#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cdu n LYS 2 N 0.00 0.00 -3.71 -1.58 5.02 -1.21 -4.25 118.16 112.44 1cdu n LYS 2 Ca 0.00 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.12 1cdu n LYS 2 Cb 0.00 0.00 -0.17 0.00 -0.02 0.00 0.00 35.03 34.84 1cdu n LYS 2 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1cdu s VAL 3 N 0.00 -0.11 -0.09 -0.18 1.01 -1.26 -0.84 120.40 118.94 1cdu s VAL 3 Ca 0.00 0.33 0.03 0.00 0.00 0.00 0.00 61.98 62.34 1cdu s VAL 3 Cb 0.00 -0.16 0.01 0.00 0.00 0.00 0.00 36.38 36.23 1cdu s VAL 3 CO 0.00 0.14 -0.18 -0.69 0.00 0.00 0.00 175.10 174.36 1cdu s VAL 4 N 1.73 1.63 -0.28 2.92 1.01 0.76 -4.94 120.40 123.23 1cdu s VAL 4 Ca -0.01 -0.77 -0.15 0.00 0.00 0.00 0.00 61.98 61.05 1cdu s VAL 4 Cb -0.12 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.78 1cdu s VAL 4 CO -0.04 0.47 0.39 -0.76 0.00 0.00 0.00 175.10 175.16 1cdu s LEU 5 N 0.52 4.08 0.24 3.92 1.02 -1.26 -0.53 118.68 126.67 1cdu s LEU 5 Ca -0.16 0.25 0.07 0.00 0.02 0.00 0.00 54.13 54.31 1cdu s LEU 5 Cb -0.17 -2.44 -0.04 0.00 0.02 0.00 0.00 46.19 43.56 1cdu s LEU 5 CO 0.06 -0.21 0.16 -0.83 0.02 0.00 0.00 176.35 175.55 1cdu s GLY 6 N 1.65 1.48 -0.17 -3.19 0.00 0.28 -4.92 107.32 102.45 1cdu s GLY 6 Ca 0.15 -1.42 -0.01 0.00 0.00 0.00 0.00 44.72 43.45 1cdu s GLY 6 CO 0.10 -1.46 -0.14 0.54 0.00 0.00 0.00 173.10 172.15 1cdu s LYS 7 N -3.71 3.21 0.11 2.90 1.02 -1.26 -1.53 119.74 120.48 1cdu s LYS 7 Ca 0.32 -0.73 -0.33 0.00 0.02 0.00 0.00 55.97 55.25 1cdu s LYS 7 Cb -0.08 -2.70 -0.18 0.00 -0.52 0.00 0.00 37.83 34.34 1cdu s LYS 7 CO 0.24 -0.07 0.76 1.17 -0.92 0.00 0.00 175.35 176.52 1cdu n LYS 8 N 4.33 0.00 0.00 1.68 4.81 -0.21 -0.61 118.16 128.15 1cdu n LYS 8 Ca -0.19 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.25 1cdu n LYS 8 Cb 0.51 -1.21 0.00 0.00 0.02 0.00 0.00 35.03 34.35 1cdu n LYS 8 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1cdu n GLY 9 N 1.76 2.83 3.89 3.14 0.00 0.16 -4.89 105.19 112.07 1cdu n GLY 9 Ca 0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 1cdu n GLY 9 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1cdu s ASP 10 N -0.07 2.58 0.19 1.61 1.11 0.21 -3.58 116.67 118.72 1cdu s ASP 10 Ca 0.00 0.24 0.06 0.00 0.18 0.00 0.00 52.55 53.03 1cdu s ASP 10 Cb 0.00 -0.24 -0.04 0.00 1.07 0.00 0.00 42.92 43.71 1cdu s ASP 10 CO 0.00 -3.07 0.14 -0.89 1.18 0.00 0.00 175.17 172.53 1cdu s THR 11 N -3.81 4.37 0.07 -1.27 2.01 -1.26 -1.20 115.64 114.56 1cdu s THR 11 Ca 0.75 -1.22 -0.06 0.00 0.31 0.00 0.00 61.69 61.47 1cdu s THR 11 Cb -0.03 -3.27 -0.01 0.00 0.01 0.00 0.00 72.50 69.19 1cdu s THR 11 CO 0.54 -0.18 0.11 0.54 -0.69 0.00 0.00 174.62 174.94 1cdu s VAL 12 N -1.87 0.16 -0.04 3.82 0.11 -0.55 -4.93 120.40 117.10 1cdu s VAL 12 Ca 0.31 -1.35 0.01 0.00 -2.93 0.00 0.00 61.98 58.02 1cdu s VAL 12 Cb -0.09 -1.31 0.02 0.00 -1.53 0.00 0.00 36.38 33.47 1cdu s VAL 12 CO 0.23 -0.75 -0.04 -0.70 -3.33 0.00 0.00 175.10 170.52 1cdu s GLU 13 N -3.65 0.72 -0.30 1.54 2.12 -1.26 -2.54 118.70 115.33 1cdu s GLU 13 Ca 0.04 -0.07 -0.03 0.00 0.36 0.00 0.00 54.97 55.27 1cdu s GLU 13 Cb 0.05 -0.75 0.04 0.00 0.26 0.00 0.00 34.13 33.73 1cdu s GLU 13 CO -0.10 -0.08 0.02 -0.51 -0.54 0.00 0.00 175.26 174.05 1cdu s LEU 14 N 0.90 3.92 0.61 2.70 1.43 -0.31 -4.97 118.68 122.96 1cdu s LEU 14 Ca -0.11 -1.20 -0.16 0.00 -1.03 0.00 0.00 54.13 51.63 1cdu s LEU 14 Cb -0.14 -1.75 -0.03 0.00 0.03 0.00 0.00 46.19 44.31 1cdu s LEU 14 CO -0.00 -0.26 1.08 0.42 0.23 0.00 0.00 176.35 177.82 1cdu s THR 15 N 1.30 3.54 -0.25 5.49 -4.23 -1.26 -1.80 115.64 118.42 1cdu s THR 15 Ca -0.04 0.75 -0.03 0.00 -1.18 0.00 0.00 61.69 61.19 1cdu s THR 15 Cb -0.19 -3.27 0.14 0.00 1.34 0.00 0.00 72.50 70.51 1cdu s THR 15 CO -0.00 -0.40 0.43 0.00 -0.54 0.00 0.00 174.62 174.10 1cdu s THR 17 N 2.62 3.79 0.22 0.00 2.01 -1.26 -0.94 115.64 122.08 1cdu s THR 17 Ca 0.12 -1.55 -0.17 0.00 0.31 0.00 0.00 61.69 60.40 1cdu s THR 17 Cb -0.15 -2.97 0.02 0.00 0.01 0.00 0.00 72.50 69.41 1cdu s THR 17 CO -0.16 -0.23 0.53 0.00 -0.69 0.00 0.00 174.62 174.07 1cdu s ALA 18 N -1.97 -0.81 0.00 7.40 0.00 -0.22 -4.97 121.76 121.19 1cdu s ALA 18 Ca 0.30 -0.38 0.00 0.00 0.00 0.00 0.00 51.96 51.87 1cdu s ALA 18 Cb -0.08 0.89 0.00 0.00 0.00 0.00 0.00 23.12 23.93 1cdu s ALA 18 CO 0.20 -0.84 0.00 0.43 0.00 0.00 0.00 175.76 175.55 1cdu n SER 19 N -0.36 0.00 -0.15 0.00 7.64 -1.26 -4.68 113.62 114.81 1cdu n SER 19 Ca -0.07 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.81 1cdu n SER 19 Cb 0.62 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.82 1cdu n SER 19 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1cdu n GLN 20 N 0.00 0.00 -1.14 1.43 -0.00 -1.26 -4.32 117.38 112.09 1cdu n GLN 20 Ca 0.00 0.00 -0.39 0.00 -0.00 0.00 0.00 57.00 56.61 1cdu n GLN 20 Cb 0.00 -0.15 -0.08 0.00 -0.00 0.00 0.00 30.24 30.01 1cdu n GLN 20 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.06 178.23 1cdu n LYS 21 N -0.65 0.91 -0.18 2.61 3.00 -1.26 -4.65 118.16 117.94 1cdu n LYS 21 Ca 0.00 -1.67 0.00 0.00 -0.00 0.00 0.00 58.31 56.64 1cdu n LYS 21 Cb 0.20 -3.02 0.00 0.00 0.00 0.00 0.00 35.03 32.21 1cdu n LYS 21 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1cdu n LYS 22 N 7.63 0.00 0.00 1.64 4.76 -1.26 -4.56 118.16 126.38 1cdu n LYS 22 Ca 0.47 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.91 1cdu n LYS 22 Cb 0.43 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.62 