#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fsw s SER 4 N -3.41 -0.20 -0.13 0.00 1.04 -1.26 -1.66 113.70 108.08 3fsw s SER 4 Ca 0.63 -0.60 -0.10 0.00 0.48 0.00 0.00 55.95 56.36 3fsw s SER 4 Cb -0.33 0.58 0.04 0.00 0.10 0.00 0.00 66.02 66.41 3fsw s SER 4 CO 0.87 -1.08 0.33 0.54 0.98 0.00 0.00 173.24 174.89 3fsw s VAL 5 N -3.91 -0.01 -0.15 5.02 0.11 -0.69 -4.95 120.40 115.82 3fsw s VAL 5 Ca 0.12 0.04 -0.14 0.00 -2.93 0.00 0.00 61.98 59.06 3fsw s VAL 5 Cb -0.01 -0.47 -0.05 0.00 -1.53 0.00 0.00 36.38 34.32 3fsw s VAL 5 CO 0.00 0.01 0.32 -1.81 -3.33 0.00 0.00 175.10 170.30 3fsw s ASP 6 N 0.52 6.48 0.01 3.54 1.11 -1.26 -0.98 116.67 126.08 3fsw s ASP 6 Ca -0.03 0.56 0.03 0.00 0.18 0.00 0.00 52.55 53.29 3fsw s ASP 6 Cb -0.04 -2.20 -0.01 0.00 1.07 0.00 0.00 42.92 41.74 3fsw s ASP 6 CO -0.03 0.09 -0.09 -0.63 1.18 0.00 0.00 175.17 175.69 3fsw s ILE 7 N 0.44 0.72 -0.10 0.77 1.01 -0.27 -4.96 121.20 118.81 3fsw s ILE 7 Ca 0.18 -0.53 0.03 0.00 0.00 0.00 0.00 60.65 60.33 3fsw s ILE 7 Cb -0.13 -0.63 0.01 0.00 0.01 0.00 0.00 42.46 41.71 3fsw s ILE 7 CO 0.05 0.10 -0.21 -1.10 0.00 0.00 0.00 174.94 173.78 3fsw s GLN 8 N -0.48 2.71 -0.17 2.79 -0.21 -1.26 -1.13 119.66 121.91 3fsw s GLN 8 Ca 0.02 -0.76 -0.07 0.00 0.02 0.00 0.00 55.36 54.57 3fsw s GLN 8 Cb -0.05 -2.12 -0.04 0.00 1.00 0.00 0.00 33.01 31.80 3fsw s GLN 8 CO -0.00 0.09 0.07 0.20 -2.12 0.00 0.00 175.29 173.53 3fsw s GLY 9 N 0.56 1.94 0.19 3.09 0.00 -0.79 -2.45 107.32 109.87 3fsw s GLY 9 Ca -0.15 -0.73 0.00 0.00 0.00 0.00 0.00 44.72 43.84 3fsw s GLY 9 CO 0.05 -0.04 0.00 1.16 0.00 0.00 0.00 173.10 174.28 3fsw n ASN 10 N 3.24 2.45 0.28 1.64 0.23 -0.83 -3.84 115.26 118.43 3fsw n ASN 10 Ca -0.17 -1.85 0.18 0.00 -0.53 0.00 0.00 54.58 52.21 3fsw n ASN 10 Cb 0.53 0.15 0.74 0.00 -2.08 0.00 0.00 39.78 39.12 3fsw n ASN 10 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 3fsw h ASP 11 N 0.47 0.00 -0.24 0.53 3.32 -1.91 -2.82 116.42 115.78 3fsw h ASP 11 Ca -0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.89 3fsw h ASP 11 Cb 0.49 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.04 3fsw h ASP 11 CO 0.26 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.78 3fsw n GLN 12 N -3.09 1.80 -3.58 3.56 1.13 -1.26 -4.91 117.38 111.02 3fsw n GLN 12 Ca 0.00 -0.96 -0.21 0.00 -1.94 0.00 0.00 57.00 53.90 3fsw n GLN 12 Cb 0.28 -1.36 0.07 0.00 0.11 0.00 0.00 30.24 29.34 3fsw n GLN 12 CO 0.00 0.00 0.00 -0.12 -1.44 0.00 0.00 177.06 175.50 3fsw n MET 13 N 0.23 -6.30 -4.32 -1.09 1.56 -1.06 -5.01 117.12 101.13 3fsw n MET 13 Ca 0.09 0.76 -0.18 0.00 -0.27 0.00 0.00 57.70 58.10 3fsw n MET 13 Cb 0.32 -5.65 -0.14 0.00 2.15 0.00 0.00 33.22 29.90 3fsw n MET 13 CO 0.00 0.00 0.00 -0.65 -0.73 0.00 0.00 175.97 174.59 3fsw s GLN 14 N -5.82 0.72 0.48 2.12 -0.21 -1.26 -4.50 119.66 111.19 3fsw s GLN 14 Ca 0.17 -0.42 -0.08 0.00 0.02 0.00 0.00 55.36 55.05 3fsw s GLN 14 Cb -0.08 -0.68 -0.05 0.00 1.00 0.00 0.00 33.01 33.20 3fsw s GLN 14 CO 0.76 0.18 0.83 -0.06 -2.12 0.00 0.00 175.29 174.88 3fsw s PHE 15 N -0.42 3.54 -1.01 0.91 0.08 -1.26 -1.96 117.98 117.88 3fsw s PHE 15 Ca 0.02 0.98 0.17 0.00 0.12 0.00 0.00 56.93 58.21 3fsw s PHE 15 Cb -0.05 -2.42 0.71 0.00 -0.57 0.00 0.00 43.02 40.69 3fsw s PHE 15 CO -0.00 -0.30 1.61 0.27 -0.10 0.00 0.00 175.22 176.70 3fsw n ASN 16 N -2.04 4.76 -3.76 1.36 6.94 -1.02 -4.84 115.26 116.65 3fsw n ASN 16 Ca 0.02 -2.51 -0.13 0.00 -0.02 0.00 0.00 54.58 51.94 3fsw n ASN 16 Cb 0.55 -0.59 -0.09 0.00 -2.36 0.00 0.00 39.78 37.28 3fsw n ASN 16 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 3fsw s THR 17 N -2.00 0.04 -0.96 5.53 -1.32 -1.26 -4.99 115.64 110.68 3fsw s THR 17 Ca 0.50 -0.34 0.09 0.00 -1.21 0.00 0.00 61.69 60.73 3fsw s THR 17 Cb 0.33 -0.57 0.19 0.00 -1.51 0.00 0.00 72.50 70.95 3fsw s THR 17 CO 0.22 -0.19 1.06 -0.46 -2.21 0.00 0.00 174.62 173.05 3fsw n ASN 18 N 1.76 2.43 -3.66 8.08 0.23 -1.26 -4.86 115.26 117.98 3fsw n ASN 18 Ca -0.19 -1.77 -0.08 0.00 -0.53 0.00 0.00 54.58 52.01 3fsw n ASN 18 Cb 0.56 -0.13 -0.09 0.00 -2.08 0.00 0.00 39.78 38.05 3fsw n ASN 18 