#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2tsb n GLU 2 N 0.00 0.00 -1.69 0.00 -0.00 -1.26 -4.24 120.64 113.45 2tsb n GLU 2 Ca 0.00 0.00 -0.32 0.00 -0.00 0.00 0.00 57.16 56.84 2tsb n GLU 2 Cb 0.00 0.00 0.05 0.00 -0.00 0.00 0.00 31.44 31.49 2tsb n GLU 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2tsb s SER 4 N -2.38 -0.46 0.04 0.00 1.04 -1.26 -0.56 113.70 110.12 2tsb s SER 4 Ca 0.58 0.26 0.01 0.00 0.48 0.00 0.00 55.95 57.28 2tsb s SER 4 Cb 0.46 0.42 -0.03 0.00 0.10 0.00 0.00 66.02 66.98 2tsb s SER 4 CO -0.06 -0.59 -0.06 0.54 0.98 0.00 0.00 173.24 174.05 2tsb s VAL 5 N -2.26 0.39 -0.19 5.02 0.11 -0.64 -1.49 120.40 121.35 2tsb s VAL 5 Ca -0.01 -1.17 -0.04 0.00 -2.93 0.00 0.00 61.98 57.82 2tsb s VAL 5 Cb -0.01 -0.68 -0.02 0.00 -1.53 0.00 0.00 36.38 34.14 2tsb s VAL 5 CO -0.03 -0.52 -0.02 -1.81 -3.33 0.00 0.00 175.10 169.39 2tsb s ASP 6 N -1.80 4.75 0.36 3.54 1.01 -1.26 -1.81 116.67 121.45 2tsb s ASP 6 Ca -0.08 -0.21 0.08 0.00 0.71 0.00 0.00 52.55 53.05 2tsb s ASP 6 Cb -0.07 -1.80 -0.07 0.00 1.01 0.00 0.00 42.92 41.99 2tsb s ASP 6 CO -0.01 0.08 -0.03 -0.63 0.21 0.00 0.00 175.17 174.79 2tsb s ILE 7 N 0.87 1.98 -0.25 0.77 1.01 0.34 -4.94 121.20 120.97 2tsb s ILE 7 Ca 0.00 -2.09 -0.17 0.00 0.00 0.00 0.00 60.65 58.39 2tsb s ILE 7 Cb -0.14 -2.79 0.07 0.00 0.01 0.00 0.00 42.46 39.61 2tsb s ILE 7 CO 0.02 -0.11 0.64 0.00 0.00 0.00 0.00 174.94 175.49 2tsb s GLN 8 N -3.69 0.68 -0.15 2.79 -2.07 -1.26 -3.09 119.66 112.87 2tsb s GLN 8 Ca 0.34 1.08 -0.07 0.00 -1.82 0.00 0.00 55.36 54.89 2tsb s GLN 8 Cb 0.06 0.18 -0.04 0.00 -1.09 0.00 0.00 33.01 32.13 2tsb s GLN 8 CO 0.17 -0.13 0.08 0.20 -1.32 0.00 0.00 175.29 174.28 2tsb s GLY 9 N 1.23 1.97 0.00 2.60 0.00 -0.78 -2.15 107.32 110.19 2tsb s GLY 9 Ca -0.07 -0.72 0.00 0.00 0.00 0.00 0.00 44.72 43.93 2tsb s GLY 9 CO -0.13 -0.14 0.00 1.16 0.00 0.00 0.00 173.10 173.99 2tsb n ASN 10 N 2.93 1.57 -0.18 1.64 0.23 -0.69 -3.28 115.26 117.48 2tsb n ASN 10 Ca -0.18 -0.48 0.08 0.00 -0.53 0.00 0.00 54.58 53.48 2tsb n ASN 10 Cb 0.53 0.00 0.42 0.00 -2.08 0.00 0.00 39.78 38.65 2tsb n ASN 10 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2tsb n ASP 11 N -0.68 0.54 -0.39 0.53 8.00 -1.26 -3.17 116.55 120.12 2tsb n ASP 11 Ca 0.00 -1.59 0.06 0.00 0.71 0.00 0.00 54.79 53.97 2tsb n ASP 11 Cb 0.00 -0.04 0.02 0.00 -0.02 0.00 0.00 41.12 41.08 2tsb n ASP 11 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2tsb n GLN 12 N -0.39 1.40 -2.47 -1.24 1.13 -1.26 -4.97 117.38 109.57 2tsb n GLN 12 Ca 0.13 -0.96 -0.03 0.00 -1.94 0.00 0.00 57.00 54.21 2tsb n GLN 12 Cb 0.14 -1.20 0.01 0.00 0.11 0.00 0.00 30.24 29.30 2tsb n GLN 12 CO 0.00 0.00 0.00 -0.12 -1.44 0.00 0.00 177.06 175.50 2tsb n MET 13 N 0.23 -0.88 -4.02 -1.09 0.00 -1.19 -5.04 117.12 105.13 2tsb n MET 13 Ca 0.06 0.10 -0.09 0.00 0.00 0.00 0.00 57.70 57.77 2tsb n MET 13 Cb 0.29 -2.89 -0.11 0.00 0.00 0.00 0.00 33.22 30.51 2tsb n MET 13 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 175.97 175.32 2tsb s GLN 14 N -4.82 0.43 0.27 2.12 -0.21 -1.26 -3.66 119.66 112.52 2tsb s GLN 14 Ca 0.05 -0.83 0.00 0.00 0.02 0.00 0.00 55.36 54.59 2tsb s GLN 14 Cb -0.02 0.12 -0.04 0.00 1.00 0.00 0.00 33.01 34.07 2tsb s GLN 14 CO 0.08 -0.06 0.46 -0.06 -2.12 0.00 0.00 175.29 173.59 2tsb s PHE 15 N -2.31 3.48 -2.00 0.91 0.08 -1.26 -1.71 117.98 115.18 2tsb s PHE 15 Ca -0.08 0.32 0.30 0.00 0.12 0.00 0.00 56.93 57.60 2tsb s PHE 15 Cb -0.04 -1.85 1.81 0.00 -0.57 0.00 0.00 43.02 42.37 2tsb s PHE 15 CO -0.04 0.27 2.16 0.27 -0.10 0.00 0.00 175.22 177.79 2tsb n ASN 16 N -1.20 0.01 -3.61 1.36 6.94 -0.91 -4.78 115.26 113.06 2tsb n ASN 16 Ca -0.05 -1.05 -0.15 0.00 -0.02 0.00 0.00 54.58 53.30 2tsb n ASN 16 Cb 0.55 -0.00 -0.07 0.00 -2.36 0.00 0.00 39.78 37.90 2tsb n ASN 16 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 2tsb s THR 17 N -2.00 0.01 0.00 5.53 -1.32 -1.26 -5.01 115.64 111.59 2tsb s THR 17 Ca 0.46 -0.05 0.00 0.00 -1.21 0.00 0.00 61.69 60.88 2tsb s THR 17 Cb 0.21 -0.91 0.00 0.00 -1.51 0.00 0.00 72.50 70.29 2tsb s THR 17 CO 0.35 -0.03 0.95 0.59 -2.21 0.00 0.00 174.62 174.27 2tsb n ASN 18 N 1.82 1.80 -3.67 8.08 4.13 -1.26 -4.79 115.26 121.37 2tsb n ASN 18 