#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ydu s ASP 2 N 0.00 6.48 -0.31 6.43 2.15 -1.26 -4.93 116.67 125.23 1ydu s ASP 2 Ca 0.00 0.51 -0.00 0.00 0.43 0.00 0.00 52.55 53.49 1ydu s ASP 2 Cb 0.00 -2.55 0.13 0.00 -0.30 0.00 0.00 42.92 40.21 1ydu s ASP 2 CO 0.00 -1.37 0.28 -1.58 -0.17 0.00 0.00 175.17 172.32 1ydu s GLN 3 N 4.75 0.39 -0.12 4.34 0.74 -1.26 -5.10 119.66 123.40 1ydu s GLN 3 Ca 0.52 -0.48 -0.00 0.00 0.05 0.00 0.00 55.36 55.45 1ydu s GLN 3 Cb -0.09 -0.81 0.02 0.00 1.10 0.00 0.00 33.01 33.23 1ydu s GLN 3 CO 0.31 -1.08 -0.09 0.42 -0.55 0.00 0.00 175.29 174.29 1ydu s ILE 4 N 1.99 1.13 -0.85 -2.34 1.09 -1.26 -5.07 121.20 115.89 1ydu s ILE 4 Ca 0.12 -0.36 -0.06 0.00 -1.10 0.00 0.00 60.65 59.25 1ydu s ILE 4 Cb -0.15 -1.12 0.22 0.00 -1.06 0.00 0.00 42.46 40.34 1ydu s ILE 4 CO -0.24 0.38 0.75 -0.36 -0.10 0.00 0.00 174.94 175.38 1ydu s PHE 5 N 1.59 3.82 -0.85 3.97 0.08 -1.26 -4.99 117.98 120.34 1ydu s PHE 5 Ca 0.03 -2.68 -0.19 0.00 0.12 0.00 0.00 56.93 54.21 1ydu s PHE 5 Cb -0.13 -3.46 0.12 0.00 -0.57 0.00 0.00 43.02 38.98 1ydu s PHE 5 CO -0.08 -0.85 1.05 1.21 -0.10 0.00 0.00 175.22 176.45 1ydu s ASN 6 N 0.79 6.51 -0.46 1.36 2.47 -1.26 -4.96 114.94 119.39 1ydu s ASN 6 Ca 0.24 -1.81 -0.13 0.00 0.42 0.00 0.00 52.86 51.57 1ydu s ASN 6 Cb -0.12 -2.39 0.08 0.00 -1.45 0.00 0.00 41.25 37.37 1ydu s ASN 6 CO -0.09 -1.13 0.36 -1.59 -3.72 0.00 0.00 177.10 170.94 1ydu s LYS 7 N 2.89 2.85 -0.06 0.43 0.00 -1.26 -5.02 119.74 119.58 1ydu s LYS 7 Ca 0.29 -1.42 -0.05 0.00 0.00 0.00 0.00 55.97 54.78 1ydu s LYS 7 Cb -0.09 -4.03 0.01 0.00 0.00 0.00 0.00 37.83 33.72 1ydu s LYS 7 CO -0.04 -1.03 0.15 0.54 0.00 0.00 0.00 175.35 174.96 1ydu s VAL 8 N 1.56 -0.00 -0.24 1.79 0.11 -1.26 -5.12 120.40 117.24 1ydu s VAL 8 Ca 0.04 0.00 -0.04 0.00 -2.93 0.00 0.00 61.98 59.05 1ydu s VAL 8 Cb -0.24 -0.21 0.09 0.00 -1.53 0.00 0.00 36.38 34.48 1ydu s VAL 8 CO 0.05 0.00 0.15 -0.83 -3.33 0.00 0.00 175.10 171.14 1ydu s GLY 9 N 0.09 0.29 -1.07 6.54 0.00 -1.26 -5.06 107.32 106.84 1ydu s GLY 9 Ca -0.00 -0.53 -0.22 0.00 0.00 0.00 0.00 44.72 43.97 1ydu s GLY 9 CO 0.00 2.05 1.72 -0.56 0.00 0.00 0.00 173.10 176.32 1ydu s SER 10 N 2.18 5.95 -0.22 1.64 0.01 -1.26 -4.88 113.70 117.12 1ydu s SER 10 Ca 0.06 -1.47 0.00 0.00 1.31 0.00 0.00 55.95 55.86 1ydu s SER 10 Cb -0.16 -2.57 0.03 0.00 0.21 0.00 0.00 66.02 63.53 1ydu s SER 10 CO -0.24 -2.04 -0.12 -0.47 0.41 0.00 0.00 173.24 170.78 1ydu s TYR 11 N 7.23 2.98 -0.45 2.43 5.04 -1.26 -5.07 117.35 128.24 1ydu s TYR 11 Ca 0.58 -1.69 -0.25 0.00 -2.44 0.00 0.00 57.07 53.27 1ydu s TYR 11 Cb -0.01 -1.98 0.03 0.00 0.35 0.00 0.00 41.96 40.34 1ydu s TYR 11 CO -0.00 -0.78 0.89 -0.46 -1.34 0.00 0.00 175.55 173.87 1ydu s TRP 12 N 1.28 2.95 -0.76 4.97 -0.00 -1.26 -4.96 118.94 121.15 1ydu s TRP 12 Ca 0.01 0.36 -0.25 0.00 -0.00 0.00 0.00 56.10 56.22 1ydu s TRP 12 Cb -0.16 -3.88 0.05 0.00 -0.00 0.00 0.00 33.47 29.49 1ydu s TRP 12 CO -0.08 -1.06 1.19 -1.17 -0.00 0.00 0.00 176.95 175.83 1ydu s LEU 13 N 3.63 3.73 -0.27 5.86 2.96 -1.26 -4.93 118.68 128.40 1ydu s LEU 13 Ca 0.35 -0.85 0.01 0.00 -0.22 0.00 0.00 54.13 53.42 1ydu s LEU 13 Cb -0.11 -2.50 0.08 0.00 0.50 0.00 0.00 46.19 44.16 1ydu s LEU 13 CO 0.25 -1.62 0.02 -0.83 -1.32 0.00 0.00 176.35 172.85 1ydu s GLY 14 N 3.86 1.28 -0.93 7.98 0.00 -1.26 -5.06 107.32 113.20 1ydu s GLY 14 Ca 0.32 -1.60 -0.24 0.00 0.00 0.00 0.00 44.72 43.20 1ydu s GLY 14 CO 0.09 1.19 1.42 1.62 0.00 0.00 0.00 173.10 177.41 1ydu s GLN 15 N 1.42 3.44 -0.67 2.90 0.74 -1.26 -4.93 119.66 121.29 1ydu s GLN 15 Ca 0.02 -0.82 -0.18 0.00 0.05 0.00 0.00 55.36 54.43 1ydu s GLN 15 Cb -0.18 -5.00 0.12 0.00 1.10 0.00 0.00 33.01 29.05 1ydu s GLN 15 CO -0.12 -2.23 0.79 -1.59 -0.55 0.00 0.00 175.29 171.59 1ydu s LYS 16 N 5.27 3.20 -0.51 1.67 -2.85 -1.26 -4.99 119.74 120.27 1ydu s LYS 16 Ca 0.44 -1.50 -0.03 0.00 -1.00 0.00 0.00 55.97 53.87 1ydu s LYS 16 Cb -0.03 -4.38 0.13 0.00 -2.06 0.00 0.00 37.83 31.50 1ydu s LYS 16 CO -0.02 -1.56 0.32 0.00 0.10 0.00 0.00 175.35 174.19 1ydu s ALA 17 N 2.45 3.37 -0.47 0.59 0.00 -1.26 -4.90 121.76 121.54 1ydu s ALA 17 Ca 0.16 -2.87 0.06 0.00 0.00 0.00 0.00 51.96 49.31 1ydu s ALA 17 Cb -0.19 -2.56 0.20 0.00 0.00 0.00 0.00 23.12 20.56 1ydu s ALA 17 CO 0.02 -1.95 0.64 -1.71 0.00 0.00 0.00 175.76 172.76 1ydu n ASN 18 N 4.12 -2.24 -2.73 0.00 5.15 -1.26 -5.03 115.26 113.27 1ydu n ASN 18 Ca 0.02 -2.83 -0.02 0.00 -0.60 0.00 0.00 54.58 51.14 1ydu n ASN 18 Cb 0.40 0.94 0.02 0.00 -0.53 0.00 0.00 39.78 40.61 1ydu n ASN 18 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 1ydu s LYS 19 N 0.42 0.41 -0.05 1.20 2.47 -1.26 -5.15 119.74 117.78 1ydu s LYS 19 Ca 0.32 -0.37 -0.06 0.00 -1.56 0.00 0.00 55.97 54.30 1ydu s LYS 19 Cb 0.07 -0.01 0.01 0.00 -1.46 0.00 0.00 37.83 36.45 1ydu s LYS 19 CO -0.13 -0.52 0.16 -1.14 0.16 0.00 0.00 175.35 173.87 1ydu s GLN 20 N 1.13 0.21 -0.14 4.03 2.00 -1.26 -5.13 119.66 120.51 1ydu s GLN 20 Ca 0.23 0.16 -0.01 0.00 -2.00 0.00 0.00 55.36 53.74 1ydu s GLN 20 Cb 0.08 0.10 0.04 0.00 0.80 0.00 0.00 33.01 34.03 1ydu s GLN 20 CO -0.10 -0.03 -0.03 -0.06 -0.50 0.00 0.00 175.29 174.57 1ydu s PHE 21 N -0.07 1.33 -0.25 1.67 0.40 -1.26 -5.10 117.98 114.71 1ydu s PHE 21 Ca -0.01 -0.79 -0.26 0.00 -0.60 0.00 0.00 56.93 55.26 1ydu s PHE 21 Cb -0.02 -1.14 0.00 0.00 0.51 0.00 0.00 43.02 42.37 1ydu s PHE 21 CO 0.00 -0.54 0.91 0.34 0.70 0.00 0.00 175.22 176.64 1ydu s ASP 22 N 1.76 6.92 0.02 1.36 2.15 -1.26 -5.02 116.67 122.60 1ydu s ASP 22 Ca 0.02 1.13 0.03 0.00 0.43 0.00 0.00 52.55 54.16 1ydu s ASP 22 Cb -0.14 -2.48 -0.01 0.00 -0.30 0.00 0.00 42.92 39.99 1ydu s ASP 22 CO -0.07 -0.59 -0.11 -0.94 -0.17 0.00 0.00 175.17 173.29 1ydu s SER 23 N 1.33 1.23 0.65 -0.34 1.04 -1.26 -5.14 113.70 111.21 1ydu s SER 23 Ca 0.38 -0.32 -0.08 0.00 0.48 0.00 0.00 55.95 56.41 1ydu s SER 23 Cb -0.15 -0.09 0.02 0.00 0.10 0.00 0.00 66.02 65.91 1ydu s SER 23 CO 0.08 0.03 0.98 0.68 0.98 0.00 0.00 173.24 175.99 1ydu s VAL 24 N -0.61 3.24 0.00 5.02 -7.23 -1.26 -5.05 120.40 114.51 1ydu s VAL 24 Ca 0.01 0.05 0.00 0.00 -1.81 0.00 0.00 61.98 60.23 1ydu s VAL 24 Cb -0.06 -3.34 0.00 0.00 0.56 0.00 0.00 36.38 33.54 1ydu s VAL 24 CO 0.00 -0.38 0.00 0.61 -0.31 0.00 0.00 175.10 175.02 1ydu n GLY 25 N -2.78 2.29 3.09 2.32 0.00 -1.26 -5.10 105.19 103.75 1ydu n GLY 25 Ca 0.06 -1.41 -0.32 0.00 0.00 0.00 0.00 46.02 44.34 1ydu n GLY 25 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ydu s ASN 26 N 0.00 4.21 -0.33 1.61 3.84 -1.26 -5.03 114.94 117.98 1ydu s ASN 26 Ca 0.00 -1.22 -0.01 0.00 0.21 0.00 0.00 52.86 51.83 1ydu s ASN 26 Cb 0.00 -1.55 0.11 0.00 -0.55 0.00 0.00 41.25 39.26 1ydu s ASN 26 CO 0.00 -0.15 0.15 1.51 -2.79 0.00 0.00 177.10 175.82 1ydu s ASP 27 N 1.15 3.57 -0.26 -4.21 -4.77 -1.26 -5.06 116.67 105.83 1ydu s ASP 27 Ca -0.06 -1.75 -0.01 0.00 -3.30 0.00 0.00 52.55 47.43 1ydu s ASP 27 Cb -0.18 -0.60 0.15 0.00 -1.09 0.00 0.00 42.92 41.20 1ydu s ASP 27 CO -0.06 -0.38 0.42 -0.22 0.70 0.00 0.00 175.17 175.62 1ydu s LEU 28 N 1.52 -0.79 -0.24 2.11 1.98 -1.26 -5.10 118.68 116.91 1ydu s LEU 28 Ca 0.12 0.11 -0.04 0.00 -2.89 0.00 0.00 54.13 51.43 1ydu s LEU 28 Cb -0.19 1.25 0.08 0.00 0.66 0.00 0.00 46.19 47.99 1ydu s LEU 28 CO -0.21 -0.31 0.11 0.21 -1.89 0.00 0.00 176.35 174.26 1ydu s ASN 29 N 2.59 3.04 -1.21 3.68 3.84 -1.26 -5.06 114.94 120.55 1ydu s ASN 29 Ca 0.13 -1.00 -0.10 0.00 0.21 0.00 0.00 52.86 52.09 1ydu s ASN 29 Cb -0.14 -0.31 0.20 0.00 -0.55 0.00 0.00 41.25 40.45 1ydu s ASN 29 CO -0.21 -0.40 1.60 -1.20 -2.79 0.00 0.00 177.10 174.10 1ydu n SER 30 N 5.26 5.37 0.00 -4.21 7.64 -1.26 -4.63 113.62 121.79 1ydu n SER 30 Ca -0.06 -3.10 0.00 0.00 1.01 0.00 0.00 58.87 56.71 1ydu n SER 30 Cb 0.45 -1.47 0.00 0.00 -1.01 0.00 0.00 64.21 62.18 1ydu n SER 30 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 1ydu n VAL 31 N 3.40 0.00 0.04 0.44 3.14 -1.26 -4.97 118.33 119.12 1ydu n VAL 31 Ca 0.35 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.73 1ydu n VAL 31 Cb 0.38 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.16 1ydu n VAL 31 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 1ydu n SER 32 N 0.00 -0.03 -2.94 6.55 3.41 -1.26 -5.03 113.62 114.32 1ydu n SER 32 Ca 0.00 0.13 -0.20 0.00 -0.26 0.00 0.00 58.87 58.54 1ydu n SER 32 Cb 0.00 0.10 0.06 0.00 -0.26 0.00 0.00 64.21 64.11 1ydu n SER 32 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1ydu n THR 33 N -2.79 -2.30 -2.02 6.66 -1.04 -1.26 -4.92 114.28 106.61 1ydu n THR 33 Ca 0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.59 1ydu n THR 33 Cb 0.03 -3.46 -0.03 0.00 -1.82 0.00 0.00 70.33 65.05 1ydu n THR 33 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1ydu s SER 34 N -3.15 6.56 -1.11 8.00 1.04 -1.26 -4.90 113.70 118.87 1ydu s SER 34 Ca 0.44 2.08 -0.21 0.00 0.48 0.00 0.00 55.95 58.74 1ydu s SER 34 Cb -0.19 -2.53 0.07 0.00 0.10 0.00 0.00 66.02 63.46 1ydu s SER 34 CO 0.54 -1.03 1.52 -0.63 0.98 0.00 0.00 173.24 174.61 1ydu s ILE 35 N 4.44 4.09 0.34 -1.02 -1.09 -1.26 -4.91 121.20 121.79 1ydu s ILE 35 Ca 0.74 -1.28 0.09 0.00 -2.23 0.00 0.00 60.65 57.97 1ydu s ILE 35 Cb -0.31 -5.08 -0.07 0.00 -1.58 0.00 0.00 42.46 35.42 1ydu s ILE 35 CO 0.29 -1.92 -0.08 -1.61 -1.23 0.00 0.00 174.94 170.39 1ydu s GLU 36 N 4.42 1.79 0.00 2.79 0.41 -1.26 -5.09 118.70 121.76 1ydu s GLU 36 Ca 0.47 -1.93 0.00 0.00 -0.41 0.00 0.00 54.97 53.10 1ydu s GLU 36 Cb 0.01 -1.61 0.00 0.00 -1.78 0.00 0.00 34.13 30.75 1ydu s GLU 36 CO -0.04 0.10 0.00 0.41 -0.49 0.00 0.00 175.26 175.25 1ydu n GLY 37 N -0.78 2.27 0.00 -1.39 0.00 -1.26 -4.68 105.19 99.35 1ydu n GLY 37 Ca -0.05 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.57 1ydu n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ydu n GLY 38 N 2.20 1.37 3.49 -0.02 0.00 -1.26 -4.48 105.19 106.49 1ydu n GLY 38 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1ydu n GLY 38 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ydu s THR 39 N -1.64 4.95 -0.61 2.61 2.01 -1.26 -5.00 115.64 116.70 1ydu s THR 39 Ca 0.00 -0.17 -0.02 0.00 0.31 0.00 0.00 61.69 61.82 1ydu s THR 39 Cb 0.00 -4.14 0.16 0.00 0.01 0.00 0.00 72.50 68.53 1ydu s THR 39 CO 0.00 -0.54 0.41 -1.59 -0.69 0.00 0.00 174.62 172.21 1ydu s LYS 40 N 2.48 2.47 -0.01 4.92 0.00 -1.26 -4.18 119.74 124.16 1ydu s LYS 40 Ca 0.17 -2.57 -0.04 0.00 0.00 0.00 0.00 55.97 53.53 1ydu s LYS 40 Cb -0.16 -3.66 -0.02 0.00 0.00 0.00 0.00 37.83 33.99 1ydu s LYS 40 CO 0.16 -1.16 -0.09 1.87 0.00 0.00 0.00 175.35 176.12 1ydu n TRP 41 N 3.38 0.00 -3.66 1.78 -0.00 -1.26 -5.08 117.44 112.60 1ydu n TRP 41 Ca 0.08 0.00 -0.12 0.00 -0.00 0.00 0.00 57.50 57.45 1ydu n TRP 41 Cb 0.37 -0.18 -0.08 0.00 -0.00 0.00 0.00 31.31 31.42 1ydu n TRP 41 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 177.69 176.52 1ydu s LEU 42 N -6.95 -0.46 -0.10 5.87 0.20 -1.26 -5.10 118.68 110.87 1ydu s LEU 42 Ca -0.09 1.28 -0.02 0.00 0.69 0.00 0.00 54.13 55.99 1ydu s LEU 42 Cb 0.02 2.14 -0.01 0.00 -0.43 0.00 0.00 46.19 47.91 1ydu s LEU 42 CO 0.12 -0.22 -0.04 0.58 -0.29 0.00 0.00 176.35 176.50 1ydu h VAL 43 N 4.37 0.00 -1.42 1.68 2.07 -1.89 -3.47 116.25 117.59 1ydu h VAL 43 Ca -0.29 -0.95 0.00 0.00 0.82 0.00 0.00 66.70 66.28 1ydu h VAL 43 Cb 1.18 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 1ydu h VAL 43 CO 0.13 0.00 -0.36 -3.20 0.02 0.00 0.00 177.57 174.16 1ydu n ASN 44 N -4.60 -3.58 -4.42 0.57 5.15 -1.26 -4.62 115.26 102.49 1ydu n ASN 44 Ca -0.02 0.59 -0.45 