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3fsw s ALA 19 N -0.93 -1.26 -0.11 -2.53 0.00 -1.26 -1.90 121.76 113.77 3fsw s ALA 19 Ca 0.17 1.61 -0.02 0.00 0.00 0.00 0.00 51.96 53.72 3fsw s ALA 19 Cb 0.10 -1.36 -0.03 0.00 0.00 0.00 0.00 23.12 21.83 3fsw s ALA 19 CO 0.13 -0.75 -0.05 0.42 0.00 0.00 0.00 175.76 175.51 3fsw s ILE 20 N 2.58 3.80 -0.20 0.00 1.01 0.03 -4.98 121.20 123.45 3fsw s ILE 20 Ca -0.03 -0.41 0.00 0.00 0.00 0.00 0.00 60.65 60.21 3fsw s ILE 20 Cb -0.12 -2.61 0.02 0.00 0.01 0.00 0.00 42.46 39.76 3fsw s ILE 20 CO -0.14 0.55 -0.15 0.42 0.00 0.00 0.00 174.94 175.62 3fsw s THR 21 N -0.19 2.38 -0.08 2.92 -4.23 -1.26 -1.72 115.64 113.45 3fsw s THR 21 Ca 0.03 -0.92 -0.16 0.00 -1.18 0.00 0.00 61.69 59.45 3fsw s THR 21 Cb -0.13 -2.07 -0.05 0.00 1.34 0.00 0.00 72.50 71.60 3fsw s THR 21 CO 0.03 0.45 0.43 -0.69 -0.54 0.00 0.00 174.62 174.29 3fsw s VAL 22 N 1.31 5.15 0.01 2.29 1.01 0.36 -4.96 120.40 125.56 3fsw s VAL 22 Ca 0.04 0.86 -0.30 0.00 0.00 0.00 0.00 61.98 62.57 3fsw s VAL 22 Cb -0.14 -3.76 -0.06 0.00 0.00 0.00 0.00 36.38 32.42 3fsw s VAL 22 CO -0.10 0.42 1.44 -0.62 0.00 0.00 0.00 175.10 176.24 3fsw s ASP 23 N 0.05 6.82 0.61 3.32 -1.08 -1.26 -0.90 116.67 124.23 3fsw s ASP 23 Ca 0.24 2.16 0.32 0.00 -0.52 0.00 0.00 52.55 54.75 3fsw s ASP 23 Cb -0.15 -2.56 1.82 0.00 -1.46 0.00 0.00 42.92 40.57 3fsw s ASP 23 CO 0.10 -0.74 2.15 0.07 0.52 0.00 0.00 175.17 177.27 3fsw h LYS 24 N 7.92 0.00 0.00 4.34 2.10 -0.38 -1.05 116.57 129.50 3fsw h LYS 24 Ca -0.38 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.27 3fsw h LYS 24 Cb 1.18 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.51 3fsw h LYS 24 CO 0.91 0.00 -0.02 -1.13 -2.00 0.00 0.00 179.45 177.21 3fsw n SER 25 N -3.56 0.12 -4.73 7.07 3.41 -1.26 -4.88 113.62 109.78 3fsw n SER 25 Ca -0.00 0.48 -0.41 0.00 -0.26 0.00 0.00 58.87 58.67 3fsw n SER 25 Cb 0.25 -0.50 -0.03 0.00 -0.26 0.00 0.00 64.21 63.67 3fsw n SER 25 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3fsw h LYS 27 N 5.65 -0.03 -5.51 0.00 3.64 -1.89 -3.41 116.57 115.01 3fsw h LYS 27 Ca -0.44 0.00 -0.52 0.00 -1.27 0.00 0.00 60.65 58.42 3fsw h LYS 27 Cb 1.21 0.01 -0.14 0.00 -0.41 0.00 0.00 32.23 32.90 3fsw h LYS 27 CO 0.78 0.52 -0.65 -0.65 -2.27 0.00 0.00 179.45 177.18 3fsw s GLN 28 N -3.87 1.66 -0.01 1.90 -0.21 -1.26 -1.73 119.66 116.14 3fsw s GLN 28 Ca -0.16 -1.87 0.01 0.00 0.02 0.00 0.00 55.36 53.35 3fsw s GLN 28 Cb 0.01 -1.22 0.00 0.00 1.00 0.00 0.00 33.01 32.80 3fsw s GLN 28 CO 0.65 -0.01 -0.03 0.12 -2.12 0.00 0.00 175.29 173.90 3fsw s PHE 29 N -2.99 0.30 -0.14 0.91 5.36 -0.31 -4.80 117.98 116.32 3fsw s PHE 29 Ca 0.32 -0.05 0.02 0.00 -0.96 0.00 0.00 56.93 56.27 3fsw s PHE 29 Cb 0.06 -0.22 0.01 0.00 -0.34 0.00 0.00 43.02 42.52 3fsw s PHE 29 CO 0.14 -0.02 -0.21 0.99 -1.46 0.00 0.00 175.22 174.65 3fsw s THR 30 N 0.08 2.01 -0.24 0.12 2.01 -0.66 -1.64 115.64 117.32 3fsw s THR 30 Ca -0.00 -0.95 -0.11 0.00 0.31 0.00 0.00 61.69 60.94 3fsw s THR 30 Cb -0.03 -1.78 -0.05 0.00 0.01 0.00 0.00 72.50 70.65 3fsw s THR 30 CO -0.00 0.54 0.17 -0.69 -0.69 0.00 0.00 174.62 173.95 3fsw s VAL 31 N 0.83 5.35 -0.62 3.82 1.01 0.06 -1.70 120.40 129.15 3fsw s VAL 31 Ca -0.07 0.21 -0.11 0.00 0.00 0.00 0.00 61.98 62.01 3fsw s VAL 31 Cb -0.15 -3.51 0.16 0.00 0.00 0.00 0.00 36.38 32.87 3fsw s VAL 31 CO -0.02 0.34 0.52 0.20 0.00 0.00 0.00 175.10 176.14 3fsw s ASN 32 N 1.07 6.02 -0.01 3.32 0.01 -0.15 -1.56 114.94 123.64 3fsw s ASN 32 Ca 0.08 -2.30 -0.24 0.00 -0.71 0.00 0.00 52.86 49.69 3fsw s ASN 32 Cb -0.14 -2.08 -0.05 0.00 0.41 0.00 0.00 41.25 39.40 3fsw s ASN 32 CO 0.05 -0.63 0.71 -0.22 -1.51 0.00 0.00 177.10 175.51 3fsw s LEU 33 N 0.78 4.38 0.15 0.60 2.96 -0.23 -1.12 118.68 126.20 3fsw s LEU 33 Ca 0.11 1.29 0.05 0.00 -0.22 0.00 0.00 54.13 55.36 3fsw s LEU 33 Cb -0.21 -3.12 -0.04 0.00 0.50 0.00 0.00 46.19 43.31 3fsw s LEU 33 CO -0.03 -0.04 -0.11 -0.94 -1.32 0.00 0.00 176.35 173.92 3fsw s SER 34 N 0.34 1.85 -0.44 3.68 1.04 -0.28 -1.02 113.70 118.86 3fsw s SER 34 Ca 0.37 -1.00 0.03 0.00 0.48 0.00 0.00 55.95 55.82 3fsw s SER 34 Cb -0.19 -0.02 