Ca -0.17 -1.90 -0.14 0.00 1.68 0.00 0.00 54.58 54.05 2tsb n ASN 18 Cb 0.56 0.00 -0.14 0.00 -1.54 0.00 0.00 39.78 38.67 2tsb n ASN 18 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2tsb s ALA 19 N -0.90 -0.49 0.01 5.41 0.00 -1.26 -0.61 121.76 123.93 2tsb s ALA 19 Ca 0.00 0.87 0.08 0.00 0.00 0.00 0.00 51.96 52.91 2tsb s ALA 19 Cb 0.00 -0.98 -0.02 0.00 0.00 0.00 0.00 23.12 22.12 2tsb s ALA 19 CO 0.00 -0.62 -0.25 0.42 0.00 0.00 0.00 175.76 175.31 2tsb s ILE 20 N 2.38 1.96 -0.14 0.00 1.01 0.57 -4.93 121.20 122.05 2tsb s ILE 20 Ca 0.01 -1.18 -0.01 0.00 0.00 0.00 0.00 60.65 59.48 2tsb s ILE 20 Cb -0.12 -1.65 0.04 0.00 0.01 0.00 0.00 42.46 40.73 2tsb s ILE 20 CO -0.08 0.44 -0.05 -0.89 0.00 0.00 0.00 174.94 174.36 2tsb s THR 21 N -0.68 0.97 -0.26 2.92 2.01 -1.26 -1.13 115.64 118.21 2tsb s THR 21 Ca 0.10 -0.43 -0.12 0.00 0.31 0.00 0.00 61.69 61.55 2tsb s THR 21 Cb -0.09 -1.11 -0.05 0.00 0.01 0.00 0.00 72.50 71.26 2tsb s THR 21 CO 0.00 0.20 0.21 -0.69 -0.69 0.00 0.00 174.62 173.65 2tsb s VAL 22 N 1.71 5.31 0.47 3.82 1.01 -0.35 -4.96 120.40 127.41 2tsb s VAL 22 Ca 0.02 0.25 -0.21 0.00 0.00 0.00 0.00 61.98 62.04 2tsb s VAL 22 Cb -0.14 -3.55 -0.09 0.00 0.00 0.00 0.00 36.38 32.60 2tsb s VAL 22 CO -0.08 0.28 1.03 -0.62 0.00 0.00 0.00 175.10 175.71 2tsb s ASP 23 N 1.44 6.47 0.21 3.32 2.15 -1.26 -0.62 116.67 128.38 2tsb s ASP 23 Ca 0.09 1.91 0.21 0.00 0.43 0.00 0.00 52.55 55.18 2tsb s ASP 23 Cb -0.15 -2.56 0.90 0.00 -0.30 0.00 0.00 42.92 40.81 2tsb s ASP 23 CO 0.08 -0.69 1.63 0.29 -0.17 0.00 0.00 175.17 176.31 2tsb n LYS 24 N -0.82 0.14 0.00 4.34 5.02 -0.58 -1.77 118.16 124.50 2tsb n LYS 24 Ca 0.08 0.43 0.15 0.00 -2.02 0.00 0.00 58.31 56.96 2tsb n LYS 24 Cb 0.52 -1.81 0.81 0.00 -0.02 0.00 0.00 35.03 34.53 2tsb n LYS 24 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2tsb n SER 25 N -2.08 0.28 -4.72 4.39 7.64 -1.26 -4.82 113.62 113.05 2tsb n SER 25 Ca 0.02 -0.85 -0.40 0.00 1.01 0.00 0.00 58.87 58.65 2tsb n SER 25 Cb 0.18 -0.06 -0.05 0.00 -1.01 0.00 0.00 64.21 63.27 2tsb n SER 25 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2tsb h LYS 27 N 6.67 0.15 -4.58 0.00 1.63 -1.90 -3.41 116.57 115.14 2tsb h LYS 27 Ca -0.41 -0.26 -0.33 0.00 -0.85 0.00 0.00 60.65 58.79 2tsb h LYS 27 Cb 1.20 0.10 -0.26 0.00 -0.60 0.00 0.00 32.23 32.67 2tsb h LYS 27 CO 0.75 1.06 -0.76 -0.65 -3.45 0.00 0.00 179.45 176.41 2tsb s GLN 28 N -2.66 0.56 0.01 1.90 -0.21 -1.26 -0.43 119.66 117.58 2tsb s GLN 28 Ca -0.03 -0.46 0.08 0.00 0.02 0.00 0.00 55.36 54.97 2tsb s GLN 28 Cb 0.08 -0.48 -0.02 0.00 1.00 0.00 0.00 33.01 33.58 2tsb s GLN 28 CO 0.85 0.12 -0.25 0.12 -2.12 0.00 0.00 175.29 174.01 2tsb s PHE 29 N -0.63 2.35 -0.07 0.91 5.36 0.18 -4.81 117.98 121.28 2tsb s PHE 29 Ca -0.02 -0.41 0.05 0.00 -0.96 0.00 0.00 56.93 55.59 2tsb s PHE 29 Cb -0.05 -1.46 -0.01 0.00 -0.34 0.00 0.00 43.02 41.16 2tsb s PHE 29 CO 0.00 0.05 -0.22 0.99 -1.46 0.00 0.00 175.22 174.58 2tsb s THR 30 N -0.71 2.31 -0.29 0.12 2.01 0.27 -1.30 115.64 118.05 2tsb s THR 30 Ca 0.11 -0.97 -0.04 0.00 0.31 0.00 0.00 61.69 61.11 2tsb s THR 30 Cb -0.10 -1.87 0.03 0.00 0.01 0.00 0.00 72.50 70.57 2tsb s THR 30 CO 0.01 0.57 0.02 -0.69 -0.69 0.00 0.00 174.62 173.83 2tsb s VAL 31 N -0.12 3.32 -0.37 3.82 1.01 0.29 -1.62 120.40 126.73 2tsb s VAL 31 Ca -0.04 -1.10 -0.14 0.00 0.00 0.00 0.00 61.98 60.70 2tsb s VAL 31 Cb -0.14 -2.81 -0.00 0.00 0.00 0.00 0.00 36.38 33.43 2tsb s VAL 31 CO 0.04 -0.01 0.26 0.20 0.00 0.00 0.00 175.10 175.59 2tsb s ASN 32 N 1.35 6.06 0.34 3.32 0.01 -0.75 -2.00 114.94 123.26 2tsb s ASN 32 Ca -0.02 -0.64 -0.01 0.00 -0.71 0.00 0.00 52.86 51.49 2tsb s ASN 32 Cb -0.18 -2.14 -0.04 0.00 0.41 0.00 0.00 41.25 39.30 2tsb s ASN 32 CO -0.00 -0.33 0.57 -0.22 -1.51 0.00 0.00 177.10 175.61 2tsb s LEU 33 N 1.70 3.99 0.18 0.60 2.96 0.21 -0.51 118.68 127.82 2tsb s LEU 33 Ca 0.05 0.55 -0.21 0.00 -0.22 0.00 0.00 54.13 54.31 2tsb s LEU 33 Cb -0.18 -3.41 0.05 0.00 0.50 0.00 0.00 46.19 43.15 2tsb s LEU 33 CO 0.10 -0.29 0.57 -0.44 -1.32 0.00 0.00 176.35 174.97 2tsb s SER 34 N -3.83 -0.41 -0.47 3.68 0.01 -1.18 -2.70 113.70 108.81 2tsb s SER 34 Ca 0.41 -0.24 0.03 0.00 1.31 0.00 0.00 55.95 57.46 2tsb s SER 