#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 -3.47 0.02 -0.02 0.00 1.04 -1.26 -1.73 113.70 108.29 3fsw s SER 4 Ca 0.43 -0.93 -0.05 0.00 0.48 0.00 0.00 55.95 55.88 3fsw s SER 4 Cb 0.41 0.46 0.00 0.00 0.10 0.00 0.00 66.02 67.00 3fsw s SER 4 CO -0.11 -0.94 0.11 0.54 0.98 0.00 0.00 173.24 173.82 3fsw s VAL 5 N -4.00 0.05 -0.20 5.02 0.11 -0.34 -4.93 120.40 116.11 3fsw s VAL 5 Ca 0.20 -0.45 -0.06 0.00 -2.93 0.00 0.00 61.98 58.75 3fsw s VAL 5 Cb 0.03 -0.31 -0.03 0.00 -1.53 0.00 0.00 36.38 34.54 3fsw s VAL 5 CO 0.03 -0.24 0.03 -1.81 -3.33 0.00 0.00 175.10 169.78 3fsw s ASP 6 N -0.81 5.14 -0.01 3.54 1.11 -1.26 -1.17 116.67 123.20 3fsw s ASP 6 Ca -0.09 -0.11 0.03 0.00 0.18 0.00 0.00 52.55 52.56 3fsw s ASP 6 Cb -0.05 -1.89 -0.01 0.00 1.07 0.00 0.00 42.92 42.04 3fsw s ASP 6 CO 0.01 0.08 -0.10 -0.63 1.18 0.00 0.00 175.17 175.71 3fsw s ILE 7 N 0.91 0.79 -0.04 0.77 -1.09 -0.91 -4.98 121.20 116.65 3fsw s ILE 7 Ca 0.02 -0.42 0.06 0.00 -2.23 0.00 0.00 60.65 58.08 3fsw s ILE 7 Cb -0.14 -0.67 -0.02 0.00 -1.58 0.00 0.00 42.46 40.05 3fsw s ILE 7 CO 0.02 0.23 -0.22 -1.10 -1.23 0.00 0.00 174.94 172.64 3fsw s GLN 8 N -0.18 2.39 -0.14 2.79 -0.21 -1.26 -2.03 119.66 121.03 3fsw s GLN 8 Ca 0.03 -0.85 -0.00 0.00 0.02 0.00 0.00 55.36 54.56 3fsw s GLN 8 Cb -0.05 -2.19 -0.01 0.00 1.00 0.00 0.00 33.01 31.76 3fsw s GLN 8 CO -0.00 0.52 -0.13 0.20 -2.12 0.00 0.00 175.29 173.76 3fsw s GLY 9 N -0.49 1.54 0.11 3.09 0.00 -0.85 -2.21 107.32 108.51 3fsw s GLY 9 Ca 0.06 -0.91 0.00 0.00 0.00 0.00 0.00 44.72 43.88 3fsw s GLY 9 CO 0.01 -0.14 0.03 1.16 0.00 0.00 0.00 173.10 174.15 3fsw n ASN 10 N 3.62 2.01 0.17 1.64 0.23 -0.96 -3.91 115.26 118.06 3fsw n ASN 10 Ca -0.18 -1.44 0.13 0.00 -0.53 0.00 0.00 54.58 52.56 3fsw n ASN 10 Cb 0.53 0.05 0.42 0.00 -2.08 0.00 0.00 39.78 38.69 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 0.22 0.00 -0.59 0.53 3.32 -1.91 -3.00 116.42 114.99 3fsw h ASP 11 Ca -0.08 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.73 3fsw h ASP 11 Cb 0.27 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 39.67 3fsw h ASP 11 CO 0.14 0.00 0.30 0.00 -1.72 0.00 0.00 179.24 177.96 3fsw n GLN 12 N -2.64 2.49 -3.65 3.56 3.00 -1.26 -4.93 117.38 113.96 3fsw n GLN 12 Ca 0.03 -2.12 -0.26 0.00 -0.01 0.00 0.00 57.00 54.65 3fsw n GLN 12 Cb 0.39 -1.89 0.04 0.00 0.00 0.00 0.00 30.24 28.78 3fsw n GLN 12 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.06 176.94 3fsw n MET 13 N -0.27 -2.37 -3.80 -1.09 1.56 -1.13 -4.99 117.12 105.02 3fsw n MET 13 Ca 0.34 0.55 -0.13 0.00 -0.27 0.00 0.00 57.70 58.18 3fsw n MET 13 Cb 1.18 -4.64 -0.14 0.00 2.15 0.00 0.00 33.22 31.77 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 -5.80 0.08 0.53 2.12 -0.21 -1.26 -4.55 119.66 110.57 3fsw s GLN 14 Ca 0.32 0.23 -0.10 0.00 0.02 0.00 0.00 55.36 55.83 3fsw s GLN 14 Cb -0.10 -0.08 -0.05 0.00 1.00 0.00 0.00 33.01 33.78 3fsw s GLN 14 CO 0.84 -0.09 0.91 -0.06 -2.12 0.00 0.00 175.29 174.76 3fsw s PHE 15 N 0.61 3.56 -0.79 0.91 0.08 -1.26 -2.28 117.98 118.82 3fsw s PHE 15 Ca -0.05 1.14 0.13 0.00 0.12 0.00 0.00 56.93 58.27 3fsw s PHE 15 Cb -0.06 -2.56 0.64 0.00 -0.57 0.00 0.00 43.02 40.47 3fsw s PHE 15 CO -0.03 -0.42 1.51 0.27 -0.10 0.00 0.00 175.22 176.45 3fsw n ASN 16 N -2.19 4.50 -3.66 1.36 6.94 -0.94 -4.88 115.26 116.40 3fsw n ASN 16 Ca 0.04 -2.57 -0.11 0.00 -0.02 0.00 0.00 54.58 51.91 3fsw n ASN 16 Cb 0.54 -0.59 -0.05 0.00 -2.36 0.00 0.00 39.78 37.32 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 -2.13 0.07 -0.03 5.53 -1.32 -1.26 -4.97 115.64 111.52 3fsw s THR 17 Ca 0.44 -0.55 0.04 0.00 -1.21 0.00 0.00 61.69 60.41 3fsw s THR 17 Cb 0.31 -1.08 0.06 0.00 -1.51 0.00 0.00 72.50 70.28 3fsw s THR 17 CO 0.17 -0.30 0.93 -0.46 -2.21 0.00 0.00 174.62 172.74 3fsw n ASN 18 N 0.09 1.50 -3.54 8.08 0.23 -1.26 -4.82 115.26 115.54 3fsw n ASN 18 Ca -0.17 -2.02 -0.05 0.00 -0.53 0.00 0.00 54.58 51.81 3fsw n ASN 18 Cb 0.62 -0.10 -0.07 0.00 -2.08 0.00 0.00 39.78 38.15 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 -1.10 -1.47 -0.07 -2.53 0.00 -1.26 -2.22 121.76 113.12 3fsw s ALA 19 Ca 