 0.00 0.00 46.19 47.20 3fqo s LEU 24 CO 0.01 -0.23 1.85 -0.65 -1.32 0.00 0.00 176.35 176.02 3fqo h PRO 25 N 6.28 0.51 -0.34 0.98 0.11 -1.97 -0.97 132.00 136.61 3fqo h PRO 25 Ca 0.16 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 66.26 3fqo h PRO 25 Cb 0.95 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.93 3fqo h PRO 25 CO 0.30 0.34 0.22 -0.91 -0.21 0.00 0.00 178.00 177.74 3fqo h ASN 26 N 0.53 0.34 0.15 -2.05 2.35 -1.94 -1.75 115.58 113.21 3fqo h ASN 26 Ca 0.47 -0.01 -0.24 0.00 -0.55 0.00 0.00 56.30 55.98 3fqo h ASN 26 Cb 1.00 -0.08 0.01 0.00 0.05 0.00 0.00 38.32 39.30 3fqo h ASN 26 CO -0.21 0.24 -0.94 -0.78 -1.65 0.00 0.00 177.43 174.10 3fqo h ASP 27 N 0.40 0.71 -0.83 5.81 1.82 -1.61 -2.07 116.42 120.66 3fqo h ASP 27 Ca 0.13 -0.55 0.00 0.00 -0.39 0.00 0.00 57.03 56.22 3fqo h ASP 27 Cb 0.03 -0.22 -0.04 0.00 0.68 0.00 0.00 39.33 39.78 3fqo h ASP 27 CO -0.03 1.34 0.52 -0.07 -1.61 0.00 0.00 179.24 179.40 3fqo h LEU 28 N 0.33 0.99 -0.57 2.28 3.38 -1.28 -0.46 115.31 119.98 3fqo h LEU 28 Ca -0.09 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 3fqo h LEU 28 Cb 1.58 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 42.05 3fqo h LEU 28 CO 0.17 0.74 0.32 0.11 0.09 0.00 0.00 178.44 179.87 3fqo h LYS 29 N 1.15 0.79 -0.20 1.13 1.57 -1.29 -0.17 116.57 119.55 3fqo h LYS 29 Ca 0.30 -0.09 0.04 0.00 -1.87 0.00 0.00 60.65 59.03 3fqo h LYS 29 Cb -0.08 -0.16 -0.04 0.00 0.08 0.00 0.00 32.23 32.04 3fqo h LYS 29 CO -0.06 0.60 -0.04 1.25 -0.57 0.00 0.00 179.45 180.63 3fqo h HIS 30 N 0.77 -0.08 -0.36 -1.35 2.76 -0.91 -0.23 115.15 115.75 3fqo h HIS 30 Ca 0.20 0.02 0.02 0.00 -2.20 0.00 0.00 60.37 58.41 3fqo h HIS 30 Cb 0.03 0.07 -0.03 0.00 1.55 0.00 0.00 27.41 29.03 3fqo h HIS 30 CO -0.01 -0.07 0.20 0.28 -1.30 0.00 0.00 177.93 177.02 3fqo h VAL 31 N 0.02 1.01 -0.57 5.26 2.07 -0.92 -0.96 116.25 122.16 3fqo h VAL 31 Ca 0.10 -0.14 0.03 0.00 0.82 0.00 0.00 66.70 67.51 3fqo h VAL 31 Cb 0.14 0.57 -0.04 0.00 -1.52 0.00 0.00 31.29 30.44 3fqo h VAL 31 CO -0.19 0.07 0.33 0.50 0.02 0.00 0.00 177.57 178.30 3fqo h LYS 32 N 0.41 0.63 -0.24 1.57 3.64 -0.74 -1.14 116.57 120.70 3fqo h LYS 32 Ca 0.15 -0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 59.41 3fqo h LYS 32 Cb 0.03 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.70 3fqo h LYS 32 CO -0.08 0.42 -0.16 -0.22 -2.27 0.00 0.00 179.45 177.13 3fqo h LYS 33 N 0.65 0.53 -0.63 1.90 3.64 -0.86 -2.09 116.57 119.71 3fqo h LYS 33 Ca 0.24 -0.25 -0.08 0.00 -1.27 0.00 0.00 60.65 59.29 3fqo h LYS 33 Cb 0.06 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 3fqo h LYS 33 CO -0.12 0.82 0.10 -0.07 -2.27 0.00 0.00 179.45 177.91 3fqo h LEU 34 N 0.24 1.01 -0.50 5.20 4.07 -1.04 -3.37 115.31 120.93 3fqo h LEU 34 Ca 0.05 -0.26 0.00 0.00 0.08 0.00 0.00 57.88 57.74 3fqo h LEU 34 Cb 0.69 -0.27 0.00 0.00 1.08 0.00 0.00 40.66 42.16 3fqo h LEU 34 CO 0.04 1.02 -0.32 -1.54 -1.08 0.00 0.00 178.44 176.56 3fqo n SER 35 N -4.26 0.99 -4.71 -0.43 3.41 -0.44 -4.88 113.62 103.30 3fqo n SER 35 Ca 0.04 -1.00 -0.42 0.00 -0.26 0.00 0.00 58.87 57.23 3fqo n SER 35 Cb 0.29 0.66 -0.03 0.00 -0.26 0.00 0.00 64.21 64.87 3fqo n SER 35 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3fqo s THR 36 N -1.63 2.47 0.00 6.66 2.01 -0.79 -1.51 115.64 122.86 3fqo s THR 36 Ca 0.07 0.26 0.00 0.00 0.31 0.00 0.00 61.69 62.33 3fqo s THR 36 Cb 0.08 -3.17 0.00 0.00 0.01 0.00 0.00 72.50 69.43 3fqo s THR 36 CO 0.33 0.01 0.00 0.61 -0.69 0.00 0.00 174.62 174.88 3fqo n GLY 37 N 3.92 0.75 0.00 4.40 0.00 0.07 -5.00 105.19 109.34 3fqo n GLY 37 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 3fqo n GLY 37 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3fqo n HIS 38 N -2.38 0.00 -5.08 1.61 -0.00 -0.57 -4.92 115.22 103.88 3fqo n HIS 38 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 57.72 57.43 3fqo n HIS 38 Cb 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 29.99 29.83 3fqo n HIS 38 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 3fqo s THR 39 N 1.12 1.79 -0.16 1.59 2.01 -0.81 -0.94 115.64 120.24 3fqo s THR 39 Ca 0.00 -0.91 -0.04 0.00 0.31 0.00 0.00 61.69 61.06 3fqo s THR 39 Cb 0.00 -1.54 -0.02 0.00 0.01 0.00 0.00 72.50 70.95 3fqo s THR 39 CO 0.00 0.50 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.63 3fqo s LEU 40 N 0.04 3.17 -0.16 4.42 1.43 -0.26 -0.21 118.68 127.11 3fqo s LEU 40 Ca -0.07 -0.18 -0.03 0.00 -1.03 0.00 0.00 54.13 52.82 3fqo s LEU 40 Cb -0.14 -1.77 -0.02 0.00 0.03 0.00 0.00 46.19 44.29 3fqo s LEU 40 CO 0.04 0.14 -0.07 -0.69 