34 Cb -0.10 0.60 0.16 0.00 0.21 0.00 0.00 66.02 66.89 2tsb s SER 34 CO 0.35 -1.03 0.33 -2.28 0.41 0.00 0.00 173.24 171.02 2tsb s HIS 35 N -3.81 1.74 0.10 2.43 2.46 -1.22 -1.87 115.29 115.11 2tsb s HIS 35 Ca 0.05 -2.46 0.20 0.00 0.47 0.00 0.00 55.06 53.32 2tsb s HIS 35 Cb -0.01 -1.49 1.09 0.00 -0.13 0.00 0.00 32.58 32.03 2tsb s HIS 35 CO -0.08 -0.76 1.56 -1.00 -2.47 0.00 0.00 174.74 171.99 2tsb h PRO 36 N 6.02 0.00 0.00 2.88 0.13 -1.92 -3.09 132.00 136.02 2tsb h PRO 36 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 2tsb h PRO 36 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 2tsb h PRO 36 CO 0.45 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.63 2tsb n GLY 37 N -1.26 0.90 0.66 1.56 0.00 -1.26 -4.93 105.19 100.86 2tsb n GLY 37 Ca -0.01 -0.48 -0.00 0.00 0.00 0.00 0.00 46.02 45.52 2tsb n GLY 37 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2tsb n ASN 38 N 0.00 0.01 -4.94 1.61 6.94 -1.26 -4.61 115.26 113.01 2tsb n ASN 38 Ca 0.00 -1.62 -0.24 0.00 -0.02 0.00 0.00 54.58 52.70 2tsb n ASN 38 Cb 0.00 -0.08 -0.01 0.00 -2.36 0.00 0.00 39.78 37.33 2tsb n ASN 38 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2tsb s LEU 39 N 0.00 3.88 0.71 -4.53 1.43 -1.26 -4.93 118.68 113.98 2tsb s LEU 39 Ca 0.04 0.48 -0.08 0.00 -1.03 0.00 0.00 54.13 53.54 2tsb s LEU 39 Cb 0.04 -3.36 0.05 0.00 0.03 0.00 0.00 46.19 42.95 2tsb s LEU 39 CO -0.02 -0.43 1.05 -2.16 0.23 0.00 0.00 176.35 175.02 2tsb s PRO 40 N -4.43 2.32 0.29 1.29 0.04 -1.26 -2.05 135.00 131.21 2tsb s PRO 40 Ca 0.43 -0.04 0.00 0.00 0.04 0.00 0.00 61.00 61.43 2tsb s PRO 40 Cb -0.10 -2.11 0.51 0.00 0.04 0.00 0.00 34.50 32.84 2tsb s PRO 40 CO 0.38 -1.22 1.90 -0.22 0.04 0.00 0.00 177.00 177.87 2tsb h LYS 41 N -0.66 1.02 0.00 4.56 3.64 -1.84 0.76 116.57 124.05 2tsb h LYS 41 Ca -0.45 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 2tsb h LYS 41 Cb 1.30 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 2tsb h LYS 41 CO 0.62 0.67 0.00 -2.95 -2.27 0.00 0.00 179.45 175.53 2tsb h ASN 42 N 1.05 0.00 0.00 4.20 7.08 -1.95 -0.92 115.58 125.04 2tsb h ASN 42 Ca 0.41 0.00 -0.19 0.00 -3.08 0.00 0.00 56.30 53.43 2tsb h ASN 42 Cb 0.22 0.00 -0.03 0.00 -2.08 0.00 0.00 38.32 36.43 2tsb h ASN 42 CO -0.16 0.00 -1.30 0.52 -2.08 0.00 0.00 177.43 174.41 2tsb n VAL 43 N -3.03 1.50 -2.74 6.14 0.31 -0.68 -4.81 118.33 115.02 2tsb n VAL 43 Ca 0.03 -0.02 -0.14 0.00 -0.01 0.00 0.00 64.34 64.20 2tsb n VAL 43 Cb 0.43 -2.14 0.01 0.00 -0.91 0.00 0.00 33.84 31.23 2tsb n VAL 43 CO 0.00 0.00 0.00 0.80 -1.32 0.00 0.00 176.83 176.31 2tsb n MET 44 N -4.45 1.59 -2.69 5.55 1.56 0.18 -5.02 117.12 113.83 2tsb n MET 44 Ca -0.28 -3.56 -0.32 0.00 -0.27 0.00 0.00 57.70 53.27 2tsb n MET 44 Cb 0.59 -1.54 -0.05 0.00 2.15 0.00 0.00 33.22 34.38 2tsb n MET 44 CO 0.00 0.00 0.00 0.20 -0.73 0.00 0.00 175.97 175.44 2tsb s GLY 45 N -3.08 2.16 0.12 -5.12 0.00 -0.35 -4.72 107.32 96.32 2tsb s GLY 45 Ca 0.34 0.14 0.05 0.00 0.00 0.00 0.00 44.72 45.24 2tsb s GLY 45 CO -0.03 0.39 -0.11 0.30 0.00 0.00 0.00 173.10 173.65 2tsb s HIS 46 N -2.38 1.22 0.44 1.90 3.76 -0.14 -4.76 115.29 115.33 2tsb s HIS 46 Ca 0.57 -0.64 0.03 0.00 -0.15 0.00 0.00 55.06 54.87 2tsb s HIS 46 Cb -0.10 -0.64 -0.02 0.00 1.11 0.00 0.00 32.58 32.93 2tsb s HIS 46 CO 0.25 0.07 0.10 0.54 -0.85 0.00 0.00 174.74 174.85 2tsb s ASN 47 N -2.61 3.16 -0.19 1.40 2.20 -1.26 -0.88 114.94 116.76 2tsb s ASN 47 Ca 0.09 -1.68 -0.01 0.00 -0.94 0.00 0.00 52.86 50.31 2tsb s ASN 47 Cb -0.02 0.53 0.05 0.00 -2.00 0.00 0.00 41.25 39.81 2tsb s ASN 47 CO 0.01 -0.92 -0.00 0.86 -2.94 0.00 0.00 177.10 174.11 2tsb s TRP 48 N -3.11 1.45 -0.13 1.54 -0.00 -1.25 -4.09 118.94 113.35 2tsb s TRP 48 Ca 0.19 -1.07 0.02 0.00 -0.00 0.00 0.00 56.10 55.24 2tsb s TRP 48 Cb 0.02 -1.20 0.00 0.00 -0.00 0.00 0.00 33.47 32.30 2tsb s TRP 48 CO 0.12 -0.63 -0.21 0.08 -0.00 0.00 0.00 176.95 176.30 2tsb s VAL 49 N 1.71 2.26 -0.12 5.86 1.01 0.42 -1.83 120.40 129.72 2tsb s VAL 49 Ca -0.02 -0.93 -0.04 0.00 0.00 0.00 0.00 61.98 61.00 2tsb s VAL 49 Cb -0.17 -1.90 -0.03 0.00 0.00 0.00 0.00 36.38 34.27 2tsb s VAL 49 CO -0.07 0.55 0.02 -0.22 0.00 0.00 0.00 175.10 175.37 2tsb s LEU 50 N 0.59 3.67 0.00 3.92 