1cdu n LYS 22 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1cdu n SER 23 N 1.06 -0.72 0.00 4.39 2.88 -0.23 -4.50 113.62 116.50 1cdu n SER 23 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1cdu n SER 23 Cb 0.00 0.68 0.00 0.00 -0.75 0.00 0.00 64.21 64.14 1cdu n SER 23 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1cdu n ILE 24 N 0.01 0.00 -3.07 2.46 0.13 -1.26 -4.97 119.36 112.66 1cdu n ILE 24 Ca 0.00 0.00 -0.41 0.00 -1.10 0.00 0.00 62.75 61.24 1cdu n ILE 24 Cb 0.00 0.00 -0.06 0.00 -0.84 0.00 0.00 39.64 38.74 1cdu n ILE 24 CO 0.00 0.00 0.00 -1.58 2.80 0.00 0.00 176.55 177.77 1cdu s GLN 25 N 1.63 4.01 0.26 9.51 2.00 -1.26 -4.93 119.66 130.89 1cdu s GLN 25 Ca 0.00 0.49 0.05 0.00 -2.00 0.00 0.00 55.36 53.90 1cdu s GLN 25 Cb 0.00 -3.69 -0.02 0.00 0.80 0.00 0.00 33.01 30.10 1cdu s GLN 25 CO 0.00 -0.52 0.17 1.97 -0.50 0.00 0.00 175.29 176.41 1cdu n PHE 26 N 5.88 -0.33 0.00 1.67 -1.74 -1.26 -0.69 117.46 120.99 1cdu n PHE 26 Ca 0.00 -2.00 0.00 0.00 -0.56 0.00 0.00 57.45 54.90 1cdu n PHE 26 Cb 0.49 0.13 0.00 0.00 1.52 0.00 0.00 39.48 41.62 1cdu n PHE 26 CO 0.00 0.00 0.00 -2.39 -0.56 0.00 0.00 176.76 173.81 1cdu n HIS 27 N -0.54 0.00 -4.86 2.97 1.44 -1.07 -3.53 115.22 109.64 1cdu n HIS 27 Ca 0.02 0.00 -0.33 0.00 -2.01 0.00 0.00 57.72 55.40 1cdu n HIS 27 Cb 0.44 0.00 -0.14 0.00 0.12 0.00 0.00 29.99 30.41 1cdu n HIS 27 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 1cdu s TRP 28 N -2.00 2.75 0.42 -1.40 0.52 -0.49 -2.28 118.94 116.45 1cdu s TRP 28 Ca 0.00 -0.47 0.05 0.00 0.02 0.00 0.00 56.10 55.69 1cdu s TRP 28 Cb 0.00 -1.75 -0.06 0.00 -1.15 0.00 0.00 33.47 30.52 1cdu s TRP 28 CO 0.00 -0.07 0.03 0.15 0.02 0.00 0.00 176.95 177.08 1cdu s LYS 29 N -0.09 1.96 0.00 4.98 1.02 -0.80 0.17 119.74 126.98 1cdu s LYS 29 Ca -0.02 -2.16 0.00 0.00 0.02 0.00 0.00 55.97 53.81 1cdu s LYS 29 Cb -0.14 -1.39 0.00 0.00 -0.52 0.00 0.00 37.83 35.78 1cdu s LYS 29 CO 0.04 -0.19 0.00 0.27 -0.92 0.00 0.00 175.35 174.55 1cdu n ASN 30 N -1.02 1.07 -0.17 2.83 0.23 -0.93 -1.93 115.26 115.34 1cdu n ASN 30 Ca -0.08 0.00 -0.09 0.00 -0.53 0.00 0.00 54.58 53.88 1cdu n ASN 30 Cb 0.67 0.00 0.01 0.00 -2.08 0.00 0.00 39.78 38.37 1cdu n ASN 30 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1cdu h SER 31 N 0.00 0.67 -0.03 0.53 0.02 -1.88 -2.73 113.55 110.13 1cdu h SER 31 Ca 0.00 -0.19 -0.02 0.00 -0.84 0.00 0.00 61.79 60.74 1cdu h SER 31 Cb 0.00 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 1cdu h SER 31 CO 0.00 0.68 0.02 0.59 -1.14 0.00 0.00 176.83 176.98 1cdu n ASN 32 N -4.55 4.17 -0.97 3.07 3.02 -1.26 -4.79 115.26 113.95 1cdu n ASN 32 Ca 0.01 -2.24 -0.06 0.00 -0.03 0.00 0.00 54.58 52.26 