0.23 0.00 0.00 176.35 176.00 3fqo s VAL 41 N 0.55 3.51 0.04 -1.59 1.01 -0.11 -0.43 120.40 123.38 3fqo s VAL 41 Ca -0.03 -0.49 -0.02 0.00 0.00 0.00 0.00 61.98 61.44 3fqo s VAL 41 Cb -0.14 -2.53 -0.03 0.00 0.00 0.00 0.00 36.38 33.68 3fqo s VAL 41 CO 0.03 0.49 0.01 0.00 0.00 0.00 0.00 175.10 175.62 3fqo s MET 42 N 0.61 0.52 0.76 2.72 0.00 -0.07 -0.50 119.30 123.33 3fqo s MET 42 Ca -0.04 -0.91 -0.11 0.00 0.00 0.00 0.00 55.69 54.63 3fqo s MET 42 Cb -0.15 0.19 0.05 0.00 0.00 0.00 0.00 34.83 34.92 3fqo s MET 42 CO 0.03 -0.11 1.08 0.20 0.00 0.00 0.00 175.02 176.22 3fqo s GLY 43 N -2.28 1.66 0.26 3.16 0.00 0.16 -0.38 107.32 109.90 3fqo s GLY 43 Ca -0.03 0.10 -0.02 0.00 0.00 0.00 0.00 44.72 44.77 3fqo s GLY 43 CO -0.06 0.45 1.82 -0.09 0.00 0.00 0.00 173.10 175.22 3fqo h ARG 44 N -1.01 0.86 -0.46 2.90 1.12 -1.71 -2.55 114.38 113.53 3fqo h ARG 44 Ca -0.45 -0.05 -0.08 0.00 -1.11 0.00 0.00 59.98 58.29 3fqo h ARG 44 Cb 1.23 -0.19 -0.02 0.00 -0.01 0.00 0.00 29.97 30.98 3fqo h ARG 44 CO 0.55 0.57 -0.02 0.87 -3.11 0.00 0.00 179.97 178.82 3fqo h LYS 45 N 0.88 0.82 -0.39 0.20 1.57 -1.92 -1.73 116.57 115.99 3fqo h LYS 45 Ca 0.45 -0.27 -0.00 0.00 -1.87 0.00 0.00 60.65 58.95 3fqo h LYS 45 Cb 0.43 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 3fqo h LYS 45 CO -0.26 0.89 0.24 1.15 -0.57 0.00 0.00 179.45 180.90 3fqo h THR 46 N 0.67 1.12 -0.57 -0.16 2.02 -1.83 -1.82 112.91 112.34 3fqo h THR 46 Ca 0.13 -0.27 0.01 0.00 0.77 0.00 0.00 66.41 67.04 3fqo h THR 46 Cb 0.53 0.59 -0.03 0.00 -1.74 0.00 0.00 68.15 67.51 3fqo h THR 46 CO 0.03 0.12 0.38 0.15 0.37 0.00 0.00 175.52 176.57 3fqo h PHE 47 N 0.52 0.71 -0.36 3.16 3.04 -1.29 -1.62 116.94 121.11 3fqo h PHE 47 Ca 0.14 0.02 -0.07 0.00 3.98 0.00 0.00 57.97 62.04 3fqo h PHE 47 Cb -0.01 -0.24 -0.02 0.00 2.56 0.00 0.00 35.95 38.24 3fqo h PHE 47 CO -0.04 0.45 -0.07 0.93 -2.02 0.00 0.00 178.31 177.56 3fqo h GLU 48 N 0.77 0.61 0.00 1.11 4.39 -1.11 0.12 114.58 120.47 3fqo h GLU 48 Ca 0.21 -0.17 -0.09 0.00 0.34 0.00 0.00 59.36 59.65 3fqo h GLU 48 Cb -0.09 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.48 3fqo h GLU 48 CO -0.04 0.68 -0.45 0.66 -1.16 0.00 0.00 179.01 178.70 3fqo h SER 49 N 0.56 0.00 -0.01 1.42 4.64 -1.08 -3.07 113.55 116.01 3fqo h SER 49 Ca 0.11 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.42 3fqo h SER 49 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 3fqo h SER 49 CO 0.02 0.45 -0.03 0.40 -0.87 0.00 0.00 176.83 176.80 3fqo h ILE 50 N 0.00 1.52 0.00 0.95 2.04 -0.62 -3.48 117.51 117.92 3fqo h ILE 50 Ca -0.00 -1.59 0.00 0.00 1.00 0.00 0.00 64.86 64.27 3fqo h ILE 50 Cb 1.00 2.58 0.00 0.00 -0.74 0.00 0.00 36.82 39.65 3fqo h ILE 50 CO 0.06 0.42 0.00 0.61 0.00 0.00 0.00 178.15 179.24 3fqo n GLY 51 N 0.71 2.81 3.24 5.37 0.00 0.35 -5.02 105.19 112.66 3fqo n GLY 51 Ca -0.09 -0.81 -0.10 0.00 0.00 0.00 0.00 46.02 45.02 3fqo n GLY 51 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3fqo s LYS 52 N 0.00 0.89 0.62 1.61 -2.85 -1.26 -4.96 119.74 113.79 3fqo s LYS 52 Ca 0.00 -0.78 -0.19 0.00 -1.00 0.00 0.00 55.97 54.00 3fqo s LYS 52 Cb 0.00 0.38 -0.02 0.00 -2.06 0.00 0.00 37.83 36.12 3fqo s LYS 52 CO 0.00 -0.31 1.28 -1.25 0.10 0.00 0.00 175.35 175.18 3fqo s PRO 53 N -3.52 2.75 -0.00 1.78 0.04 -1.26 -4.97 135.00 129.82 3fqo s PRO 53 Ca 0.02 2.03 -0.30 0.00 0.04 0.00 0.00 61.00 62.79 3fqo s PRO 53 Cb 0.03 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.61 3fqo s PRO 53 CO -0.09 -1.43 0.97 -0.51 0.04 0.00 0.00 177.00 175.98 3fqo s LEU 54 N -4.16 4.37 0.58 -3.56 1.43 -1.26 -5.01 118.68 111.08 3fqo s LEU 54 Ca 0.80 1.65 -0.20 0.00 -1.03 0.00 0.00 54.13 55.34 3fqo s LEU 54 Cb -0.36 -3.56 -0.04 0.00 0.03 0.00 0.00 46.19 42.26 3fqo s LEU 54 CO 0.39 -0.25 1.24 -2.65 0.23 0.00 0.00 176.35 175.30 3fqo n PRO 55 N 3.89 1.32 -2.46 1.29 -0.02 -1.26 -4.03 135.00 133.73 3fqo n PRO 55 Ca 0.06 0.50 -0.14 0.00 -2.02 0.00 0.00 63.50 61.90 3fqo n PRO 55 Cb 0.51 -2.45 0.01 0.00 -0.02 0.00 0.00 33.50 31.55 3fqo n PRO 55 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3fqo n ASN 56 N -1.16 -4.35 -3.50 2.55 5.03 -1.26 -4.92 115.26 107.66 3fqo n ASN 56 Ca 0.13 -0.08 -0.11 0.00 0.87 0.00 0.00 54.58 55.39 3fqo n ASN 56 Cb 0.46 -3.40 -0.02 0.00 -1.02 0.00 0.00 39.78 35.80 3fqo n ASN 56 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3fqo s ARG 57 N -4.92 1.30 0.01 3.52 1.70 -1.26 -0.75 118.95 118.55 3fqo s ARG 57 Ca 0.08 -0.53 -0.30 0.00 -0.47 0.00 0.00 55.73 54.51 3fqo s ARG 57 Cb -0.03 0.57 -0.05 0.00 -0.57 0.00 0.00 34.95 