2.96 -0.59 -1.20 118.68 128.03 2tsb s LEU 50 Ca -0.12 0.14 -0.08 0.00 -0.22 0.00 0.00 54.13 53.85 2tsb s LEU 50 Cb -0.16 -1.87 0.03 0.00 0.50 0.00 0.00 46.19 44.69 2tsb s LEU 50 CO 0.03 0.32 0.63 -1.54 -1.32 0.00 0.00 176.35 174.47 2tsb n SER 51 N 2.54 -1.80 -4.87 3.68 3.41 -0.96 -0.53 113.62 115.09 2tsb n SER 51 Ca -0.18 -2.70 -0.31 0.00 -0.26 0.00 0.00 58.87 55.41 2tsb n SER 51 Cb 0.53 3.13 -0.01 0.00 -0.26 0.00 0.00 64.21 67.60 2tsb n SER 51 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2tsb s THR 52 N -2.46 4.69 0.55 6.66 -4.23 -1.26 -1.91 115.64 117.68 2tsb s THR 52 Ca 0.22 0.86 0.24 0.00 -1.18 0.00 0.00 61.69 61.83 2tsb s THR 52 Cb -0.03 -3.81 0.32 0.00 1.34 0.00 0.00 72.50 70.31 2tsb s THR 52 CO 0.16 -0.92 2.20 0.00 -0.54 0.00 0.00 174.62 175.52 2tsb h ALA 53 N 0.26 1.67 -0.02 3.99 0.00 0.66 -1.43 119.26 124.40 2tsb h ALA 53 Ca -0.45 -0.01 -0.22 0.00 0.00 0.00 0.00 54.91 54.22 2tsb h ALA 53 Cb 1.19 -0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.99 2tsb h ALA 53 CO 0.62 0.02 -0.85 0.00 0.00 0.00 0.00 179.25 179.04 2tsb h ALA 54 N 1.98 0.13 0.00 0.00 0.00 -1.92 -3.35 119.26 116.11 2tsb h ALA 54 Ca -0.00 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.27 2tsb h ALA 54 Cb 0.04 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2tsb h ALA 54 CO 0.00 0.56 -0.07 -0.25 0.00 0.00 0.00 179.25 179.49 2tsb n ASP 55 N -4.00 0.73 -0.36 0.00 8.00 -0.57 -4.40 116.55 115.94 2tsb n ASP 55 Ca -0.10 0.51 0.10 0.00 0.71 0.00 0.00 54.79 56.01 2tsb n ASP 55 Cb 0.79 -0.66 0.27 0.00 -0.02 0.00 0.00 41.12 41.50 2tsb n ASP 55 CO 0.00 0.00 0.00 -0.03 -0.39 0.00 0.00 177.20 176.78 2tsb h MET 56 N 0.00 0.85 -0.55 -1.24 4.05 -1.60 -2.59 114.93 113.84 2tsb h MET 56 Ca 0.00 -0.05 0.07 0.00 -0.28 0.00 0.00 59.70 59.44 2tsb h MET 56 Cb 0.72 -0.19 -0.06 0.00 -0.80 0.00 0.00 31.60 31.27 2tsb h MET 56 CO 0.00 0.56 0.24 -0.56 0.23 0.00 0.00 176.91 177.39 2tsb h GLN 57 N 0.88 0.44 -0.10 0.39 3.07 -1.84 -2.83 115.11 115.11 2tsb h GLN 57 Ca 0.53 -0.03 -0.19 0.00 0.09 0.00 0.00 58.65 59.06 2tsb h GLN 57 Cb 0.68 -0.10 0.01 0.00 0.08 0.00 0.00 27.48 28.15 2tsb h GLN 57 CO -0.32 0.29 -0.68 0.78 0.09 0.00 0.00 178.83 179.00 2tsb h GLY 58 N 0.46 0.70 0.36 0.06 0.00 -1.79 -1.62 103.07 101.23 2tsb h GLY 58 Ca 0.26 -1.03 -0.01 0.00 0.00 0.00 0.00 47.33 46.55 2tsb h GLY 58 CO -0.23 0.92 -0.50 -2.08 0.00 0.00 0.00 176.54 174.65 2tsb h VAL 59 N 0.28 0.00 -0.94 4.60 2.07 -1.52 0.52 116.25 121.26 2tsb h VAL 59 Ca -0.06 0.00 0.23 0.00 0.82 0.00 0.00 66.70 67.69 2tsb h VAL 59 Cb 1.32 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.97 2tsb h VAL 59 CO 0.14 0.00 0.49 0.58 0.02 0.00 0.00 177.57 178.80 2tsb h VAL 60 N -0.89 0.53 -0.11 2.57 2.07 -1.54 0.28 116.25 119.15 2tsb h VAL 60 Ca -0.04 -0.17 -0.14 0.00 0.82 0.00 0.00 66.70 67.16 2tsb h VAL 60 Cb 0.81 -0.03 0.01 0.00 -1.52 0.00 0.00 31.29 30.56 2tsb h VAL 60 CO -0.14 0.09 -0.48 0.74 0.02 0.00 0.00 177.57 177.81 2tsb h THR 61 N 0.51 1.36 0.00 2.57 2.02 -0.61 -1.82 112.91 116.95 2tsb h THR 61 Ca 0.59 -1.79 -0.07 0.00 0.77 0.00 0.00 66.41 65.91 2tsb h THR 61 Cb 1.10 2.15 -0.01 0.00 -1.74 0.00 0.00 68.15 69.65 2tsb h THR 61 CO -0.49 0.54 -0.34 0.44 0.37 0.00 0.00 175.52 176.04 2tsb h ASP 62 N 0.13 0.00 -0.04 4.18 5.19 -0.13 -3.17 116.42 122.59 2tsb h ASP 62 Ca -0.03 0.00 -0.15 0.00 -0.62 0.00 0.00 57.03 56.23 2tsb h ASP 62 Cb 1.11 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.63 2tsb h ASP 62 CO 0.10 0.34 -0.58 1.23 -3.12 0.00 0.00 179.24 177.21 2tsb h GLY 63 N 2.22 0.51 2.00 2.75 0.00 -0.37 -2.90 103.07 107.28 2tsb h GLY 63 Ca -0.00 -0.82 0.00 0.00 0.00 0.00 0.00 47.33 46.51 2tsb h GLY 63 CO 0.04 0.72 0.00 0.00 0.00 0.00 0.00 176.54 177.31 2tsb h MET 64 N -0.01 0.00 0.00 4.80 -0.00 -1.39 -2.72 114.93 115.61 2tsb h MET 64 Ca -0.06 0.00 -0.11 0.00 -0.00 0.00 0.00 59.70 59.53 2tsb h MET 64 Cb 1.26 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.84 2tsb h MET 64 CO 0.12 0.00 -0.51 0.00 -0.00 0.00 0.00 176.91 176.52 2tsb h ALA 65 N 2.04 0.71 0.00 -3.00 0.00 -1.59 -3.35 119.26 114.08 2tsb h ALA 65 Ca 0.00 -0.46 -0.05 0.00 0.00 0.00 0.00 54.91 54.39 2tsb h ALA 65 Cb 0.54 