1cdu n ASN 32 Cb 0.17 -0.81 -0.02 0.00 -0.61 0.00 0.00 39.78 38.51 1cdu n ASN 32 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1cdu n GLN 33 N 0.91 -1.32 -2.38 3.52 1.13 -1.03 -4.85 117.38 113.36 1cdu n GLN 33 Ca 0.02 0.37 -0.43 0.00 -1.94 0.00 0.00 57.00 55.02 1cdu n GLN 33 Cb 0.52 -4.31 -0.02 0.00 0.11 0.00 0.00 30.24 26.53 1cdu n GLN 33 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1cdu s ILE 34 N -1.35 4.10 -0.14 5.09 1.01 -1.26 -4.77 121.20 123.87 1cdu s ILE 34 Ca 0.00 1.25 -0.29 0.00 0.00 0.00 0.00 60.65 61.61 1cdu s ILE 34 Cb 0.00 -4.07 -0.03 0.00 0.01 0.00 0.00 42.46 38.37 1cdu s ILE 34 CO 0.00 -0.40 1.46 -0.75 0.00 0.00 0.00 174.94 175.25 1cdu s LYS 35 N 4.15 4.13 -0.14 2.79 2.20 -1.26 -2.19 119.74 129.42 1cdu s LYS 35 Ca 0.58 1.84 -0.25 0.00 -0.36 0.00 0.00 55.97 57.78 1cdu s LYS 35 Cb -0.19 -3.89 -0.23 0.00 -1.51 0.00 0.00 37.83 32.02 1cdu s LYS 35 CO 0.23 -0.87 0.65 0.82 -0.36 0.00 0.00 175.35 175.82 1cdu h ILE 36 N 5.64 1.54 -1.56 5.43 1.08 -0.60 -3.37 117.51 125.67 1cdu h ILE 36 Ca -0.32 -2.18 0.08 0.00 -0.39 0.00 0.00 64.86 62.04 1cdu h ILE 36 Cb 1.14 2.94 -0.27 0.00 -3.07 0.00 0.00 36.82 37.56 1cdu h ILE 36 CO 0.97 0.52 0.46 -1.48 -0.69 0.00 0.00 178.15 177.94 1cdu s LEU 37 N -8.24 -0.44 0.00 1.44 2.34 -1.15 -3.19 118.68 109.44 1cdu s LEU 37 Ca -0.17 0.82 0.00 0.00 0.06 0.00 0.00 54.13 54.84 1cdu s LEU 37 Cb -0.02 1.82 0.00 0.00 -0.56 0.00 0.00 46.19 47.42 1cdu s LEU 37 CO 0.60 -0.14 0.00 0.61 -1.06 0.00 0.00 176.35 176.37 1cdu n GLY 38 N 2.45 3.22 3.26 -3.48 0.00 -0.37 -1.40 105.19 108.87 1cdu n GLY 38 Ca -0.13 -1.31 -0.34 0.00 0.00 0.00 0.00 46.02 44.24 1cdu n GLY 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1cdu s ASN 39 N -0.60 3.79 -0.89 1.61 4.22 -1.23 0.05 114.94 121.90 1cdu s ASN 39 Ca 0.00 -0.47 -0.24 0.00 -2.14 0.00 0.00 52.86 50.01 1cdu s ASN 39 Cb 0.00 -1.61 0.05 0.00 1.28 0.00 0.00 41.25 40.97 1cdu s ASN 39 CO 0.00 0.04 1.33 -1.10 -2.04 0.00 0.00 177.10 175.33 1cdu s GLN 40 N 1.08 3.42 0.04 3.55 -0.21 0.40 -4.70 119.66 123.24 1cdu s GLN 40 Ca -0.00 -0.87 0.00 0.00 0.02 0.00 0.00 55.36 54.51 1cdu s GLN 40 Cb -0.14 -4.85 0.00 0.00 1.00 0.00 0.00 33.01 29.02 1cdu s GLN 40 CO -0.03 -2.12 0.00 0.41 -2.12 0.00 0.00 175.29 171.43 1cdu n GLY 41 N 6.15 0.27 0.00 3.09 0.00 -1.26 -1.22 105.19 112.22 1cdu n GLY 41 Ca 0.20 0.69 0.00 0.00 0.00 0.00 0.00 46.02 46.91 1cdu n GLY 41 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1cdu n SER 42 N 0.90 0.21 -4.81 1.61 3.41 -1.26 -4.95 113.62 108.74 1cdu n SER 42 Ca 0.00 -0.59 -0.22 0.00 -0.26 0.00 0.00 58.87 57.80 1cdu n SER 42 Cb 0.00 0.72 -0.05 0.00 -0.26 0.00 0.00 64.21 64.62 1cdu n SER 42 