34.86 3fqo s ARG 57 CO 0.10 -0.57 1.20 0.50 -1.08 0.00 0.00 175.30 175.45 3fqo s ARG 58 N -3.69 4.40 -0.29 3.89 3.52 -0.11 -4.90 118.95 121.76 3fqo s ARG 58 Ca 0.03 1.73 -0.08 0.00 -0.13 0.00 0.00 55.73 57.29 3fqo s ARG 58 Cb -0.02 -3.44 -0.00 0.00 -1.56 0.00 0.00 34.95 29.93 3fqo s ARG 58 CO -0.10 -0.34 0.10 -0.80 -0.81 0.00 0.00 175.30 173.36 3fqo s ASN 59 N 1.26 5.26 -0.18 -2.12 0.01 -1.26 -1.10 114.94 116.82 3fqo s ASN 59 Ca 0.58 -0.56 -0.01 0.00 -0.71 0.00 0.00 52.86 52.16 3fqo s ASN 59 Cb -0.28 -1.93 -0.00 0.00 0.41 0.00 0.00 41.25 39.45 3fqo s ASN 59 CO 0.26 -0.17 -0.12 -0.69 -1.51 0.00 0.00 177.10 174.87 3fqo s VAL 60 N 1.56 2.83 -0.16 1.60 1.01 0.43 -0.61 120.40 127.05 3fqo s VAL 60 Ca 0.04 -0.70 -0.03 0.00 0.00 0.00 0.00 61.98 61.29 3fqo s VAL 60 Cb -0.17 -2.22 -0.02 0.00 0.00 0.00 0.00 36.38 33.97 3fqo s VAL 60 CO 0.04 0.49 -0.06 -0.69 0.00 0.00 0.00 175.10 174.89 3fqo s VAL 61 N 1.03 3.61 -0.22 2.92 1.01 -0.01 -0.89 120.40 127.85 3fqo s VAL 61 Ca -0.01 -0.45 -0.17 0.00 0.00 0.00 0.00 61.98 61.35 3fqo s VAL 61 Cb -0.15 -2.58 -0.03 0.00 0.00 0.00 0.00 36.38 33.62 3fqo s VAL 61 CO -0.03 0.48 0.46 -0.22 0.00 0.00 0.00 175.10 175.80 3fqo s LEU 62 N 0.60 4.12 0.06 3.92 2.96 0.49 -1.30 118.68 129.52 3fqo s LEU 62 Ca -0.04 0.54 -0.22 0.00 -0.22 0.00 0.00 54.13 54.20 3fqo s LEU 62 Cb -0.15 -2.60 0.05 0.00 0.50 0.00 0.00 46.19 44.00 3fqo s LEU 62 CO 0.03 -0.17 0.51 0.28 -1.32 0.00 0.00 176.35 175.68 3fqo s THR 63 N 1.71 0.03 -1.05 3.68 -1.32 -0.86 -1.80 115.64 116.02 3fqo s THR 63 Ca 0.21 -0.27 0.26 0.00 -1.21 0.00 0.00 61.69 60.67 3fqo s THR 63 Cb -0.15 -0.98 0.09 0.00 -1.51 0.00 0.00 72.50 69.94 3fqo s THR 63 CO 0.09 -0.15 1.56 -1.54 -2.21 0.00 0.00 174.62 172.36 3fqo n SER 64 N 0.35 0.40 -4.59 8.08 3.41 -1.26 -4.18 113.62 115.83 3fqo n SER 64 Ca -0.18 -0.11 -0.42 0.00 -0.26 0.00 0.00 58.87 57.90 3fqo n SER 64 Cb 0.61 0.06 -0.03 0.00 -0.26 0.00 0.00 64.21 64.59 3fqo n SER 64 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3fqo s ASP 65 N -2.96 5.90 0.16 4.04 3.68 -1.26 -4.86 116.67 121.36 3fqo s ASP 65 Ca 0.13 0.85 0.20 0.00 2.13 0.00 0.00 52.55 55.85 3fqo s ASP 65 Cb 0.18 -2.53 0.84 0.00 -1.45 0.00 0.00 42.92 39.96 3fqo s ASP 65 CO 0.65 -1.79 1.61 0.35 0.13 0.00 0.00 175.17 176.12 3fqo n THR 66 N 7.22 0.90 0.68 1.71 -2.24 -1.26 -2.26 114.28 119.04 3fqo n THR 66 Ca 0.19 0.24 0.12 0.00 -2.27 0.00 0.00 64.05 62.34 3fqo n THR 66 Cb 0.48 -1.11 0.15 0.00 -2.10 0.00 0.00 70.33 67.76 3fqo n THR 66 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3fqo n SER 67 N -1.95 0.63 -4.68 3.42 7.64 -1.26 -4.95 113.62 112.47 3fqo n SER 67 Ca 0.03 -0.06 -0.47 0.00 1.01 0.00 0.00 58.87 59.37 3fqo n SER 67 Cb 0.20 0.35 -0.04 0.00 -1.01 0.00 0.00 64.21 63.71 3fqo n SER 67 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 3fqo n PHE 68 N -1.91 2.37 -3.66 1.43 7.35 -0.96 -4.95 117.46 117.12 3fqo n PHE 68 Ca 0.03 -0.05 -0.09 0.00 -0.76 0.00 0.00 57.45 56.59 3fqo n PHE 68 Cb 0.41 -2.68 -0.10 0.00 0.35 0.00 0.00 39.48 37.46 3fqo n PHE 68 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 3fqo s ASN 69 N 3.79 -0.23 -0.01 -2.13 3.84 -1.26 -4.96 114.94 113.97 3fqo s ASN 69 Ca 0.90 0.95 0.02 0.00 0.21 0.00 0.00 52.86 54.95 3fqo s ASN 69 Cb -0.64 1.23 -0.00 0.00 -0.55 0.00 0.00 41.25 41.28 3fqo s ASN 69 CO 0.48 -0.23 -0.08 -0.69 -2.79 0.00 0.00 177.10 173.80 3fqo s VAL 70 N 2.46 0.63 0.07 -5.21 1.01 -1.26 -5.12 120.40 112.97 3fqo s VAL 70 Ca -0.02 -0.32 -0.31 0.00 0.00 0.00 0.00 61.98 61.33 3fqo s VAL 70 Cb -0.12 -0.54 -0.07 0.00 0.00 0.00 0.00 36.38 35.65 3fqo s VAL 70 CO -0.12 0.19 1.47 -1.83 0.00 0.00 0.00 175.10 174.81 3fqo s GLU 71 N -0.06 4.27 0.00 2.72 -1.05 -1.26 -2.70 118.70 120.61 3fqo s GLU 71 Ca 0.01 2.12 0.00 0.00 -0.15 0.00 0.00 54.97 56.96 3fqo s GLU 71 Cb -0.04 -3.45 0.00 0.00 -0.44 0.00 0.00 34.13 30.20 3fqo s GLU 71 CO -0.00 -0.58 0.00 0.41 0.95 0.00 0.00 175.26 176.04 3fqo n GLY 72 N 3.70 0.68 2.95 -3.83 0.00 -1.26 -4.83 105.19 102.60 3fqo n GLY 72 Ca 0.13 -0.27 -0.21 0.00 0.00 0.00 0.00 46.02 45.67 3fqo n GLY 72 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fqo s VAL 73 N -2.00 0.73 0.00 1.61 1.01 -1.10 -4.39 120.40 116.26 3fqo s VAL 73 Ca 0.00 -0.27 -0.08 0.00 0.00 0.00 0.00 61.98 61.63 3fqo s VAL 73 Cb 0.00 -0.69 -0.05 0.00 0.00 0.00 0.00 36.38 35.64 3fqo s VAL 73 CO 0.00 0.25 0.28 -1.81 0.00 0.00 0.00 175.10 173.83 3fqo s ASP 74 N 0.63 6.53 -0.07 3.32 1.01 0.22 -4.63 116.67 123.68 3fqo s ASP 74 Ca -0.10 0.62 0.01 0.00 0.71 0.00 0.00 