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2tsb h ALA 65 CO 0.00 0.64 -0.25 0.77 0.00 0.00 0.00 179.25 180.41 2tsb h SER 66 N 0.00 0.00 -4.56 0.00 0.02 -1.26 -3.50 113.55 104.24 2tsb h SER 66 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2tsb h SER 66 Cb 1.31 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.85 2tsb h SER 66 CO 0.07 0.25 0.00 0.61 -1.14 0.00 0.00 176.83 176.61 2tsb n GLY 67 N 0.54 0.03 0.40 -3.77 0.00 -1.25 -4.44 105.19 96.69 2tsb n GLY 67 Ca 0.01 -1.58 0.21 0.00 0.00 0.00 0.00 46.02 44.66 2tsb n GLY 67 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2tsb h LEU 68 N 0.00 0.46 -2.00 0.99 5.85 -1.92 0.29 115.31 118.97 2tsb h LEU 68 Ca 0.00 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.79 2tsb h LEU 68 Cb 0.00 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.02 2tsb h LEU 68 CO 0.00 0.14 0.00 -2.24 -0.34 0.00 0.00 178.44 176.00 2tsb h ASP 69 N 0.43 0.00 -0.11 1.25 2.03 -2.02 -1.84 116.42 116.17 2tsb h ASP 69 Ca 0.54 0.00 -0.03 0.00 -0.73 0.00 0.00 57.03 56.82 2tsb h ASP 69 Cb 1.33 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.81 2tsb h ASP 69 CO -0.25 0.00 -0.13 0.29 -1.03 0.00 0.00 179.24 178.12 2tsb n LYS 70 N -2.83 1.76 -2.10 4.15 5.02 0.84 -4.95 118.16 120.06 2tsb n LYS 70 Ca -0.01 -2.90 -0.13 0.00 -2.02 0.00 0.00 58.31 53.25 2tsb n LYS 70 Cb 0.15 -1.65 -0.02 0.00 -0.02 0.00 0.00 35.03 33.49 2tsb n LYS 70 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2tsb n ASP 71 N -1.13 -3.87 -3.92 4.39 8.00 -0.69 -1.77 116.55 117.56 2tsb n ASP 71 Ca 0.21 0.22 -0.29 0.00 0.71 0.00 0.00 54.79 55.64 2tsb n ASP 71 Cb 0.77 -3.38 -0.01 0.00 -0.02 0.00 0.00 41.12 38.48 2tsb n ASP 71 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2tsb n TYR 72 N -2.93 -1.66 -3.71 1.24 4.01 -0.24 -4.77 117.16 109.09 2tsb n TYR 72 Ca -0.15 0.62 -0.13 0.00 -0.16 0.00 0.00 57.90 58.08 2tsb n TYR 72 Cb 0.56 -3.55 -0.13 0.00 -0.31 0.00 0.00 39.34 35.91 2tsb n TYR 72 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2tsb s LEU 73 N -6.91 0.17 -0.01 7.72 1.43 -0.73 -4.27 118.68 116.08 2tsb s LEU 73 Ca 0.15 0.56 -0.33 0.00 -1.03 0.00 0.00 54.13 53.48 2tsb s LEU 73 Cb -0.06 0.75 -0.12 0.00 0.03 0.00 0.00 46.19 46.80 2tsb s LEU 73 CO 0.90 -0.19 1.85 1.17 0.23 0.00 0.00 176.35 180.30 2tsb n LYS 74 N 4.58 2.36 -1.97 1.70 4.81 -1.26 -4.87 118.16 123.51 2tsb n LYS 74 Ca -0.19 0.86 -0.42 0.00 -0.87 0.00 0.00 58.31 57.69 2tsb n LYS 74 Cb 0.52 -2.72 -0.03 0.00 0.02 0.00 0.00 35.03 32.82 2tsb n LYS 74 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2tsb s PRO 75 N 3.50 4.21 -0.73 1.64 0.04 -1.26 -2.74 135.00 139.66 2tsb s PRO 75 Ca 0.89 2.29 -0.01 0.00 0.04 0.00 0.00 61.00 64.21 2tsb s PRO 75 Cb -0.62 -3.49 0.00 0.00 0.04 0.00 0.00 34.50 30.43 2tsb s PRO 75 CO 0.46 -0.68 0.62 -0.25 0.04 0.00 0.00 177.00 177.19 2tsb n ASP 76 N 5.17 -2.55 -4.78 6.66 8.00 -1.26 -4.99 116.55 122.79 2tsb n ASP 76 Ca 0.15 -0.36 -0.39 0.00 0.71 0.00 0.00 54.79 54.90 2tsb n ASP 76 Cb 0.40 -3.23 -0.06 0.00 -0.02 0.00 0.00 41.12 38.21 2tsb n ASP 76 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2tsb s ASP 77 N -3.68 7.16 -0.10 -2.24 -1.08 -1.11 -4.97 116.67 110.64 2tsb s ASP 77 Ca 0.07 1.37 -0.04 0.00 -0.52 0.00 0.00 52.55 53.43 2tsb s ASP 77 Cb -0.03 -2.41 -0.26 0.00 -1.46 0.00 0.00 42.92 38.76 2tsb s ASP 77 CO 0.43 0.19 0.44 0.77 0.52 0.00 0.00 175.17 177.53 2tsb h SER 78 N 4.82 0.38 0.21 -0.34 4.64 -1.94 -3.35 113.55 117.96 2tsb h SER 78 Ca -0.47 -0.82 0.00 0.00 -0.47 0.00 0.00 61.79 60.02 2tsb h SER 78 Cb 1.21 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 2tsb h SER 78 CO 0.66 1.73 0.00 0.54 -0.87 0.00 0.00 176.83 178.90 2tsb n ARG 79 N -3.43 0.16 -2.76 4.77 1.74 -1.26 -4.59 116.66 111.30 2tsb n ARG 79 Ca -0.29 0.58 -0.43 0.00 -0.77 0.00 0.00 57.85 56.95 2tsb n ARG 79 Cb 1.05 -1.95 -0.03 0.00 -1.02 0.00 0.00 32.46 30.51 2tsb n ARG 79 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2tsb s VAL 80 N -3.50 4.62 0.10 1.55 1.01 -1.26 -4.41 120.40 118.51 2tsb s VAL 80 Ca -0.01 1.53 0.01 0.00 0.00 0.00 0.00 61.98 63.51 2tsb s VAL 80 Cb 0.07 -4.31 -0.25 0.00 0.00 0.00 0.00 36.38 31.89 2tsb s VAL 80 CO 0.26 -0.39 