0.13 0.00 0.10 0.00 0.00 66.02 66.04 3fsw s SER 34 CO 0.20 -0.31 0.22 -2.28 0.98 0.00 0.00 173.24 172.04 3fsw s HIS 35 N -3.25 2.46 -2.05 5.02 2.46 -1.03 -1.88 115.29 117.02 3fsw s HIS 35 Ca 0.17 -2.63 0.31 0.00 0.47 0.00 0.00 55.06 53.38 3fsw s HIS 35 Cb 0.02 -2.23 1.79 0.00 -0.13 0.00 0.00 32.58 32.03 3fsw s HIS 35 CO 0.01 -0.79 2.17 -0.35 -2.47 0.00 0.00 174.74 173.30 3fsw n PRO 36 N 3.59 1.07 0.00 2.88 -0.04 -1.25 -1.60 135.00 139.64 3fsw n PRO 36 Ca 0.06 -0.12 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 3fsw n PRO 36 Cb 0.35 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.31 3fsw n PRO 36 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3fsw n GLY 37 N 1.03 -1.66 0.00 0.55 0.00 -1.26 -4.87 105.19 98.98 3fsw n GLY 37 Ca 0.23 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.73 3fsw n GLY 37 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3fsw n ASN 38 N -1.12 0.37 -4.79 1.61 3.02 -1.26 -3.97 115.26 109.13 3fsw n ASN 38 Ca 0.00 -1.15 -0.36 0.00 -0.03 0.00 0.00 54.58 53.04 3fsw n ASN 38 Cb 0.00 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.11 3fsw n ASN 38 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3fsw s LEU 39 N -0.15 4.31 1.04 3.41 1.43 -1.26 -4.85 118.68 122.61 3fsw s LEU 39 Ca 0.00 1.75 -0.13 0.00 -1.03 0.00 0.00 54.13 54.73 3fsw s LEU 39 Cb 0.00 -3.98 0.21 0.00 0.03 0.00 0.00 46.19 42.45 3fsw s LEU 39 CO 0.00 -0.07 1.08 -2.16 0.23 0.00 0.00 176.35 175.43 3fsw s PRO 40 N -2.13 0.12 0.30 1.29 0.04 -1.26 -2.28 135.00 131.08 3fsw s PRO 40 Ca 0.50 0.56 -0.00 0.00 0.04 0.00 0.00 61.00 62.10 3fsw s PRO 40 Cb -0.18 -1.70 0.49 0.00 0.04 0.00 0.00 34.50 33.16 3fsw s PRO 40 CO 0.22 -2.95 1.92 -0.22 0.04 0.00 0.00 177.00 176.02 3fsw h LYS 41 N -2.05 1.04 0.00 4.56 3.64 -1.87 -1.76 116.57 120.13 3fsw h LYS 41 Ca -0.56 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 58.76 3fsw h LYS 41 Cb 1.33 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 3fsw h LYS 41 CO 0.56 0.69 0.00 -2.95 -2.27 0.00 0.00 179.45 175.48 3fsw h ASN 42 N 1.07 0.00 0.00 4.20 -1.07 -1.95 -1.52 115.58 116.31 3fsw h ASN 42 Ca 0.37 0.00 -0.35 0.00 0.07 0.00 0.00 56.30 56.39 3fsw h ASN 42 Cb 0.10 0.00 -0.06 0.00 -2.07 0.00 0.00 38.32 36.29 3fsw h ASN 42 CO -0.12 0.00 -2.32 1.33 0.07 0.00 0.00 177.43 176.38 3fsw n VAL 43 N -2.55 1.33 -2.71 6.14 0.24 -1.00 -4.82 118.33 114.96 3fsw n VAL 43 Ca 0.04 -0.62 -0.05 0.00 -2.04 0.00 0.00 64.34 61.67 3fsw n VAL 43 Cb 0.41 -1.02 0.08 0.00 -1.47 0.00 0.00 33.84 31.84 3fsw n VAL 43 CO 0.00 0.00 0.00 0.80 -2.14 0.00 0.00 176.83 175.49 3fsw n MET 44 N -3.00 1.32 -2.65 7.34 0.00 -0.69 -5.04 117.12 114.40 3fsw n MET 44 Ca -0.38 -2.42 -0.38 0.00 -0.00 0.00 0.00 57.70 54.53 3fsw n MET 44 Cb 1.01 -0.58 -0.05 0.00 0.00 0.00 0.00 33.22 33.59 3fsw n MET 44 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 3fsw s GLY 45 N -2.23 2.90 0.08 -5.12 0.00 -0.57 -4.81 107.32 97.56 3fsw s GLY 45 Ca 0.22 0.66 0.07 0.00 0.00 0.00 0.00 44.72 45.67 3fsw s GLY 45 CO -0.05 1.16 -0.19 0.30 0.00 0.00 0.00 173.10 174.32 3fsw s HIS 46 N -1.45 1.61 0.32 1.90 3.76 0.02 -4.77 115.29 116.68 3fsw s HIS 46 Ca 0.49 -0.41 0.03 0.00 -0.15 0.00 0.00 55.06 55.03 3fsw s HIS 46 Cb -0.24 -0.91 -0.06 0.00 1.11 0.00 0.00 32.58 32.48 3fsw s HIS 46 CO 0.30 0.13 0.07 0.54 -0.85 0.00 0.00 174.74 174.93 3fsw s ASN 47 N -1.64 2.23 -0.16 1.40 2.20 -1.26 -0.34 114.94 117.36 3fsw s ASN 47 Ca 0.04 -1.40 0.01 0.00 -0.94 0.00 0.00 52.86 50.58 3fsw s ASN 47 Cb -0.09 0.00 0.02 0.00 -2.00 0.00 0.00 41.25 39.17 3fsw s ASN 47 CO 0.03 -0.65 -0.20 0.86 -2.94 0.00 0.00 177.10 174.20 3fsw s TRP 48 N -3.36 2.65 -0.04 1.54 -0.00 -1.26 -3.77 118.94 114.70 3fsw s TRP 48 Ca 0.36 -1.49 0.02 0.00 -0.00 0.00 0.00 56.10 55.00 3fsw s TRP 48 Cb 0.08 -1.83 0.01 0.00 -0.00 0.00 0.00 33.47 31.72 3fsw s TRP 48 CO 0.15 -0.72 -0.10 0.08 -0.00 0.00 0.00 176.95 176.36 3fsw s VAL 49 N 1.16 0.87 -0.11 5.86 1.01 0.47 -1.26 120.40 128.41 3fsw s VAL 49 Ca 0.01 -0.39 0.02 0.00 0.00 0.00 0.00 61.98 61.62 3fsw s VAL 49 Cb -0.14 -0.79 -0.01 0.00 0.00 0.00 0.00 