52.55 53.79 3fqo s ASP 74 Cb -0.13 -2.12 -0.03 0.00 1.01 0.00 0.00 42.92 41.66 3fqo s ASP 74 CO 0.01 0.27 -0.08 -0.69 0.21 0.00 0.00 175.17 174.89 3fqo s VAL 75 N -1.26 3.62 0.19 -1.27 1.01 -1.26 -0.83 120.40 120.60 3fqo s VAL 75 Ca 0.26 -0.51 0.07 0.00 0.00 0.00 0.00 61.98 61.80 3fqo s VAL 75 Cb -0.14 -2.47 -0.05 0.00 0.00 0.00 0.00 36.38 33.73 3fqo s VAL 75 CO 0.15 0.59 -0.13 0.27 0.00 0.00 0.00 175.10 175.98 3fqo s ILE 76 N -0.75 1.58 0.00 2.22 -4.36 -0.42 -4.93 121.20 114.54 3fqo s ILE 76 Ca 0.11 -2.15 0.00 0.00 -0.26 0.00 0.00 60.65 58.36 3fqo s ILE 76 Cb -0.11 -1.97 0.00 0.00 1.25 0.00 0.00 42.46 41.63 3fqo s ILE 76 CO 0.01 -0.62 0.23 1.41 0.24 0.00 0.00 174.94 176.21 3fqo n HIS 77 N -0.28 0.00 -3.83 1.37 8.25 -1.26 -2.04 115.22 117.43 3fqo n HIS 77 Ca -0.09 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.28 3fqo n HIS 77 Cb 0.60 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.64 3fqo n HIS 77 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3fqo s SER 78 N -0.39 0.06 0.27 0.41 1.04 -1.26 -4.75 113.70 109.07 3fqo s SER 78 Ca 0.00 -0.52 -0.00 0.00 0.48 0.00 0.00 55.95 55.91 3fqo s SER 78 Cb 0.00 0.34 0.55 0.00 0.10 0.00 0.00 66.02 67.00 3fqo s SER 78 CO 0.00 -0.68 1.78 0.40 0.98 0.00 0.00 173.24 175.72 3fqo h ILE 79 N 2.95 0.77 -0.47 -1.02 1.08 -2.01 -2.51 117.51 116.30 3fqo h ILE 79 Ca -0.33 -0.24 0.12 0.00 -0.39 0.00 0.00 64.86 64.01 3fqo h ILE 79 Cb 1.20 0.00 -0.02 0.00 -3.07 0.00 0.00 36.82 34.93 3fqo h ILE 79 CO 0.53 0.13 0.33 -0.33 -0.69 0.00 0.00 178.15 178.12 3fqo h GLU 80 N 0.71 0.09 0.00 2.37 4.39 -2.03 0.29 114.58 120.40 3fqo h GLU 80 Ca 0.47 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 60.15 3fqo h GLU 80 Cb 0.63 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.26 3fqo h GLU 80 CO -0.34 0.06 -0.09 -0.44 -1.16 0.00 0.00 179.01 177.04 3fqo h ASP 81 N 0.10 0.00 -0.81 1.42 3.32 -1.87 -3.03 116.42 115.54 3fqo h ASP 81 Ca 0.22 0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.28 3fqo h ASP 81 Cb 0.77 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.28 3fqo h ASP 81 CO -0.02 0.09 0.54 0.40 -1.72 0.00 0.00 179.24 178.52 3fqo h ILE 82 N 0.00 1.21 0.00 0.35 2.04 -1.08 -2.79 117.51 117.24 3fqo h ILE 82 Ca -0.00 -0.39 0.00 0.00 1.00 0.00 0.00 64.86 65.47 3fqo h ILE 82 Cb 0.29 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.39 3fqo h ILE 82 CO 0.01 0.20 0.00 -1.22 0.00 0.00 0.00 178.15 177.15 3fqo n TYR 83 N -4.51 0.36 1.17 1.37 4.01 -1.14 -2.02 117.16 116.39 3fqo n TYR 83 Ca 0.08 0.14 0.12 0.00 -0.16 0.00 0.00 57.90 58.08 3fqo n TYR 83 Cb 0.02 -0.72 0.23 0.00 -0.31 0.00 0.00 39.34 38.56 3fqo n TYR 83 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 3fqo n GLN 84 N -1.82 1.31 -2.62 -0.72 3.00 -1.05 -4.90 117.38 110.57 3fqo n GLN 84 Ca 0.03 -0.94 -0.42 0.00 -0.01 0.00 0.00 57.00 55.66 3fqo n GLN 84 Cb 0.23 -1.48 -0.03 0.00 0.00 0.00 0.00 30.24 28.96 3fqo n GLN 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 3fqo s LEU 85 N -2.34 4.36 0.53 1.08 1.43 -0.86 -5.04 118.68 117.84 3fqo s LEU 85 Ca 0.25 1.76 -0.14 0.00 -1.03 0.00 0.00 54.13 54.98 3fqo s LEU 85 Cb 0.19 -3.57 -0.06 0.00 0.03 0.00 0.00 46.19 42.78 3fqo s LEU 85 CO 0.48 -0.34 0.96 -2.16 0.23 0.00 0.00 176.35 175.52 3fqo s PRO 86 N 1.09 3.81 0.89 1.29 0.04 -1.26 -4.94 135.00 135.92 3fqo s PRO 86 Ca 0.54 0.79 0.00 0.00 0.04 0.00 0.00 61.00 62.37 3fqo s PRO 86 Cb -0.23 -2.17 0.00 0.00 0.04 0.00 0.00 34.50 32.14 3fqo s PRO 86 CO 0.28 -0.32 0.00 0.41 0.04 0.00 0.00 177.00 177.41 3fqo n GLY 87 N -1.89 -1.82 3.62 0.56 0.00 -1.26 -4.78 105.19 99.62 3fqo n GLY 87 Ca 0.06 -1.63 -0.43 0.00 0.00 0.00 0.00 46.02 44.02 3fqo n GLY 87 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3fqo s HIS 88 N 0.00 3.13 -0.20 1.61 5.65 -1.26 -3.73 115.29 120.49 3fqo s HIS 88 Ca 0.00 0.96 -0.06 0.00 0.25 0.00 0.00 55.06 56.20 3fqo s HIS 88 Cb 0.00 -3.59 -0.03 0.00 -1.18 0.00 0.00 32.58 27.78 3fqo s HIS 88 CO 0.00 -0.75 0.04 0.08 -0.65 0.00 0.00 174.74 173.46 3fqo s VAL 89 N 3.46 4.41 -0.24 0.89 1.01 -0.32 -1.92 120.40 127.69 3fqo s VAL 89 Ca 0.40 -0.16 -0.07 0.00 0.00 0.00 0.00 61.98 62.16 3fqo s VAL 89 Cb -0.12 -3.00 -0.03 0.00 0.00 0.00 0.00 36.38 33.23 3fqo s VAL 89 CO 0.16 0.43 0.05 -0.36 0.00 0.00 0.00 175.10 175.38 3fqo s PHE 90 N 0.77 3.07 -0.20 5.22 0.08 0.71 -1.04 117.98 126.60 3fqo s PHE 90 Ca 0.02 -0.48 -0.29 0.00 0.12 0.00 0.00 56.93 56.30 3fqo s PHE 90 Cb -0.14 -2.21 -0.01 0.00 -0.57 0.00 0.00 43.02 40.09 3fqo s PHE 90 CO 0.02 -0.37 1.35 0.42 -0.10 0.00 