0.07 1.62 -0.01 0.00 0.00 0.00 0.00 51.96 53.63 3fsw s ALA 19 Cb 0.06 -1.59 -0.03 0.00 0.00 0.00 0.00 23.12 21.55 3fsw s ALA 19 CO 0.01 -0.96 0.00 0.42 0.00 0.00 0.00 175.76 175.23 3fsw s ILE 20 N 2.69 4.31 -0.08 0.00 1.01 0.30 -4.96 121.20 124.48 3fsw s ILE 20 Ca 0.03 -0.30 0.05 0.00 0.00 0.00 0.00 60.65 60.42 3fsw s ILE 20 Cb -0.13 -2.83 -0.01 0.00 0.01 0.00 0.00 42.46 39.50 3fsw s ILE 20 CO -0.16 0.56 -0.23 0.42 0.00 0.00 0.00 174.94 175.53 3fsw s THR 21 N -0.93 2.17 -0.25 2.92 -4.23 -1.26 -1.94 115.64 112.12 3fsw s THR 21 Ca 0.15 -1.01 -0.04 0.00 -1.18 0.00 0.00 61.69 59.60 3fsw s THR 21 Cb -0.11 -1.81 -0.00 0.00 1.34 0.00 0.00 72.50 71.92 3fsw s THR 21 CO 0.04 0.56 -0.01 -0.69 -0.54 0.00 0.00 174.62 173.99 3fsw s VAL 22 N 0.01 3.52 0.03 2.29 1.01 -0.48 -4.96 120.40 121.82 3fsw s VAL 22 Ca -0.08 -0.60 -0.30 0.00 0.00 0.00 0.00 61.98 61.00 3fsw s VAL 22 Cb -0.15 -2.69 -0.08 0.00 0.00 0.00 0.00 36.38 33.46 3fsw s VAL 22 CO 0.05 0.30 1.78 -0.62 0.00 0.00 0.00 175.10 176.60 3fsw s ASP 23 N 1.47 6.55 0.00 3.32 -1.08 -1.26 -1.38 116.67 124.29 3fsw s ASP 23 Ca 0.04 2.50 0.14 0.00 -0.52 0.00 0.00 52.55 54.72 3fsw s ASP 23 Cb -0.15 -2.54 0.85 0.00 -1.46 0.00 0.00 42.92 39.61 3fsw s ASP 23 CO -0.01 -0.97 1.29 1.17 0.52 0.00 0.00 175.17 177.17 3fsw n LYS 24 N 6.69 0.60 -0.03 4.34 0.00 -0.62 -1.40 118.16 127.74 3fsw n LYS 24 Ca 0.18 0.00 0.12 0.00 0.00 0.00 0.00 58.31 58.61 3fsw n LYS 24 Cb 0.41 -1.37 0.12 0.00 0.00 0.00 0.00 35.03 34.19 3fsw n LYS 24 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 3fsw n SER 25 N -0.87 3.06 -4.75 3.14 3.41 -1.26 -4.94 113.62 111.42 3fsw n SER 25 Ca 0.11 -1.99 -0.41 0.00 -0.26 0.00 0.00 58.87 56.32 3fsw n SER 25 Cb 0.05 -0.04 -0.04 0.00 -0.26 0.00 0.00 64.21 63.91 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 4.56 0.53 -5.46 0.00 1.79 -1.92 -3.41 116.57 112.66 3fsw h LYS 27 Ca -0.45 -0.49 -0.42 0.00 -2.18 0.00 0.00 60.65 57.11 3fsw h LYS 27 Cb 1.21 0.12 -0.16 0.00 -1.58 0.00 0.00 32.23 31.82 3fsw h LYS 27 CO 0.70 1.12 -0.74 -0.65 -1.08 0.00 0.00 179.45 178.80 3fsw s GLN 28 N -3.47 1.19 -0.01 3.15 -0.21 -1.26 -1.12 119.66 117.93 3fsw s GLN 28 Ca -0.12 -1.46 0.01 0.00 0.02 0.00 0.00 55.36 53.80 3fsw s GLN 28 Cb 0.05 -0.98 0.01 0.00 1.00 0.00 0.00 33.01 33.09 3fsw s GLN 28 CO 0.84 0.17 -0.01 0.12 -2.12 0.00 0.00 175.29 174.29 3fsw s PHE 29 N -2.76 0.20 -0.11 0.91 5.36 -0.25 -4.84 117.98 116.49 3fsw s PHE 29 Ca 0.17 -0.01 0.01 0.00 -0.96 0.00 0.00 56.93 56.15 3fsw s PHE 29 Cb -0.01 -0.21 -0.02 0.00 -0.34 0.00 0.00 43.02 42.44 3fsw s PHE 29 CO 0.05 -0.05 -0.15 0.99 -1.46 0.00 0.00 175.22 174.60 3fsw s THR 30 N 0.37 2.93 -0.21 0.12 2.01 -0.70 -1.69 115.64 118.48 3fsw s THR 30 Ca -0.03 -0.72 -0.04 0.00 0.31 0.00 0.00 61.69 61.20 3fsw s THR 30 Cb -0.06 -2.20 -0.02 0.00 0.01 0.00 0.00 72.50 70.24 3fsw s THR 30 CO -0.01 0.54 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.76 3fsw s VAL 31 N 0.08 3.68 -0.66 3.82 1.01 0.68 -1.20 120.40 127.81 3fsw s VAL 31 Ca -0.06 -0.40 -0.10 0.00 0.00 0.00 0.00 61.98 61.42 3fsw s VAL 31 Cb -0.15 -2.67 0.17 0.00 0.00 0.00 0.00 36.38 33.73 3fsw s VAL 31 CO 0.05 0.42 0.56 0.20 0.00 0.00 0.00 175.10 176.33 3fsw s ASN 32 N 1.23 6.07 0.12 3.32 0.01 -0.32 -0.87 114.94 124.50 3fsw s ASN 32 Ca 0.03 -2.44 -0.23 0.00 -0.71 0.00 0.00 52.86 49.51 3fsw s ASN 32 Cb -0.14 -2.07 -0.07 0.00 0.41 0.00 0.00 41.25 39.37 3fsw s ASN 32 CO 0.00 -0.58 0.69 -0.22 -1.51 0.00 0.00 177.10 175.47 3fsw s LEU 33 N 0.56 4.56 0.06 0.60 2.96 0.19 -2.13 118.68 125.49 3fsw s LEU 33 Ca 0.13 1.48 -0.06 0.00 -0.22 0.00 0.00 54.13 55.46 3fsw s LEU 33 Cb -0.19 -3.12 -0.01 0.00 0.50 0.00 0.00 46.19 43.37 3fsw s LEU 33 CO -0.04 0.23 0.12 -0.94 -1.32 0.00 0.00 176.35 174.40 3fsw s SER 34 N -1.10 0.19 -0.27 3.68 1.04 -0.86 -0.99 113.70 115.39 3fsw s SER 34 Ca 0.33 -0.64 0.03 0.00 0.48 0.00 0.00 55.95 56.15 3fsw s SER 34 Cb -0.22 0.27 0.07 0.00 0.10 0.00 0.00 66.02 66.25 3fsw s SER 34 CO 0.23 -0.61 -0.05 -2.28 0.98 0.00 0.00 173.24 171.51 3fsw s HIS 35 N -3.31 3.11 -1.75 5.02 2.46 -0.47 -2.00 115.29 118.35 3fsw