1.20 0.40 0.00 0.00 0.00 175.10 176.57 2tsb h ILE 81 N 5.67 1.60 -2.66 2.22 2.04 -1.06 -3.48 117.51 121.85 2tsb h ILE 81 Ca -0.22 -3.23 0.05 0.00 1.00 0.00 0.00 64.86 62.46 2tsb h ILE 81 Cb 1.07 2.91 -0.13 0.00 -0.74 0.00 0.00 36.82 39.93 2tsb h ILE 81 CO 0.98 0.93 0.35 0.00 0.00 0.00 0.00 178.15 180.41 2tsb s ALA 82 N -2.68 -1.68 -0.21 1.87 0.00 -1.25 -4.99 121.76 112.82 2tsb s ALA 82 Ca -0.02 0.65 -0.35 0.00 0.00 0.00 0.00 51.96 52.24 2tsb s ALA 82 Cb 0.08 0.67 0.14 0.00 0.00 0.00 0.00 23.12 24.02 2tsb s ALA 82 CO 0.86 -0.76 1.23 -3.38 0.00 0.00 0.00 175.76 173.71 2tsb s HIS 83 N -3.47 -0.12 0.26 0.00 -3.43 -1.26 -1.55 115.29 105.73 2tsb s HIS 83 Ca 0.04 0.08 0.02 0.00 -0.80 0.00 0.00 55.06 54.41 2tsb s HIS 83 Cb -0.01 0.51 0.02 0.00 -1.43 0.00 0.00 32.58 31.67 2tsb s HIS 83 CO -0.09 -0.17 0.20 0.25 -2.00 0.00 0.00 174.74 172.93 2tsb n THR 84 N -0.02 0.00 -2.33 -5.38 -2.24 -0.76 -4.77 114.28 98.78 2tsb n THR 84 Ca 0.01 -1.03 -0.24 0.00 -2.27 0.00 0.00 64.05 60.52 2tsb n THR 84 Cb 0.58 -0.31 0.06 0.00 -2.10 0.00 0.00 70.33 68.57 2tsb n THR 84 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2tsb s LYS 85 N -3.08 2.24 -0.08 -0.78 1.02 -1.26 -4.67 119.74 113.13 2tsb s LYS 85 Ca 0.15 -0.44 -0.27 0.00 0.02 0.00 0.00 55.97 55.44 2tsb s LYS 85 Cb -0.01 -2.26 -0.02 0.00 -0.52 0.00 0.00 37.83 35.02 2tsb s LYS 85 CO 0.10 -1.13 0.88 -1.17 -0.92 0.00 0.00 175.35 173.11 2tsb s LEU 86 N -5.12 4.29 0.21 3.17 2.96 -1.26 -4.51 118.68 118.41 2tsb s LEU 86 Ca 0.60 1.40 0.11 0.00 -0.22 0.00 0.00 54.13 56.02 2tsb s LEU 86 Cb -0.10 -3.36 -0.04 0.00 0.50 0.00 0.00 46.19 43.18 2tsb s LEU 86 CO 0.43 -0.29 -0.19 0.27 -1.32 0.00 0.00 176.35 175.25 2tsb s ILE 87 N 1.40 2.59 0.50 6.68 -4.36 -0.06 -4.87 121.20 123.08 2tsb s ILE 87 Ca 0.44 -2.01 0.06 0.00 -0.26 0.00 0.00 60.65 58.88 2tsb s ILE 87 Cb -0.19 -2.28 0.01 0.00 1.25 0.00 0.00 42.46 41.25 2tsb s ILE 87 CO 0.20 -0.17 0.32 -0.83 0.24 0.00 0.00 174.94 174.69 2tsb s GLY 88 N -2.88 2.39 0.45 6.27 0.00 -1.26 -0.97 107.32 111.32 2tsb s GLY 88 Ca 0.24 -1.45 -0.24 0.00 0.00 0.00 0.00 44.72 43.26 2tsb s GLY 88 CO 0.12 -1.92 1.23 -1.14 0.00 0.00 0.00 173.10 171.38 2tsb n SER 89 N -1.58 2.27 0.00 1.64 3.41 -0.87 -2.02 113.62 116.47 2tsb n SER 89 Ca -0.02 1.06 0.00 0.00 -0.26 0.00 0.00 58.87 59.64 2tsb n SER 89 Cb 0.64 -1.48 0.00 0.00 -0.26 0.00 0.00 64.21 63.11 2tsb n SER 89 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2tsb n GLY 90 N 0.89 2.76 3.83 5.00 0.00 -1.17 -4.96 105.19 111.55 2tsb n GLY 90 Ca 0.08 -0.03 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 2tsb n GLY 90 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2tsb s GLU 91 N 0.00 4.08 0.14 1.61 2.02 -0.86 -4.89 118.70 120.80 2tsb s GLU 91 Ca 0.00 1.02 0.07 0.00 0.02 0.00 0.00 54.97 56.09 2tsb s GLU 91 Cb 0.00 -2.16 -0.04 0.00 0.10 0.00 0.00 34.13 32.03 2tsb s GLU 91 CO 0.00 -0.15 -0.17 0.15 0.02 0.00 0.00 175.26 175.11 2tsb s LYS 92 N -3.65 1.15 0.08 1.61 1.02 -1.26 -3.42 119.74 115.27 2tsb s LYS 92 Ca 0.60 -1.30 -0.22 0.00 0.02 0.00 0.00 55.97 55.07 2tsb s LYS 92 Cb -0.09 -1.16 0.05 0.00 -0.52 0.00 0.00 37.83 36.11 2tsb s LYS 92 CO 0.23 0.24 0.52 0.34 -0.92 0.00 0.00 175.35 175.76 2tsb s ASP 93 N -2.47 -0.44 0.01 2.83 2.15 -1.10 -5.02 116.67 112.63 2tsb s ASP 93 Ca 0.11 0.07 -0.01 0.00 0.43 0.00 0.00 52.55 53.16 2tsb s ASP 93 Cb -0.06 0.51 -0.01 0.00 -0.30 0.00 0.00 42.92 43.07 2tsb s ASP 93 CO 0.05 -0.80 -0.00 -0.44 -0.17 0.00 0.00 175.17 173.81 2tsb s SER 94 N -2.26 0.10 -0.05 -0.34 0.01 -1.26 -0.62 113.70 109.28 2tsb s SER 94 Ca -0.03 -0.22 -0.00 0.00 1.31 0.00 0.00 55.95 57.01 2tsb s SER 94 Cb -0.00 0.07 0.03 0.00 0.21 0.00 0.00 66.02 66.32 2tsb s SER 94 CO -0.06 -0.16 -0.01 0.54 0.41 0.00 0.00 173.24 173.97 2tsb s VAL 95 N -0.72 0.34 -0.10 3.43 0.11 -0.85 -4.92 120.40 117.69 2tsb s VAL 95 Ca -0.08 0.06 -0.00 0.00 -2.93 0.00 0.00 61.98 59.03 2tsb s VAL 95 Cb -0.05 -0.45 -0.03 0.00 -1.53 0.00 0.00 36.38 34.33 2tsb s VAL 95 CO -0.00 0.21 -0.07 -0.89 -3.33 0.00 0.00 175.10 171.02 2tsb s THR 96 N 1.41 3.63 0.08 5.04 2.01 -1.26 -0.55 115.64 126.00 2tsb s THR 96 Ca -0.04 -0.48 -0.00 0.00 0.31 0.00 0.00 61.69 61.48 