0.00 175.22 176.54 3fqo s ILE 91 N 1.54 4.11 -0.91 0.64 -1.09 0.14 -0.94 121.20 124.69 3fqo s ILE 91 Ca 0.06 1.31 0.13 0.00 -2.23 0.00 0.00 60.65 59.92 3fqo s ILE 91 Cb -0.15 -3.96 -0.07 0.00 -1.58 0.00 0.00 42.46 36.70 3fqo s ILE 91 CO 0.03 -0.24 0.65 0.33 -1.23 0.00 0.00 174.94 174.47 3fqo n PHE 92 N 7.16 0.00 0.00 3.97 -0.00 0.34 -1.06 117.46 127.86 3fqo n PHE 92 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.60 3fqo n PHE 92 Cb 0.45 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.93 3fqo n PHE 92 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3fqo n GLY 93 N 1.17 1.52 0.00 7.13 0.00 -1.25 -4.91 105.19 108.85 3fqo n GLY 93 Ca 0.04 -2.10 0.00 0.00 0.00 0.00 0.00 46.02 43.96 3fqo n GLY 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fqo n GLY 94 N -1.45 1.85 0.23 -0.02 0.00 -1.26 -0.67 105.19 103.87 3fqo n GLY 94 Ca 0.00 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.38 3fqo n GLY 94 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3fqo h GLN 95 N 0.00 0.29 -0.51 1.61 4.15 -1.97 -1.12 115.11 117.57 3fqo h GLN 95 Ca 0.00 -0.02 -0.06 0.00 0.77 0.00 0.00 58.65 59.34 3fqo h GLN 95 Cb 0.00 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 27.60 3fqo h GLN 95 CO 0.00 0.19 0.07 1.79 -1.93 0.00 0.00 178.83 178.95 3fqo h THR 96 N 0.30 1.25 -0.47 2.39 1.35 -1.93 -0.92 112.91 114.88 3fqo h THR 96 Ca 0.31 -0.96 -0.10 0.00 -0.55 0.00 0.00 66.41 65.11 3fqo h THR 96 Cb 0.43 0.89 -0.02 0.00 -1.73 0.00 0.00 68.15 67.72 3fqo h THR 96 CO -0.36 0.34 -0.08 0.25 -0.25 0.00 0.00 175.52 175.41 3fqo h LEU 97 N 0.72 0.89 -0.58 3.87 5.85 -1.74 -1.29 115.31 123.04 3fqo h LEU 97 Ca 0.15 -0.35 0.01 0.00 0.84 0.00 0.00 57.88 58.53 3fqo h LEU 97 Cb 0.41 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 3fqo h LEU 97 CO 0.01 1.03 0.38 1.88 -0.34 0.00 0.00 178.44 181.40 3fqo h TYR 98 N 0.74 0.71 -0.97 1.25 0.05 -1.09 0.45 116.97 118.11 3fqo h TYR 98 Ca 0.12 0.02 0.01 0.00 0.05 0.00 0.00 58.73 58.94 3fqo h TYR 98 Cb 0.62 -0.24 -0.05 0.00 1.01 0.00 0.00 36.73 38.08 3fqo h TYR 98 CO 0.05 0.44 0.64 0.93 -1.05 0.00 0.00 178.16 179.17 3fqo h GLU 99 N 0.76 1.27 0.00 4.88 5.08 -0.99 0.20 114.58 125.78 3fqo h GLU 99 Ca 0.21 -0.08 -0.10 0.00 -1.00 0.00 0.00 59.36 58.40 3fqo h GLU 99 Cb -0.07 -0.29 -0.01 0.00 0.50 0.00 0.00 28.75 28.88 3fqo h GLU 99 CO -0.06 0.84 -0.49 0.93 -1.00 0.00 0.00 179.01 179.24 3fqo h GLU 100 N 1.30 0.00 0.00 2.33 5.08 -0.87 -3.37 114.58 119.05 3fqo h GLU 100 Ca 0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 3fqo h GLU 100 Cb -0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.13 3fqo h GLU 100 CO -0.09 0.49 -1.28 -1.33 -1.00 0.00 0.00 179.01 175.80 3fqo n MET 101 N -3.52 1.12 -0.29 2.33 2.81 0.12 -4.68 117.12 115.01 3fqo n MET 101 Ca -0.00 -0.08 0.09 0.00 -1.81 0.00 0.00 57.70 55.90 3fqo n MET 101 Cb 0.59 -1.22 0.32 0.00 -0.71 0.00 0.00 33.22 32.21 3fqo n MET 101 CO 0.00 0.00 0.00 0.97 1.51 0.00 0.00 175.97 178.45 3fqo h ILE 102 N 0.00 0.91 -0.00 2.02 2.10 -0.79 0.72 117.51 122.47 3fqo h ILE 102 Ca 0.00 -0.28 0.00 0.00 1.08 0.00 0.00 64.86 65.66 3fqo h ILE 102 Cb 0.47 0.02 0.00 0.00 -1.09 0.00 0.00 36.82 36.22 3fqo h ILE 102 CO 0.00 0.15 0.00 0.47 -1.08 0.00 0.00 178.15 177.69 3fqo n ASP 103 N -4.55 0.13 -0.02 2.19 10.43 -1.26 -3.89 116.55 119.58 3fqo n ASP 103 Ca 0.16 -1.09 -0.00 0.00 2.57 0.00 0.00 54.79 56.44 3fqo n ASP 103 Cb 0.38 -0.00 -0.05 0.00 1.84 0.00 0.00 41.12 43.29 3fqo n ASP 103 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 3fqo n LYS 104 N -0.88 1.70 -2.46 -1.24 4.76 0.20 -5.05 118.16 115.19 3fqo n LYS 104 Ca 0.22 -0.03 -0.34 0.00 -2.87 0.00 0.00 58.31 55.29 3fqo n LYS 104 Cb 0.13 -1.15 -0.02 0.00 -1.84 0.00 0.00 35.03 32.14 3fqo n LYS 104 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 3fqo s VAL 105 N -2.28 3.60 0.08 -0.18 -7.23 -0.89 -4.98 120.40 108.53 3fqo s VAL 105 Ca -0.03 1.01 -0.15 0.00 -1.81 0.00 0.00 61.98 60.99 3fqo s VAL 105 Cb 0.03 -3.41 -0.13 0.00 0.56 0.00 0.00 36.38 33.43 3fqo s VAL 105 CO 0.25 -0.21 1.33 0.44 -0.31 0.00 0.00 175.10 176.61 3fqo h ASP 106 N 1.48 0.74 -5.25 4.85 3.32 -1.31 -3.46 116.42 116.80 3fqo h ASP 106 Ca -0.50 -0.56 -0.08 0.00 0.02 0.00 0.00 57.03 55.92 3fqo h ASP 106 Cb 1.23 -0.21 -0.08 0.00 0.22 0.00 0.00 39.33 40.49 3fqo h ASP 106 CO 0.58 1.16 -0.07 1.51 -1.72 0.00 0.00 179.24 180.70 3fqo s ASP 107 N -6.69 0.04 -0.03 6.45 -4.77 -1.22 -2.09 116.67 108.37 3fqo s ASP 107 Ca -0.12 -1.00 0.01 0.00 -3.30 0.00 0.00 52.55 48.13 3fqo s ASP 107 Cb 0.08 