0.00 -0.60 0.00 0.00 54.58 54.10 1ydu n ASN 44 Cb 0.06 -1.27 -0.02 0.00 -0.53 0.00 0.00 39.78 38.02 1ydu n ASN 44 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1ydu s LYS 45 N -4.84 3.66 0.00 1.20 1.02 -1.26 -4.85 119.74 114.67 1ydu s LYS 45 Ca 0.00 -2.03 0.00 0.00 0.02 0.00 0.00 55.97 53.96 1ydu s LYS 45 Cb 0.00 -4.81 0.00 0.00 -0.52 0.00 0.00 37.83 32.50 1ydu s LYS 45 CO 0.00 -1.65 0.00 1.51 -0.92 0.00 0.00 175.35 174.29 1ydu n ILE 46 N 5.00 0.00 -3.94 2.17 3.06 -1.26 -5.20 119.36 119.18 1ydu n ILE 46 Ca 0.23 0.00 -0.09 0.00 -2.50 0.00 0.00 62.75 60.38 1ydu n ILE 46 Cb 0.48 0.00 -0.03 0.00 0.54 0.00 0.00 39.64 40.63 1ydu n ILE 46 CO 0.00 0.00 0.00 -1.59 -2.50 0.00 0.00 176.55 172.46 1ydu s LYS 47 N -2.00 1.77 0.00 9.51 0.00 -1.26 -4.86 119.74 122.90 1ydu s LYS 47 Ca 0.00 -1.28 0.00 0.00 0.00 0.00 0.00 55.97 54.69 1ydu s LYS 47 Cb 0.00 0.53 0.00 0.00 0.00 0.00 0.00 37.83 38.36 1ydu s LYS 47 CO 0.00 -0.78 0.00 0.41 0.00 0.00 0.00 175.35 174.98 1ydu n GLY 48 N -0.45 -0.53 3.55 0.59 0.00 -1.26 -4.94 105.19 102.15 1ydu n GLY 48 Ca -0.03 -0.29 -0.40 0.00 0.00 0.00 0.00 46.02 45.30 1ydu n GLY 48 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ydu s LYS 49 N -0.86 3.07 -0.46 1.61 2.20 -1.26 -4.89 119.74 119.15 1ydu s LYS 49 Ca 0.00 -0.09 -0.27 0.00 -0.36 0.00 0.00 55.97 55.25 1ydu s LYS 49 Cb 0.00 -4.32 -0.04 0.00 -1.51 0.00 0.00 37.83 31.96 1ydu s LYS 49 CO 0.00 -2.32 2.05 1.41 -0.36 0.00 0.00 175.35 176.13 1ydu s MET 50 N 6.03 2.70 0.08 4.03 -2.45 -1.26 -4.95 119.30 123.47 1ydu s MET 50 Ca 0.44 1.21 0.01 0.00 -1.25 0.00 0.00 55.69 56.10 1ydu s MET 50 Cb -0.09 -4.40 0.01 0.00 1.25 0.00 0.00 34.83 31.61 1ydu s MET 50 CO 0.15 -2.61 0.10 1.04 1.05 0.00 0.00 175.02 174.75 1ydu n GLN 51 N 8.90 0.99 -2.44 4.11 1.13 -1.26 -5.07 117.38 123.74 1ydu n GLN 51 Ca 0.27 -0.42 -0.40 0.00 -1.94 0.00 0.00 57.00 54.50 1ydu n GLN 51 Cb 0.51 -0.02 -0.04 0.00 0.11 0.00 0.00 30.24 30.79 1ydu n GLN 51 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 1ydu s LYS 52 N -2.35 4.60 0.00 -1.09 1.02 -1.26 -4.87 119.74 115.79 1ydu s LYS 52 Ca 0.08 1.84 0.00 0.00 0.02 0.00 0.00 55.97 57.91 1ydu s LYS 52 Cb -0.01 -3.17 0.00 0.00 -0.52 0.00 0.00 37.83 34.14 1ydu s LYS 52 CO 0.05 0.17 0.05 -0.35 -0.92 0.00 0.00 175.35 174.34 1ydu n PRO 53 N 1.13 0.05 0.01 -1.68 -0.04 -1.26 -4.32 135.00 128.88 1ydu n PRO 53 Ca -0.01 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.32 1ydu n PRO 53 Cb 0.45 -1.48 -0.09 0.00 -0.04 0.00 0.00 33.50 32.34 1ydu n PRO 53 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1ydu h LEU 54 N 1.96 -0.00 -0.76 1.53 4.07 -1.97 -3.24 115.31 116.90 1ydu h LEU 54 Ca 0.00 -0.29 0.00 0.00 0.08 0.00 0.00 57.88 57.67 1ydu h LEU 54 Cb 0.05 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.79 1ydu h LEU 54 CO 0.00 0.29 0.00 -2.65 -1.08 0.00 0.00 178.44 175.00 1ydu n PRO 55 N -4.95 0.09 0.09 1.13 -0.02 -1.26 -0.19 135.00 129.89 1ydu n PRO 55 Ca -0.08 0.53 -0.05 0.00 -2.02 0.00 0.00 63.50 61.88 1ydu n PRO 55 Cb 0.16 -1.76 0.11 0.00 -0.02 0.00 0.00 33.50 31.99 1ydu n PRO 55 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1ydu h GLU 56 N 0.00 0.20 -0.05 -0.52 4.39 -1.85 0.20 114.58 116.95 1ydu h GLU 56 Ca 0.00 -0.15 -0.14 0.00 0.34 0.00 0.00 59.36 59.41 1ydu h GLU 56 Cb 0.07 0.03 0.01 0.00 -0.10 0.00 0.00 28.75 28.76 1ydu h GLU 56 CO 0.00 0.77 -0.51 -0.07 -1.16 0.00 0.00 179.01 178.04 1ydu h LEU 57 N 0.15 0.54 -1.15 1.33 -0.00 -0.73 -2.74 115.31 112.70 1ydu h LEU 57 Ca -0.01 -0.70 0.03 0.00 -0.00 0.00 0.00 57.88 57.20 1ydu h LEU 57 Cb 1.16 -0.16 -0.05 0.00 -0.00 0.00 0.00 40.66 41.60 1ydu h LEU 57 CO 0.10 1.16 0.58 -0.07 -0.00 0.00 0.00 178.44 180.20 1ydu h LEU 58 N -0.03 0.96 -0.40 1.67 4.07 -1.23 -0.21 115.31 120.13 1ydu h LEU 58 Ca -0.05 -0.01 -0.15 0.00 0.08 0.00 0.00 57.88 57.74 1ydu h LEU 58 Cb 1.19 -0.23 -0.02 0.00 1.08 0.00 0.00 40.66 42.68 1ydu h LEU 58 CO 0.10 0.67 -0.74 0.07 -1.08 0.00 0.00 178.44 177.46 1ydu h LYS 59 N 1.12 0.00 0.00 1.13 5.09 -1.02 -3.27 116.57 119.62 1ydu h LYS 59 Ca 0.34 0.00 -0.13 0.00 0.09 0.00 0.00 60.65 60.95 1ydu h LYS 59 Cb -0.01 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 32.30 1ydu h LYS 59 CO -0.10 0.74 -0.63 1.05 -2.09 0.00 0.00 179.45 178.42 1ydu h GLU 60 N 0.00 0.00 -0.35 0.07 4.11 -0.77 -3.13 114.58 114.51 1ydu h GLU 60 Ca -0.01 0.00 0.04 0.00 0.07 0.00 0.00 59.36 59.46 1ydu h GLU 60 Cb 1.37 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.59 1ydu h GLU 60 CO 0.10 0.63 0.12 1.88 0.07 0.00 0.00 179.01 181.80 1ydu h TYR 61 N 0.00 0.22 0.00 2.06 0.05 -1.26 -3.43 116.97 114.60 1ydu h TYR 61 Ca -0.01 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.79 1ydu h TYR 61 Cb 1.37 -0.05 0.00 0.00 1.01 0.00 0.00 36.73 39.06 1ydu h TYR 61 CO 0.00 0.09 0.00 -0.25 -1.05 0.00 0.00 178.16 176.95 1ydu n ASP 62 N -5.02 0.00 -4.42 3.88 8.00 -1.21 -4.91 116.55 112.87 1ydu n ASP 62 Ca 0.01 0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.18 1ydu n ASP 62 Cb 0.12 0.00 -0.14 0.00 -0.02 0.00 0.00 41.12 41.08 1ydu n ASP 62 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1ydu s LEU 63 N -1.01 2.60 -0.15 0.64 2.01 -1.19 -4.42 118.68 117.15 1ydu s LEU 63 Ca 0.00 -0.28 0.07 0.00 0.01 0.00 0.00 54.13 53.93 1ydu s LEU 63 Cb 0.00 -1.53 0.47 0.00 0.01 0.00 0.00 46.19 45.14 1ydu s LEU 63 CO 0.00 0.30 1.26 -0.81 1.01 0.00 0.00 176.35 178.11 1ydu n PRO 64 N 2.62 3.07 -0.36 1.29 -0.05 -1.24 -3.92 135.00 136.41 1ydu n PRO 64 Ca -0.17 -1.81 -0.00 0.00 -0.05 0.00 0.00 63.50 61.46 1ydu n PRO 64 Cb 0.52 -1.91 0.13 0.00 -0.05 0.00 0.00 33.50 32.19 1ydu n PRO 64 CO 0.00 0.00 0.00 -0.84 -0.05 0.00 0.00 175.50 174.61 1ydu h ILE 65 N 2.10 1.18 0.00 0.52 -2.65 -1.87 -3.45 117.51 113.34 1ydu h ILE 65 Ca 0.05 -0.43 0.00 0.00 1.03 0.00 0.00 64.86 65.51 1ydu h ILE 65 Cb 1.45 -0.18 0.00 0.00 -2.05 0.00 0.00 36.82 36.04 1ydu h ILE 65 CO 0.33 0.23 0.00 0.61 0.03 0.00 0.00 178.15 179.35 1ydu n GLY 66 N -1.36 0.00 5.00 0.16 0.00 -1.25 -4.08 105.19 103.65 1ydu n GLY 66 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1ydu n GLY 66 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1ydu n ILE 67 N -1.88 0.00 0.01 -0.61 5.41 -1.26 -3.89 119.36 117.14 1ydu n ILE 67 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 1ydu n ILE 67 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 1ydu n ILE 67 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 176.55 176.88 1ydu n PHE 68 N 0.00 -1.02 0.00 1.39 7.35 -1.26 -0.73 117.46 123.19 1ydu n PHE 68 Ca 0.00 0.06 -0.05 0.00 -0.76 0.00 0.00 57.45 56.71 1ydu n PHE 68 Cb 0.00 0.32 -0.11 0.00 0.35 0.00 0.00 39.48 40.04 1ydu n PHE 68 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 1ydu n PRO 69 N -2.35 0.63 0.00 -7.13 -0.05 -1.26 -4.95 135.00 119.89 1ydu n PRO 69 Ca 0.00 0.26 0.00 0.00 -0.05 0.00 0.00 63.50 63.71 1ydu n PRO 69 Cb 0.00 -1.80 0.00 0.00 -0.05 0.00 0.00 33.50 31.65 1ydu n PRO 69 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 175.50 175.86 1ydu n GLY 70 N 1.48 2.96 0.07 0.55 0.00 -1.25 -4.84 105.19 104.16 1ydu n GLY 70 Ca -0.13 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.76 1ydu n GLY 70 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ydu h ASP 71 N 0.00 -0.02 -4.11 1.61 5.19 -1.92 -3.43 116.42 113.74 1ydu h ASP 71 Ca 0.00 -0.72 -0.45 0.00 -0.62 0.00 0.00 57.03 55.24 1ydu h ASP 71 Cb 0.00 0.00 0.14 0.00 0.18 0.00 0.00 39.33 39.66 1ydu h ASP 71 CO 0.00 0.73 0.27 0.00 -3.12 0.00 0.00 179.24 177.12 1ydu s ALA 72 N -3.13 1.54 0.00 3.45 0.00 -1.26 -4.61 121.76 117.75 1ydu s ALA 72 Ca -0.17 -0.56 0.00 0.00 0.00 0.00 0.00 51.96 51.24 1ydu s ALA 72 Cb -0.01 -3.03 0.00 0.00 0.00 0.00 0.00 23.12 20.08 1ydu s ALA 72 CO 0.64 -2.50 0.00 2.41 0.00 0.00 0.00 175.76 176.32 1ydu n THR 73 N -3.92 0.00 -2.34 0.00 -1.04 -1.09 -4.86 114.28 101.03 1ydu n THR 73 Ca 0.07 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.96 1ydu n THR 73 Cb 0.59 -0.26 0.06 0.00 -1.82 0.00 0.00 70.33 68.91 1ydu n THR 73 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1ydu n ASN 74 N 1.02 0.62 -3.74 8.00 3.02 -1.25 -3.87 115.26 119.06 1ydu n ASN 74 Ca 0.00 -1.54 -0.12 0.00 -0.03 0.00 0.00 54.58 52.88 1ydu n ASN 74 Cb 0.22 -0.34 -0.11 0.00 -0.61 0.00 0.00 39.78 38.93 1ydu n ASN 74 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 1ydu s TYR 75 N -1.54 -0.39 -0.02 3.10 -0.85 -1.26 -3.95 117.35 112.43 1ydu s TYR 75 Ca 0.34 0.92 -0.06 0.00 -0.52 0.00 0.00 57.07 57.75 1ydu s TYR 75 Cb -0.02 0.13 0.00 0.00 0.38 0.00 0.00 41.96 42.46 1ydu s TYR 75 CO 0.23 -0.21 0.13 -1.21 -1.52 0.00 0.00 175.55 172.96 1ydu s GLU 76 N 0.62 0.35 -0.00 -3.49 0.41 0.01 -4.75 118.70 111.85 1ydu s GLU 76 Ca -0.04 -0.18 -0.15 0.00 -0.41 0.00 0.00 54.97 54.20 1ydu s GLU 76 Cb -0.05 0.15 0.02 0.00 -1.78 0.00 0.00 34.13 32.47 1ydu s GLU 76 CO -0.04 -0.07 0.31 -0.59 -0.49 0.00 0.00 175.26 174.38 1ydu s PHE 77 N -0.82 -0.17 0.38 1.61 -0.12 -1.26 0.40 117.98 118.01 1ydu s PHE 77 Ca -0.09 0.21 0.02 0.00 -0.05 0.00 0.00 56.93 57.02 1ydu s PHE 77 Cb -0.05 0.10 -0.01 0.00 -0.63 0.00 0.00 43.02 42.42 1ydu s PHE 77 CO 0.01 -0.41 0.58 -0.51 -0.05 0.00 0.00 175.22 174.83 1ydu s ASP 78 N -1.47 6.02 -0.08 1.98 1.01 -1.25 -5.00 116.67 117.89 1ydu s ASP 78 Ca -0.12 0.22 -0.01 0.00 0.71 0.00 0.00 52.55 53.35 1ydu s ASP 78 Cb -0.04 -1.63 -0.00 0.00 1.01 0.00 0.00 42.92 42.25 1ydu s ASP 78 CO 0.03 -0.50 -0.01 -0.08 0.21 0.00 0.00 175.17 174.82 1ydu h GLU 79 N 0.64 0.00 0.10 8.23 4.81 -1.96 -2.71 114.58 123.69 1ydu h GLU 79 Ca -0.47 0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 58.47 1ydu h GLU 79 Cb 1.24 0.00 0.03 0.00 0.63 0.00 0.00 28.75 30.65 1ydu h GLU 79 CO 0.58 0.00 -1.18 1.49 -0.73 0.00 0.00 179.01 179.17 1ydu h GLU 80 N -0.76 0.62 -0.50 1.92 4.81 -2.02 -3.23 114.58 115.43 1ydu h GLU 80 Ca 0.00 -0.80 -0.10 0.00 -0.13 0.00 0.00 59.36 58.33 1ydu h GLU 80 Cb 0.04 0.26 -0.02 0.00 0.63 0.00 0.00 28.75 29.66 1ydu h GLU 80 CO 0.00 1.36 -0.09 1.15 -0.73 0.00 0.00 179.01 180.70 1ydu h THR 81 N 0.25 1.26 0.00 0.32 2.02 -2.00 -3.46 112.91 111.30 1ydu h THR 81 Ca -0.18 -1.20 0.00 0.00 0.77 0.00 0.00 66.41 65.80 1ydu h THR 81 Cb 1.85 0.97 0.00 0.00 -1.74 0.00 0.00 68.15 69.24 1ydu h THR 81 CO 0.23 0.42 0.00 0.29 0.37 0.00 0.00 175.52 176.83 1ydu n LYS 82 N -4.16 -1.38 -2.76 6.66 5.02 -1.02 -4.92 118.16 115.59 1ydu n LYS 82 Ca 0.02 0.35 -0.43 0.00 -2.02 0.00 0.00 58.31 56.23 1ydu n LYS 82 Cb 0.38 -4.72 -0.03 0.00 -0.02 0.00 0.00 35.03 30.63 1ydu n LYS 82 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1ydu s LYS 83 N -1.61 3.80 0.11 1.97 2.20 -1.26 -4.82 119.74 120.13 1ydu s LYS 83 Ca 0.00 0.56 -0.30 0.00 -0.36 0.00 0.00 55.97 55.87 1ydu s LYS 83 Cb 0.00 -3.83 -0.06 0.00 -1.51 0.00 0.00 37.83 32.43 1ydu s LYS 83 CO 0.00 -1.04 0.97 -1.17 -0.36 0.00 0.00 175.35 173.74 1ydu s LEU 84 N 3.67 4.50 -0.10 5.43 1.98 0.33 -3.74 118.68 130.75 1ydu s LEU 84 Ca 0.40 1.80 0.04 0.00 -2.89 0.00 0.00 54.13 53.48 1ydu s LEU 84 Cb -0.11 -3.59 0.00 0.00 0.66 0.00 0.00 46.19 43.15 1ydu s LEU 84 CO 0.21 -0.07 -0.23 0.28 -1.89 0.00 0.00 176.35 174.65 1ydu s THR 85 N -0.01 1.96 -0.15 3.68 -1.32 0.16 -0.20 115.64 119.77 1ydu s THR 85 Ca 0.47 -0.96 -0.07 0.00 -1.21 0.00 0.00 61.69 59.92 1ydu s THR 85 Cb -0.23 -1.71 -0.04 0.00 -1.51 0.00 0.00 72.50 69.01 1ydu s THR 85 CO 0.30 0.54 0.08 -0.69 -2.21 0.00 0.00 174.62 172.64 1ydu s VAL 86 N 0.40 4.95 -0.33 5.08 