#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dsf s VAL 2 N 0.00 5.04 -0.19 2.12 1.01 -1.26 -4.98 120.40 122.14 1dsf s VAL 2 Ca 0.00 0.92 -0.16 0.00 0.00 0.00 0.00 61.98 62.74 1dsf s VAL 2 Cb 0.00 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 1dsf s VAL 2 CO 0.00 0.05 0.40 -0.69 0.00 0.00 0.00 175.10 174.86 1dsf s VAL 3 N 2.37 5.20 -0.22 2.92 1.01 -1.26 -4.77 120.40 125.65 1dsf s VAL 3 Ca 0.22 0.73 -0.10 0.00 0.00 0.00 0.00 61.98 62.84 1dsf s VAL 3 Cb -0.16 -3.74 -0.05 0.00 0.00 0.00 0.00 36.38 32.44 1dsf s VAL 3 CO 0.09 0.27 0.13 -0.04 0.00 0.00 0.00 175.10 175.55 1dsf s MET 4 N 1.18 4.04 -0.19 2.72 -1.94 -1.26 -0.58 119.30 123.28 1dsf s MET 4 Ca 0.20 -0.29 -0.01 0.00 -1.71 0.00 0.00 55.69 53.88 1dsf s MET 4 Cb -0.15 -3.45 -0.00 0.00 2.01 0.00 0.00 34.83 33.25 1dsf s MET 4 CO 0.08 0.12 -0.12 0.99 -0.01 0.00 0.00 175.02 176.08 1dsf s THR 5 N 0.86 2.84 -0.08 2.05 2.01 0.16 -4.49 115.64 119.00 1dsf s THR 5 Ca 0.07 -0.69 0.01 0.00 0.31 0.00 0.00 61.69 61.39 1dsf s THR 5 Cb -0.13 -2.24 -0.03 0.00 0.01 0.00 0.00 72.50 70.11 1dsf s THR 5 CO 0.03 0.48 -0.09 -1.10 -0.69 0.00 0.00 174.62 173.25 1dsf s GLN 6 N 1.16 2.82 -0.01 4.92 -0.21 -1.26 0.13 119.66 127.20 1dsf s GLN 6 Ca 0.01 -0.60 0.00 0.00 0.02 0.00 0.00 55.36 54.80 1dsf s GLN 6 Cb -0.14 -2.57 0.01 0.00 1.00 0.00 0.00 33.01 31.31 1dsf s GLN 6 CO -0.04 0.58 -0.01 0.95 -2.12 0.00 0.00 175.29 174.65 1dsf s THR 7 N -0.58 0.13 0.00 -0.19 -4.23 -0.99 -4.58 115.64 105.19 1dsf s THR 7 Ca 0.09 -0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.59 1dsf s THR 7 Cb -0.12 -0.16 0.00 0.00 1.34 0.00 0.00 72.50 73.57 1dsf s THR 7 CO 0.02 0.07 0.00 -0.81 -0.54 0.00 0.00 174.62 173.36 1dsf n PRO 8 N 3.43 0.80 -0.09 3.99 -0.04 -1.26 -2.16 135.00 139.67 1dsf n PRO 8 Ca -0.18 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.11 1dsf n PRO 8 Cb 0.56 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.90 1dsf n PRO 8 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1dsf h LEU 9 N 0.00 0.00 -8.60 1.53 6.46 -1.85 -3.42 115.31 109.44 1dsf h LEU 9 Ca 0.00 -0.74 -0.70 0.00 -0.12 0.00 0.00 57.88 56.33 1dsf h LEU 9 Cb 0.00 0.00 -0.30 0.00 -0.73 0.00 0.00 40.66 39.63 1dsf h LEU 9 CO 0.00 1.22 -0.87 -0.44 -0.62 0.00 0.00 178.44 177.72 1dsf s SER 10 N -6.50 3.18 -0.35 1.25 0.01 -1.26 -0.03 113.70 109.99 1dsf s SER 10 Ca -0.23 -0.45 0.00 0.00 1.31 0.00 0.00 55.95 56.58 1dsf s SER 10 Cb 0.01 -0.58 0.11 0.00 0.21 0.00 0.00 66.02 65.77 1dsf s SER 10 CO 0.63 0.29 0.15 -0.22 0.41 0.00 0.00 173.24 174.50 1dsf s LEU 11 N -0.46 2.23 0.10 2.44 0.20 0.77 -4.92 118.68 119.04 1dsf s LEU 11 Ca 0.05 -1.97 -0.30 0.00 0.69 0.00 0.00 54.13 52.60 1dsf s LEU 11 Cb -0.11 -0.86 -0.06 0.00 -0.43 0.00 0.00 46.19 44.72 1dsf s LEU 11 CO 0.01 -0.36 1.18 -2.16 -0.29 0.00 0.00 176.35 174.72 1dsf s PRO 12 N 1.21 4.47 0.11 0.98 0.04 -1.26 -1.18 135.00 139.37 1dsf s PRO 12 Ca 0.13 1.77 0.02 0.00 0.04 0.00 0.00 61.00 62.96 1dsf s PRO 12 Cb -0.20 -3.32 -0.04 0.00 0.04 0.00 0.00 34.50 30.98 1dsf s PRO 12 CO -0.15 -0.17 -0.05 0.54 0.04 0.00 0.00 177.00 177.21 1dsf s VAL 13 N 0.65 0.65 0.16 -0.36 0.11 0.12 -4.82 120.40 116.92 1dsf s VAL 13 Ca 0.56 -1.94 0.07 0.00 -2.93 0.00 0.00 61.98 57.74 1dsf s VAL 13 Cb -0.30 -1.77 -0.04 0.00 -1.53 0.00 0.00 36.38 32.74 1dsf s VAL 13 CO 0.31 -0.79 0.01 -0.44 -3.33 0.00 0.00 175.10 170.86 1dsf s SER 14 N -3.06 4.84 0.20 3.54 0.01 -1.26 -0.26 113.70 117.70 1dsf s SER 14 Ca 0.14 -0.35 -0.32 0.00 1.31 0.00 0.00 55.95 56.73 1dsf s SER 14 Cb 0.06 -1.06 -0.12 0.00 0.21 0.00 0.00 66.02 65.11 1dsf s SER 14 CO -0.03 0.10 1.73 0.18 0.41 0.00 0.00 173.24 175.64 1dsf n LEU 15 N -0.02 4.01 0.00 2.44 4.77 -1.26 -1.58 117.00 125.35 1dsf n LEU 15 Ca -0.10 1.