2tsb s THR 96 Cb -0.13 -2.52 -0.04 0.00 0.01 0.00 0.00 72.50 69.82 2tsb s THR 96 CO -0.03 0.56 -0.03 0.72 -0.69 0.00 0.00 174.62 175.16 2tsb s PHE 97 N -0.35 0.68 0.11 4.92 -0.71 -0.42 -4.97 117.98 117.25 2tsb s PHE 97 Ca 0.05 -1.04 -0.29 0.00 -1.04 0.00 0.00 56.93 54.61 2tsb s PHE 97 Cb -0.12 -0.45 -0.06 0.00 -1.21 0.00 0.00 43.02 41.18 2tsb s PHE 97 CO 0.02 -0.32 0.92 -0.51 -1.34 0.00 0.00 175.22 173.99 2tsb s ASP 98 N -2.98 7.46 0.43 1.98 1.01 -1.26 -0.64 116.67 122.68 2tsb s ASP 98 Ca 0.11 1.75 0.30 0.00 0.71 0.00 0.00 52.55 55.41 2tsb s ASP 98 Cb 0.07 -2.57 1.32 0.00 1.01 0.00 0.00 42.92 42.75 2tsb s ASP 98 CO -0.07 -0.02 1.90 0.58 0.21 0.00 0.00 175.17 177.76 2tsb h VAL 99 N 3.95 0.00 0.00 -1.27 2.07 -0.97 -2.20 116.25 117.82 2tsb h VAL 99 Ca -0.43 -0.31 -0.02 0.00 0.82 0.00 0.00 66.70 66.76 2tsb h VAL 99 Cb 1.21 1.17 -0.00 0.00 -1.52 0.00 0.00 31.29 32.15 2tsb h VAL 99 CO 0.71 0.00 -0.08 0.77 0.02 0.00 0.00 177.57 179.00 2tsb h SER 100 N 0.00 0.00 0.37 0.57 4.64 -1.89 0.11 113.55 117.35 2tsb h SER 100 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2tsb h SER 100 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 2tsb h SER 100 CO 0.00 0.08 0.00 0.29 -0.87 0.00 0.00 176.83 176.33 2tsb n LYS 101 N -4.29 0.24 -4.32 4.77 4.76 -0.83 -4.75 118.16 113.73 2tsb n LYS 101 Ca -0.03 0.12 -0.30 0.00 -2.87 0.00 0.00 58.31 55.23 2tsb n LYS 101 Cb 0.16 -1.50 -0.11 0.00 -1.84 0.00 0.00 35.03 31.74 2tsb n LYS 101 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2tsb s LEU 102 N -2.61 2.93 0.12 -0.35 1.43 0.39 -5.13 118.68 115.47 2tsb s LEU 102 Ca 0.17 -0.40 0.06 0.00 -1.03 0.00 0.00 54.13 52.93 2tsb s LEU 102 Cb 0.12 -1.74 -0.04 0.00 0.03 0.00 0.00 46.19 44.57 2tsb s LEU 102 CO 0.29 0.20 -0.16 -1.59 0.23 0.00 0.00 176.35 175.32 2tsb s LYS 103 N -2.01 1.05 0.34 1.70 -2.85 -1.26 -5.01 119.74 111.69 2tsb s LYS 103 Ca 0.19 -1.22 -0.28 0.00 -1.00 0.00 0.00 55.97 53.66 2tsb s LYS 103 Cb -0.11 -1.02 -0.10 0.00 -2.06 0.00 0.00 37.83 34.54 2tsb s LYS 103 CO 0.11 0.21 1.27 -2.00 0.10 0.00 0.00 175.35 175.04 2tsb s GLU 104 N -2.47 4.32 0.00 1.78 2.12 -1.26 -2.79 118.70 120.40 2tsb s GLU 104 Ca 0.08 2.13 0.00 0.00 0.36 0.00 0.00 54.97 57.54 2tsb s GLU 104 Cb -0.06 -3.02 0.00 0.00 0.26 0.00 0.00 34.13 31.31 2tsb s GLU 104 CO 0.04 -0.19 0.00 0.41 -0.54 0.00 0.00 175.26 174.98 2tsb n GLY 105 N 0.82 3.10 3.85 -1.50 0.00 -1.26 -5.02 105.19 105.18 2tsb n GLY 105 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2tsb n GLY 105 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2tsb s GLU 106 N -0.36 3.97 -0.24 1.61 2.12 -1.12 -5.09 118.70 119.59 2tsb s GLU 106 Ca 0.00 0.54 -0.04 0.00 0.36 0.00 0.00 54.97 55.83 2tsb s GLU 106 Cb 0.00 -2.62 -0.00 0.00 0.26 0.00 0.00 34.13 31.77 2tsb s GLU 106 CO 0.00 0.28 -0.02 -1.14 -0.54 0.00 0.00 175.26 173.84 2tsb s GLN 107 N -2.66 3.25 0.21 4.30 0.74 -1.26 -4.76 119.66 119.46 2tsb s GLN 107 Ca 0.48 -0.72 0.07 0.00 0.05 0.00 0.00 55.36 55.25 2tsb s GLN 107 Cb -0.12 -3.09 -0.04 0.00 1.10 0.00 0.00 33.01 30.86 2tsb s GLN 107 CO 0.19 -0.28 0.05 0.71 -0.55 0.00 0.00 175.29 175.42 2tsb s TYR 108 N 1.46 2.91 -0.10 1.67 2.02 -1.18 0.12 117.35 124.25 2tsb s TYR 108 Ca 0.04 -0.13 0.02 0.00 -0.37 0.00 0.00 57.07 56.63 2tsb s TYR 108 Cb -0.15 -1.36 0.02 0.00 -0.40 0.00 0.00 41.96 40.06 2tsb s TYR 108 CO -0.02 0.54 -0.14 -1.64 -1.57 0.00 0.00 175.55 172.72 2tsb s MET 109 N -3.28 2.06 0.15 -0.62 -1.94 -0.80 -1.08 119.30 113.79 2tsb s MET 109 Ca 0.30 -0.50 -0.10 0.00 -1.71 0.00 0.00 55.69 53.68 2tsb s MET 109 Cb -0.09 -1.77 -0.06 0.00 2.01 0.00 0.00 34.83 34.92 2tsb s MET 109 CO 0.21 -0.07 0.47 -0.59 -0.01 0.00 0.00 175.02 175.03 2tsb s PHE 110 N 1.01 3.51 0.26 -0.03 -0.12 -1.04 -2.28 117.98 119.30 2tsb s PHE 110 Ca -0.07 0.82 -0.14 0.00 -0.05 0.00 0.00 56.93 57.50 2tsb s PHE 110 Cb -0.15 -2.20 0.05 0.00 -0.63 0.00 0.00 43.02 40.10 2tsb s PHE 110 CO -0.01 0.41 0.70 1.97 -0.05 0.00 0.00 175.22 178.23 2tsb n PHE 111 N 0.39 -1.81 -5.15 3.49 -1.74 -0.34 -1.72 117.46 110.58 2tsb n PHE 111 Ca -0.04 -1.34 -0.29 0.00 -0.56 0.00 0.00 57.45 55.22 2tsb n PHE 111 Cb 0.52 0.66 -0.16 0.00 1.52 0.00 0.00 39.48 42.02 