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1cdu s VAL 43 N -0.72 2.83 -0.09 -3.33 -7.23 -0.36 -5.10 120.40 106.41 1cdu s VAL 43 Ca 0.00 -1.51 -0.19 0.00 -1.81 0.00 0.00 61.98 58.47 1cdu s VAL 43 Cb 0.00 -3.03 -0.04 0.00 0.56 0.00 0.00 36.38 33.87 1cdu s VAL 43 CO 0.00 -0.08 0.52 -0.22 -0.31 0.00 0.00 175.10 175.01 1cdu s LEU 44 N -3.99 4.31 -0.11 1.32 2.96 -1.26 -0.46 118.68 121.46 1cdu s LEU 44 Ca 0.43 0.92 0.01 0.00 -0.22 0.00 0.00 54.13 55.26 1cdu s LEU 44 Cb -0.02 -2.77 0.02 0.00 0.50 0.00 0.00 46.19 43.92 1cdu s LEU 44 CO 0.25 0.02 -0.11 0.42 -1.32 0.00 0.00 176.35 175.62 1cdu s THR 45 N 0.42 1.19 -0.16 3.68 -4.23 0.11 -4.86 115.64 111.79 1cdu s THR 45 Ca 0.28 -0.43 -0.04 0.00 -1.18 0.00 0.00 61.69 60.32 1cdu s THR 45 Cb -0.16 -1.15 -0.03 0.00 1.34 0.00 0.00 72.50 72.51 1cdu s THR 45 CO 0.12 0.39 -0.04 -0.54 -0.54 0.00 0.00 174.62 174.02 1cdu s LYS 46 N 1.34 3.66 0.90 3.99 1.02 -1.26 -1.24 119.74 128.15 1cdu s LYS 46 Ca -0.01 -0.52 -0.14 0.00 0.02 0.00 0.00 55.97 55.32 1cdu s LYS 46 Cb -0.14 -2.93 0.15 0.00 -0.52 0.00 0.00 37.83 34.40 1cdu s LYS 46 CO -0.05 0.22 1.26 0.20 -0.92 0.00 0.00 175.35 176.06 1cdu s GLY 47 N 0.42 1.72 -1.11 -3.33 0.00 -1.19 -4.93 107.32 98.89 1cdu s GLY 47 Ca -0.04 -1.02 -0.22 0.00 0.00 0.00 0.00 44.72 43.44 1cdu s GLY 47 CO 0.03 -0.36 1.92 -1.55 0.00 0.00 0.00 173.10 173.13 1cdu n PRO 48 N -3.57 1.79 -4.37 2.90 -0.04 -1.26 -4.68 135.00 125.77 1cdu n PRO 48 Ca 0.13 -2.42 -0.19 0.00 -0.04 0.00 0.00 63.50 60.97 1cdu n PRO 48 Cb 0.60 -3.50 -0.10 0.00 -0.04 0.00 0.00 33.50 30.46 1cdu n PRO 48 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1cdu s SER 49 N 5.77 2.75 0.25 3.54 1.04 -1.26 -5.01 113.70 120.78 1cdu s SER 49 Ca 0.64 -1.03 0.15 0.00 0.48 0.00 0.00 55.95 56.19 1cdu s SER 49 Cb 0.04 -0.16 0.80 0.00 0.10 0.00 0.00 66.02 66.79 1cdu s SER 49 CO 0.12 -0.14 1.41 2.29 0.98 0.00 0.00 173.24 177.90 1cdu n LYS 50 N -0.43 0.10 0.00 4.02 2.85 -1.26 -0.35 118.16 123.09 1cdu n LYS 50 Ca -0.07 0.58 0.11 0.00 -1.05 0.00 0.00 58.31 57.87 1cdu n LYS 50 Cb 0.60 -1.89 -0.00 0.00 -0.65 0.00 0.00 35.03 33.09 1cdu n LYS 50 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1cdu n LEU 51 N -2.02 0.80 -0.01 -5.58 4.32 -1.26 -4.76 117.00 108.49 1cdu n LEU 51 Ca -0.01 -0.31 -0.00 0.00 -0.02 0.00 0.00 56.01 55.67 1cdu n LEU 51 Cb 0.10 -0.08 -0.00 0.00 -1.62 0.00 0.00 43.42 41.82 1cdu n LEU 51 CO 0.07 0.19 0.13 -3.20 -1.22 0.00 0.00 177.39 173.36 1cdu n ASN 52 N -1.55 -0.02 -0.63 -1.43 2.85 0.53 0.41 115.26 115.42 1cdu n ASN 52 Ca 0.04 0.29 0.03 0.00 -0.11 0.00 0.00 54.58 54.82 1cdu n ASN 52 Cb 0.34 -0.13 0.10 0.00 1.24 0.00 0.00 39.78 41.34 1cdu n ASN 52 CO 0.00 0.00 0.00 -0.90 -2.11 0.00 0.00 177.26 174.25 1cdu n ASP 53 N -2.44 1.69 0.00 1.20 5.68 -1.26 -3.20 116.55 118.22 1cdu n ASP 53 Ca 0.00 -2.13 0.00 0.00 -0.50 0.00 0.00 54.79 52.16 1cdu n ASP 53 Cb 0.01 -0.35 0.00 0.00 -1.14 0.00 0.00 41.12 39.64 1cdu n ASP 53 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1cdu n ARG 54 N 0.13 3.39 -3.08 0.11 1.74 0.41 -5.00 116.66 114.36 1cdu n ARG 54 Ca 0.07 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.76 1cdu n ARG 54 Cb 0.34 -0.56 -0.05 0.00 -1.02 0.00 0.00 32.46 31.17 1cdu n ARG 54 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1cdu s ALA 55 N -0.95 3.44 0.34 7.54 0.00 0.17 -1.72 121.76 130.57 1cdu s ALA 55 Ca 0.00 0.20 -0.17 0.00 0.00 0.00 0.00 51.96 51.99 1cdu s ALA 55 Cb 0.00 -2.88 0.04 0.00 0.00 0.00 0.00 23.12 20.28 1cdu s ALA 55 CO 0.00 0.17 0.74 0.34 0.00 0.00 0.00 175.76 177.01 1cdu s ASP 56 N -0.41 -0.07 0.24 0.00 2.15 0.58 -4.92 116.67 114.24 1cdu s ASP 56 Ca 0.35 -0.93 0.04 0.00 0.43 0.00 0.00 52.55 52.43 1cdu s ASP 56 Cb -0.20 0.79 -0.01 0.00 -0.30 0.00 0.00 42.92 43.19 1cdu s ASP 56 CO 0.22 -1.52 0.23 -0.24 -0.17 0.00 0.00 175.17 173.69 1cdu n SER 57 N -0.99 -0.61 -3.70 -0.34 2.88 -1.26 -0.56 113.62 109.04 1cdu n SER 57 Ca -0.06 -2.51 -0.30 0.00 -1.33 0.00 0.00 58.87 54.68 1cdu n SER 57 Cb 0.60 1.33 -0.14 0.00 -0.75 0.00 0.00 64.21 65.25 1cdu n SER 57 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 1cdu s ARG 58 N -2.87 0.87 0.36 -1.46 3.52 -1.26 -4.99 118.95 113.12 1cdu s ARG 58 Ca 0.27 -1.38 0.06 0.00 -0.13 0.00 0.00 55.73 54.54 1cdu s ARG 58 Cb 0.01 -2.02 0.74 0.00 -1.56 0.00 0.00 34.95 32.12 1cdu s ARG 58 CO 0.19 -1.06 1.96 0.00 -0.81 0.00 0.00 175.30 175.57 1cdu h ARG 59 N 7.56 0.73 0.00 5.12 3.08 -1.97 -2.16 114.38 126.74 1cdu h ARG 59 Ca -0.08 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.93 1cdu h ARG 59 Cb 0.98 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.87 1cdu h ARG 59 CO 0.45 0.49 0.00 -1.13 -1.07 0.00 0.00 179.97 178.71 1cdu n SER 60 N -4.48 0.57 -0.03 7.04 3.41 -1.26 -1.26 113.62 117.61 1cdu n SER 60 Ca 0.11 0.72 0.12 0.00 -0.26 0.00 0.00 58.87 59.56 1cdu n SER 60 Cb 0.23 -0.81 0.17 0.00 -0.26 0.00 0.00 64.21 63.54 1cdu n SER 60 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1cdu n LEU 61 N -2.22 0.69 -0.25 1.04 4.77 -0.81 -4.06 117.00 116.16 1cdu n LEU 61 Ca -0.00 -0.15 -0.05 0.00 -0.03 0.00 0.00 56.01 55.77 1cdu n LEU 61 Cb 0.09 -0.18 0.05 0.00 -2.33 0.00 0.00 43.42 41.06 1cdu n LEU 61 CO 0.12 0.17 1.14 -0.50 -1.33 0.00 0.00 177.39 176.99 1cdu h TRP 62 N 0.15 0.90 0.00 -1.77 6.55 -1.13 -0.44 115.95 120.20 1cdu h TRP 62 Ca 0.00 0.01 0.00 0.00 0.95 0.00 0.00 58.89 59.85 1cdu h TRP 62 Cb 0.51 -0.30 0.00 0.00 -0.86 0.00 0.00 29.16 28.51 1cdu h TRP 62 CO 0.00 0.59 0.13 -0.44 -1.05 0.00 0.00 178.44 177.67 1cdu h ASP 63 N 0.95 0.00 -1.10 -3.49 3.32 -1.73 0.12 116.42 114.49 1cdu h ASP 63 Ca 0.25 0.00 -0.61 0.00 0.02 0.00 0.00 57.03 56.69 1cdu h ASP 63 Cb -0.06 0.00 -0.38 0.00 0.22 0.00 0.00 39.33 39.11 1cdu h ASP 63 CO -0.05 0.00 -0.17 0.00 -1.72 0.00 0.00 179.24 177.30 1cdu n GLN 64 N -2.92 3.26 -4.22 3.56 10.64 -0.21 -4.04 117.38 123.45 1cdu n GLN 64 Ca -0.02 -3.95 -0.37 0.00 -1.83 0.00 0.00 57.00 50.83 1cdu n GLN 64 Cb 0.19 -2.28 -0.04 0.00 -0.86 0.00 0.00 30.24 27.26 1cdu n GLN 64 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1cdu n GLY 65 N -0.70 -0.44 3.08 2.61 0.00 0.26 -4.87 105.19 105.13 1cdu n GLY 65 Ca 0.49 0.12 -0.28 0.00 0.00 0.00 0.00 46.02 46.34 1cdu n GLY 65 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1cdu s ASN 66 N -3.22 2.40 -0.44 1.61 0.02 -1.01 -1.05 114.94 113.26 1cdu s ASN 66 Ca 0.74 -0.42 0.04 0.00 -1.02 0.00 0.00 52.86 52.20 1cdu s ASN 66 Cb -0.41 -1.09 0.17 0.00 0.02 0.00 0.00 41.25 39.94 1cdu s ASN 66 CO 0.91 0.04 0.35 -0.36 0.02 0.00 0.00 177.10 178.07 1cdu s PHE 67 N 0.80 1.35 0.64 2.20 0.08 -0.11 -3.17 117.98 119.76 1cdu s PHE 67 Ca -0.10 -2.43 -0.14 0.00 0.12 0.00 0.00 56.93 54.38 1cdu s PHE 67 Cb -0.16 -1.11 -0.02 0.00 -0.57 0.00 0.00 43.02 41.17 1cdu s PHE 67 CO 0.01 -0.80 1.06 -1.25 -0.10 0.00 0.00 175.22 174.15 1cdu s PRO 68 N -0.08 3.13 -0.09 0.24 0.04 -1.26 -4.15 135.00 132.82 1cdu s PRO 68 Ca 0.32 1.12 0.02 0.00 0.04 0.00 0.00 61.00 62.50 1cdu s PRO 68 Cb 0.02 -2.01 -0.02 0.00 0.04 0.00 0.00 34.50 32.54 1cdu s PRO 68 CO -0.19 -0.96 -0.14 -1.17 0.04 0.00 0.00 177.00 174.58 1cdu s LEU 69 N -4.92 2.68 -0.10 -3.56 0.20 -0.74 -4.48 118.68 107.75 1cdu s LEU 69 Ca 0.62 -0.29 0.01 0.00 0.69 0.00 0.00 54.13 55.16 1cdu s LEU 69 Cb -0.15 -1.57 0.02 0.00 -0.43 0.00 0.00 46.19 44.05 1cdu s LEU 69 CO 0.44 0.24 -0.12 -0.63 -0.29 0.00 0.00 176.35 175.99 1cdu s ILE 70 N -0.10 1.25 -0.21 6.68 1.01 0.27 -1.16 121.20 128.94 1cdu s ILE 70 Ca -0.02 -0.48 0.02 0.00 0.00 0.00 0.00 60.65 60.16 1cdu s ILE 70 Cb -0.14 -1.17 0.04 0.00 0.01 0.00 0.00 42.46 41.20 1cdu s ILE 70 CO 0.04 0.39 -0.15 -0.63 0.00 0.00 0.00 174.94 174.59 1cdu s ILE 71 N 1.13 2.02 0.46 2.92 1.01 -1.05 -0.31 121.20 127.39 1cdu s ILE 71 Ca -0.05 -1.19 0.06 0.00 0.00 0.00 0.00 60.65 59.46 1cdu s ILE 71 Cb -0.14 -1.98 0.02 0.00 0.01 0.00 0.00 42.46 40.37 1cdu s ILE 71 CO -0.02 0.27 0.64 -0.54 0.00 0.00 0.00 174.94 175.29 1cdu s LYS 72 N 1.24 2.73 -1.19 2.79 1.02 -0.70 -1.49 119.74 124.15 1cdu s LYS 72 Ca -0.01 -1.09 -0.31 0.00 0.02 0.00 0.00 55.97 54.58 1cdu s LYS 72 Cb -0.16 -2.67 0.03 