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.94 1dsf n LEU 15 Cb 0.55 -1.57 0.00 0.00 -2.33 0.00 0.00 43.42 40.06 1dsf n LEU 15 CO 0.39 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.24 1dsf n GLY 16 N 3.99 2.08 3.73 -0.72 0.00 0.14 -4.93 105.19 109.48 1dsf n GLY 16 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 1dsf n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1dsf s ASP 17 N -1.44 4.03 -0.09 1.61 1.11 -0.62 -4.31 116.67 116.96 1dsf s ASP 17 Ca 0.00 2.06 -0.05 0.00 0.18 0.00 0.00 52.55 54.74 1dsf s ASP 17 Cb 0.00 -2.55 -0.04 0.00 1.07 0.00 0.00 42.92 41.40 1dsf s ASP 17 CO 0.00 -2.36 0.09 -1.10 1.18 0.00 0.00 175.17 172.98 1dsf s GLN 18 N -4.53 3.26 0.06 8.23 -0.21 -1.25 -1.45 119.66 123.76 1dsf s GLN 18 Ca 0.66 -0.26 -0.09 0.00 0.02 0.00 0.00 55.36 55.69 1dsf s GLN 18 Cb -0.21 -3.03 0.00 0.00 1.00 0.00 0.00 33.01 30.77 1dsf s GLN 18 CO 0.53 0.74 0.20 0.00 -2.12 0.00 0.00 175.29 174.64 1dsf s ALA 19 N -1.01 -0.34 -0.00 6.09 0.00 -0.47 -5.00 121.76 121.04 1dsf s ALA 19 Ca 0.16 -0.37 0.01 0.00 0.00 0.00 0.00 51.96 51.75 1dsf s ALA 19 Cb -0.12 0.35 -0.00 0.00 0.00 0.00 0.00 23.12 23.35 1dsf s ALA 19 CO 0.05 -0.41 -0.02 -1.54 0.00 0.00 0.00 175.76 173.84 1dsf s SER 20 N -2.34 0.24 -0.07 0.00 1.04 -1.26 -0.30 113.70 111.01 1dsf s SER 20 Ca -0.02 -0.03 0.04 0.00 0.48 0.00 0.00 55.95 56.42 1dsf s SER 20 Cb 0.01 -0.03 -0.02 0.00 0.10 0.00 0.00 66.02 66.08 1dsf s SER 20 CO -0.06 0.02 -0.18 -0.63 0.98 0.00 0.00 173.24 173.36 1dsf s ILE 21 N 0.01 2.66 0.03 -1.02 -1.09 1.00 -4.89 121.20 117.89 1dsf s ILE 21 Ca 0.00 -0.85 0.01 0.00 -2.23 0.00 0.00 60.65 57.59 1dsf s ILE 21 Cb -0.01 -2.03 -0.04 0.00 -1.58 0.00 0.00 42.46 38.79 1dsf s ILE 21 CO -0.00 0.57 0.05 -0.55 -1.23 0.00 0.00 174.94 173.78 1dsf s SER 22 N -0.27 5.43 -0.06 3.58 0.15 -0.92 -0.66 113.70 120.95 1dsf s SER 22 Ca 0.01 0.03 -0.03 0.00 0.70 0.00 0.00 55.95 56.67 1dsf s SER 22 Cb -0.13 -1.47 0.04 0.00 -1.71 0.00 0.00 66.02 62.75 1dsf s SER 22 CO 0.03 0.24 0.10 0.00 1.20 0.00 0.00 173.24 174.81 1dsf s ARG 24 N 2.17 2.37 0.09 0.00 3.52 0.12 -0.84 118.95 126.38 1dsf s ARG 24 Ca 0.04 -0.79 0.03 0.00 -0.13 0.00 0.00 55.73 54.87 1dsf s ARG 24 Cb -0.12 -2.25 -0.04 0.00 -1.56 0.00 0.00 34.95 30.98 1dsf s ARG 24 CO -0.04 0.59 0.13 0.45 -0.81 0.00 0.00 175.30 175.61 1dsf s SER 25 N -0.65 5.76 0.11 -2.12 0.15 0.53 0.40 113.70 117.88 1dsf s SER 25 Ca 0.10 0.05 0.26 0.00 0.70 0.00 0.00 55.95 57.06 1dsf s SER 25 Cb -0.11 -1.61 0.98 0.00 -1.71 0.00 0.00 66.02 63.57 1dsf s SER 25 CO 0.00 0.15 1.80 -1.54 1.20 0.00 0.00 173.24 174.86 1dsf n SER 26 N 0.28 0.40 -4.05 5.45 3.41 0.25 -4.83 113.62 114.53 1dsf n SER 26 Ca -0.08 0.55 -0.09 0.00 -0.26 0.00 0.00 58.87 59.00 1dsf n SER 26 Cb 0.52 -0.65 -0.09 0.00 -0.26 0.00 0.00 64.21 63.73 1dsf n SER 26 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1dsf s GLN 27 N -3.07 0.83 0.10 4.33 -0.21 -1.26 -4.92 119.66 115.45 1dsf s GLN 27 Ca 0.11 -1.24 -0.31 0.00 0.02 0.00 0.00 55.36 53.94 1dsf s GLN 27 Cb 0.14 0.27 -0.08 0.00 1.00 0.00 0.00 33.01 34.34 1dsf s GLN 27 CO 0.52 -0.23 1.40 1.21 -2.12 0.00 0.00 175.29 176.07 1dsf s ASN 27 N -2.96 6.82 0.00 5.90 3.84 -1.26 -4.65 114.94 122.62 1dsf s ASN 27 Ca 0.14 2.31 0.18 0.00 0.21 0.00 0.00 52.86 55.69 1dsf s ASN 27 Cb 0.07 -2.58 0.51 0.00 -0.55 0.00 0.00 41.25 38.69 1dsf s ASN 27 CO -0.05 -0.67 1.42 0.18 -2.79 0.00 0.00 177.10 175.18 1dsf n LEU 27 N 4.22 2.72 -4.63 3.21 4.77 -0.79 -4.85 117.00 