s HIS 35 Ca 0.01 -2.32 0.07 0.00 0.47 0.00 0.00 55.06 53.29 3fsw s HIS 35 Cb 0.03 -2.07 0.24 0.00 -0.13 0.00 0.00 32.58 30.65 3fsw s HIS 35 CO -0.08 -0.87 1.14 -0.35 -2.47 0.00 0.00 174.74 172.11 3fsw n PRO 36 N 4.46 1.76 -0.44 2.88 -0.04 -1.25 -2.88 135.00 139.49 3fsw n PRO 36 Ca -0.09 -0.97 0.00 0.00 -0.04 0.00 0.00 63.50 62.40 3fsw n PRO 36 Cb 0.42 -1.32 0.00 0.00 -0.04 0.00 0.00 33.50 32.57 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 0.78 1.27 0.02 0.55 0.00 -1.26 -4.94 105.19 101.60 3fsw n GLY 37 Ca 0.09 -1.99 0.03 0.00 0.00 0.00 0.00 46.02 44.15 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 -1.71 2.29 -4.80 1.61 3.02 -1.26 -4.24 115.26 110.16 3fsw n ASN 38 Ca 0.00 0.00 -0.34 0.00 -0.03 0.00 0.00 54.58 54.21 3fsw n ASN 38 Cb 0.00 1.34 -0.06 0.00 -0.61 0.00 0.00 39.78 40.45 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 -4.08 4.03 0.74 3.41 1.43 -1.26 -4.79 118.68 118.17 3fsw s LEU 39 Ca -0.05 1.80 -0.12 0.00 -1.03 0.00 0.00 54.13 54.73 3fsw s LEU 39 Cb 0.06 -4.39 0.04 0.00 0.03 0.00 0.00 46.19 41.94 3fsw s LEU 39 CO 0.48 -0.38 1.11 -2.16 0.23 0.00 0.00 176.35 175.63 3fsw s PRO 40 N -2.87 2.31 0.32 1.29 0.04 -1.26 -2.69 135.00 132.14 3fsw s PRO 40 Ca 0.60 1.33 0.02 0.00 0.04 0.00 0.00 61.00 62.99 3fsw s PRO 40 Cb -0.14 -1.89 0.59 0.00 0.04 0.00 0.00 34.50 33.10 3fsw s PRO 40 CO 0.18 -1.62 1.92 -0.22 0.04 0.00 0.00 177.00 177.30 3fsw h LYS 41 N -0.73 0.93 0.00 4.56 3.64 -1.90 -1.45 116.57 121.62 3fsw h LYS 41 Ca -0.45 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 58.86 3fsw h LYS 41 Cb 1.25 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 32.85 3fsw h LYS 41 CO 0.51 0.61 -0.06 -2.95 -2.27 0.00 0.00 179.45 175.30 3fsw h ASN 42 N 0.96 0.00 0.00 4.20 -1.07 -1.95 0.13 115.58 117.84 3fsw h ASN 42 Ca 0.37 0.00 -0.33 0.00 0.07 0.00 0.00 56.30 56.41 3fsw h ASN 42 Cb 0.22 0.00 -0.06 0.00 -2.07 0.00 0.00 38.32 36.41 3fsw h ASN 42 CO -0.13 0.06 -2.23 1.33 0.07 0.00 0.00 177.43 176.52 3fsw n VAL 43 N -3.26 1.24 -2.61 6.14 0.24 -0.62 -4.77 118.33 114.68 3fsw n VAL 43 Ca -0.01 -0.55 0.02 0.00 -2.04 0.00 0.00 64.34 61.76 3fsw n VAL 43 Cb 0.26 -1.08 0.03 0.00 -1.47 0.00 0.00 33.84 31.58 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 0.71 -2.00 7.34 1.56 -0.75 -5.03 117.12 115.95 3fsw n MET 44 Ca -0.36 -2.51 -0.38 0.00 -0.27 0.00 0.00 57.70 54.18 3fsw n MET 44 Cb 0.95 -0.58 0.01 0.00 2.15 0.00 0.00 33.22 35.75 3fsw n MET 44 CO 0.00 0.00 0.00 0.20 -0.73 0.00 0.00 175.97 175.44 3fsw s GLY 45 N -2.62 2.87 0.08 -5.12 0.00 0.03 -4.89 107.32 97.67 3fsw s GLY 45 Ca 0.29 1.20 0.04 0.00 0.00 0.00 0.00 44.72 46.25 3fsw s GLY 45 CO -0.11 1.74 -0.11 0.30 0.00 0.00 0.00 173.10 174.91 3fsw s HIS 46 N -1.35 1.05 0.28 1.90 3.76 -0.54 -4.73 115.29 115.67 3fsw s HIS 46 Ca 0.64 -0.54 0.02 0.00 -0.15 0.00 0.00 55.06 55.03 3fsw s HIS 46 Cb -0.37 -0.59 -0.06 0.00 1.11 0.00 0.00 32.58 32.68 3fsw s HIS 46 CO 0.45 0.01 0.08 0.54 -0.85 0.00 0.00 174.74 174.97 3fsw s ASN 47 N -1.97 1.65 -0.16 1.40 2.20 -1.26 0.67 114.94 117.47 3fsw s ASN 47 Ca -0.01 -1.37 0.01 0.00 -0.94 0.00 0.00 52.86 50.54 3fsw s ASN 47 Cb -0.07 0.06 0.01 0.00 -2.00 0.00 0.00 41.25 39.25 3fsw s ASN 47 CO 0.01 -0.68 -0.18 0.86 -2.94 0.00 0.00 177.10 174.17 3fsw s TRP 48 N -3.57 2.76 -0.05 1.54 -0.00 -1.26 -3.96 118.94 114.40 3fsw s TRP 48 Ca 0.37 -1.33 0.03 0.00 -0.00 0.00 0.00 56.10 55.17 3fsw s TRP 48 Cb 0.08 -1.89 0.01 0.00 -0.00 0.00 0.00 33.47 31.66 3fsw s TRP 48 CO 0.14 -0.64 -0.12 0.08 -0.00 0.00 0.00 176.95 176.41 3fsw s VAL 49 N 1.03 1.08 -0.14 5.86 1.01 -0.53 -0.66 120.40 128.05 3fsw s VAL 49 Ca -0.01 -0.49 -0.01 0.00 0.00 0.00 0.00 61.98 61.47 3fsw s VAL 49 Cb -0.15 -0.97 -0.02 0.00 0.00 0.00 0.00 36.38 35.25 3fsw s VAL 49 CO -0.05 0.33 -0.11 -0.22 0.00 0.00 0.00 175.10 175.06 3fsw s LEU 50 N 0.41 2.84 0.35 3.92 2.96 0.16 -1.80 118.68 127.51 3fsw s LEU 50 Ca -0.09 -0.29 0.02 0.00 -0.22 0.00 0.00 54.13 53.54 3fsw s LEU 50 Cb -0.13 -1.65 -0.01 0.00 0.50 0.00 0.00 46.19 44.90 3fsw s LEU 50 CO 0.02 0.15 0.42 -0.94 -1.32 0.00 0.00 176.35 174.68 3fsw s SER 