0.63 0.02 0.00 -1.09 0.00 0.00 42.92 42.55 3fqo s ASP 107 CO 0.84 -1.22 -0.01 -0.04 0.70 0.00 0.00 175.17 175.44 3fqo s MET 108 N -3.74 0.38 -0.48 2.11 -1.94 0.66 -1.26 119.30 115.02 3fqo s MET 108 Ca 0.22 0.00 -0.13 0.00 -1.71 0.00 0.00 55.69 54.07 3fqo s MET 108 Cb -0.01 -0.49 0.10 0.00 2.01 0.00 0.00 34.83 36.44 3fqo s MET 108 CO 0.11 -0.08 0.40 0.71 -0.01 0.00 0.00 175.02 176.14 3fqo s TYR 109 N 0.75 3.30 -0.15 -0.03 1.51 0.12 -0.39 117.35 122.46 3fqo s TYR 109 Ca -0.08 -1.33 -0.03 0.00 -1.01 0.00 0.00 57.07 54.62 3fqo s TYR 109 Cb -0.11 -3.40 -0.03 0.00 -0.11 0.00 0.00 41.96 38.31 3fqo s TYR 109 CO -0.01 -0.92 -0.03 0.42 -1.11 0.00 0.00 175.55 173.90 3fqo s ILE 110 N 1.54 3.97 -0.38 2.71 1.01 0.41 -1.51 121.20 128.95 3fqo s ILE 110 Ca 0.04 -0.34 -0.13 0.00 0.00 0.00 0.00 60.65 60.22 3fqo s ILE 110 Cb -0.26 -2.73 0.01 0.00 0.01 0.00 0.00 42.46 39.49 3fqo s ILE 110 CO 0.03 0.51 0.24 -0.89 0.00 0.00 0.00 174.94 174.83 3fqo s THR 111 N 0.18 4.95 -0.37 2.92 2.01 0.64 0.54 115.64 126.51 3fqo s THR 111 Ca -0.01 -0.63 -0.24 0.00 0.31 0.00 0.00 61.69 61.11 3fqo s THR 111 Cb -0.14 -3.70 0.01 0.00 0.01 0.00 0.00 72.50 68.69 3fqo s THR 111 CO 0.03 -0.20 0.84 -0.69 -0.69 0.00 0.00 174.62 173.91 3fqo s VAL 112 N 1.64 4.67 -0.27 3.82 1.01 0.52 -1.14 120.40 130.65 3fqo s VAL 112 Ca 0.04 0.98 -0.25 0.00 0.00 0.00 0.00 61.98 62.75 3fqo s VAL 112 Cb -0.19 -4.27 -0.00 0.00 0.00 0.00 0.00 36.38 31.93 3fqo s VAL 112 CO 0.08 -0.49 0.85 -0.63 0.00 0.00 0.00 175.10 174.92 3fqo s ILE 113 N 3.27 4.78 -1.23 2.22 -1.09 0.70 -1.28 121.20 128.58 3fqo s ILE 113 Ca 0.34 1.50 -0.07 0.00 -2.23 0.00 0.00 60.65 60.20 3fqo s ILE 113 Cb -0.13 -4.17 0.03 0.00 -1.58 0.00 0.00 42.46 36.62 3fqo s ILE 113 CO 0.18 -0.17 2.68 -0.62 -1.23 0.00 0.00 174.94 175.77 3fqo n GLU 114 N 6.17 3.94 -4.10 2.79 -0.58 0.36 -2.57 120.64 126.66 3fqo n GLU 114 Ca 0.06 -2.82 -0.11 0.00 -0.42 0.00 0.00 57.16 53.87 3fqo n GLU 114 Cb 0.48 -2.58 -0.07 0.00 -0.57 0.00 0.00 31.44 28.69 3fqo n GLU 114 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 3fqo s GLY 115 N 0.98 1.00 -0.29 0.62 0.00 -1.26 -4.69 107.32 103.69 3fqo s GLY 115 Ca 0.60 -1.29 0.03 0.00 0.00 0.00 0.00 44.72 44.06 3fqo s GLY 115 CO -0.09 -1.00 -0.04 0.54 0.00 0.00 0.00 173.10 172.50 3fqo s LYS 116 N -4.04 2.02 0.22 2.90 1.02 -1.26 -1.91 119.74 118.68 3fqo s LYS 116 Ca 0.30 -1.52 0.06 0.00 0.02 0.00 0.00 55.97 54.83 3fqo s LYS 116 Cb 0.03 -3.03 -0.03 0.00 -0.52 0.00 0.00 37.83 34.27 3fqo s LYS 116 CO 0.11 -0.70 0.23 -0.06 -0.92 0.00 0.00 175.35 174.01 3fqo s PHE 117 N 1.05 3.24 0.04 3.18 0.08 -1.26 -5.09 117.98 119.23 3fqo s PHE 117 Ca -0.02 -0.04 -0.31 0.00 0.12 0.00 0.00 56.93 56.68 3fqo s PHE 117 Cb -0.20 -1.50 -0.06 0.00 -0.57 0.00 0.00 43.02 40.70 3fqo s PHE 117 CO -0.06 0.50 1.28 0.50 -0.10 0.00 0.00 175.22 177.35 3fqo s ARG 118 N -3.65 4.36 0.10 0.44 3.52 -1.26 -4.97 118.95 117.50 3fqo s ARG 118 Ca 0.33 1.87 0.01 0.00 -0.13 0.00 0.00 55.73 57.80 3fqo s ARG 118 Cb -0.09 -3.41 -0.04 0.00 -1.56 0.00 0.00 34.95 29.85 3fqo s ARG 118 CO 0.26 -0.39 -0.04 0.20 -0.81 0.00 0.00 175.30 174.52 3fqo s GLY 119 N 1.31 0.79 0.00 8.12 0.00 -1.26 -4.66 107.32 111.62 3fqo s GLY 119 Ca 0.61 -1.36 0.00 0.00 0.00 0.00 0.00 44.72 43.96 3fqo s GLY 119 CO 0.28 -1.43 0.41 2.09 0.00 0.00 0.00 173.10 174.45 3fqo n ASP 120 N -0.04 0.77 -3.92 1.64 3.85 -0.58 -4.98 116.55 113.30 3fqo n ASP 120 Ca -0.11 -1.09 -0.18 0.00 -0.71 0.00 0.00 54.79 52.70 3fqo n ASP 120 Cb 0.61 0.00 -0.16 0.00 -1.35 0.00 0.00 41.12 40.23 3fqo n ASP 120 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 3fqo s THR 121 N -0.09 0.48 0.02 2.12 2.01 -1.09 -5.01 115.64 114.08 3fqo s THR 121 Ca 0.00 -0.16 0.03 0.00 0.31 0.00 0.00 61.69 61.87 3fqo s THR 121 Cb 0.00 -0.47 -0.01 0.00 0.01 0.00 0.00 72.50 72.03 3fqo s THR 121 CO 0.00 0.18 -0.09 -0.36 -0.69 0.00 0.00 174.62 173.66 3fqo s PHE 122 N 0.49 0.81 0.26 4.92 0.08 -1.26 -0.21 117.98 123.06 3fqo s PHE 122 Ca -0.06 -0.27 -0.30 0.00 0.12 0.00 0.00 56.93 56.42 3fqo s PHE 122 Cb -0.10 -0.50 -0.09 0.00 -0.57 0.00 0.00 43.02 41.77 3fqo s PHE 122 CO -0.00 -0.02 1.03 0.12 -0.10 0.00 0.00 175.22 176.25 3fqo s PHE 123 N -0.64 3.75 0.67 0.36 5.36 0.29 -4.54 117.98 123.24 3fqo s PHE 123 Ca -0.01 1.79 -0.17 0.00 -0.96 0.00 0.00 56.93 57.59 3fqo s PHE 123 Cb -0.06 -3.16 0.01 0.00 -0.34 0.00 0.00 43.02 39.47 3fqo s PHE 123 CO 0.00 -0.12 1.24 -1.25 -1.46 0.00 0.00 175.22 173.63 3fqo s PRO 124 N -1.30 2.46 0.56 10.12 0.04 -1.26 -4.87 135.00 140.75 3fqo s PRO 124 Ca 