121.65 1dsf n LEU 27 Ca 0.12 -1.30 -0.43 0.00 -0.03 0.00 0.00 56.01 54.37 1dsf n LEU 27 Cb 0.42 -0.29 -0.02 0.00 -2.33 0.00 0.00 43.42 41.20 1dsf n LEU 27 CO 0.59 0.65 1.09 -0.69 -1.33 0.00 0.00 177.39 177.70 1dsf s VAL 27 N -1.41 4.23 0.59 4.08 1.01 -1.26 -3.53 120.40 124.10 1dsf s VAL 27 Ca 0.35 1.40 -0.16 0.00 0.00 0.00 0.00 61.98 63.57 1dsf s VAL 27 Cb 0.19 -4.22 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 1dsf s VAL 27 CO 0.25 -0.48 1.07 -2.28 0.00 0.00 0.00 175.10 173.67 1dsf s HIS 27 N 4.18 2.90 0.52 5.22 2.46 0.16 -4.92 115.29 125.80 1dsf s HIS 27 Ca 0.54 1.53 0.34 0.00 0.47 0.00 0.00 55.06 57.93 1dsf s HIS 27 Cb -0.16 -3.06 1.85 0.00 -0.13 0.00 0.00 32.58 31.08 1dsf s HIS 27 CO 0.21 -1.22 2.03 0.77 -2.47 0.00 0.00 174.74 174.06 1dsf h SER 27 N 0.54 0.00 -0.06 9.88 0.02 -1.94 0.35 113.55 122.34 1dsf h SER 27 Ca -0.47 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 1dsf h SER 27 Cb 1.23 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.77 1dsf h SER 27 CO 0.57 0.00 0.00 -0.90 -1.14 0.00 0.00 176.83 175.36 1dsf n ASP 28 N -2.83 0.84 0.00 3.07 5.68 -1.26 -4.92 116.55 117.14 1dsf n ASP 28 Ca -0.02 -1.46 0.00 0.00 -0.50 0.00 0.00 54.79 52.81 1dsf n ASP 28 Cb 0.21 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.15 1dsf n ASP 28 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1dsf n GLY 29 N 1.01 0.72 3.77 6.12 0.00 0.12 -5.05 105.19 111.89 1dsf n GLY 29 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 1dsf n GLY 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dsf s LYS 30 N -0.30 2.82 -0.33 1.61 1.02 -1.25 -4.85 119.74 118.47 1dsf s LYS 30 Ca 0.00 -0.81 -0.05 0.00 0.02 0.00 0.00 55.97 55.14 1dsf s LYS 30 Cb 0.00 -2.65 0.05 0.00 -0.52 0.00 0.00 37.83 34.71 1dsf s LYS 30 CO 0.00 0.52 0.07 0.99 -0.92 0.00 0.00 175.35 176.02 1dsf s THR 31 N -1.55 3.47 -1.28 2.17 2.01 -1.26 0.38 115.64 119.57 1dsf s THR 31 Ca 0.29 -1.28 -0.07 0.00 0.31 0.00 0.00 61.69 60.95 1dsf s THR 31 Cb -0.11 -3.00 0.15 0.00 0.01 0.00 0.00 72.50 69.56 1dsf s THR 31 CO 0.22 -0.18 2.13 -1.22 -0.69 0.00 0.00 174.62 174.87 1dsf n TYR 32 N 4.73 2.70 -4.39 4.92 4.01 -1.23 -4.26 117.16 123.64 1dsf n TYR 32 Ca -0.12 -2.79 -0.34 0.00 -0.16 0.00 0.00 57.90 54.50 1dsf n TYR 32 Cb 0.44 -1.82 -0.13 0.00 -0.31 0.00 0.00 39.34 37.52 1dsf n TYR 32 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1dsf s LEU 33 N -1.48 3.08 0.21 7.72 2.96 -1.26 -0.30 118.68 129.61 1dsf s LEU 33 Ca 0.47 -0.22 0.03 0.00 -0.22 0.00 0.00 54.13 54.19 1dsf s LEU 33 Cb 0.14 -1.74 -0.05 0.00 0.50 0.00 0.00 46.19 45.04 1dsf s LEU 33 CO -0.05 0.13 -0.01 -1.00 -1.32 0.00 0.00 176.35 174.11 1dsf s HIS 34 N 0.57 1.44 -0.04 5.38 3.76 0.20 0.02 115.29 126.62 1dsf s HIS 34 Ca -0.04 -0.94 0.03 0.00 -0.15 0.00 0.00 55.06 53.95 1dsf s HIS 34 Cb -0.15 -0.82 0.01 0.00 1.11 0.00 0.00 32.58 32.73 1dsf s HIS 34 CO 0.03 -0.08 -0.11 -1.58 -0.85 0.00 0.00 174.74 172.15 1dsf s TRP 35 N -3.49 1.19 0.07 1.40 0.52 0.14 0.07 118.94 118.85 1dsf s TRP 35 Ca 0.27 -0.36 0.09 0.00 0.02 0.00 0.00 56.10 56.11 1dsf s TRP 35 Cb 0.06 -0.87 -0.03 0.00 -1.15 0.00 0.00 33.47 31.48 1dsf s TRP 35 CO 0.07 -0.17 -0.23 -0.06 0.02 0.00 0.00 176.95 176.57 1dsf s PHE 36 N 0.40 2.02 -0.11 -1.98 0.40 -0.24 -0.62 117.98 117.84 1dsf s PHE 36 Ca -0.08 -0.39 0.01 0.00 -0.60 0.00 0.00 56.93 55.87 1dsf s PHE 36 Cb -0.12 -1.16 -0.02 0.00 0.51 0.00 0.00 43.02 42.24 1dsf s PHE 36 CO 0.02 0.17 -0.15 -1.17 0.70 0.00 0.00 175.22 174.79 1dsf s LEU 37 N -1.53 2.64 -0.43 -0.37 0.20 0.15 -1.65 118.68 117.69 1dsf s LEU 37 Ca 0.09 -0.33 0.04 0.00 0.69 0.00 0.00 