1.01 1.00 -0.81 120.40 131.71 1ydu s VAL 86 Ca -0.18 0.01 -0.27 0.00 0.00 0.00 0.00 61.98 61.54 1ydu s VAL 86 Cb -0.18 -3.19 0.01 0.00 0.00 0.00 0.00 36.38 33.02 1ydu s VAL 86 CO 0.08 0.52 1.00 -0.76 0.00 0.00 0.00 175.10 175.94 1ydu s LEU 87 N -0.18 3.96 -0.29 3.92 2.01 -1.25 -1.73 118.68 125.11 1ydu s LEU 87 Ca 0.08 0.87 0.02 0.00 0.01 0.00 0.00 54.13 55.11 1ydu s LEU 87 Cb -0.12 -3.41 0.08 0.00 0.01 0.00 0.00 46.19 42.76 1ydu s LEU 87 CO 0.01 -0.84 0.02 -0.63 1.01 0.00 0.00 176.35 175.92 1ydu s ILE 88 N 3.52 1.68 -0.25 -0.59 1.01 0.96 -2.66 121.20 124.88 1ydu s ILE 88 Ca 0.42 -1.71 -0.31 0.00 0.00 0.00 0.00 60.65 59.05 1ydu s ILE 88 Cb -0.12 -2.12 -0.08 0.00 0.01 0.00 0.00 42.46 40.15 1ydu s ILE 88 CO 0.16 -0.42 2.19 -2.65 0.00 0.00 0.00 174.94 174.21 1ydu n PRO 89 N 4.54 1.70 -0.38 2.79 -0.02 -1.26 -3.87 135.00 138.50 1ydu n PRO 89 Ca -0.04 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 1ydu n PRO 89 Cb 0.43 -2.94 0.00 0.00 -0.02 0.00 0.00 33.50 30.97 1ydu n PRO 89 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1ydu n SER 90 N 10.69 -2.08 -4.66 2.55 7.64 -1.26 -3.82 113.62 122.67 1ydu n SER 90 Ca 0.33 0.45 -0.43 0.00 1.01 0.00 0.00 58.87 60.23 1ydu n SER 90 Cb 0.36 -0.46 -0.02 0.00 -1.01 0.00 0.00 64.21 63.08 1ydu n SER 90 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1ydu s ILE 91 N -4.24 4.72 -0.25 0.44 1.09 -1.26 -4.44 121.20 117.26 1ydu s ILE 91 Ca 0.00 1.96 -0.14 0.00 -1.10 0.00 0.00 60.65 61.36 1ydu s ILE 91 Cb 0.00 -4.28 -0.04 0.00 -1.06 0.00 0.00 42.46 37.08 1ydu s ILE 91 CO 0.00 -0.14 0.34 0.00 -0.10 0.00 0.00 174.94 175.04 1ydu s GLU 93 N 1.79 3.16 -0.35 0.00 2.02 -1.26 -0.15 118.70 123.91 1ydu s GLU 93 Ca 0.14 -0.75 -0.01 0.00 0.02 0.00 0.00 54.97 54.37 1ydu s GLU 93 Cb -0.15 -2.70 0.09 0.00 0.10 0.00 0.00 34.13 31.46 1ydu s GLU 93 CO 0.09 -0.14 0.09 0.14 0.02 0.00 0.00 175.26 175.46 1ydu s VAL 94 N 1.20 2.95 -0.01 2.63 -7.23 0.04 -4.96 120.40 115.01 1ydu s VAL 94 Ca 0.02 -1.88 -0.08 0.00 -1.81 0.00 0.00 61.98 58.23 1ydu s VAL 94 Cb -0.14 -2.93 0.01 0.00 0.56 0.00 0.00 36.38 33.88 1ydu s VAL 94 CO -0.07 -0.46 0.16 -0.83 -0.31 0.00 0.00 175.10 173.60 1ydu s GLY 95 N 1.43 -0.00 0.00 2.32 0.00 -1.20 -0.70 107.32 109.16 1ydu s GLY 95 Ca 0.04 0.01 0.00 0.00 0.00 0.00 0.00 44.72 44.76 1ydu s GLY 95 CO -0.04 -0.13 0.00 -1.72 0.00 0.00 0.00 173.10 171.21 1ydu n TYR 96 N 1.63 0.00 0.03 1.90 4.01 -1.22 -4.94 117.16 118.57 1ydu n TYR 96 Ca -0.21 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.35 1ydu n TYR 96 Cb 0.56 0.00 -0.14 0.00 -0.31 0.00 0.00 39.34 39.45 1ydu n TYR 96 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 1ydu h LYS 97 N 0.00 0.23 0.00 -0.72 1.57 -2.00 -3.49 116.57 112.17 1ydu h LYS 97 Ca 0.00 -0.40 0.00 0.00 -1.87 0.00 0.00 60.65 58.38 1ydu h LYS 97 Cb 0.00 0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1ydu h LYS 97 CO 0.00 1.07 0.00 -3.47 -0.57 0.00 0.00 179.45 176.48 1ydu n ASP 98 N -3.41 0.00 -0.27 0.86 2.03 -1.26 -5.01 116.55 109.48 1ydu n ASP 98 Ca -0.23 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.08 1ydu n ASP 98 Cb 1.05 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.45 1ydu n ASP 98 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1ydu n SER 99 N 0.00 0.35 -2.72 1.67 7.64 -1.26 -3.43 113.62 115.87 1ydu n SER 99 Ca 0.00 -1.27 -0.05 0.00 1.01 0.00 0.00 58.87 58.57 1ydu n SER 99 Cb 0.00 -0.17 0.03 0.00 -1.01 0.00 0.00 64.21 63.06 1ydu n SER 99 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1ydu n SER 100 N -0.13 -2.46 -4.08 6.43 3.41 -1.25 -4.66 113.62 110.89 1ydu n SER 100 Ca 0.00 -2.22 -0.34 0.00 -0.26 0.00 0.00 58.87 56.05 1ydu n SER 100 Cb 0.09 1.31 -0.13 0.00 -0.26 0.00 0.00 64.21 65.22 1ydu n SER 100 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1ydu s VAL 101 N 0.78 2.92 -0.14 -3.33 1.01 0.12 -3.26 120.40 118.48 1ydu s VAL 101 Ca 0.28 -2.20 -0.02 0.00 0.00 0.00 0.00 61.98 60.04 1ydu s VAL 101 Cb 0.11 -3.05 -0.02 0.00 0.00 0.00 0.00 36.38 33.42 1ydu s VAL 101 CO -0.11 -0.66 -0.09 -0.76 0.00 0.00 0.00 175.10 173.48 1ydu s LEU 102 N 1.02 2.96 -0.31 3.92 2.01 0.12 -0.61 118.68 127.79 1ydu s LEU 102 Ca 0.10 -0.24 0.00 0.00 0.01 0.00 0.00 54.13 53.99 1ydu s LEU 102 Cb -0.21 -1.69 0.07 0.00 0.01 0.00 0.00 46.19 44.36 1ydu s LEU 102 CO -0.06 0.16 0.01 -0.75 1.01 0.00 0.00 176.35 176.72 1ydu s LYS 103 N 0.39 2.19 -0.57 1.70 2.20 -1.09 -0.78 119.74 123.78 1ydu s LYS 103 Ca -0.07 -1.45 -0.20 0.00 -0.36 0.00 0.00 55.97 53.89 1ydu s LYS 103 Cb -0.15 -3.17 0.08 0.00 -1.51 0.00 0.00 37.83 33.08 1ydu s LYS 103 CO 0.04 -0.72 0.73 -0.06 -0.36 0.00 0.00 175.35 174.98 1ydu s PHE 104 N 1.15 2.96 0.90 4.03 0.08 0.79 -4.09 117.98 123.80 1ydu s PHE 104 Ca -0.02 -0.69 -0.15 0.00 0.12 0.00 0.00 56.93 56.19 1ydu s PHE 104 Cb -0.20 -3.89 0.21 0.00 -0.57 0.00 0.00 43.02 38.57 1ydu s PHE 104 CO -0.03 -1.26 1.08 -2.37 -0.10 0.00 0.00 175.22 172.54 1ydu n THR 105 N 5.67 0.00 -0.08 0.64 5.66 -1.26 -0.83 114.28 124.07 1ydu n THR 105 Ca -0.07 -0.71 -0.17 0.00 -3.05 0.00 0.00 64.05 60.05 1ydu n THR 105 Cb 0.44 -1.47 -0.12 0.00 -1.55 0.00 0.00 70.33 67.63 1ydu n THR 105 CO 0.00 0.00 0.00 0.71 -3.05 0.00 0.00 175.07 172.73 1ydu h THR 106 N -1.92 1.38 -3.32 1.09 1.35 -1.78 -3.39 112.91 106.33 1ydu h THR 106 Ca -0.36 -2.24 -0.66 0.00 -0.55 0.00 0.00 66.41 62.60 1ydu h THR 106 Cb 1.03 2.81 -0.39 0.00 -1.73 0.00 0.00 68.15 69.88 1ydu h THR 106 CO 0.25 0.47 -0.41 0.42 -0.25 0.00 0.00 175.52 176.00 1ydu s THR 107 N -2.27 3.40 -0.03 6.82 -4.23 -1.26 -0.03 115.64 118.05 1ydu s THR 107 Ca -0.23 -3.67 -0.28 0.00 -1.18 0.00 0.00 61.69 56.34 1ydu s THR 107 Cb 0.01 -3.21 -0.03 0.00 1.34 0.00 0.00 72.50 70.61 1ydu s THR 