0.43 1.89 -0.21 0.00 0.04 0.00 0.00 61.00 63.15 3fqo s PRO 124 Cb -0.29 -1.86 -0.04 0.00 0.04 0.00 0.00 34.50 32.35 3fqo s PRO 124 CO 0.37 -1.62 1.30 -2.14 0.04 0.00 0.00 177.00 174.95 3fqo s PRO 125 N -3.59 3.08 0.03 0.56 0.02 -1.26 -5.04 135.00 128.79 3fqo s PRO 125 Ca 0.78 2.10 -0.12 0.00 0.02 0.00 0.00 61.00 63.78 3fqo s PRO 125 Cb -0.33 -2.15 0.01 0.00 0.02 0.00 0.00 34.50 32.05 3fqo s PRO 125 CO 0.41 -1.19 0.26 1.52 -0.33 0.00 0.00 177.00 177.66 3fqo s TYR 126 N -1.39 -0.05 -0.02 6.54 -0.85 -1.26 -5.16 117.35 115.16 3fqo s TYR 126 Ca 0.73 -0.07 0.05 0.00 -0.52 0.00 0.00 57.07 57.27 3fqo s TYR 126 Cb -0.37 0.04 -0.03 0.00 0.38 0.00 0.00 41.96 41.98 3fqo s TYR 126 CO 0.43 -0.44 -0.17 0.95 -1.52 0.00 0.00 175.55 174.79 3fqo s THR 127 N -2.27 2.85 -1.54 -3.49 -4.23 -1.26 -5.01 115.64 100.70 3fqo s THR 127 Ca -0.07 -0.92 0.12 0.00 -1.18 0.00 0.00 61.69 59.64 3fqo s THR 127 Cb -0.02 -2.13 0.24 0.00 1.34 0.00 0.00 72.50 71.93 3fqo s THR 127 CO -0.02 0.51 1.27 0.49 -0.54 0.00 0.00 174.62 176.33 3fqo n PHE 128 N 2.08 0.00 0.56 3.99 3.72 -1.26 -1.75 117.46 124.80 3fqo n PHE 128 Ca -0.17 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.36 3fqo n PHE 128 Cb 0.52 -0.23 0.42 0.00 -0.94 0.00 0.00 39.48 39.25 3fqo n PHE 128 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 176.76 175.86 3fqo n GLU 129 N -1.23 0.26 0.00 -1.08 0.28 -1.26 -2.93 120.64 114.68 3fqo n GLU 129 Ca 0.06 0.27 0.10 0.00 -0.16 0.00 0.00 57.16 57.44 3fqo n GLU 129 Cb 0.08 -1.84 -0.08 0.00 1.43 0.00 0.00 31.44 31.04 3fqo n GLU 129 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 3fqo n ASP 130 N -2.30 1.35 -3.87 -1.84 10.43 -0.72 -4.94 116.55 114.67 3fqo n ASP 130 Ca 0.05 -1.18 -0.20 0.00 2.57 0.00 0.00 54.79 56.03 3fqo n ASP 130 Cb 0.39 0.82 -0.16 0.00 1.84 0.00 0.00 41.12 44.00 3fqo n ASP 130 CO 0.00 0.00 0.00 0.26 -1.07 0.00 0.00 177.20 176.39 3fqo s TRP 131 N -2.79 0.71 0.06 1.24 0.52 -1.15 -1.56 118.94 115.96 3fqo s TRP 131 Ca 0.12 -0.19 -0.20 0.00 0.02 0.00 0.00 56.10 55.84 3fqo s TRP 131 Cb 0.17 -0.66 -0.06 0.00 -1.15 0.00 0.00 33.47 31.76 3fqo s TRP 131 CO 0.76 -0.21 0.60 -2.00 0.02 0.00 0.00 176.95 176.12 3fqo s GLU 132 N 1.06 4.28 -0.73 4.98 2.12 0.44 -4.72 118.70 126.12 3fqo s GLU 132 Ca -0.09 0.79 -0.24 0.00 0.36 0.00 0.00 54.97 55.79 3fqo s GLU 132 Cb -0.14 -3.27 0.05 0.00 0.26 0.00 0.00 34.13 31.03 3fqo s GLU 132 CO -0.01 0.55 1.15 0.08 -0.54 0.00 0.00 175.26 176.49 3fqo s VAL 133 N -0.85 4.04 0.18 3.70 1.01 -1.26 -1.08 120.40 126.15 3fqo s VAL 133 Ca 0.30 -0.11 -0.05 0.00 0.00 0.00 0.00 61.98 62.12 3fqo s VAL 133 Cb -0.20 -4.82 -0.05 0.00 0.00 0.00 0.00 36.38 31.31 3fqo s VAL 133 CO 0.19 -1.68 1.50 0.00 0.00 0.00 0.00 175.10 175.11 3fqo h ALA 134 N 9.76 0.66 -2.25 5.51 0.00 -1.32 -3.47 119.26 128.16 3fqo h ALA 134 Ca -0.23 -0.49 -0.03 0.00 0.00 0.00 0.00 54.91 54.16 3fqo h ALA 134 Cb 1.05 -0.09 -0.17 0.00 0.00 0.00 0.00 17.79 18.58 3fqo h ALA 134 CO 1.24 0.68 0.24 -1.54 0.00 0.00 0.00 179.25 179.87 3fqo s SER 135 N -6.90 -0.60 -0.21 0.00 1.04 -1.16 -4.99 113.70 100.89 3fqo s SER 135 Ca -0.08 0.47 -0.04 0.00 0.48 0.00 0.00 55.95 56.78 3fqo s SER 135 Cb 0.11 0.53 0.10 0.00 0.10 0.00 0.00 66.02 66.86 3fqo s SER 135 CO 0.85 -0.69 0.28 -0.55 0.98 0.00 0.00 173.24 174.12 3fqo s SER 136 N -1.66 0.85 -0.19 7.02 0.15 -1.26 -1.41 113.70 117.21 3fqo s SER 136 Ca -0.06 0.05 0.01 0.00 0.70 0.00 0.00 55.95 56.64 3fqo s SER 136 Cb -0.00 0.67 0.04 0.00 -1.71 0.00 0.00 66.02 65.01 3fqo s SER 136 CO 0.02 -0.30 -0.12 -0.69 1.20 0.00 0.00 173.24 173.35 3fqo s VAL 137 N 2.41 1.66 0.18 4.45 1.01 -0.31 -4.97 120.40 124.83 3fqo s VAL 137 Ca 0.08 -0.91 -0.32 0.00 0.00 0.00 0.00 61.98 60.83 3fqo s VAL 137 Cb -0.15 -1.67 -0.11 0.00 0.00 0.00 0.00 36.38 34.45 3fqo s VAL 137 CO -0.13 0.26 1.67 -1.61 0.00 0.00 0.00 175.10 175.30 3fqo s GLU 138 N 1.41 4.16 0.54 2.72 2.02 -1.26 -0.68 118.70 127.60 3fqo s GLU 138 Ca 0.01 2.51 -0.18 0.00 0.02 0.00 0.00 54.97 57.33 3fqo s GLU 138 Cb -0.15 -3.16 -0.06 0.00 0.10 0.00 0.00 34.13 30.85 3fqo s GLU 138 CO -0.09 -0.71 1.04 0.20 0.02 0.00 0.00 175.26 175.72 3fqo s GLY 139 N 1.33 2.26 -0.07 -1.39 0.00 0.19 -4.91 107.32 104.73 3fqo s GLY 139 Ca 0.74 0.44 -0.18 0.00 0.00 0.00 0.00 44.72 45.71 3fqo s GLY 139 CO 0.32 0.75 0.49 0.54 0.00 0.00 0.00 173.10 175.20 3fqo s LYS 140 N -3.75 4.26 0.11 2.90 1.02 -1.26 -4.65 119.74 118.38 3fqo s LYS 140 Ca 0.64 0.51 -0.23 0.00 0.02 0.00 0.00 55.97 56.91 3fqo s LYS 140 Cb -0.15 -3.38 -0.07 0.00 -0.52 0.00 0.00 37.83 33.71 