54.13 54.62 1dsf s LEU 37 Cb -0.10 -1.57 0.11 0.00 -0.43 0.00 0.00 46.19 44.21 1dsf s LEU 37 CO 0.03 0.20 0.15 -1.58 -0.29 0.00 0.00 176.35 174.87 1dsf s GLN 38 N 0.12 1.73 0.76 1.98 0.74 0.42 0.37 119.66 125.78 1dsf s GLN 38 Ca -0.07 -2.23 -0.13 0.00 0.05 0.00 0.00 55.36 52.98 1dsf s GLN 38 Cb -0.15 -3.27 0.06 0.00 1.10 0.00 0.00 33.01 30.74 1dsf s GLN 38 CO 0.05 -1.02 1.15 0.15 -0.55 0.00 0.00 175.29 175.07 1dsf s LYS 39 N 0.34 2.07 -0.05 1.67 1.02 -1.26 -0.97 119.74 122.56 1dsf s LYS 39 Ca 0.14 1.53 -0.35 0.00 0.02 0.00 0.00 55.97 57.31 1dsf s LYS 39 Cb -0.22 -1.85 -0.13 0.00 -0.52 0.00 0.00 37.83 35.11 1dsf s LYS 39 CO -0.04 -1.84 1.77 -2.30 -0.92 0.00 0.00 175.35 172.02 1dsf n PRO 40 N -3.11 1.99 -0.98 -1.68 -0.02 -1.26 -0.92 135.00 129.02 1dsf n PRO 40 Ca 0.12 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 1dsf n PRO 40 Cb 0.51 -2.52 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 1dsf n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1dsf n GLY 41 N 4.08 0.77 1.19 -1.23 0.00 -1.26 -5.01 105.19 103.72 1dsf n GLY 41 Ca 0.22 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.16 1dsf n GLY 41 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1dsf n GLN 42 N -2.25 1.11 -4.09 1.61 1.13 -0.10 -5.14 117.38 109.66 1dsf n GLN 42 Ca 0.00 -1.03 -0.22 0.00 -1.94 0.00 0.00 57.00 53.81 1dsf n GLN 42 Cb 0.01 0.05 -0.04 0.00 0.11 0.00 0.00 30.24 30.37 1dsf n GLN 42 CO 0.00 0.00 0.00 -1.12 -1.44 0.00 0.00 177.06 174.50 1dsf s SER 43 N -2.04 5.66 0.90 1.08 0.01 -1.26 -4.76 113.70 113.29 1dsf s SER 43 Ca 0.13 -0.19 -0.11 0.00 1.31 0.00 0.00 55.95 57.09 1dsf s SER 43 Cb -0.01 -1.48 0.13 0.00 0.21 0.00 0.00 66.02 64.87 1dsf s SER 43 CO 0.08 -0.03 1.13 -2.65 0.41 0.00 0.00 173.24 172.17 1dsf n PRO 44 N -1.15 -0.34 -3.95 12.44 -0.02 -1.26 -4.51 135.00 136.20 1dsf n PRO 44 Ca -0.08 -0.03 -0.14 0.00 -2.02 0.00 0.00 63.50 61.23 1dsf n PRO 44 Cb 0.57 -2.37 -0.14 0.00 -0.02 0.00 0.00 33.50 31.54 1dsf n PRO 44 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1dsf s THR 45 N -2.53 0.13 0.12 3.45 2.01 0.16 -4.93 115.64 114.05 1dsf s THR 45 Ca 0.68 -0.04 -0.31 0.00 0.31 0.00 0.00 61.69 62.33 1dsf s THR 45 Cb -0.24 -0.14 -0.08 0.00 0.01 0.00 0.00 72.50 72.05 1dsf s THR 45 CO 0.57 0.05 1.45 -0.22 -0.69 0.00 0.00 174.62 175.78 1dsf s LEU 46 N 0.15 4.37 -0.11 4.42 2.96 -1.26 0.31 118.68 129.51 1dsf s LEU 46 Ca -0.01 2.39 -0.07 0.00 -0.22 0.00 0.00 54.13 56.22 1dsf s LEU 46 Cb -0.03 -3.59 -0.05 0.00 0.50 0.00 0.00 46.19 43.02 1dsf s LEU 46 CO -0.00 -0.71 -0.17 -0.11 -1.32 0.00 0.00 176.35 174.03 1dsf n LEU 47 N 4.14 1.08 -3.78 -0.68 7.94 0.20 -4.74 117.00 121.17 1dsf n LEU 47 Ca 0.12 0.18 -0.14 0.00 -1.11 0.00 0.00 56.01 55.06 1dsf n LEU 47 Cb 0.41 -0.43 -0.15 0.00 0.53 0.00 0.00 43.42 43.78 1dsf n LEU 47 CO 0.59 0.09 -0.32 -0.63 -1.11 0.00 0.00 177.39 176.02 1dsf s ILE 48 N -2.29 -0.05 0.09 1.96 1.01 -1.02 -1.69 121.20 119.22 1dsf s ILE 48 Ca -0.18 0.18 0.08 0.00 0.00 0.00 0.00 60.65 60.74 1dsf s ILE 48 Cb 0.06 -0.11 -0.04 0.00 0.01 0.00 0.00 42.46 42.38 1dsf s ILE 48 CO 0.23 0.07 -0.16 -0.72 0.00 0.00 0.00 174.94 174.36 1dsf s TYR 49 N 0.96 2.58 -1.28 3.97 1.13 0.14 -0.69 117.35 124.17 1dsf s TYR 49 Ca -0.08 -0.24 -0.04 0.00 -1.41 0.00 0.00 57.07 55.31 1dsf s TYR 49 Cb -0.11 -1.39 -0.01 0.00 -1.10 0.00 0.00 41.96 39.35 1dsf s TYR 49 CO -0.03 0.36 0.68 1.63 -2.51 0.00 0.00 175.55 175.68 1dsf n LYS 50 N 0.97 -3.90 0.00 -3.49 5.02 -0.85 -1.75 118.16 114.16 1dsf n LYS 50 Ca -0.15 0.57 0.00 0.00 -2.02 0.00 0.00 58.31 56.71 1dsf n LYS 50 Cb 0.52 -4.94 0.00 0.00 -0.02 0.00 0.00 