51 N 0.44 1.27 0.64 3.68 1.04 -0.66 -0.54 113.70 119.57 3fsw s SER 51 Ca -0.08 -1.62 -0.14 0.00 0.48 0.00 0.00 55.95 54.59 3fsw s SER 51 Cb -0.15 0.64 -0.01 0.00 0.10 0.00 0.00 66.02 66.59 3fsw s SER 51 CO 0.04 -1.24 1.07 0.42 0.98 0.00 0.00 173.24 174.52 3fsw s THR 52 N -3.11 3.70 0.35 2.02 -4.23 -1.26 -0.87 115.64 112.24 3fsw s THR 52 Ca 0.34 0.74 0.07 0.00 -1.18 0.00 0.00 61.69 61.66 3fsw s THR 52 Cb 0.00 -3.30 0.31 0.00 1.34 0.00 0.00 72.50 70.86 3fsw s THR 52 CO 0.24 -0.54 1.90 0.00 -0.54 0.00 0.00 174.62 175.67 3fsw h ALA 53 N 0.04 1.75 -0.68 3.99 0.00 -1.26 -1.50 119.26 121.59 3fsw h ALA 53 Ca -0.46 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.48 3fsw h ALA 53 Cb 1.22 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.81 3fsw h ALA 53 CO 0.56 0.06 0.45 0.00 0.00 0.00 0.00 179.25 180.32 3fsw h ALA 54 N 1.59 1.61 -0.00 0.00 0.00 -1.92 -2.98 119.26 117.55 3fsw h ALA 54 Ca 0.41 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.28 3fsw h ALA 54 Cb 0.52 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3fsw h ALA 54 CO -0.17 0.31 -0.68 -0.25 0.00 0.00 0.00 179.25 178.46 3fsw n ASP 55 N -4.46 1.18 0.14 0.00 8.00 -0.62 -4.71 116.55 116.08 3fsw n ASP 55 Ca 0.09 -0.98 -0.16 0.00 0.71 0.00 0.00 54.79 54.45 3fsw n ASP 55 Cb 0.13 0.62 -0.09 0.00 -0.02 0.00 0.00 41.12 41.76 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 0.78 -0.73 -0.40 -1.24 4.05 -1.25 -0.89 114.93 115.25 3fsw h MET 56 Ca 0.00 0.05 -0.03 0.00 -0.28 0.00 0.00 59.70 59.44 3fsw h MET 56 Cb 0.57 0.16 -0.02 0.00 -0.80 0.00 0.00 31.60 31.51 3fsw h MET 56 CO 0.00 -0.48 0.12 0.37 0.23 0.00 0.00 176.91 177.15 3fsw h GLN 57 N -0.75 0.58 -0.52 0.39 5.75 -1.84 -0.52 115.11 118.20 3fsw h GLN 57 Ca -0.00 -0.09 -0.07 0.00 -0.15 0.00 0.00 58.65 58.34 3fsw h GLN 57 Cb 0.75 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 29.17 3fsw h GLN 57 CO -0.24 0.52 0.07 0.78 -2.65 0.00 0.00 178.83 177.31 3fsw h GLY 58 N 0.77 0.94 0.90 2.39 0.00 -1.73 0.22 103.07 106.56 3fsw h GLY 58 Ca 0.14 -0.64 -0.02 0.00 0.00 0.00 0.00 47.33 46.81 3fsw h GLY 58 CO -0.01 0.59 0.09 -2.08 0.00 0.00 0.00 176.54 175.14 3fsw h VAL 59 N 0.75 1.19 -0.84 4.60 2.07 -0.69 -1.22 116.25 122.10 3fsw h VAL 59 Ca 0.16 -0.58 -0.00 0.00 0.82 0.00 0.00 66.70 67.09 3fsw h VAL 59 Cb 0.42 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 31.23 3fsw h VAL 59 CO 0.01 0.19 0.52 0.58 0.02 0.00 0.00 177.57 178.90 3fsw h VAL 60 N 0.27 1.23 -0.10 2.57 2.07 -0.86 0.10 116.25 121.54 3fsw h VAL 60 Ca 0.09 -0.49 -0.05 0.00 0.82 0.00 0.00 66.70 67.07 3fsw h VAL 60 Cb 0.21 0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 30.02 3fsw h VAL 60 CO -0.00 0.24 -0.15 0.74 0.02 0.00 0.00 177.57 178.42 3fsw h THR 61 N 1.15 1.38 -0.11 2.57 2.02 -0.37 -1.83 112.91 117.72 3fsw h THR 61 Ca 0.30 -1.39 -0.14 0.00 0.77 0.00 0.00 66.41 65.95 3fsw h THR 61 Cb -0.06 2.07 -0.01 0.00 -1.74 0.00 0.00 68.15 68.41 3fsw h THR 61 CO -0.06 0.40 -0.56 0.44 0.37 0.00 0.00 175.52 176.11 3fsw h ASP 62 N -0.17 0.38 -0.61 4.18 3.32 -1.24 -2.96 116.42 119.32 3fsw h ASP 62 Ca 0.01 -0.21 0.05 0.00 0.02 0.00 0.00 57.03 56.91 3fsw h ASP 62 Cb 0.71 -0.11 -0.05 0.00 0.22 0.00 0.00 39.33 40.10 3fsw h ASP 62 CO 0.03 0.86 0.32 1.23 -1.72 0.00 0.00 179.24 179.97 3fsw h GLY 63 N 1.30 0.88 1.67 2.75 0.00 -0.73 -0.71 103.07 108.23 3fsw h GLY 63 Ca 0.00 -0.22 -0.06 0.00 0.00 0.00 0.00 47.33 47.05 3fsw h GLY 63 CO 0.09 0.13 -0.12 1.98 0.00 0.00 0.00 176.54 178.63 3fsw h MET 64 N 0.61 0.40 -0.17 4.80 1.85 -1.25 -0.68 114.93 120.50 3fsw h MET 64 Ca 0.27 -0.10 -0.01 0.00 -0.61 0.00 0.00 59.70 59.24 3fsw h MET 64 Cb 0.17 -0.05 -0.01 0.00 0.43 0.00 0.00 31.60 32.15 3fsw h MET 64 CO -0.18 0.52 0.05 0.00 -0.40 0.00 0.00 176.91 176.91 3fsw h ALA 65 N 1.51 0.22 -0.90 0.39 0.00 -1.27 -3.15 119.26 116.06 3fsw h ALA 65 Ca 0.07 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3fsw h ALA 65 Cb 0.44 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 3fsw h ALA 65 CO 0.02 -0.16 0.57 0.77 0.00 0.00 0.00 179.25 180.46 3fsw h SER 66 N 0.09 1.05 -4.11 0.00 0.02 -0.74 -3.48 113.55 106.37 3fsw h SER 66 Ca 0.05 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 3fsw h SER 66 Cb 0.23 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.50 3fsw h SER 66 CO -0.00 0.78 0.00 0.61 -1.14 0.00 0.00 176.83 177.08 3fsw n GLY 67 N -1.29 -2.32 0.37 -3.77 0.00 -0.30 -4.18 105.19 93.69 3fsw n GLY 67 Ca 0.10 -1.56 0.04 0.00 0.00 0.00 0.00 46.02 44.59 3fsw n GLY 67 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3fsw h LEU 68 N 0.00 1.01 -0.26 0.99 5.85 -1.89 0.79 115.31 121.80 3fsw h LEU 68 Ca 0.00 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 3fsw h LEU 68 Cb 0.00 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 40.84 3fsw h LEU 68 CO 0.00 0.62 0.00 0.47 -0.34 0.00 0.00 178.44 179.19 3fsw n ASP 69 N -4.53 0.23 -0.48 1.25 8.00 -1.26 -1.21 116.55 118.54 3fsw n ASP 69 Ca 0.16 0.56 0.09 0.00 0.71 0.00 0.00 54.79 56.31 3fsw n ASP 69 Cb 0.22 -0.61 0.19 0.00 -0.02 0.00 0.00 41.12 40.91 3fsw n ASP 69 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3fsw n LYS 70 N -1.75 2.23 -2.36 -1.24 4.76 -0.70 -4.97 118.16 114.13 3fsw n LYS 70 Ca 0.03 -2.60 -0.19 0.00 -2.87 0.00 0.00 58.31 52.67 3fsw n LYS 70 Cb 0.18 -1.61 -0.01 0.00 -1.84 0.00 0.00 35.03 31.74 3fsw n LYS 70 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 3fsw n ASP 71 N -0.84 -5.55 -3.75 4.39 9.92 -0.35 -3.00 116.55 117.36 3fsw n ASP 71 Ca 0.17 -0.01 -0.27 0.00 -0.53 0.00 0.00 54.79 54.14 3fsw n ASP 71 Cb 0.72 -4.60 0.05 0.00 -0.64 0.00 0.00 41.12 36.65 3fsw n ASP 71 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 3fsw n TYR 72 N -4.00 -2.53 -3.73 1.24 4.01 0.19 -4.79 117.16 107.55 3fsw n TYR 72 Ca -0.23 0.93 -0.13 0.00 -0.16 0.00 0.00 57.90 58.31 3fsw n TYR 72 Cb 0.67 -4.40 -0.14 0.00 -0.31 0.00 0.00 39.34 35.17 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 -7.27 0.47 -0.08 7.72 1.43 -1.16 -4.47 118.68 115.30 3fsw s LEU 73 Ca 0.62 0.44 -0.37 0.00 -1.03 0.00 0.00 54.13 53.79 3fsw s LEU 73 Cb -0.30 0.58 -0.15 0.00 0.03 0.00 0.00 46.19 46.36 3fsw s LEU 73 CO 0.77 -0.17 1.65 1.17 0.23 0.00 0.00 176.35 180.00 3fsw n LYS 74 N 4.32 1.51 -2.06 1.70 4.81 -1.26 -4.85 118.16 122.33 3fsw n LYS 74 Ca -0.24 0.55 -0.39 0.00 -0.87 0.00 0.00 58.31 57.36 3fsw n LYS 74 Cb 0.52 -2.27 0.00 0.00 0.02 0.00 0.00 35.03 33.30 3fsw n LYS 74 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 3fsw s PRO 75 N 2.53 3.81 -1.57 1.64 0.02 -1.26 -2.89 135.00 137.28 3fsw s PRO 75 Ca 0.91 2.09 -0.14 0.00 0.02 0.00 0.00 61.00 63.87 3fsw s PRO 75 Cb -0.90 -2.61 0.10 0.00 0.02 0.00 0.00 34.50 31.10 3fsw s PRO 75 CO 0.54 -0.60 0.93 -0.25 -0.33 0.00 0.00 177.00 177.29 3fsw n ASP 76 N -0.16 -4.34 -4.61 2.53 8.00 -1.26 -4.92 116.55 111.79 3fsw n ASP 76 Ca 0.05 -0.84 -0.43 0.00 0.71 0.00 0.00 54.79 54.29 3fsw n ASP 76 Cb 0.45 -3.63 -0.02 0.00 -0.02 0.00 0.00 41.12 37.90 3fsw n ASP 76 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3fsw s ASP 77 N -3.35 6.35 0.20 -2.24 -1.08 -1.14 -4.88 116.67 110.53 3fsw s ASP 77 Ca 0.66 1.14 0.21 0.00 -0.52 0.00 0.00 52.55 54.04 3fsw s ASP 77 Cb -0.34 -2.54 0.88 0.00 -1.46 0.00 0.00 42.92 39.47 3fsw s ASP 77 CO 0.85 -1.37 1.63 -1.54 0.52 0.00 0.00 175.17 175.26 3fsw n SER 78 N 8.72 0.49 0.23 -0.34 3.41 -1.26 -2.49 113.62 122.37 3fsw n SER 78 Ca 0.18 0.63 0.13 0.00 -0.26 0.00 0.00 58.87 59.54 3fsw n SER 78 Cb 0.47 -0.73 0.27 0.00 -0.26 0.00 0.00 64.21 63.96 3fsw n SER 78 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 3fsw h ARG 79 N 0.00 0.00 -6.25 4.33 3.08 -1.97 -3.42 114.38 110.15 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 0.30 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.25 3fsw h ARG 79 CO 0.00 0.02 0.72 0.08 -1.07 0.00 0.00 179.97 179.72 3fsw s VAL 80 N -3.30 4.30 0.09 2.04 1.01 -1.04 -4.44 120.40 119.06 3fsw s VAL 80 Ca 0.06 0.71 -0.15 0.00 0.00 0.00 0.00 61.98 62.59 3fsw s VAL 80 Cb 0.06 -4.56 -0.09 0.00 0.00 0.00 0.00 36.38 31.78 3fsw s VAL 80 CO 0.65 -1.07 1.40 0.40 0.00 0.00 0.00 175.10 176.48 3fsw h ILE 81 N 6.10 1.31 -2.41 2.22 2.04 -1.08 -3.46 117.51 122.22 3fsw h ILE 81 Ca -0.25 -1.47 -0.08 0.00 1.00 0.00 0.00 64.86 64.06 3fsw h ILE 81 Cb 1.07 1.64 -0.21 0.00 -0.74 0.00 0.00 36.82 38.57 3fsw h ILE 81 CO 1.10 0.47 -0.04 0.00 0.00 0.00 0.00 178.15 179.67 3fsw s ALA 82 N -4.31 -1.37 -0.04 1.87 0.00 -1.21 -5.00 121.76 111.70 3fsw s ALA 82 Ca -0.12 1.29 -0.23 0.00 0.00 0.00 0.00 51.96 52.90 3fsw s ALA 82 Cb 0.08 -0.52 0.05 0.00 0.00 0.00 0.00 23.12 22.73 3fsw s ALA 82 CO 0.82 -0.29 0.50 -3.38 0.00 0.00 0.00 175.76 173.41 3fsw s HIS 83 N -0.35 -0.42 0.64 0.00 -3.43 -1.26 0.38 115.29 110.84 3fsw s HIS 83 Ca -0.05 0.71 -0.04 0.00 -0.80 0.00 0.00 55.06 54.88 3fsw s HIS 83 Cb -0.03 0.25 0.04 0.00 -1.43 0.00 0.00 32.58 31.41 3fsw s HIS 83 CO 0.04 -0.50 0.92 0.95 -2.00 0.00 0.00 174.74 174.15 3fsw s THR 84 N -1.23 2.74 0.80 -5.38 -4.23 0.17 -4.82 115.64 103.68 3fsw s THR 84 Ca -0.12 -0.30 -0.11 0.00 -1.18 0.00 0.00 61.69 59.98 3fsw s THR 84 Cb -0.03 -3.12 0.07 0.00 1.34 0.00 0.00 72.50 70.76 3fsw s THR 84 CO 0.07 -0.12 1.10 -0.54 -0.54 0.00 0.00 174.62 174.59 3fsw s LYS 85 N -5.06 2.04 0.10 3.99 1.02 -1.26 -4.53 119.74 116.04 3fsw s LYS 85 Ca 0.58 1.17 -0.31 0.00 0.02 0.00 0.00 55.97 57.43 3fsw s LYS 85 Cb -0.11 -1.87 -0.07 0.00 -0.52 0.00 0.00 37.83 35.26 3fsw s LYS 85 CO 0.43 -1.80 1.31 -1.17 -0.92 0.00 0.00 175.35 173.20 3fsw s LEU 86 N -6.02 4.37 0.03 3.17 2.96 -1.26 -4.44 118.68 117.49 3fsw s LEU 86 Ca 0.62 2.21 0.06 0.00 -0.22 0.00 0.00 54.13 56.79 3fsw s LEU 86 Cb -0.18 -3.58 -0.02 0.00 0.50 0.00 0.00 46.19 42.91 3fsw s LEU 86 CO 0.56 -0.57 -0.17 0.27 -1.32 0.00 0.00 176.35 175.12 3fsw s ILE 87 N 1.02 1.36 0.09 6.68 -4.36 0.21 -4.91 121.20 121.29 3fsw s ILE 87 Ca 0.62 -1.00 0.01 0.00 -0.26 0.00 0.00 60.65 60.02 3fsw s ILE 87 Cb -0.34 -1.18 0.01 0.00 1.25 0.00 0.00 42.46 42.20 3fsw s ILE 87 CO 0.30 0.17 0.09 0.61 0.24 0.00 0.00 174.94 176.35 3fsw n GLY 88 N 2.07 2.52 3.60 6.27 0.00 -1.26 -1.46 105.19 116.93 3fsw n GLY 88 Ca -0.17 -2.17 -0.45 0.00 0.00 0.00 0.00 46.02 43.23 3fsw n GLY 88 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3fsw n SER 89 N -2.40 1.50 0.00 1.61 2.88 -1.10 -2.24 113.62 113.89 3fsw n SER 89 Ca 0.01 1.17 0.00 0.00 -1.33 0.00 0.00 58.87 58.72 3fsw n SER 89 Cb 0.09 -1.29 0.00 0.00 -0.75 0.00 0.00 64.21 62.26 3fsw n SER 89 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3fsw n GLY 90 N 1.48 0.57 3.57 0.46 0.00 -1.14 -5.00 105.19 105.13 3fsw n GLY 90 Ca 0.11 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.13 1.91 -0.08 1.61 2.02 -0.95 -4.99 118.70 118.10 3fsw s GLU 91 Ca 0.00 -1.86 -0.15 0.00 0.02 0.00 0.00 54.97 52.98 3fsw s GLU 91 Cb 0.00 -1.79 0.03 0.00 0.10 0.00 0.00 34.13 32.47 3fsw s GLU 91 CO 0.00 0.15 0.37 -1.59 0.02 0.00 0.00 175.26 174.21 3fsw s LYS 92 N -3.64 0.59 0.00 1.61 -2.85 -1.26 -1.37 119.74 112.82 3fsw s LYS 92 Ca 0.33 0.20 -0.02 0.00 -1.00 0.00 0.00 55.97 55.48 3fsw s LYS 92 Cb 0.01 0.27 -0.01 0.00 -2.06 0.00 0.00 37.83 36.05 3fsw s LYS 92 CO 0.17 -0.13 0.04 0.34 0.10 0.00 0.00 175.35 175.87 3fsw s ASP 93 N -0.57 0.11 0.01 0.03 2.15 -0.16 -4.99 116.67 113.25 3fsw s ASP 93 Ca -0.07 -0.27 0.08 0.00 0.43 0.00 0.00 52.55 52.73 3fsw s ASP 93 Cb -0.04 0.13 -0.02 0.00 -0.30 0.00 0.00 42.92 42.69 3fsw s ASP 93 CO 0.03 -0.25 -0.26 -0.44 -0.17 0.00 0.00 175.17 174.08 3fsw s SER 94 N -1.07 3.04 -0.01 -0.34 0.01 -1.26 -0.63 113.70 113.44 3fsw s SER 94 Ca -0.12 -0.52 0.03 0.00 1.31 0.00 0.00 55.95 56.66 3fsw s SER 94 Cb -0.07 -0.31 -0.01 0.00 0.21 0.00 0.00 66.02 65.85 3fsw s SER 94 CO -0.00 0.28 -0.12 0.54 0.41 0.00 0.00 173.24 174.36 3fsw s VAL 95 N -0.70 0.93 -0.04 3.43 0.11 -0.05 -4.93 120.40 119.15 3fsw s VAL 95 Ca 0.11 -0.49 0.06 0.00 -2.93 0.00 0.00 61.98 58.73 3fsw s VAL 95 Cb -0.10 -0.79 -0.02 0.00 -1.53 0.00 0.00 36.38 33.94 3fsw s VAL 95 CO 0.01 0.27 -0.23 -0.89 -3.33 0.00 0.00 175.10 170.92 3fsw s THR 96 N -0.16 2.27 0.14 5.04 2.01 -1.26 -0.23 115.64 123.46 3fsw s THR 96 Ca 0.02 -1.01 -0.00 0.00 0.31 0.00 0.00 61.69 61.01 3fsw s THR 96 Cb -0.06 -1.82 -0.04 0.00 0.01 0.00 0.00 72.50 70.59 3fsw s THR 96 CO -0.00 0.58 0.03 0.72 -0.69 0.00 0.00 174.62 175.25 3fsw s