3fqo s LYS 140 CO 0.29 0.30 0.69 -0.51 -0.92 0.00 0.00 175.35 175.20 3fqo s LEU 141 N 0.13 4.55 0.00 3.17 1.43 -1.26 -4.85 118.68 121.84 3fqo s LEU 141 Ca 0.27 1.46 0.00 0.00 -1.03 0.00 0.00 54.13 54.82 3fqo s LEU 141 Cb -0.16 -3.11 0.00 0.00 0.03 0.00 0.00 46.19 42.94 3fqo s LEU 141 CO 0.12 0.21 0.00 -0.90 0.23 0.00 0.00 176.35 176.02 3fqo n ASP 142 N 1.80 0.00 -0.22 2.29 3.85 -0.74 -5.00 116.55 118.54 3fqo n ASP 142 Ca -0.07 -0.36 -0.01 0.00 -0.71 0.00 0.00 54.79 53.64 3fqo n ASP 142 Cb 0.50 0.00 0.11 0.00 -1.35 0.00 0.00 41.12 40.37 3fqo n ASP 142 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 3fqo h GLU 143 N 0.00 0.52 -0.02 0.11 9.09 -2.02 -3.10 114.58 119.16 3fqo h GLU 143 Ca 0.00 -0.03 0.00 0.00 0.05 0.00 0.00 59.36 59.38 3fqo h GLU 143 Cb 0.00 -0.12 0.00 0.00 -1.65 0.00 0.00 28.75 26.98 3fqo h GLU 143 CO 0.00 0.35 -0.24 1.63 0.05 0.00 0.00 179.01 180.80 3fqo n LYS 144 N -4.89 1.73 -3.67 1.06 4.76 -1.26 -4.70 118.16 111.19 3fqo n LYS 144 Ca 0.09 -1.42 -0.30 0.00 -2.87 0.00 0.00 58.31 53.81 3fqo n LYS 144 Cb 0.23 -1.47 -0.14 0.00 -1.84 0.00 0.00 35.03 31.81 3fqo n LYS 144 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 3fqo s ASN 145 N -2.24 3.72 0.00 4.39 0.01 -1.17 -4.39 114.94 115.25 3fqo s ASN 145 Ca 0.24 -1.93 0.08 0.00 -0.71 0.00 0.00 52.86 50.53 3fqo s ASN 145 Cb 0.19 -0.78 0.08 0.00 0.41 0.00 0.00 41.25 41.15 3fqo s ASN 145 CO 0.44 -0.37 0.79 0.35 -1.51 0.00 0.00 177.10 176.80 3fqo n THR 146 N 4.45 0.10 -4.32 1.60 -2.24 -1.26 -1.79 114.28 110.82 3fqo n THR 146 Ca 0.02 -0.55 -0.34 0.00 -2.27 0.00 0.00 64.05 60.91 3fqo n THR 146 Cb 0.39 1.09 -0.11 0.00 -2.10 0.00 0.00 70.33 69.60 3fqo n THR 146 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3fqo s ILE 147 N -0.68 4.09 0.43 2.28 1.01 -1.26 -5.03 121.20 122.03 3fqo s ILE 147 Ca 0.10 -0.29 -0.25 0.00 0.00 0.00 0.00 60.65 60.21 3fqo s ILE 147 Cb 0.07 -2.80 -0.08 0.00 0.01 0.00 0.00 42.46 39.65 3fqo s ILE 147 CO 0.10 0.49 1.33 -2.84 0.00 0.00 0.00 174.94 174.02 3fqo s PRO 148 N 0.30 3.82 -0.08 2.79 0.02 -1.26 -4.90 135.00 135.70 3fqo s PRO 148 Ca -0.02 2.20 -0.27 0.00 0.02 0.00 0.00 61.00 62.93 3fqo s PRO 148 Cb -0.14 -2.67 0.06 0.00 0.02 0.00 0.00 34.50 31.77 3fqo s PRO 148 CO 0.02 -0.63 0.61 -3.38 -0.33 0.00 0.00 177.00 173.30 3fqo s HIS 149 N -1.27 -0.59 -0.05 6.54 -3.43 -1.26 -0.48 115.29 114.75 3fqo s HIS 149 Ca 0.59 1.10 0.01 0.00 -0.80 0.00 0.00 55.06 55.96 3fqo s HIS 149 Cb -0.39 0.32 0.02 0.00 -1.43 0.00 0.00 32.58 31.11 3fqo s HIS 149 CO 0.49 -0.52 -0.06 0.99 -2.00 0.00 0.00 174.74 173.65 3fqo s THR 150 N -0.92 0.64 -0.31 -5.38 2.01 -0.40 0.54 115.64 111.81 3fqo s THR 150 Ca -0.09 -0.18 -0.21 0.00 0.31 0.00 0.00 61.69 61.52 3fqo s THR 150 Cb -0.02 -0.65 -0.01 0.00 0.01 0.00 0.00 72.50 71.84 3fqo s THR 150 CO 0.07 0.25 0.66 -0.36 -0.69 0.00 0.00 174.62 174.55 3fqo s PHE 151 N 0.92 3.20 -0.11 4.92 0.08 0.14 -0.35 117.98 126.78 3fqo s PHE 151 Ca -0.11 0.58 -0.02 0.00 0.12 0.00 0.00 56.93 57.51 3fqo s PHE 151 Cb -0.14 -3.06 -0.03 0.00 -0.57 0.00 0.00 43.02 39.22 3fqo s PHE 151 CO 0.00 -0.52 -0.04 -0.51 -0.10 0.00 0.00 175.22 174.06 3fqo s LEU 152 N 2.69 3.31 -0.28 -0.37 1.43 0.19 -1.16 118.68 124.49 3fqo s LEU 152 Ca 0.26 -0.02 -0.05 0.00 -1.03 0.00 0.00 54.13 53.30 3fqo s LEU 152 Cb -0.15 -1.76 0.02 0.00 0.03 0.00 0.00 46.19 44.33 3fqo s LEU 152 CO 0.12 0.29 0.03 -2.28 0.23 0.00 0.00 176.35 174.75 3fqo s HIS 153 N -0.38 3.12 -0.12 0.29 5.65 -0.50 -0.45 115.29 122.91 3fqo s HIS 153 Ca 0.06 -1.19 -0.01 0.00 0.25 0.00 0.00 55.06 54.17 3fqo s HIS 153 Cb -0.12 -2.18 -0.03 0.00 -1.18 0.00 0.00 32.58 29.07 3fqo s HIS 153 CO 0.02 -0.63 -0.07 -0.51 -0.65 0.00 0.00 174.74 172.90 3fqo s LEU 154 N 1.44 3.09 -0.07 8.88 1.02 0.48 -0.77 118.68 132.74 3fqo s LEU 154 Ca 0.02 -0.14 0.05 0.00 0.02 0.00 0.00 54.13 54.07 3fqo s LEU 154 Cb -0.17 -1.71 -0.01 0.00 0.02 0.00 0.00 46.19 44.32 3fqo s LEU 154 CO 0.00 0.24 -0.22 -0.63 0.02 0.00 0.00 176.35 175.75 3fqo s ILE 155 N -0.05 2.30 0.14 -0.59 1.01 -0.24 -0.25 121.20 123.52 3fqo s ILE 155 Ca -0.00 -0.97 -0.32 0.00 0.00 0.00 0.00 60.65 59.36 3fqo s ILE 155 Cb -0.13 -1.87 -0.11 0.00 0.01 0.00 0.00 42.46 40.36 3fqo s ILE 155 CO 0.03 0.56 1.80 -1.14 0.00 0.00 0.00 174.94 176.19 3fqo n ARG 156 N 3.07 2.72 0.00 2.79 0.63 -0.89 -0.42 116.66 124.57 3fqo n ARG 156 Ca -0.18 0.99 0.06 0.00 -0.92 0.00 0.00 57.85 57.80 3fqo n ARG 156 Cb 0.52 -2.86 0.36 0.00 0.45 0.00 0.00 32.46 30.93 3fqo n ARG 156 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75