35.03 30.60 1dsf n LYS 50 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1dsf n VAL 51 N -4.22 0.00 -0.68 -0.18 0.31 0.10 -4.23 118.33 109.44 1dsf n VAL 51 Ca -0.26 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.07 1dsf n VAL 51 Cb 0.66 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.59 1dsf n VAL 51 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1dsf n SER 52 N 3.03 0.45 -4.62 4.52 3.41 -1.25 -3.73 113.62 115.43 1dsf n SER 52 Ca 0.00 -1.13 -0.41 0.00 -0.26 0.00 0.00 58.87 57.07 1dsf n SER 52 Cb 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 1dsf n SER 52 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1dsf s ASN 53 N -0.13 6.63 0.13 4.04 0.01 -0.72 -4.66 114.94 120.24 1dsf s ASN 53 Ca 0.00 0.72 -0.30 0.00 -0.71 0.00 0.00 52.86 52.57 1dsf s ASN 53 Cb 0.00 -2.37 -0.06 0.00 0.41 0.00 0.00 41.25 39.23 1dsf s ASN 53 CO 0.00 -0.46 0.95 -0.13 -1.51 0.00 0.00 177.10 175.95 1dsf s ARG 54 N 2.67 4.71 0.66 -0.60 0.52 -1.26 0.26 118.95 125.91 1dsf s ARG 54 Ca 0.29 1.45 -0.11 0.00 -0.52 0.00 0.00 55.73 56.83 1dsf s ARG 54 Cb -0.15 -3.36 -0.01 0.00 0.52 0.00 0.00 34.95 31.94 1dsf s ARG 54 CO 0.09 0.25 1.05 0.12 0.02 0.00 0.00 175.30 176.84 1dsf s PHE 55 N -0.16 3.25 0.15 -0.53 5.36 -0.68 -4.89 117.98 120.49 1dsf s PHE 55 Ca 0.46 1.39 -0.34 0.00 -0.96 0.00 0.00 56.93 57.49 1dsf s PHE 55 Cb -0.24 -2.84 -0.15 0.00 -0.34 0.00 0.00 43.02 39.45 1dsf s PHE 55 CO 0.30 -1.05 1.29 -1.13 -1.46 0.00 0.00 175.22 173.17 1dsf n SER 56 N -2.90 1.80 0.00 6.13 3.41 -1.26 -1.40 113.62 119.41 1dsf n SER 56 Ca 0.07 1.13 0.00 0.00 -0.26 0.00 0.00 58.87 59.81 1dsf n SER 56 Cb 0.54 -1.26 0.00 0.00 -0.26 0.00 0.00 64.21 63.23 1dsf n SER 56 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1dsf n GLY 57 N 2.32 1.24 3.65 5.00 0.00 -1.26 -5.02 105.19 111.12 1dsf n GLY 57 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1dsf n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1dsf s VAL 58 N -3.43 4.89 0.78 1.61 1.01 -0.49 -5.03 120.40 119.73 1dsf s VAL 58 Ca 0.00 1.48 -0.14 0.00 0.00 0.00 0.00 61.98 63.32 1dsf s VAL 58 Cb 0.00 -4.07 0.07 0.00 0.00 0.00 0.00 36.38 32.37 1dsf s VAL 58 CO 0.00 -0.01 1.22 -2.84 0.00 0.00 0.00 175.10 173.48 1dsf s PRO 59 N 2.47 1.79 0.00 2.72 0.02 -1.26 -4.88 135.00 135.87 1dsf s PRO 59 Ca 0.34 1.81 0.08 0.00 0.02 0.00 0.00 61.00 63.25 1dsf s PRO 59 Cb -0.16 -1.79 0.50 0.00 0.02 0.00 0.00 34.50 33.07 1dsf s PRO 59 CO 0.09 -2.11 1.15 -0.40 -0.33 0.00 0.00 177.00 175.40 1dsf n ASP 60 N -3.05 0.00 0.11 2.53 5.68 -1.26 -2.67 116.55 117.88 1dsf n ASP 60 Ca 0.14 -1.32 0.12 0.00 -0.50 0.00 0.00 54.79 53.23 1dsf n ASP 60 Cb 0.50 0.00 0.45 0.00 -1.14 0.00 0.00 41.12 40.94 1dsf n ASP 60 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1dsf n ARG 61 N -0.66 0.20 -3.67 0.11 1.74 -1.26 -4.63 116.66 108.48 1dsf n ARG 61 Ca 0.06 0.31 -0.37 0.00 -0.77 0.00 0.00 57.85 57.09 1dsf n ARG 61 Cb 0.03 -1.81 -0.10 0.00 -1.02 0.00 0.00 32.46 29.56 1dsf n ARG 61 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1dsf s PHE 62 N -3.20 3.29 -0.02 -1.55 0.08 -1.09 -0.00 117.98 115.48 1dsf s PHE 62 Ca 0.07 0.17 -0.00 0.00 0.12 0.00 0.00 56.93 57.29 1dsf s PHE 62 Cb 0.11 -2.27 0.02 0.00 -0.57 0.00 0.00 43.02 40.31 1dsf s PHE 62 CO 0.47 0.02 0.03 -1.54 -0.10 0.00 0.00 175.22 174.10 1dsf s SER 63 N 1.15 0.04 0.12 1.36 1.04 -0.41 -4.96 113.70 112.04 1dsf s SER 63 Ca 0.07 0.05 0.06 0.00 0.48 0.00 0.00 55.95 56.61 1dsf s SER 63 Cb -0.14 -0.03 -0.04 0.00 0.10 0.00 0.00 66.02 65.91 1dsf s SER 63 CO 0.05 -0.10 -0.01 -0.83 0.98 0.00 0.00 173.24 173.34 1dsf s GLY 64 