36.38 35.45 3fsw s VAL 49 CO -0.09 0.28 -0.18 -0.22 0.00 0.00 0.00 175.10 174.88 3fsw s LEU 50 N 0.34 2.41 0.25 3.92 2.96 0.10 -1.20 118.68 127.46 3fsw s LEU 50 Ca -0.06 -0.43 -0.08 0.00 -0.22 0.00 0.00 54.13 53.34 3fsw s LEU 50 Cb -0.11 -1.51 -0.01 0.00 0.50 0.00 0.00 46.19 45.06 3fsw s LEU 50 CO 0.01 0.17 0.38 -0.94 -1.32 0.00 0.00 176.35 174.65 3fsw s SER 51 N 0.29 0.10 0.68 3.68 1.04 -0.81 -0.24 113.70 118.43 3fsw s SER 51 Ca -0.13 -1.13 -0.15 0.00 0.48 0.00 0.00 55.95 55.01 3fsw s SER 51 Cb -0.17 0.54 0.01 0.00 0.10 0.00 0.00 66.02 66.50 3fsw s SER 51 CO 0.07 -1.07 1.15 0.42 0.98 0.00 0.00 173.24 174.79 3fsw s THR 52 N -3.94 2.87 0.35 2.02 -4.23 -1.26 -1.09 115.64 110.35 3fsw s THR 52 Ca 0.28 0.42 0.10 0.00 -1.18 0.00 0.00 61.69 61.32 3fsw s THR 52 Cb 0.02 -2.97 0.33 0.00 1.34 0.00 0.00 72.50 71.22 3fsw s THR 52 CO 0.11 -0.23 1.81 0.00 -0.54 0.00 0.00 174.62 175.78 3fsw h ALA 53 N 0.01 1.87 0.00 3.99 0.00 -0.84 -1.60 119.26 122.70 3fsw h ALA 53 Ca -0.47 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.45 3fsw h ALA 53 Cb 1.27 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 3fsw h ALA 53 CO 0.53 -0.20 -0.17 0.00 0.00 0.00 0.00 179.25 179.40 3fsw h ALA 54 N 1.62 1.57 0.00 0.00 0.00 -1.91 -3.10 119.26 117.44 3fsw h ALA 54 Ca 0.53 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.28 3fsw h ALA 54 Cb 0.97 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3fsw h ALA 54 CO -0.29 0.21 -1.21 -0.25 0.00 0.00 0.00 179.25 177.71 3fsw n ASP 55 N -4.13 0.78 -0.09 0.00 8.00 -0.66 -4.67 116.55 115.78 3fsw n ASP 55 Ca -0.02 -0.76 -0.09 0.00 0.71 0.00 0.00 54.79 54.63 3fsw n ASP 55 Cb 0.25 1.23 -0.03 0.00 -0.02 0.00 0.00 41.12 42.54 3fsw n ASP 55 CO 0.00 0.00 0.00 -0.03 -0.39 0.00 0.00 177.20 176.78 3fsw h MET 56 N 0.00 -0.30 -0.47 -1.24 1.85 -1.34 -2.07 114.93 111.36 3fsw h MET 56 Ca 0.00 0.02 -0.10 0.00 -0.61 0.00 0.00 59.70 59.02 3fsw h MET 56 Cb 0.60 0.07 -0.02 0.00 0.43 0.00 0.00 31.60 32.68 3fsw h MET 56 CO 0.00 -0.20 -0.09 0.37 -0.40 0.00 0.00 176.91 176.58 3fsw h GLN 57 N -0.31 0.84 -0.45 0.39 5.75 -1.83 -0.74 115.11 118.75 3fsw h GLN 57 Ca 0.15 -0.28 0.00 0.00 -0.15 0.00 0.00 58.65 58.37 3fsw h GLN 57 Cb 0.56 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 29.02 3fsw h GLN 57 CO -0.51 0.90 0.30 0.78 -2.65 0.00 0.00 178.83 177.65 3fsw h GLY 58 N 0.97 0.64 0.94 2.39 0.00 -1.78 0.26 103.07 106.49 3fsw h GLY 58 Ca 0.13 -0.24 -0.01 0.00 0.00 0.00 0.00 47.33 47.21 3fsw h GLY 58 CO 0.04 0.24 0.15 -2.08 0.00 0.00 0.00 176.54 174.89 3fsw h VAL 59 N 0.62 1.15 -0.51 4.60 2.07 -0.99 -1.71 116.25 121.49 3fsw h VAL 59 Ca 0.17 -0.44 -0.06 0.00 0.82 0.00 0.00 66.70 67.19 3fsw h VAL 59 Cb -0.07 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 3fsw h VAL 59 CO -0.04 0.16 0.08 0.58 0.02 0.00 0.00 177.57 178.37 3fsw h VAL 60 N 0.37 1.23 0.09 2.57 2.07 -0.73 -0.90 116.25 120.94 3fsw h VAL 60 Ca 0.11 -0.87 -0.00 0.00 0.82 0.00 0.00 66.70 66.75 3fsw h VAL 60 Cb 0.11 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 3fsw h VAL 60 CO -0.01 0.32 -0.04 0.74 0.02 0.00 0.00 177.57 178.59 3fsw h THR 61 N 0.76 1.16 -0.01 2.57 2.02 -0.36 -1.73 112.91 117.32 3fsw h THR 61 Ca 0.16 -1.29 -0.04 0.00 0.77 0.00 0.00 66.41 66.01 3fsw h THR 61 Cb 0.35 1.94 -0.01 0.00 -1.74 0.00 0.00 68.15 68.69 3fsw h THR 61 CO 0.01 0.30 -0.18 0.44 0.37 0.00 0.00 175.52 176.45 3fsw h ASP 62 N -0.75 0.01 0.20 4.18 5.19 -1.38 -2.23 116.42 121.66 3fsw h ASP 62 Ca -0.01 -0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 56.30 3fsw h ASP 62 Cb 0.58 -0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.07 3fsw h ASP 62 CO 0.02 0.20 -0.36 1.23 -3.12 0.00 0.00 179.24 177.21 3fsw h GLY 63 N 0.58 0.25 1.59 2.75 0.00 -1.09 -1.63 103.07 105.51 3fsw h GLY 63 Ca 0.00 -0.22 -0.20 0.00 0.00 0.00 0.00 47.33 46.91 3fsw h GLY 63 CO 0.02 0.20 -0.82 1.98 0.00 0.00 0.00 176.54 177.92 3fsw h MET 64 N 0.20 0.39 -0.24 4.80 -1.53 -0.73 -2.16 114.93 115.66 3fsw h MET 64 Ca 0.02 -0.36 0.01 0.00 -3.44 0.00 0.00 59.70 55.92 3fsw h MET 64 Cb 0.74 0.09 -0.01 0.00 -0.55 0.00 