PHE 97 N -0.47 0.94 0.06 4.92 -0.71 -0.68 -4.97 117.98 117.07 3fsw s PHE 97 Ca 0.06 -1.15 -0.29 0.00 -1.04 0.00 0.00 56.93 54.51 3fsw s PHE 97 Cb -0.11 -0.54 -0.05 0.00 -1.21 0.00 0.00 43.02 41.11 3fsw s PHE 97 CO 0.01 -0.40 0.95 -0.51 -1.34 0.00 0.00 175.22 173.93 3fsw s ASP 98 N -3.08 7.41 0.59 1.98 -0.00 -1.26 -1.10 116.67 121.22 3fsw s ASP 98 Ca 0.22 1.70 0.38 0.00 -0.00 0.00 0.00 52.55 54.85 3fsw s ASP 98 Cb 0.07 -2.57 1.79 0.00 -0.00 0.00 0.00 42.92 42.22 3fsw s ASP 98 CO 0.01 -0.14 2.13 0.58 -0.00 0.00 0.00 175.17 177.75 3fsw h VAL 99 N 4.38 0.00 0.00 -1.27 2.07 -1.35 -2.33 116.25 117.75 3fsw h VAL 99 Ca -0.42 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 66.80 3fsw h VAL 99 Cb 1.21 1.27 -0.00 0.00 -1.52 0.00 0.00 31.29 32.26 3fsw h VAL 99 CO 0.73 0.00 -0.04 0.77 0.02 0.00 0.00 177.57 179.05 3fsw h SER 100 N 0.00 0.00 0.26 0.57 4.64 -1.87 -1.69 113.55 115.45 3fsw h SER 100 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 3fsw h SER 100 Cb 0.29 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.38 3fsw h SER 100 CO 0.00 0.04 -0.15 0.11 -0.87 0.00 0.00 176.83 175.96 3fsw h LYS 101 N 0.00 0.00 -6.02 4.77 6.56 -1.81 -3.42 116.57 116.65 3fsw h LYS 101 Ca -0.00 0.00 -0.56 0.00 -1.06 0.00 0.00 60.65 59.03 3fsw h LYS 101 Cb 0.32 0.00 -0.06 0.00 -0.57 0.00 0.00 32.23 31.92 3fsw h LYS 101 CO 0.01 0.15 0.12 -0.51 -2.06 0.00 0.00 179.45 177.16 3fsw s LEU 102 N -7.97 4.30 0.15 2.94 1.43 -0.64 -5.06 118.68 113.83 3fsw s LEU 102 Ca -0.03 1.18 0.05 0.00 -1.03 0.00 0.00 54.13 54.29 3fsw s LEU 102 Cb 0.14 -3.10 -0.04 0.00 0.03 0.00 0.00 46.19 43.23 3fsw s LEU 102 CO 0.64 -0.15 0.15 -0.54 0.23 0.00 0.00 176.35 176.68 3fsw s LYS 103 N 0.96 2.95 0.39 1.70 -0.14 -1.26 -5.03 119.74 119.31 3fsw s LYS 103 Ca 0.37 -0.82 -0.23 0.00 -1.36 0.00 0.00 55.97 53.93 3fsw s LYS 103 Cb -0.18 -2.69 -0.10 0.00 -1.68 0.00 0.00 37.83 33.18 3fsw s LYS 103 CO 0.18 0.50 0.96 -1.21 -0.76 0.00 0.00 175.35 175.02 3fsw s GLU 104 N -3.04 4.31 -1.03 1.68 0.41 -1.26 -3.57 118.70 116.21 3fsw s GLU 104 Ca 0.31 1.24 0.00 0.00 -0.41 0.00 0.00 54.97 56.11 3fsw s GLU 104 Cb -0.10 -2.42 0.00 0.00 -1.78 0.00 0.00 34.13 29.83 3fsw s GLU 104 CO 0.24 0.04 0.00 0.41 -0.49 0.00 0.00 175.26 175.45 3fsw n GLY 105 N -0.12 0.84 3.32 -1.39 0.00 -1.26 -5.02 105.19 101.56 3fsw n GLY 105 Ca 0.05 -0.53 -0.22 0.00 0.00 0.00 0.00 46.02 45.32 3fsw n GLY 105 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3fsw s GLU 106 N -3.31 1.23 -0.19 1.61 2.56 -1.23 -5.14 118.70 114.23 3fsw s GLU 106 Ca 0.00 -1.34 -0.03 0.00 0.00 0.00 0.00 54.97 53.59 3fsw s GLU 106 Cb 0.00 -1.33 -0.02 0.00 2.00 0.00 0.00 34.13 34.78 3fsw s GLU 106 CO 0.00 0.28 -0.05 -0.65 -0.56 0.00 0.00 175.26 174.28 3fsw s GLN 107 N -2.57 3.49 0.06 4.30 -1.52 -1.26 -4.97 119.66 117.18 3fsw s GLN 107 Ca 0.13 -0.59 0.08 0.00 -1.95 0.00 0.00 55.36 53.03 3fsw s GLN 107 Cb -0.07 -2.94 -0.03 0.00 -0.22 0.00 0.00 33.01 29.75 3fsw s GLN 107 CO 0.06 0.00 -0.21 0.71 -0.25 0.00 0.00 175.29 175.60 3fsw s TYR 108 N 0.97 2.48 -0.02 0.91 2.02 -1.24 -0.78 117.35 121.69 3fsw s TYR 108 Ca 0.00 -0.30 0.03 0.00 -0.37 0.00 0.00 57.07 56.42 3fsw s TYR 108 Cb -0.15 -1.41 -0.00 0.00 -0.40 0.00 0.00 41.96 40.00 3fsw s TYR 108 CO 0.01 0.25 -0.09 -1.64 -1.57 0.00 0.00 175.55 172.50 3fsw s MET 109 N -1.55 0.90 0.18 -0.62 -1.94 -0.05 -1.23 119.30 114.98 3fsw s MET 109 Ca 0.14 -0.33 0.06 0.00 -1.71 0.00 0.00 55.69 53.85 3fsw s MET 109 Cb -0.10 -0.85 -0.04 0.00 2.01 0.00 0.00 34.83 35.85 3fsw s MET 109 CO 0.05 0.16 0.09 -0.59 -0.01 0.00 0.00 175.02 174.72 3fsw s PHE 110 N -0.00 3.03 -0.09 -0.03 -0.12 -0.36 -1.65 117.98 118.76 3fsw s PHE 110 Ca 0.00 -0.07 -0.32 0.00 -0.05 0.00 0.00 56.93 56.49 3fsw s PHE 110 Cb -0.06 -1.45 0.12 0.00 -0.63 0.00 0.00 43.02 41.00 3fsw s PHE 110 CO 0.00 0.52 1.04 -0.59 -0.05 0.00 0.00 175.22 176.14 3fsw s PHE 111 N -1.79 -0.24 -0.09 3.49 -0.71 -0.75 -1.33 117.98 116.56 3fsw s PHE 111 Ca 0.30 0.15 -0.19 0.00 -1.04 0.00 0.00 56.93 56.15 3fsw s PHE 111 Cb -0.10 0.53 -0.04 0.00 -1.21 0.00 0.00 43.02 42.20 3fsw s PHE 111 CO 0.22 -0.39 0.50 0.00 -1.34 0.00 0.00 175.22 174.21 3fsw n ALA 113 N 3.46 3.15 -1.61 0.00 0.00 -1.26 -3.09 120.51 121.15 3fsw n ALA 113 Ca -0.07 -0.37 -0.42 0.00 0.00 0.00 0.00 53.44 52.58 3fsw n ALA 113 Cb 0.52 -1.16 0.01 0.00 0.00 0.00 0.00 19.45 18.82 3fsw n ALA 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fsw n ALA 114 N -0.90 0.18 -1.52 0.00 0.00 -1.26 -4.63 120.51 112.37 3fsw n ALA 114 Ca 0.11 0.24 -0.57 0.00 0.00 0.00 0.00 53.44 53.21 3fsw n ALA 114 Cb 0.34 -2.08 -0.09 0.00 0.00 0.00 0.00 19.45 17.62 3fsw n ALA 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fsw n ALA 115 N -0.44 0.15 -0.35 0.00 0.00 -1.26 -0.63 120.51 118.00 3fsw n ALA 115 Ca 0.09 0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.75 3fsw n ALA 115 Cb 0.39 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.59 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 7.07 0.00 0.15 0.00 0.00 -1.26 -4.89 120.51 121.57 3fsw n ALA 116 Ca 0.38 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.84 3fsw n ALA 116 Cb 0.09 0.00 0.14 0.00 0.00 0.00 0.00 19.45 19.69 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 -0.08 0.00 -0.00 -1.12 -3.31 115.15 110.63 3fsw h HIS 117 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.36 3fsw h HIS 117 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 27.41 3fsw h HIS 117 CO 0.00 0.54 0.03 0.00 -0.00 0.00 0.00 177.93 178.50 3fsw h ALA 118 N 1.46 1.90 -0.76 2.45 0.00 -1.71 0.14 119.26 122.73 3fsw h ALA 118 Ca -0.01 -0.03 0.14 0.00 0.00 0.00 0.00 54.91 55.02 3fsw h ALA 118 Cb 1.22 -0.04 -0.10 0.00 0.00 0.00 0.00 17.79 18.88 3fsw h ALA 118 CO 0.07 0.09 0.30 0.00 0.00 0.00 0.00 179.25 179.71 3fsw h ALA 119 N 1.92 1.08 0.01 0.00 0.00 -1.90 -2.98 119.26 117.39 3fsw h ALA 119 Ca 0.03 0.12 -0.36 0.00 0.00 0.00 0.00 54.91 54.70 3fsw h ALA 119 Cb 0.03 0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 3fsw h ALA 119 CO -0.00 -0.21 -2.22 0.00 0.00 0.00 0.00 179.25 176.81 3fsw n ALA 120 N -2.51 1.41 -3.42 0.00 0.00 -0.87 -4.83 120.51 110.29 3fsw n ALA 120 Ca 0.15 -1.08 -0.44 0.00 0.00 0.00 0.00 53.44 52.07 3fsw n ALA 120 Cb 0.42 -0.36 -0.03 0.00 0.00 0.00 0.00 19.45 19.49 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 -2.53 3.64 0.05 0.00 1.00 0.44 -4.75 119.30 117.14 3fsw s MET 121 Ca -0.16 -2.83 -0.27 0.00 0.00 0.00 0.00 55.69 52.43 3fsw s MET 121 Cb 0.07 -4.33 0.09 0.00 0.00 0.00 0.00 34.83 30.67 3fsw s MET 121 CO 0.77 -1.26 0.80 -1.59 0.00 0.00 0.00 175.02 173.74 3fsw s LYS 122 N -0.53 0.97 0.01 2.03 -2.85 -1.26 -1.65 119.74 116.47 3fsw s LYS 122 Ca 0.23 -0.36 -0.07 0.00 -1.00 0.00 0.00 55.97 54.76 3fsw s LYS 122 Cb -0.11 0.44 0.03 0.00 -2.06 0.00 0.00 37.83 36.13 3fsw s LYS 122 CO -0.08 -0.43 0.34 0.41 0.10 0.00 0.00 175.35 175.69 3fsw n GLY 123 N -0.29 0.72 3.86 0.59 0.00 -0.44 -4.70 105.19 104.93 3fsw n GLY 123 Ca -0.11 -0.93 -0.32 0.00 0.00 0.00 0.00 46.02 44.67 3fsw n GLY 123 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3fsw s THR 124 N -2.22 5.08 -0.09 2.61 -4.23 -0.94 -1.23 115.64 114.62 3fsw s THR 124 Ca 0.08 -0.45 0.02 0.00 -1.18 0.00 0.00 61.69 60.17 3fsw s THR 124 Cb -0.00 -3.43 0.01 0.00 1.34 0.00 0.00 72.50 70.42 3fsw s THR 124 CO 0.00 0.20 -0.16 -0.22 -0.54 0.00 0.00 174.62 173.90 3fsw s LEU 125 N -2.26 1.78 -0.02 4.79 0.20 -0.36 -0.53 118.68 122.27 3fsw s LEU 125 Ca 0.30 -0.41 -0.01 0.00 0.69 0.00 0.00 54.13 54.71 3fsw s LEU 125 Cb -0.13 -1.06 0.02 0.00 -0.43 0.00 0.00 46.19 44.60 3fsw s LEU 125 CO 0.23 0.06 0.04 -0.89 -0.29 0.00 0.00 176.35 175.49 3fsw s THR 126 N 0.70 -0.04 0.35 3.68 2.01 -0.82 -3.70 115.64 117.81 3fsw s THR 126 Ca -0.13 0.13 -0.27 0.00 0.31 0.00 0.00 61.69 61.73 3fsw s THR 126 Cb -0.16 -0.08 -0.09 0.00 0.01 0.00 0.00 72.50 72.18 3fsw s THR 126 CO 0.03 0.05 1.20 -0.76 -0.69 0.00 0.00 174.62 174.45 3fsw s LEU 127 N 0.67 4.36 0.00 4.42 1.43 -1.26 -1.38 118.68 126.93 3fsw s LEU 127 Ca -0.06 2.44 0.00 0.00 -1.03 0.00 0.00 54.13 55.49 3fsw s LEU 127 Cb -0.08 -3.80 0.00 0.00 0.03 0.00 0.00 46.19 42.34 3fsw s LEU 127 CO -0.02 -0.50 0.00 0.29 0.23 0.00 0.00 176.35 176.35