107 CO 0.63 -0.95 0.92 0.54 -0.54 0.00 0.00 174.62 175.21 1ydu s VAL 108 N -0.86 4.90 0.06 2.29 0.11 -0.70 -4.81 120.40 121.40 1ydu s VAL 108 Ca 0.22 1.91 0.02 0.00 -2.93 0.00 0.00 61.98 61.20 1ydu s VAL 108 Cb -0.14 -4.25 -0.04 0.00 -1.53 0.00 0.00 36.38 30.42 1ydu s VAL 108 CO -0.09 0.17 0.09 0.42 -3.33 0.00 0.00 175.10 172.36 1ydu s THR 109 N 1.05 4.61 -0.26 5.04 -4.23 -1.26 -0.00 115.64 120.60 1ydu s THR 109 Ca 0.48 -0.67 0.00 0.00 -1.18 0.00 0.00 61.69 60.32 1ydu s THR 109 Cb -0.20 -3.20 0.00 0.00 1.34 0.00 0.00 72.50 70.44 1ydu s THR 109 CO 0.25 0.18 0.00 0.61 -0.54 0.00 0.00 174.62 175.11 1ydu n GLY 110 N 0.61 -0.57 3.05 3.99 0.00 0.72 -0.01 105.19 112.98 1ydu n GLY 110 Ca -0.09 -0.60 -0.30 0.00 0.00 0.00 0.00 46.02 45.03 1ydu n GLY 110 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ydu s HIS 111 N -3.06 2.26 -0.04 1.61 3.76 -0.75 -0.51 115.29 118.56 1ydu s HIS 111 Ca 0.00 -1.24 0.05 0.00 -0.15 0.00 0.00 55.06 53.72 1ydu s HIS 111 Cb 0.00 -1.63 -0.01 0.00 1.11 0.00 0.00 32.58 32.05 1ydu s HIS 111 CO 0.00 -0.65 -0.21 -1.17 -0.85 0.00 0.00 174.74 171.86 1ydu s LEU 112 N 1.33 2.00 0.31 0.89 0.20 -1.26 -1.18 118.68 120.97 1ydu s LEU 112 Ca 0.02 -0.41 0.03 0.00 0.69 0.00 0.00 54.13 54.46 1ydu s LEU 112 Cb -0.13 -1.13 -0.05 0.00 -0.43 0.00 0.00 46.19 44.44 1ydu s LEU 112 CO -0.09 0.21 0.08 -1.61 -0.29 0.00 0.00 176.35 174.66 1ydu s GLU 113 N -0.17 1.60 -0.66 1.98 2.02 -0.40 -5.01 118.70 118.07 1ydu s GLU 113 Ca -0.00 -1.90 -0.24 0.00 0.02 0.00 0.00 54.97 52.85 1ydu s GLU 113 Cb -0.11 -0.61 0.06 0.00 0.10 0.00 0.00 34.13 33.56 1ydu s GLU 113 CO 0.02 -0.27 1.02 0.21 0.02 0.00 0.00 175.26 176.27 1ydu s LYS 114 N -3.92 3.16 0.00 1.61 2.36 -1.26 -3.51 119.74 118.18 1ydu s LYS 114 Ca 0.35 -0.63 0.00 0.00 -2.55 0.00 0.00 55.97 53.14 1ydu s LYS 114 Cb 0.08 -4.19 0.00 0.00 -1.05 0.00 0.00 37.83 32.66 1ydu s LYS 114 CO 0.15 -1.84 0.00 0.41 1.55 0.00 0.00 175.35 175.62 1ydu n GLY 115 N 5.31 2.39 3.41 5.54 0.00 -1.26 -4.92 105.19 115.66 1ydu n GLY 115 Ca -0.02 -0.34 -0.10 0.00 0.00 0.00 0.00 46.02 45.56 1ydu n GLY 115 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ydu s LYS 116 N 0.00 1.24 -0.26 1.61 0.00 -1.23 -1.67 119.74 119.43 1ydu s LYS 116 Ca 0.00 -1.03 0.03 0.00 0.00 0.00 0.00 55.97 54.97 1ydu s LYS 116 Cb 0.00 0.44 0.06 0.00 0.00 0.00 0.00 37.83 38.33 1ydu s LYS 116 CO 0.00 -0.48 -0.09 -1.17 0.00 0.00 0.00 175.35 173.60 1ydu s LEU 117 N -2.92 3.28 -0.13 2.77 0.20 -0.75 -1.27 118.68 119.85 1ydu s LEU 117 Ca 0.13 -1.37 -0.01 0.00 0.69 0.00 0.00 54.13 53.57 1ydu s LEU 117 Cb 0.02 -1.47 -0.02 0.00 -0.43 0.00 0.00 46.19 44.29 1ydu s LEU 117 CO -0.02 -0.20 -0.10 0.42 -0.29 0.00 0.00 176.35 176.16 1ydu s THR 118 N 1.16 3.38 -0.01 3.68 -4.23 -0.33 -1.78 115.64 117.52 1ydu s THR 118 Ca -0.08 -0.55 -0.01 0.00 -1.18 0.00 0.00 61.69 59.87 1ydu s THR 118 Cb -0.20 -2.43 0.01 0.00 1.34 0.00 0.00 72.50 71.21 1ydu s THR 118 CO -0.05 0.52 0.03 -0.67 -0.54 0.00 0.00 174.62 173.91 1ydu n ASP 119 N 3.37 -4.70 -4.72 3.99 2.03 -1.24 -3.04 116.55 112.23 1ydu n ASP 119 Ca -0.18 0.85 -0.24 0.00 0.52 0.00 0.00 54.79 55.75 1ydu n ASP 119 Cb 0.53 -3.06 -0.07 0.00 -0.72 0.00 0.00 41.12 37.80 1ydu n ASP 119 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1ydu s VAL 120 N -0.30 2.82 0.00 5.18 -7.23 -0.74 -1.81 120.40 118.32 1ydu s VAL 120 Ca -0.03 -1.73 0.00 0.00 -1.81 0.00 0.00 61.98 58.41 1ydu s VAL 120 Cb 0.00 -2.95 0.00 0.00 0.56 0.00 0.00 36.38 33.99 1ydu s VAL 120 CO 0.08 -0.15 0.05 1.21 -0.31 0.00 0.00 175.10 175.99 1ydu n GLU 121 N -1.15 3.47 -0.01 4.82 4.07 0.99 -4.00 120.64 128.83 1ydu n GLU 121 Ca -0.03 -0.05 0.08 0.00 -0.06 0.00 0.00 57.16 57.10 1ydu n GLU 121 Cb 0.62 -0.39 -0.12 0.00 -0.06 0.00 0.00 31.44 31.49 1ydu n GLU 121 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1ydu n GLY 122 N 0.51 -0.69 3.31 8.31 0.00 -1.20 -4.80 105.19 110.63 1ydu n GLY 122 Ca 0.00 -0.38 -0.45 0.00 0.00 0.00 0.00 46.02 45.19 1ydu n GLY 122 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ydu s ILE 123 N -3.03 5.09 0.16 -0.61 1.01 -1.26 -4.43 121.20 118.13 1ydu s ILE 123 Ca -0.05 -1.48 -0.21 0.00 0.00 0.00 0.00 60.65 58.91 1ydu s ILE 123 Cb 0.10 -4.25 -0.08 0.00 0.01 0.00 0.00 42.46 38.25 1ydu s ILE 123 CO 0.65 -0.83 0.69 -0.75 0.00 0.00 0.00 174.94 174.71 1ydu s LYS 124 N 1.58 4.33 -0.10 2.79 2.20 -1.26 -3.98 119.74 125.30 1ydu s LYS 124 Ca 0.03 0.92 -0.14 0.00 -0.36 0.00 0.00 55.97 56.42 1ydu s LYS 124 Cb -0.29 -3.10 0.03 0.00 -1.51 0.00 0.00 37.83 32.96 1ydu s LYS 124 CO 0.03 0.52 0.37 0.99 -0.36 0.00 0.00 175.35 176.90 1ydu s THR 125 N -1.29 0.02 -0.26 3.43 2.01 -1.22 -2.66 115.64 115.66 1ydu s THR 125 Ca 0.37 -0.13 -0.01 0.00 0.31 0.00 0.00 61.69 62.23 1ydu s THR 125 Cb -0.19 -0.57 0.08 0.00 0.01 0.00 0.00 72.50 71.83 1ydu s THR 125 CO 0.22 -0.07 0.05 -0.75 -0.69 0.00 0.00 174.62 173.37 1ydu s LYS 126 N -0.26 0.91 -0.06 4.92 2.36 0.22 -0.36 119.74 127.47 1ydu s LYS 126 Ca -0.04 -0.88 -0.05 0.00 -2.55 0.00 0.00 55.97 52.45 1ydu s LYS 126 Cb -0.03 -2.19 -0.03 0.00 -1.05 0.00 0.00 37.83 34.52 1ydu s LYS 126 CO 0.02 -0.80 -0.12 1.55 1.55 0.00 0.00 175.35 177.56 1ydu n VAL 127 N 4.85 0.79 -0.02 4.02 3.14 -1.26 0.14 118.33 129.99 1ydu n VAL 127 Ca -0.06 0.03 -0.01 0.00 -2.96 0.00 0.00 64.34 61.34 1ydu n VAL 127 Cb 0.44 -1.70 -0.05 0.00 -1.06 0.00 0.00 33.84 31.47 1ydu n VAL 127 CO 0.00 0.00 0.00 0.80 -6.46 0.00 0.00 176.83 171.17 1ydu n MET 128 N -3.55 2.33 -3.83 1.45 0.00 -1.26 -4.12 117.12 108.13 1ydu n MET 128 Ca -0.13 -0.02 -0.06 0.00 -0.00 0.00 0.00 57.70 57.49 1ydu n MET 128 Cb 0.46 -1.15 -0.01 0.00 0.00 0.00 0.00 33.22 32.52 1ydu n MET 128 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 