0.00 31.60 31.86 3fsw h MET 64 CO 0.06 1.02 0.15 0.00 0.14 0.00 0.00 176.91 178.28 3fsw h ALA 65 N 0.86 0.30 -0.09 0.39 0.00 -1.34 -3.01 119.26 116.37 3fsw h ALA 65 Ca -0.05 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 3fsw h ALA 65 Cb 1.43 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 3fsw h ALA 65 CO 0.14 -0.24 0.01 1.03 0.00 0.00 0.00 179.25 180.20 3fsw h SER 66 N 0.31 0.11 -0.64 0.00 0.87 -1.17 -3.52 113.55 109.50 3fsw h SER 66 Ca 0.09 -0.01 -0.21 0.00 -1.23 0.00 0.00 61.79 60.43 3fsw h SER 66 Cb -0.02 -0.03 -0.08 0.00 -0.44 0.00 0.00 62.40 61.83 3fsw h SER 66 CO -0.03 0.13 -0.19 0.61 -0.53 0.00 0.00 176.83 176.81 3fsw n GLY 67 N -1.39 1.00 2.16 5.77 0.00 -0.82 -4.72 105.19 107.18 3fsw n GLY 67 Ca -0.02 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.90 3fsw n GLY 67 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3fsw n ASP 71 N -0.84 4.12 -1.48 1.61 8.00 -1.26 -4.76 116.55 121.94 3fsw n ASP 71 Ca -0.10 -2.25 -0.17 0.00 0.71 0.00 0.00 54.79 52.98 3fsw n ASP 71 Cb 0.53 -1.08 -0.05 0.00 -0.02 0.00 0.00 41.12 40.51 3fsw n ASP 71 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3fsw n TYR 72 N 2.73 -0.26 -3.70 1.24 4.01 -1.26 -4.89 117.16 115.03 3fsw n TYR 72 Ca 0.34 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.86 3fsw n TYR 72 Cb 0.64 -3.04 -0.18 0.00 -0.31 0.00 0.00 39.34 36.46 3fsw n TYR 72 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3fsw s LEU 73 N -4.11 0.39 0.08 7.72 1.43 -1.26 -4.34 118.68 118.58 3fsw s LEU 73 Ca 0.00 -0.12 -0.37 0.00 -1.03 0.00 0.00 54.13 52.61 3fsw s LEU 73 Cb 0.00 -0.28 -0.17 0.00 0.03 0.00 0.00 46.19 45.77 3fsw s LEU 73 CO 0.00 -0.25 1.32 1.17 0.23 0.00 0.00 176.35 178.83 3fsw n LYS 74 N 5.23 1.10 -1.70 1.70 4.81 -1.26 -4.91 118.16 123.13 3fsw n LYS 74 Ca -0.05 0.40 -0.38 0.00 -0.87 0.00 0.00 58.31 57.40 3fsw n LYS 74 Cb 0.50 -2.03 0.05 0.00 0.02 0.00 0.00 35.03 33.57 3fsw n LYS 74 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 3fsw n PRO 75 N 2.46 1.36 -4.13 1.64 -0.02 -1.26 -3.32 135.00 131.73 3fsw n PRO 75 Ca 0.18 0.51 -0.33 0.00 -2.02 0.00 0.00 63.50 61.85 3fsw n PRO 75 Cb 0.19 -2.43 -0.02 0.00 -0.02 0.00 0.00 33.50 31.21 3fsw n PRO 75 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3fsw n ASP 76 N -1.03 -2.65 -4.55 2.55 9.92 -1.26 -4.89 116.55 114.64 3fsw n ASP 76 Ca 0.12 -0.99 -0.43 0.00 -0.53 0.00 0.00 54.79 52.96 3fsw n ASP 76 Cb 0.45 -2.93 -0.04 0.00 -0.64 0.00 0.00 41.12 37.97 3fsw n ASP 76 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 3fsw s ASP 77 N -3.58 6.42 0.33 -2.24 -1.08 -1.21 -4.89 116.67 110.42 3fsw s ASP 77 Ca 0.54 -0.10 0.26 0.00 -0.52 0.00 0.00 52.55 52.73 3fsw s ASP 77 Cb -0.29 -2.46 1.08 0.00 -1.46 0.00 0.00 42.92 39.78 3fsw s ASP 77 CO 0.91 -1.20 1.78 0.77 0.52 0.00 0.00 175.17 177.95 3fsw h SER 78 N 9.26 0.00 0.56 -0.34 4.64 -1.93 -2.67 113.55 123.07 3fsw h SER 78 Ca -0.25 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.04 3fsw h SER 78 Cb 1.07 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.16 3fsw h SER 78 CO 1.08 0.00 -0.16 0.03 -0.87 0.00 0.00 176.83 176.91 3fsw h ARG 79 N 0.00 0.00 -6.11 4.77 3.08 -1.97 -3.40 114.38 110.75 3fsw h ARG 79 Ca 0.00 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.46 3fsw h ARG 79 Cb 0.42 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.36 3fsw h ARG 79 CO 0.00 0.16 0.67 0.08 -1.07 0.00 0.00 179.97 179.81 3fsw s VAL 80 N -3.99 4.32 0.08 2.04 1.01 -1.01 -4.45 120.40 118.40 3fsw s VAL 80 Ca -0.02 0.55 -0.16 0.00 0.00 0.00 0.00 61.98 62.35 3fsw s VAL 80 Cb 0.12 -4.56 -0.11 0.00 0.00 0.00 0.00 36.38 31.83 3fsw s VAL 80 CO 0.60 -1.10 1.37 0.40 0.00 0.00 0.00 175.10 176.37 3fsw h ILE 81 N 6.07 1.32 -2.58 2.22 2.04 -0.85 -3.46 117.51 122.27 3fsw h ILE 81 Ca -0.25 -1.50 -0.06 0.00 1.00 0.00 0.00 64.86 64.05 3fsw h ILE 81 Cb 1.07 1.74 -0.17 0.00 -0.74 0.00 0.00 36.82 38.72 3fsw h ILE 81 CO 1.10 0.47 0.06 0.00 0.00 0.00 0.00 178.15 179.77 3fsw s ALA 82 N -4.23 -1.41 -0.04 1.87 0.00 -1.23 -5.01 121.76 111.71 3fsw s ALA 82 Ca -0.13 0.78 -0.25 0.00 0.00 0.00 