N 0.80 1.83 0.35 7.32 0.00 -1.26 0.28 107.32 116.65 1dsf s GLY 64 Ca -0.07 -1.22 -0.08 0.00 0.00 0.00 0.00 44.72 43.36 1dsf s GLY 64 CO -0.02 -1.21 0.59 -1.35 0.00 0.00 0.00 173.10 171.11 1dsf s SER 65 N -2.53 0.54 0.00 1.64 1.04 -0.28 -4.40 113.70 109.72 1dsf s SER 65 Ca 0.26 -1.33 0.00 0.00 0.48 0.00 0.00 55.95 55.36 1dsf s SER 65 Cb -0.11 0.73 0.00 0.00 0.10 0.00 0.00 66.02 66.74 1dsf s SER 65 CO 0.18 -1.43 0.00 0.61 0.98 0.00 0.00 173.24 173.58 1dsf n GLY 66 N -0.55 2.10 3.55 7.32 0.00 -1.26 -1.78 105.19 114.58 1dsf n GLY 66 Ca -0.03 -2.13 -0.09 0.00 0.00 0.00 0.00 46.02 43.77 1dsf n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dsf s SER 67 N 0.00 -0.35 0.31 1.61 1.04 -0.52 -4.96 113.70 110.83 1dsf s SER 67 Ca 0.00 0.24 0.00 0.00 0.48 0.00 0.00 55.95 56.67 1dsf s SER 67 Cb 0.00 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.44 1dsf s SER 67 CO 0.00 -0.43 0.00 0.61 0.98 0.00 0.00 173.24 174.40 1dsf n GLY 68 N 0.34 0.89 0.00 7.32 0.00 -1.26 -2.32 105.19 110.15 1dsf n GLY 68 Ca -0.09 0.43 0.00 0.00 0.00 0.00 0.00 46.02 46.36 1dsf n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1dsf n THR 69 N 0.00 0.00 -3.95 2.61 -2.24 -1.26 -1.88 114.28 107.56 1dsf n THR 69 Ca 0.00 -0.39 -0.35 0.00 -2.27 0.00 0.00 64.05 61.04 1dsf n THR 69 Cb 0.00 1.04 -0.14 0.00 -2.10 0.00 0.00 70.33 69.12 1dsf n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1dsf s ASP 70 N -0.65 4.08 0.10 3.42 1.11 -0.98 -0.35 116.67 123.40 1dsf s ASP 70 Ca 0.00 -0.52 0.05 0.00 0.18 0.00 0.00 52.55 52.27 1dsf s ASP 70 Cb 0.00 -1.68 -0.03 0.00 1.07 0.00 0.00 42.92 42.28 1dsf s ASP 70 CO 0.00 -0.03 -0.14 -0.36 1.18 0.00 0.00 175.17 175.82 1dsf s PHE 71 N 1.42 1.32 -0.05 4.23 0.40 -0.02 -1.44 117.98 123.84 1dsf s PHE 71 Ca 0.05 -0.54 -0.04 0.00 -0.60 0.00 0.00 56.93 55.80 1dsf s PHE 71 Cb -0.14 -0.71 0.02 0.00 0.51 0.00 0.00 43.02 42.70 1dsf s PHE 71 CO -0.05 0.10 0.13 -1.50 0.70 0.00 0.00 175.22 174.60 1dsf s ILE 72 N -1.91 -0.01 -0.17 0.64 -1.16 -0.73 -0.49 121.20 117.36 1dsf s ILE 72 Ca 0.05 0.04 -0.06 0.00 -0.51 0.00 0.00 60.65 60.17 1dsf s ILE 72 Cb -0.06 -0.19 -0.04 0.00 0.61 0.00 0.00 42.46 42.78 1dsf s ILE 72 CO 0.02 0.02 0.03 -0.22 -2.81 0.00 0.00 174.94 171.98 1dsf s LEU 73 N 0.30 3.63 -0.09 8.50 2.96 0.17 -1.12 118.68 133.02 1dsf s LEU 73 Ca -0.02 0.01 0.02 0.00 -0.22 0.00 0.00 54.13 53.92 1dsf s LEU 73 Cb -0.03 -1.90 -0.02 0.00 0.50 0.00 0.00 46.19 44.74 1dsf s LEU 73 CO -0.01 0.17 -0.16 -0.75 -1.32 0.00 0.00 176.35 174.28 1dsf s LYS 74 N 0.38 2.94 -0.21 1.98 2.20 0.14 -0.00 119.74 127.17 1dsf s LYS 74 Ca 0.01 -0.74 -0.02 0.00 -0.36 0.00 0.00 55.97 54.86 1dsf s LYS 74 Cb -0.13 -2.45 0.00 0.00 -1.51 0.00 0.00 37.83 33.75 1dsf s LYS 74 CO 0.01 0.37 -0.09 0.42 -0.36 0.00 0.00 175.35 175.70 1dsf s ILE 75 N -0.09 2.90 -0.01 5.43 1.01 0.59 -1.29 121.20 129.76 1dsf s ILE 75 Ca -0.03 -0.70 -0.22 0.00 0.00 0.00 0.00 60.65 59.71 1dsf s ILE 75 Cb -0.14 -2.32 -0.12 0.00 0.01 0.00 0.00 42.46 39.89 1dsf s ILE 75 CO 0.04 0.43 0.91 0.28 0.00 0.00 0.00 174.94 176.60 1dsf h SER 76 N 8.05 -0.66 -3.14 3.58 0.02 -0.72 -1.24 113.55 119.45 1dsf h SER 76 Ca -0.42 0.02 -0.60 0.00 -0.84 0.00 0.00 61.79 59.96 1dsf h SER 76 Cb 1.15 0.17 -0.40 0.00 0.14 0.00 0.00 62.40 63.46 1dsf h SER 76 CO 0.61 -0.27 -0.78 -0.13 -1.14 0.00 0.00 176.83 175.13 1dsf s ARG 77 N -4.09 0.95 0.14 3.45 0.52 -1.25 -3.89 118.95 114.78 1dsf s ARG 77 Ca -0.11 -1.64 -0.34 0.00 -0.52 0.00 0.00 55.73 53.11 1dsf s ARG 77 Cb 0.01 -1.91 -0.15 0.00 0.52 0.00 0.00 34.95 33.41 1dsf s ARG 77 CO 0.34 -1.16 1.37 0.28 0.02 0.00 0.00 175.30 176.16 