175.97 174.47 1ydu s ILE 129 N -2.21 0.00 -0.17 1.12 1.10 -1.26 -5.09 121.20 114.68 1ydu s ILE 129 Ca -0.03 -0.92 -0.29 0.00 -0.51 0.00 0.00 60.65 58.90 1ydu s ILE 129 Cb 0.02 -2.11 -0.03 0.00 0.15 0.00 0.00 42.46 40.49 1ydu s ILE 129 CO 0.24 0.00 1.52 0.26 -2.11 0.00 0.00 174.94 174.85 1ydu s TRP 130 N -3.58 2.28 -0.21 3.50 0.51 -1.26 -4.05 118.94 116.13 1ydu s TRP 130 Ca 0.12 0.57 -0.04 0.00 -2.12 0.00 0.00 56.10 54.64 1ydu s TRP 130 Cb -0.05 -3.85 0.11 0.00 -0.81 0.00 0.00 33.47 28.87 1ydu s TRP 130 CO 0.07 -2.82 0.29 0.08 -0.51 0.00 0.00 176.95 174.06 1ydu s VAL 131 N 4.42 -0.45 -0.31 4.03 1.01 0.51 -4.99 120.40 124.62 1ydu s VAL 131 Ca 0.67 -0.06 -0.08 0.00 0.00 0.00 0.00 61.98 62.51 1ydu s VAL 131 Cb -0.26 -0.71 0.01 0.00 0.00 0.00 0.00 36.38 35.41 1ydu s VAL 131 CO 0.25 -0.14 0.12 -1.59 0.00 0.00 0.00 175.10 173.74 1ydu s LYS 132 N 2.43 3.11 0.00 2.72 -2.85 -1.26 -3.40 119.74 120.49 1ydu s LYS 132 Ca 0.09 -0.86 0.00 0.00 -1.00 0.00 0.00 55.97 54.20 1ydu s LYS 132 Cb -0.15 -3.47 0.00 0.00 -2.06 0.00 0.00 37.83 32.15 1ydu s LYS 132 CO -0.13 -0.47 0.00 1.55 0.10 0.00 0.00 175.35 176.39 1ydu n VAL 133 N 4.91 0.00 0.00 1.79 3.14 -1.26 -4.91 118.33 122.00 1ydu n VAL 133 Ca -0.14 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.24 1ydu n VAL 133 Cb 0.48 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.26 1ydu n VAL 133 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 1ydu n THR 134 N 0.00 0.00 -3.97 1.55 -2.24 -1.26 -1.79 114.28 106.56 1ydu n THR 134 Ca 0.00 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.45 1ydu n THR 134 Cb 0.00 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.18 1ydu n THR 134 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1ydu s SER 135 N 0.00 6.11 -0.18 3.42 0.15 -1.22 -4.45 113.70 117.53 1ydu s SER 135 Ca 0.00 0.26 -0.01 0.00 0.70 0.00 0.00 55.95 56.90 1ydu s SER 135 Cb 0.00 -1.86 -0.00 0.00 -1.71 0.00 0.00 66.02 62.45 1ydu s SER 135 CO 0.00 0.25 -0.12 -0.51 1.20 0.00 0.00 173.24 174.06 1ydu s ILE 136 N -1.30 2.82 -0.12 6.45 2.07 -0.73 -2.74 121.20 127.65 1ydu s ILE 136 Ca 0.27 -0.70 -0.04 0.00 -1.41 0.00 0.00 60.65 58.77 1ydu s ILE 136 Cb -0.12 -2.23 -0.03 0.00 0.13 0.00 0.00 42.46 40.21 1ydu s ILE 136 CO 0.18 0.49 0.02 -0.94 -1.91 0.00 0.00 174.94 172.79 1ydu s SER 137 N 1.10 5.38 0.32 4.50 1.04 -1.07 -1.81 113.70 123.16 1ydu s SER 137 Ca 0.00 0.12 -0.08 0.00 0.48 0.00 0.00 55.95 56.47 1ydu s SER 137 Cb -0.14 -1.70 0.01 0.00 0.10 0.00 0.00 66.02 64.28 1ydu s SER 137 CO -0.03 0.30 0.52 0.28 0.98 0.00 0.00 173.24 175.29 1ydu s THR 138 N -0.40 0.00 -0.22 2.02 -1.32 -1.25 -0.40 115.64 114.07 1ydu s THR 138 Ca 0.08 -1.45 0.11 0.00 -1.21 0.00 0.00 61.69 59.23 1ydu s THR 138 Cb -0.12 -2.54 0.44 0.00 -1.51 0.00 0.00 72.50 68.77 1ydu s THR 138 CO 0.02 0.00 1.20 -0.67 -2.21 0.00 0.00 174.62 172.96 1ydu n ASP 139 N -1.06 2.73 -3.05 8.08 2.03 -1.16 -4.08 116.55 120.04 1ydu n ASP 139 Ca -0.01 -3.65 -0.16 0.00 0.52 0.00 0.00 54.79 51.48 1ydu n ASP 139 Cb 0.61 -0.45 0.07 0.00 -0.72 0.00 0.00 41.12 40.64 1ydu n ASP 139 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ydu n ALA 140 N -0.85 -1.46 -0.89 -1.67 0.00 -0.67 -4.74 120.51 110.24 1ydu n ALA 140 Ca 0.26 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.80 1ydu n ALA 140 Cb 0.82 -3.10 0.00 0.00 0.00 0.00 0.00 19.45 17.16 1ydu n ALA 140 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ydu n SER 141 N -2.58 0.00 -4.83 0.00 2.88 -1.26 -4.65 113.62 103.18 1ydu n SER 141 Ca -0.15 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.03 1ydu n SER 141 Cb 0.61 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 64.01 1ydu n SER 141 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1ydu s LYS 142 N -0.11 4.10 -0.10 -1.46 1.02 -1.26 -4.52 119.74 117.41 1ydu s LYS 142 Ca 0.00 0.64 -0.02 0.00 0.02 0.00 0.00 55.97 56.61 1ydu s LYS 142 Cb 0.00 -2.99 -0.03 0.00 -0.52 0.00 0.00 37.83 34.29 1ydu s LYS 142 CO 0.00 0.49 0.00 0.08 -0.92 0.00 0.00 175.35 175.01 1ydu s VAL 143 N -1.40 4.31 0.00 3.17 1.01 -1.26 -2.98 120.40 123.26 1ydu s VAL 143 Ca 0.37 -0.24 0.02 0.00 0.00 0.00 0.00 61.98 62.13 1ydu s VAL 143 Cb -0.16 -2.83 -0.01 0.00 0.00 0.00 0.00 36.38 33.38 1ydu s VAL 143 CO 0.20 0.59 -0.05 -0.31 0.00 0.00 0.00 175.10 175.52 1ydu s TYR 144 N -0.69 0.49 0.86 5.22 2.02 0.46 -4.27 117.35 121.44 1ydu s TYR 144 Ca 0.11 -0.15 -0.11 0.00 -0.37 0.00 0.00 57.07 56.55 1ydu s TYR 144 Cb -0.12 -0.31 0.11 0.00 -0.40 0.00 0.00 41.96 41.25 1ydu s TYR 144 CO 0.02 -0.02 1.10 -0.59 -1.57 0.00 0.00 175.55 174.49 1ydu s PHE 145 N -0.32 2.20 0.35 2.71 -0.71 -1.25 -2.59 117.98 118.37 1ydu s PHE 145 Ca 0.00 1.52 0.00 0.00 -1.04 0.00 0.00 56.93 57.41 1ydu s PHE 145 Cb -0.03 -3.15 0.00 0.00 -1.21 0.00 0.00 43.02 38.63 1ydu s PHE 145 CO -0.00 -2.33 0.00 2.41 -1.34 0.00 0.00 175.22 173.96 1ydu n THR 146 N -3.88 0.00 -3.83 -4.49 -1.04 -1.23 -4.69 114.28 95.12 1ydu n THR 146 Ca 0.09 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.97 1ydu n THR 146 Cb 0.53 -0.28 -0.14 0.00 -1.82 0.00 0.00 70.33 68.63 1ydu n THR 146 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ydu s ALA 147 N -2.00 -0.10 0.00 2.41 0.00 -1.11 -4.81 121.76 116.15 1ydu s ALA 147 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 51.96 52.19 1ydu s ALA 147 Cb 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 23.12 22.96 1ydu s ALA 147 CO 0.00 -0.05 0.00 0.41 0.00 0.00 0.00 175.76 176.12 1ydu n GLY 148 N 3.39 1.51 0.09 0.00 0.00 -1.26 -3.45 105.19 105.47 1ydu n GLY 148 Ca -0.17 -0.01 -0.11 0.00 0.00 0.00 0.00 46.02 45.73 1ydu n GLY 148 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1ydu h MET 149 N 0.00 0.19 -1.16 1.61 