0.00 51.96 52.36 3fsw s ALA 82 Cb 0.08 0.26 0.05 0.00 0.00 0.00 0.00 23.12 23.51 3fsw s ALA 82 CO 0.82 -0.45 0.54 -3.38 0.00 0.00 0.00 175.76 173.29 3fsw s HIS 83 N -2.03 -0.49 0.69 0.00 -3.43 -1.26 -0.72 115.29 108.06 3fsw s HIS 83 Ca -0.08 0.83 -0.09 0.00 -0.80 0.00 0.00 55.06 54.92 3fsw s HIS 83 Cb -0.01 0.29 0.03 0.00 -1.43 0.00 0.00 32.58 31.47 3fsw s HIS 83 CO 0.02 -0.52 1.04 0.95 -2.00 0.00 0.00 174.74 174.22 3fsw s THR 84 N -1.21 3.10 0.89 -5.38 -4.23 -0.39 -4.83 115.64 103.59 3fsw s THR 84 Ca -0.12 0.13 -0.12 0.00 -1.18 0.00 0.00 61.69 60.41 3fsw s THR 84 Cb -0.02 -3.31 0.13 0.00 1.34 0.00 0.00 72.50 70.63 3fsw s THR 84 CO 0.08 -0.37 1.10 -1.59 -0.54 0.00 0.00 174.62 173.29 3fsw s LYS 85 N -5.26 1.28 0.01 3.99 0.00 -1.26 -4.50 119.74 114.00 3fsw s LYS 85 Ca 0.58 0.69 -0.30 0.00 0.00 0.00 0.00 55.97 56.95 3fsw s LYS 85 Cb -0.11 -1.82 -0.03 0.00 0.00 0.00 0.00 37.83 35.87 3fsw s LYS 85 CO 0.48 -2.19 0.97 -1.17 0.00 0.00 0.00 175.35 173.43 3fsw s LEU 86 N -6.16 4.38 0.07 2.77 2.96 -1.26 -4.42 118.68 117.03 3fsw s LEU 86 Ca 0.63 1.66 0.07 0.00 -0.22 0.00 0.00 54.13 56.27 3fsw s LEU 86 Cb -0.17 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 42.94 3fsw s LEU 86 CO 0.56 -0.23 -0.20 0.27 -1.32 0.00 0.00 176.35 175.44 3fsw s ILE 87 N 0.88 1.58 0.21 6.68 -4.36 0.53 -4.90 121.20 121.82 3fsw s ILE 87 Ca 0.51 -1.34 0.03 0.00 -0.26 0.00 0.00 60.65 59.59 3fsw s ILE 87 Cb -0.21 -1.42 0.03 0.00 1.25 0.00 0.00 42.46 42.11 3fsw s ILE 87 CO 0.28 0.03 0.25 0.61 0.24 0.00 0.00 174.94 176.34 3fsw n GLY 88 N 1.46 2.30 3.69 6.27 0.00 -1.26 -0.80 105.19 116.85 3fsw n GLY 88 Ca -0.19 -2.19 -0.39 0.00 0.00 0.00 0.00 46.02 43.25 3fsw n GLY 88 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3fsw n SER 89 N -2.46 2.13 0.00 1.61 3.41 -0.97 -1.98 113.62 115.37 3fsw n SER 89 Ca 0.04 1.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.64 3fsw n SER 89 Cb 0.23 -1.49 0.00 0.00 -0.26 0.00 0.00 64.21 62.69 3fsw n SER 89 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3fsw n GLY 90 N 0.92 0.43 3.95 5.00 0.00 -0.63 -4.99 105.19 109.88 3fsw n GLY 90 Ca 0.10 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.93 3fsw n GLY 90 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fsw s GLU 91 N -0.64 2.83 0.02 1.61 2.02 -0.84 -4.97 118.70 118.73 3fsw s GLU 91 Ca 0.00 -1.25 -0.16 0.00 0.02 0.00 0.00 54.97 53.58 3fsw s GLU 91 Cb 0.00 -2.66 0.03 0.00 0.10 0.00 0.00 34.13 31.60 3fsw s GLU 91 CO 0.00 -0.11 0.35 -1.59 0.02 0.00 0.00 175.26 173.93 3fsw s LYS 92 N -4.21 0.80 -0.17 1.61 -2.85 -1.26 -2.45 119.74 111.21 3fsw s LYS 92 Ca 0.49 -0.32 -0.19 0.00 -1.00 0.00 0.00 55.97 54.95 3fsw s LYS 92 Cb -0.08 0.35 0.05 0.00 -2.06 0.00 0.00 37.83 36.09 3fsw s LYS 92 CO 0.31 -0.25 0.51 0.34 0.10 0.00 0.00 175.35 176.36 3fsw s ASP 93 N -1.75 -0.52 0.08 0.03 2.15 -0.19 -5.02 116.67 111.46 3fsw s ASP 93 Ca -0.08 0.95 0.07 0.00 0.43 0.00 0.00 52.55 53.91 3fsw s ASP 93 Cb -0.02 0.96 -0.04 0.00 -0.30 0.00 0.00 42.92 43.52 3fsw s ASP 93 CO 0.00 -0.23 -0.10 -0.44 -0.17 0.00 0.00 175.17 174.23 3fsw s SER 94 N 0.05 4.37 -0.03 -0.34 0.01 -1.26 -1.07 113.70 115.43 3fsw s SER 94 Ca -0.02 -0.36 0.01 0.00 1.31 0.00 0.00 55.95 56.90 3fsw s SER 94 Cb -0.03 -0.85 0.02 0.00 0.21 0.00 0.00 66.02 65.36 3fsw s SER 94 CO 0.02 0.20 -0.05 0.54 0.41 0.00 0.00 173.24 174.35 3fsw s VAL 95 N -1.16 0.55 -0.00 3.43 0.11 -0.60 -4.89 120.40 117.84 3fsw s VAL 95 Ca 0.20 -0.17 0.05 0.00 -2.93 0.00 0.00 61.98 59.13 3fsw s VAL 95 Cb -0.11 -0.55 -0.03 0.00 -1.53 0.00 0.00 36.38 34.16 3fsw s VAL 95 CO 0.12 0.21 -0.16 -0.89 -3.33 0.00 0.00 175.10 171.05 3fsw s THR 96 N 0.64 2.91 0.06 5.04 2.01 -1.26 -0.76 115.64 124.28 3fsw s THR 96 Ca -0.09 -0.96 -0.02 0.00 0.31 0.00 0.00 61.69 60.94 3fsw s THR 96 Cb -0.12 -2.18 -0.03 0.00 0.01 0.00 0.00 72.50 70.18 3fsw s THR 96 CO 0.00 0.47 0.01 0.72 -0.69 0.00 0.00 174.62 175.12 3fsw s PHE 97 N -0.83 0.47 0.13 4.92 -0.71 -0.65 -4.97 117.98 116.33 3fsw s PHE 97 Ca 0.13 -1.00 -0.30 0.00 -1.04 0.00 0.00 56.93 54.72 3fsw s PHE 97 Cb -0.11 -0.34 -0.07 