1dsf n VAL 78 N 3.89 0.31 -4.37 3.52 0.31 -0.53 -4.60 118.33 116.86 1dsf n VAL 78 Ca 0.08 -0.08 -0.21 0.00 -0.01 0.00 0.00 64.34 64.12 1dsf n VAL 78 Cb 0.36 -1.10 -0.11 0.00 -0.91 0.00 0.00 33.84 32.09 1dsf n VAL 78 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1dsf s GLU 79 N 0.30 1.39 0.45 5.55 2.02 -1.26 0.25 118.70 127.40 1dsf s GLU 79 Ca 0.78 -1.55 0.21 0.00 0.02 0.00 0.00 54.97 54.43 1dsf s GLU 79 Cb -0.82 -1.36 1.19 0.00 0.10 0.00 0.00 34.13 33.24 1dsf s GLU 79 CO 0.46 0.26 1.87 0.00 0.02 0.00 0.00 175.26 177.87 1dsf h ALA 80 N 2.79 2.37 0.00 5.21 0.00 -1.99 -0.92 119.26 126.72 1dsf h ALA 80 Ca -0.40 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1dsf h ALA 80 Cb 1.22 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1dsf h ALA 80 CO 0.57 -0.64 0.00 -0.85 0.00 0.00 0.00 179.25 178.33 1dsf n GLU 81 N -4.45 0.10 0.11 0.00 0.00 -1.26 -2.28 120.64 112.86 1dsf n GLU 81 Ca 0.18 0.19 0.12 0.00 0.00 0.00 0.00 57.16 57.65 1dsf n GLU 81 Cb 0.75 -1.50 0.13 0.00 0.00 0.00 0.00 31.44 30.82 1dsf n GLU 81 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 1dsf h ASP 82 N 0.00 0.00 -3.59 -1.84 3.32 -1.58 -3.47 116.42 109.26 1dsf h ASP 82 Ca 0.00 -0.09 -0.56 0.00 0.02 0.00 0.00 57.03 56.41 1dsf h ASP 82 Cb 0.21 0.00 0.11 0.00 0.22 0.00 0.00 39.33 39.87 1dsf h ASP 82 CO 0.00 0.04 0.62 0.18 -1.72 0.00 0.00 179.24 178.37 1dsf n LEU 83 N -2.49 4.11 0.00 1.55 4.77 -0.97 -4.83 117.00 119.15 1dsf n LEU 83 Ca 0.02 1.22 0.00 0.00 -0.03 0.00 0.00 56.01 57.22 1dsf n LEU 83 Cb 0.49 -1.55 0.00 0.00 -2.33 0.00 0.00 43.42 40.04 1dsf n LEU 83 CO 0.37 -0.20 0.00 0.61 -1.33 0.00 0.00 177.39 176.83 1dsf n GLY 84 N 0.63 0.29 3.30 -0.72 0.00 -1.22 -4.29 105.19 103.18 1dsf n GLY 84 Ca 0.03 -1.52 -0.34 0.00 0.00 0.00 0.00 46.02 44.19 1dsf n GLY 84 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1dsf s VAL 85 N -2.99 2.97 -0.16 1.61 1.01 -0.15 -1.30 120.40 121.40 1dsf s VAL 85 Ca 0.00 -0.66 -0.10 0.00 0.00 0.00 0.00 61.98 61.22 1dsf s VAL 85 Cb 0.00 -2.29 -0.05 0.00 0.00 0.00 0.00 36.38 34.05 1dsf s VAL 85 CO 0.00 0.49 0.19 -0.31 0.00 0.00 0.00 175.10 175.47 1dsf s TYR 86 N 0.92 3.49 -0.02 5.22 1.51 -0.46 -0.44 117.35 127.59 1dsf s TYR 86 Ca -0.02 0.49 0.05 0.00 -1.01 0.00 0.00 57.07 56.58 1dsf s TYR 86 Cb -0.15 -2.15 -0.01 0.00 -0.11 0.00 0.00 41.96 39.54 1dsf s TYR 86 CO -0.01 0.42 -0.18 -0.06 -1.11 0.00 0.00 175.55 174.62 1dsf s PHE 87 N -0.08 1.59 0.12 2.71 0.40 -0.66 -0.42 117.98 121.64 1dsf s PHE 87 Ca 0.13 -0.32 0.02 0.00 -0.60 0.00 0.00 56.93 56.16 1dsf s PHE 87 Cb -0.12 -1.03 -0.04 0.00 0.51 0.00 0.00 43.02 42.34 1dsf s PHE 87 CO 0.02 -0.04 0.23 0.00 0.70 0.00 0.00 175.22 176.13 1dsf s SER 89 N -2.94 -0.11 0.04 0.00 0.15 0.11 -1.17 113.70 109.78 1dsf s SER 89 Ca 0.34 0.12 0.08 0.00 0.70 0.00 0.00 55.95 57.19 1dsf s SER 89 Cb -0.12 0.32 -0.02 0.00 -1.71 0.00 0.00 66.02 64.49 1dsf s SER 89 CO 0.27 -0.24 -0.22 0.00 1.20 0.00 0.00 173.24 174.26 1dsf s GLN 90 N -0.67 1.53 -0.06 5.44 1.03 -0.72 0.63 119.66 126.84 1dsf s GLN 90 Ca -0.08 -0.96 0.14 0.00 0.04 0.00 0.00 55.36 54.51 1dsf s GLN 90 Cb -0.04 -1.64 0.28 0.00 0.03 0.00 0.00 33.01 31.64 1dsf s GLN 90 CO 0.01 0.42 1.13 -1.13 -2.54 0.00 0.00 175.29 173.18 1dsf n SER 91 N 1.92 1.05 0.09 12.60 3.41 0.59 -3.04 113.62 130.24 1dsf n SER 91 Ca -0.17 -2.54 -0.14 0.00 -0.26 0.00 0.00 58.87 55.76 1dsf n SER 91 Cb 0.53 -0.33 -0.14 0.00 -0.26 0.00 0.00 64.21 64.01 1dsf n SER 91 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1dsf h THR 92 N 4.73 1.49 -2.96 6.66 2.02 -1.87 -3.47 112.91 119.52 1dsf h THR 92 Ca -0.08 -3.10 -0.63 