1.85 -1.91 -3.44 114.93 112.08 1ydu h MET 149 Ca 0.00 -0.02 -0.14 0.00 -0.61 0.00 0.00 59.70 58.93 1ydu h MET 149 Cb 0.00 -0.04 -0.06 0.00 0.43 0.00 0.00 31.60 31.93 1ydu h MET 149 CO 0.00 0.18 -0.13 1.63 -0.40 0.00 0.00 176.91 178.19 1ydu n LYS 150 N -4.96 -1.41 -3.83 0.39 5.02 -1.26 -4.89 118.16 107.22 1ydu n LYS 150 Ca -0.04 0.47 -0.12 0.00 -2.02 0.00 0.00 58.31 56.60 1ydu n LYS 150 Cb 0.05 -4.45 -0.12 0.00 -0.02 0.00 0.00 35.03 30.49 1ydu n LYS 150 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1ydu s LYS 151 N -2.32 0.19 -0.43 1.97 1.02 -1.26 -5.00 119.74 113.92 1ydu s LYS 151 Ca 0.00 0.13 -0.23 0.00 0.02 0.00 0.00 55.97 55.89 1ydu s LYS 151 Cb 0.00 0.09 0.02 0.00 -0.52 0.00 0.00 37.83 37.42 1ydu s LYS 151 CO 0.00 -0.03 0.80 -1.54 -0.92 0.00 0.00 175.35 173.66 1ydu s SER 152 N -0.07 6.46 -0.41 2.83 1.04 -1.26 -3.85 113.70 118.43 1ydu s SER 152 Ca -0.01 0.05 -0.10 0.00 0.48 0.00 0.00 55.95 56.37 1ydu s SER 152 Cb -0.02 -2.40 0.07 0.00 0.10 0.00 0.00 66.02 63.78 1ydu s SER 152 CO 0.00 -0.88 0.26 -0.60 0.98 0.00 0.00 173.24 173.00 1ydu s ARG 153 N 3.30 2.67 0.47 4.02 6.06 -1.26 -4.97 118.95 129.23 1ydu s ARG 153 Ca 0.31 -1.39 -0.23 0.00 -2.50 0.00 0.00 55.73 51.92 1ydu s ARG 153 Cb -0.12 -3.79 -0.07 0.00 0.06 0.00 0.00 34.95 31.02 1ydu s ARG 153 CO 0.22 -0.92 1.19 -1.12 -2.50 0.00 0.00 175.30 172.17 1ydu s SER 154 N 2.06 6.09 0.50 -2.12 0.01 -1.26 -4.36 113.70 114.61 1ydu s SER 154 Ca 0.03 2.36 0.18 0.00 1.31 0.00 0.00 55.95 59.83 1ydu s SER 154 Cb -0.22 -2.61 1.23 0.00 0.21 0.00 0.00 66.02 64.63 1ydu s SER 154 CO 0.03 -0.98 2.07 -0.09 0.41 0.00 0.00 173.24 174.68 1ydu h ARG 155 N 2.02 0.12 -0.94 12.44 9.65 -1.79 -1.26 114.38 134.61 1ydu h ARG 155 Ca -0.49 -0.01 0.25 0.00 -1.10 0.00 0.00 59.98 58.62 1ydu h ARG 155 Cb 1.25 -0.03 -0.13 0.00 -1.39 0.00 0.00 29.97 29.67 1ydu h ARG 155 CO 0.60 0.08 0.45 0.22 2.80 0.00 0.00 179.97 184.12 1ydu h ASP 156 N 0.12 0.40 0.00 -3.80 3.58 -1.91 -2.75 116.42 112.06 1ydu h ASP 156 Ca 0.14 0.16 -0.03 0.00 0.42 0.00 0.00 57.03 57.71 1ydu h ASP 156 Cb 0.39 0.13 -0.01 0.00 1.72 0.00 0.00 39.33 41.56 1ydu h ASP 156 CO -0.02 -0.02 -0.24 0.00 -2.88 0.00 0.00 179.24 176.08 1ydu h ALA 157 N 1.75 0.04 0.00 -0.78 0.00 -1.60 -3.46 119.26 115.21 1ydu h ALA 157 Ca 0.61 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1ydu h ALA 157 Cb 1.22 0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1ydu h ALA 157 CO -0.55 0.15 0.00 0.66 0.00 0.00 0.00 179.25 179.51 1ydu n TYR 158 N -4.63 0.00 0.00 0.00 4.01 -1.06 -5.07 117.16 110.40 1ydu n TYR 158 Ca -0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.64 1ydu n TYR 158 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.38 1ydu n TYR 158 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ydu n GLY 159 N 0.00 1.12 2.79 2.72 0.00 -1.10 -4.55 105.19 106.17 1ydu n GLY 159 Ca 0.00 -0.75 -0.26 0.00 0.00 0.00 0.00 46.02 45.02 1ydu n GLY 159 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ydu s VAL 160 N 0.00 0.61 -0.02 1.61 1.01 0.09 -4.00 120.40 119.70 1ydu s VAL 160 Ca 0.00 -0.27 0.02 0.00 0.00 0.00 0.00 61.98 61.73 1ydu s VAL 160 Cb 0.00 -0.87 0.01 0.00 0.00 0.00 0.00 36.38 35.51 1ydu s VAL 160 CO 0.00 0.09 -0.05 -1.10 0.00 0.00 0.00 175.10 174.04 1ydu s GLN 161 N 1.85 0.63 -0.24 2.72 -1.52 -1.26 -4.32 119.66 117.52 1ydu s GLN 161 Ca 0.02 -0.16 -0.03 0.00 -1.95 0.00 0.00 55.36 53.24 1ydu s GLN 161 Cb -0.14 -0.63 0.13 0.00 -0.22 0.00 0.00 33.01 32.14 1ydu s GLN 161 CO -0.07 0.04 0.36 0.50 -0.25 0.00 0.00 175.29 175.87 1ydu s ARG 162 N 0.34 0.33 -0.93 2.91 6.06 -1.26 -4.89 118.95 121.50 1ydu s ARG 162 Ca -0.04 0.52 -0.22 0.00 -2.50 0.00 0.00 55.73 53.49 1ydu s ARG 162 Cb -0.08 -0.53 -0.24 0.00 0.06 0.00 0.00 34.95 34.16 1ydu s ARG 162 CO -0.00 -0.62 2.44 -1.71 -2.50 0.00 0.00 175.30 172.90 1ydu n ASN 163 N 5.36 -0.06 -3.55 -2.12 5.15 -1.26 -4.82 115.26 113.96 1ydu n ASN 163 Ca -0.04 -0.32 -0.11 0.00 -0.60 0.00 0.00 54.58 53.51 1ydu n ASN 163 Cb 0.50 -0.90 -0.03 0.00 -0.53 0.00 0.00 39.78 38.82 1ydu n ASN 163 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 1ydu s GLY 164 N 6.04 -0.41 -0.02 8.20 0.00 -1.26 -4.85 107.32 115.02 1ydu s GLY 164 Ca 1.27 0.19 -0.02 0.00 0.00 0.00 0.00 44.72 46.16 1ydu s GLY 164 CO 0.46 -0.06 0.05 0.48 0.00 0.00 0.00 173.10 174.04 1ydu s LEU 165 N -2.79 1.73 0.20 0.66 0.05 -1.26 -5.12 118.68 112.15 1ydu s LEU 165 Ca 0.03 0.10 -0.30 0.00 0.05 0.00 0.00 54.13 54.01 1ydu s LEU 165 Cb -0.00 0.16 -0.09 0.00 -2.05 0.00 0.00 46.19 44.21 1ydu s LEU 165 CO -0.10 -0.03 1.27 -0.13 -0.55 0.00 0.00 176.35 176.81 1ydu s ARG 166 N 0.13 4.42 0.44 1.48 3.00 -1.26 -4.61 118.95 122.55 1ydu s ARG 166 Ca -0.01 2.00 0.12 0.00 0.00 0.00 0.00 55.73 57.85 1ydu s ARG 166 Cb -0.01 -3.20 0.99 0.00 0.00 0.00 0.00 34.95 32.72 1ydu s ARG 166 CO -0.00 -0.20 2.03 0.28 0.00 0.00 0.00 175.30 177.40 1ydu h VAL 167 N 3.73 1.10 -0.46 3.52 2.07 -1.78 -3.34 116.25 121.08 1ydu h VAL 167 Ca -0.45 -0.41 -0.52 0.00 0.82 0.00 0.00 66.70 66.14 1ydu h VAL 167 Cb 1.21 1.05 -0.04 0.00 -1.52 0.00 0.00 31.29 32.00 1ydu h VAL 167 CO 0.76 0.13 1.80 0.47 0.02 0.00 0.00 177.57 180.75 1ydu n ASP 168 N -4.40 3.61 -3.67 0.57 8.00 -1.25 -4.77 116.55 114.65 1ydu n ASP 168 Ca -0.01 -2.77 -0.12 0.00 0.71 0.00 0.00 54.79 52.60 1ydu n ASP 168 Cb 0.17 -1.64 -0.06 0.00 -0.02 0.00 0.00 41.12 39.58 1ydu n ASP 168 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1ydu s LYS 169 N 5.27 0.95 0.00 -1.24 2.20 -1.26 -4.82 119.74 120.85 1ydu s LYS 169 Ca 0.60 -0.49 0.22 0.00 -0.36 0.00 0.00 55.97 55.95 1ydu s LYS 169 Cb 0.05 0.42 0.18 0.00 -1.51 0.00 0.00 37.83 36.96 1ydu s LYS 169 CO 0.10 -0.34 1.21 1.97 -0.36 0.00 0.00 175.35 177.93