0.00 -1.21 0.00 0.00 43.02 41.30 3fsw s PHE 97 CO 0.03 -0.41 1.13 -0.51 -1.34 0.00 0.00 175.22 174.13 3fsw s ASP 98 N -2.91 7.19 0.49 1.98 -0.00 -1.26 -1.16 116.67 121.00 3fsw s ASP 98 Ca 0.07 2.06 0.27 0.00 -0.00 0.00 0.00 52.55 54.95 3fsw s ASP 98 Cb 0.08 -2.59 1.20 0.00 -0.00 0.00 0.00 42.92 41.60 3fsw s ASP 98 CO -0.10 -0.32 1.94 0.58 -0.00 0.00 0.00 175.17 177.27 3fsw h VAL 99 N 4.04 0.44 0.00 -1.27 2.07 -1.57 -2.17 116.25 117.79 3fsw h VAL 99 Ca -0.43 -0.82 0.00 0.00 0.82 0.00 0.00 66.70 66.27 3fsw h VAL 99 Cb 1.21 1.58 0.00 0.00 -1.52 0.00 0.00 31.29 32.56 3fsw h VAL 99 CO 0.75 0.15 0.00 0.77 0.02 0.00 0.00 177.57 179.26 3fsw h SER 100 N 0.00 0.00 0.78 0.57 4.64 -1.87 0.18 113.55 117.85 3fsw h SER 100 Ca -0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.26 3fsw h SER 100 Cb 0.57 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.65 3fsw h SER 100 CO 0.02 0.00 -0.26 0.11 -0.87 0.00 0.00 176.83 175.83 3fsw h LYS 101 N 0.00 0.00 -6.07 4.77 6.56 -1.78 -3.45 116.57 116.60 3fsw h LYS 101 Ca 0.00 0.00 -0.54 0.00 -1.06 0.00 0.00 60.65 59.05 3fsw h LYS 101 Cb 0.03 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 31.67 3fsw h LYS 101 CO 0.00 0.26 -0.46 -0.51 -2.06 0.00 0.00 179.45 176.68 3fsw s LEU 102 N -7.01 4.33 -0.03 2.94 1.43 0.05 -5.12 118.68 115.27 3fsw s LEU 102 Ca -0.00 0.18 0.04 0.00 -1.03 0.00 0.00 54.13 53.31 3fsw s LEU 102 Cb 0.11 -2.92 -0.01 0.00 0.03 0.00 0.00 46.19 43.41 3fsw s LEU 102 CO 0.65 0.04 -0.15 -1.59 0.23 0.00 0.00 176.35 175.53 3fsw s LYS 103 N -3.29 1.39 0.25 1.70 0.00 -1.26 -5.02 119.74 113.51 3fsw s LYS 103 Ca 0.35 -0.52 -0.31 0.00 0.00 0.00 0.00 55.97 55.49 3fsw s LYS 103 Cb -0.11 -1.27 -0.13 0.00 0.00 0.00 0.00 37.83 36.32 3fsw s LYS 103 CO 0.29 0.25 1.39 0.39 0.00 0.00 0.00 175.35 177.67 3fsw n GLU 104 N 2.99 2.04 0.00 1.78 1.02 -1.26 -2.48 120.64 124.74 3fsw n GLU 104 Ca -0.17 0.73 0.00 0.00 -0.02 0.00 0.00 57.16 57.70 3fsw n GLU 104 Cb 0.54 -2.37 0.00 0.00 -0.02 0.00 0.00 31.44 29.59 3fsw n GLU 104 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3fsw n GLY 105 N 2.01 3.14 3.93 0.62 0.00 -1.26 -5.05 105.19 108.58 3fsw n GLY 105 Ca 0.11 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 3fsw n GLY 105 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fsw s GLU 106 N -0.99 3.53 -0.24 1.61 0.41 -1.03 -5.10 118.70 116.88 3fsw s GLU 106 Ca 0.00 -0.32 -0.08 0.00 -0.41 0.00 0.00 54.97 54.16 3fsw s GLU 106 Cb 0.00 -2.80 -0.04 0.00 -1.78 0.00 0.00 34.13 29.51 3fsw s GLU 106 CO 0.00 0.36 0.10 -0.65 -0.49 0.00 0.00 175.26 174.58 3fsw s GLN 107 N -3.48 3.82 0.09 1.61 -1.52 -1.26 -4.92 119.66 114.01 3fsw s GLN 107 Ca 0.39 -0.40 0.08 0.00 -1.95 0.00 0.00 55.36 53.49 3fsw s GLN 107 Cb -0.11 -3.40 -0.04 0.00 -0.22 0.00 0.00 33.01 29.25 3fsw s GLN 107 CO 0.30 -0.07 -0.18 0.71 -0.25 0.00 0.00 175.29 175.80 3fsw s TYR 108 N 1.34 2.55 -0.03 0.91 2.02 -1.24 -0.15 117.35 122.74 3fsw s TYR 108 Ca 0.06 -0.26 0.04 0.00 -0.37 0.00 0.00 57.07 56.54 3fsw s TYR 108 Cb -0.15 -1.39 -0.00 0.00 -0.40 0.00 0.00 41.96 40.02 3fsw s TYR 108 CO 0.05 0.34 -0.14 -1.64 -1.57 0.00 0.00 175.55 172.59 3fsw s MET 109 N -1.88 1.32 0.18 -0.62 -1.94 -0.25 -1.89 119.30 114.21 3fsw s MET 109 Ca 0.17 -0.48 0.06 0.00 -1.71 0.00 0.00 55.69 53.73 3fsw s MET 109 Cb -0.11 -1.21 -0.04 0.00 2.01 0.00 0.00 34.83 35.49 3fsw s MET 109 CO 0.08 0.23 0.07 -0.59 -0.01 0.00 0.00 175.02 174.80 3fsw s PHE 110 N -0.04 2.97 0.02 -0.03 -0.12 -0.06 -1.93 117.98 118.80 3fsw s PHE 110 Ca -0.00 -0.09 -0.29 0.00 -0.05 0.00 0.00 56.93 56.50 3fsw s PHE 110 Cb -0.09 -1.42 0.10 0.00 -0.63 0.00 0.00 43.02 40.98 3fsw s PHE 110 CO 0.01 0.52 1.09 -0.59 -0.05 0.00 0.00 175.22 176.20 3fsw s PHE 111 N -1.80 -0.14 -0.08 3.49 -0.71 -0.34 -1.08 117.98 117.33 3fsw s PHE 111 Ca 0.29 -0.04 -0.16 0.00 -1.04 0.00 0.00 56.93 55.98 3fsw s PHE 111 Cb -0.09 0.57 -0.05 0.00 -1.21 0.00 0.00 43.02 42.24 3fsw s PHE 111 CO 0.21 -0.51 0.42 0.00 -1.34 0.00 0.00 175.22 173.99 3fsw n ALA 113 N 2.95 2.98 -1.76 0.00 0.00 -1.26 -3.48 120.51 119.93 3fsw n ALA 113 Ca -0.11 -0.45 -0.39 0.00 0.00 0.00 0.00 53.44 52.49 3fsw n ALA 113 Cb 0.52 -1.09 0.01 0.00 0.00 0.00 0.00 19.45 18.89 3fsw n ALA 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fsw s ALA 114 N -2.35 3.14 -0.47 0.00 0.00 -1.26 -4.71 121.76 116.11 3fsw s ALA 114 Ca 0.27 1.27 -0.45 0.00 0.00 0.00 0.00 51.96 53.06 3fsw s ALA 114 Cb 0.20 -3.51 -0.19 0.00 0.00 0.00 0.00 23.12 19.61 3fsw s ALA 114 CO 0.47 -1.00 1.79 0.00 0.00 0.00 0.00 175.76 177.03 3fsw n ALA 115 N -0.23 -0.69 -0.79 0.00 0.00 -1.26 -0.77 120.51 116.76 3fsw n ALA 115 Ca 0.06 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.87 3fsw n ALA 115 Cb 0.44 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 17.86 3fsw n ALA 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fsw n ALA 116 N 5.37 0.00 0.14 0.00 0.00 -1.26 -4.84 120.51 119.92 3fsw n ALA 116 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.82 3fsw n ALA 116 Cb -0.02 -0.54 0.18 0.00 0.00 0.00 0.00 19.45 19.07 3fsw n ALA 116 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3fsw h HIS 117 N 0.00 0.00 0.00 0.00 -0.00 -1.24 -3.31 115.15 110.60 3fsw h HIS 117 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 60.37 60.34 3fsw h HIS 117 Cb 0.08 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 27.49 3fsw h HIS 117 CO 0.05 0.58 -0.15 0.00 -0.00 0.00 0.00 177.93 178.41 3fsw h ALA 118 N 1.42 1.58 -0.91 2.45 0.00 -1.72 0.45 119.26 122.53 3fsw h ALA 118 Ca -0.01 -0.14 0.08 0.00 0.00 0.00 0.00 54.91 54.85 3fsw h ALA 118 Cb 1.12 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.82 3fsw h ALA 118 CO 0.07 0.19 0.59 0.00 0.00 0.00 0.00 179.25 180.11 3fsw h ALA 119 N 1.85 1.56 0.00 0.00 0.00 -1.91 -3.23 119.26 117.52 3fsw h ALA 119 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3fsw h ALA 119 Cb 0.30 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3fsw h ALA 119 CO 0.02 0.28 -1.57 0.00 0.00 0.00 0.00 179.25 177.98 3fsw n ALA 120 N -2.40 2.58 -3.87 0.00 0.00 -0.42 -4.81 120.51 111.59 3fsw n ALA 120 Ca 0.15 -0.33 -0.29 0.00 0.00 0.00 0.00 53.44 52.96 3fsw n ALA 120 Cb 0.25 -0.47 -0.12 0.00 0.00 0.00 0.00 19.45 19.11 3fsw n ALA 120 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3fsw s MET 121 N -2.91 2.49 0.23 0.00 1.00 0.14 -4.65 119.30 115.61 3fsw s MET 121 Ca -0.04 -3.22 -0.18 0.00 0.00 0.00 0.00 55.69 52.25 3fsw s MET 121 Cb 0.09 -3.48 0.02 0.00 0.00 0.00 0.00 34.83 31.46 3fsw s MET 121 CO 0.57 -1.26 0.58 -1.59 0.00 0.00 0.00 175.02 173.33 3fsw s LYS 122 N -1.25 1.55 -0.07 2.03 0.00 -1.26 -1.94 119.74 118.81 3fsw s LYS 122 Ca 0.24 -0.97 -0.30 0.00 0.00 0.00 0.00 55.97 54.93 3fsw s LYS 122 Cb -0.08 0.54 0.10 0.00 0.00 0.00 0.00 37.83 38.39 3fsw s LYS 122 CO -0.13 -0.68 1.34 0.20 0.00 0.00 0.00 175.35 176.08 3fsw s GLY 123 N -2.92 -0.19 0.10 0.59 0.00 -0.24 -4.71 107.32 99.96 3fsw s GLY 123 Ca 0.12 0.14 -0.05 0.00 0.00 0.00 0.00 44.72 44.93 3fsw s GLY 123 CO 0.03 6.30 0.33 -0.51 0.00 0.00 0.00 173.10 179.24 3fsw s THR 124 N -2.01 5.22 -0.08 0.90 -4.23 -0.80 -0.88 115.64 113.77 3fsw s THR 124 Ca 0.31 0.01 0.03 0.00 -1.18 0.00 0.00 61.69 60.86 3fsw s THR 124 Cb 0.00 -3.62 0.01 0.00 1.34 0.00 0.00 72.50 70.23 3fsw s THR 124 CO -0.02 0.13 -0.18 -0.22 -0.54 0.00 0.00 174.62 173.79 3fsw s LEU 125 N -2.42 1.86 -0.01 4.79 0.20 -0.80 -0.79 118.68 121.52 3fsw s LEU 125 Ca 0.37 -0.41 0.00 0.00 0.69 0.00 0.00 54.13 54.78 3fsw s LEU 125 Cb -0.13 -1.09 0.01 0.00 -0.43 0.00 0.00 46.19 44.55 3fsw s LEU 125 CO 0.23 0.10 -0.00 -0.89 -0.29 0.00 0.00 176.35 175.50 3fsw s THR 126 N 0.44 0.07 -0.08 3.68 2.01 -0.70 -3.69 115.64 117.37 3fsw s THR 126 Ca -0.15 0.01 -0.30 0.00 0.31 0.00 0.00 61.69 61.56 3fsw s THR 126 Cb -0.16 -0.10 -0.02 0.00 0.01 0.00 0.00 72.50 72.23 3fsw s THR 126 CO 0.06 0.05 1.02 -0.76 -0.69 0.00 0.00 174.62 174.29 3fsw s LEU 127 N 0.24 4.27 0.00 4.42 1.43 -1.26 -0.49 118.68 127.29 3fsw s LEU 127 Ca -0.02 1.58 0.00 0.00 -1.03 0.00 0.00 54.13 54.66 3fsw s LEU 127 Cb -0.04 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.62 3fsw s LEU 127 CO -0.01 -0.43 0.00 0.29 0.23 0.00 0.00 176.35 176.44