2tsb n PHE 111 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2tsb n THR 113 N 2.70 0.00 -1.67 0.00 -2.24 -1.26 -3.34 114.28 108.46 2tsb n THR 113 Ca -0.16 -0.28 -0.46 0.00 -2.27 0.00 0.00 64.05 60.87 2tsb n THR 113 Cb 0.52 1.23 -0.04 0.00 -2.10 0.00 0.00 70.33 69.94 2tsb n THR 113 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2tsb n PHE 114 N -0.06 2.30 -1.22 4.78 -0.00 -1.26 -4.13 117.46 117.87 2tsb n PHE 114 Ca 0.08 0.21 -0.47 0.00 -0.00 0.00 0.00 57.45 57.27 2tsb n PHE 114 Cb 0.42 -2.57 -0.07 0.00 -0.00 0.00 0.00 39.48 37.27 2tsb n PHE 114 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.76 174.46 2tsb n PRO 115 N 3.96 0.00 -0.04 -7.13 -0.02 -1.26 -1.35 135.00 129.16 2tsb n PRO 115 Ca 0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.66 2tsb n PRO 115 Cb 0.29 -1.07 0.00 0.00 -0.02 0.00 0.00 33.50 32.71 2tsb n PRO 115 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2tsb n GLY 116 N 2.57 2.00 0.28 -1.23 0.00 -1.26 -4.89 105.19 102.66 2tsb n GLY 116 Ca 0.21 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.39 2tsb n GLY 116 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 2tsb h HIS 117 N 0.00 0.00 0.00 1.61 3.86 -1.48 -2.84 115.15 116.30 2tsb h HIS 117 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2tsb h HIS 117 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 2tsb h HIS 117 CO 0.00 0.06 0.00 -1.13 0.86 0.00 0.00 177.93 177.72 2tsb n SER 118 N -3.27 0.00 0.05 2.45 3.41 -1.21 0.78 113.62 115.83 2tsb n SER 118 Ca -0.01 0.15 -0.01 0.00 -0.26 0.00 0.00 58.87 58.74 2tsb n SER 118 Cb 0.25 -0.34 0.27 0.00 -0.26 0.00 0.00 64.21 64.13 2tsb n SER 118 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2tsb h ALA 119 N 2.76 1.24 0.00 7.33 0.00 -1.85 -3.35 119.26 125.39 2tsb h ALA 119 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2tsb h ALA 119 Cb 0.19 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2tsb h ALA 119 CO 0.00 0.50 -0.57 1.28 0.00 0.00 0.00 179.25 180.45 2tsb n LEU 120 N -4.16 0.27 -4.04 0.00 4.77 -0.97 -4.87 117.00 108.00 2tsb n LEU 120 Ca -0.00 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.55 2tsb n LEU 120 Cb 0.36 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.46 2tsb n LEU 120 CO 0.40 0.04 2.06 0.00 -1.33 0.00 0.00 177.39 178.57 2tsb n ALA 121 N -1.47 4.90 -2.91 -1.18 0.00 0.23 -4.69 120.51 115.39 2tsb n ALA 121 Ca 0.00 -4.12 -0.10 0.00 0.00 0.00 0.00 53.44 49.23 2tsb n ALA 121 Cb 0.29 -3.24 -0.06 0.00 0.00 0.00 0.00 19.45 16.44 2tsb n ALA 121 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2tsb s LYS 122 N 1.92 1.12 0.18 0.00 -2.85 -1.26 -2.95 119.74 115.91 2tsb s LYS 122 Ca 0.44 -0.92 -0.09 0.00 -1.00 0.00 0.00 55.97 54.40 2tsb s LYS 122 Cb 0.08 0.43 0.03 0.00 -2.06 0.00 0.00 37.83 36.32 2tsb s LYS 122 CO -0.01 -0.43 0.47 0.41 0.10 0.00 0.00 175.35 175.89 2tsb n GLY 123 N -0.22 1.29 3.45 0.59 0.00 -0.70 -4.58 105.19 105.02 2tsb n GLY 123 Ca -0.12 -1.12 -0.27 0.00 0.00 0.00 0.00 46.02 44.52 2tsb n GLY 123 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2tsb s THR 124 N -2.45 2.49 -0.04 2.61 2.01 0.22 -2.49 115.64 118.00 2tsb s THR 124 Ca 0.10 -1.97 -0.01 0.00 0.31 0.00 0.00 61.69 60.12 2tsb s THR 124 Cb -0.02 -2.20 0.03 0.00 0.01 0.00 0.00 72.50 70.31 2tsb s THR 124 CO 0.05 -0.12 0.02 -0.22 -0.69 0.00 0.00 174.62 173.67 2tsb s LEU 125 N -2.70 0.79 -0.00 4.42 0.20 -0.24 -0.32 118.68 120.83 2tsb s LEU 125 Ca 0.21 0.01 0.01 0.00 0.69 0.00 0.00 54.13 55.05 2tsb s LEU 125 Cb -0.08 -0.20 -0.00 0.00 -0.43 0.00 0.00 46.19 45.48 2tsb s LEU 125 CO 0.11 -0.16 -0.03 0.42 -0.29 0.00 0.00 176.35 176.39 2tsb s THR 126 N 1.47 0.27 -0.28 3.68 -4.23 -0.28 -3.08 115.64 113.18 2tsb s THR 126 Ca -0.04 -0.14 -0.25 0.00 -1.18 0.00 0.00 61.69 60.08 2tsb s THR 126 Cb -0.13 -0.24 0.00 0.00 1.34 0.00 0.00 72.50 73.48 2tsb s THR 126 CO -0.03 0.08 0.85 -0.22 -0.54 0.00 0.00 174.62 174.77 2tsb s LEU 127 N -0.05 4.06 0.00 4.79 2.96 -1.26 -1.21 118.68 127.98 2tsb s LEU 127 Ca 0.01 0.89 0.00 0.00 -0.22 0.00 0.00 54.13 54.81 2tsb s LEU 127 Cb -0.02 -3.20 0.00 0.00 0.50 0.00 0.00 46.19 43.47 2tsb s LEU 127 CO -0.00 -0.62 0.39 0.29 -1.32 0.00 0.00 176.35 175.09