0.00 0.77 0.00 0.00 66.41 63.36 1dsf h THR 92 Cb 1.43 2.89 -0.16 0.00 -1.74 0.00 0.00 68.15 70.58 1dsf h THR 92 CO 0.03 0.89 -0.77 -1.00 0.37 0.00 0.00 175.52 175.05 1dsf s HIS 93 N -2.66 2.44 -0.13 3.16 3.76 -1.26 -4.95 115.29 115.64 1dsf s HIS 93 Ca -0.04 -0.30 0.00 0.00 -0.15 0.00 0.00 55.06 54.58 1dsf s HIS 93 Cb 0.08 -1.18 -0.01 0.00 1.11 0.00 0.00 32.58 32.57 1dsf s HIS 93 CO 0.87 0.54 -0.14 0.08 -0.85 0.00 0.00 174.74 175.23 1dsf s VAL 94 N -1.82 2.97 0.74 -0.90 1.01 -1.26 -3.11 120.40 118.03 1dsf s VAL 94 Ca 0.24 -0.69 -0.14 0.00 0.00 0.00 0.00 61.98 61.39 1dsf s VAL 94 Cb -0.08 -2.24 0.04 0.00 0.00 0.00 0.00 36.38 34.10 1dsf s VAL 94 CO 0.13 0.53 1.17 -2.16 0.00 0.00 0.00 175.10 174.77 1dsf s PRO 95 N 0.38 2.17 0.05 2.72 0.04 -1.26 -4.96 135.00 134.13 1dsf s PRO 95 Ca -0.11 1.63 -0.30 0.00 0.04 0.00 0.00 61.00 62.26 1dsf s PRO 95 Cb -0.16 -1.85 -0.05 0.00 0.04 0.00 0.00 34.50 32.48 1dsf s PRO 95 CO 0.06 -1.79 1.06 -0.51 0.04 0.00 0.00 177.00 175.86 1dsf s LEU 96 N -5.28 4.40 0.22 -3.56 1.02 -1.18 -4.74 118.68 109.56 1dsf s LEU 96 Ca 0.71 1.83 0.10 0.00 0.02 0.00 0.00 54.13 56.80 1dsf s LEU 96 Cb -0.26 -3.58 -0.05 0.00 0.02 0.00 0.00 46.19 42.32 1dsf s LEU 96 CO 0.46 -0.30 -0.18 0.42 0.02 0.00 0.00 176.35 176.76 1dsf s THR 97 N 0.79 2.11 0.18 5.49 -4.23 -1.17 -5.02 115.64 113.80 1dsf s THR 97 Ca 0.53 -2.21 0.07 0.00 -1.18 0.00 0.00 61.69 58.90 1dsf s THR 97 Cb -0.25 -2.11 -0.05 0.00 1.34 0.00 0.00 72.50 71.43 1dsf s THR 97 CO 0.29 -0.41 -0.13 -0.36 -0.54 0.00 0.00 174.62 173.48 1dsf s PHE 98 N -2.45 1.54 0.61 3.99 0.40 -1.26 -1.75 117.98 119.06 1dsf s PHE 98 Ca 0.24 -0.63 -0.03 0.00 -0.60 0.00 0.00 56.93 55.91 1dsf s PHE 98 Cb -0.04 -0.74 0.04 0.00 0.51 0.00 0.00 43.02 42.78 1dsf s PHE 98 CO 0.10 0.25 0.88 0.20 0.70 0.00 0.00 175.22 177.36 1dsf s GLY 99 N -3.18 1.71 -0.02 4.36 0.00 -0.32 -4.47 107.32 105.40 1dsf s GLY 99 Ca 0.19 -1.02 0.08 0.00 0.00 0.00 0.00 44.72 43.97 1dsf s GLY 99 CO 0.04 -0.71 1.17 0.00 0.00 0.00 0.00 173.10 173.60 1dsf n GLY 101 N 0.82 -0.78 2.87 0.00 0.00 -1.25 -5.00 105.19 101.86 1dsf n GLY 101 Ca 0.10 -1.60 -0.27 0.00 0.00 0.00 0.00 46.02 44.25 1dsf n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1dsf s THR 102 N -3.03 0.92 -0.40 2.61 2.01 0.44 -4.73 115.64 113.46 1dsf s THR 102 Ca 0.00 -0.34 -0.25 0.00 0.31 0.00 0.00 61.69 61.41 1dsf s THR 102 Cb 0.00 -1.03 0.02 0.00 0.01 0.00 0.00 72.50 71.49 1dsf s THR 102 CO 0.00 0.25 0.89 -0.54 -0.69 0.00 0.00 174.62 174.53 1dsf s LYS 103 N 1.74 3.71 -0.36 4.92 1.02 0.95 -1.35 119.74 130.37 1dsf s LYS 103 Ca 0.03 0.37 -0.23 0.00 0.02 0.00 0.00 55.97 56.16 1dsf s LYS 103 Cb -0.14 -3.85 0.01 0.00 -0.52 0.00 0.00 37.83 33.34 1dsf s LYS 103 CO -0.08 -1.01 0.79 -1.17 -0.92 0.00 0.00 175.35 172.96 1dsf s LEU 104 N 3.46 4.12 0.05 3.17 2.96 -0.42 -0.16 118.68 131.86 1dsf s LEU 104 Ca 0.36 0.38 0.08 0.00 -0.22 0.00 0.00 54.13 54.73 1dsf s LEU 104 Cb -0.12 -3.04 -0.03 0.00 0.50 0.00 0.00 46.19 43.51 1dsf s LEU 104 CO 0.21 -0.73 -0.23 -1.61 -1.32 0.00 0.00 176.35 172.67 1dsf s GLU 105 N 3.11 1.90 -0.13 1.98 2.02 -0.33 -3.42 118.70 123.82 1dsf s GLU 105 Ca 0.32 -1.07 -0.29 0.00 0.02 0.00 0.00 54.97 53.95 1dsf s GLU 105 Cb -0.13 -2.06 -0.02 0.00 0.10 0.00 0.00 34.13 32.02 1dsf s GLU 105 CO 0.17 0.52 1.23 -1.17 0.02 0.00 0.00 175.26 176.03 1dsf s LEU 106 N -1.35 4.21 0.00 1.80 2.96 -1.26 0.15 118.68 125.19 1dsf s LEU 106 Ca 0.13 1.71 0.27 0.00 -0.22 0.00 0.00 54.13 56.03 1dsf s LEU 106 Cb -0.10 -3.54 0.94 0.00 0.50 0.00 0.00 46.19 43.98 1dsf s LEU 106 CO 0.03 -0.69 1.68 2.29 -1.32 0.00 0.00 176.35 178.34