0.00 -0.52 0.00 0.00 37.83 34.51 1cdu s LYS 72 CO -0.09 -0.42 0.71 -1.71 -0.92 0.00 0.00 175.35 172.91 1cdu n ASN 73 N -2.02 -4.47 -4.69 2.83 5.15 -1.08 -4.80 115.26 106.19 1cdu n ASN 73 Ca 0.08 -1.22 -0.44 0.00 -0.60 0.00 0.00 54.58 52.40 1cdu n ASN 73 Cb 0.59 -2.09 -0.04 0.00 -0.53 0.00 0.00 39.78 37.72 1cdu n ASN 73 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 1cdu n LEU 74 N -4.79 3.78 -4.62 1.20 7.94 -0.34 -4.73 117.00 115.45 1cdu n LEU 74 Ca -0.11 1.01 -0.32 0.00 -1.11 0.00 0.00 56.01 55.48 1cdu n LEU 74 Cb 0.57 -1.50 -0.10 0.00 0.53 0.00 0.00 43.42 42.92 1cdu n LEU 74 CO 0.72 0.06 -0.37 -0.54 -1.11 0.00 0.00 177.39 176.15 1cdu s LYS 75 N 2.36 2.59 0.00 1.96 1.02 -1.26 0.35 119.74 126.76 1cdu s LYS 75 Ca 0.82 -0.71 0.02 0.00 0.02 0.00 0.00 55.97 56.12 1cdu s LYS 75 Cb -0.55 -2.53 0.09 0.00 -0.52 0.00 0.00 37.83 34.31 1cdu s LYS 75 CO 0.39 0.60 0.95 0.44 -0.92 0.00 0.00 175.35 176.81 1cdu n ILE 76 N 1.48 1.43 1.23 2.17 -6.64 -1.26 -0.19 119.36 117.59 1cdu n ILE 76 Ca -0.15 0.36 0.14 0.00 -1.77 0.00 0.00 62.75 61.33 1cdu n ILE 76 Cb 0.53 -1.33 0.70 0.00 -1.44 0.00 0.00 39.64 38.09 1cdu n ILE 76 CO 0.00 0.00 0.00 -0.62 -1.77 0.00 0.00 176.55 174.16 1cdu n GLU 77 N -1.38 0.24 0.00 6.28 4.71 -1.26 -2.77 120.64 126.46 1cdu n GLU 77 Ca 0.01 0.00 0.14 0.00 -0.01 0.00 0.00 57.16 57.30 1cdu n GLU 77 Cb 0.02 -1.50 0.60 0.00 -1.01 0.00 0.00 31.44 29.54 1cdu n GLU 77 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1cdu n ASP 78 N -1.38 0.43 -4.68 1.62 8.00 0.74 -4.81 116.55 116.46 1cdu n ASP 78 Ca 0.11 -0.48 -0.42 0.00 0.71 0.00 0.00 54.79 54.71 1cdu n ASP 78 Cb 0.28 -0.09 -0.03 0.00 -0.02 0.00 0.00 41.12 41.27 1cdu n ASP 78 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1cdu s SER 79 N -2.54 6.79 0.00 -2.24 0.01 -1.11 -4.80 113.70 109.80 1cdu s SER 79 Ca 0.27 2.17 0.00 0.00 1.31 0.00 0.00 55.95 59.70 1cdu s SER 79 Cb 0.20 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.87 1cdu s SER 79 CO 0.49 -0.78 0.00 -0.67 0.41 0.00 0.00 173.24 172.69 1cdu n ASP 80 N 5.70 0.00 -4.61 2.44 2.03 0.26 -4.96 116.55 117.41 1cdu n ASP 80 Ca 0.14 0.00 -0.38 0.00 0.52 0.00 0.00 54.79 55.07 1cdu n ASP 80 Cb 0.43 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.73 1cdu n ASP 80 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1cdu s THR 81 N -2.00 5.31 -0.07 5.18 2.01 -1.26 -0.57 115.64 124.24 1cdu s THR 81 Ca 0.00 0.23 -0.05 0.00 0.31 0.00 0.00 61.69 62.18 1cdu s THR 81 Cb 0.00 -3.55 -0.04 0.00 0.01 0.00 0.00 72.50 68.92 1cdu s THR 81 CO 0.00 0.27 0.16 -0.31 -0.69 0.00 0.00 174.62 174.05 1cdu s TYR 82 N 1.60 3.58 -0.03 4.92 2.02 0.18 -2.90 117.35 126.72 1cdu s TYR 82 Ca 0.08 0.45 0.06 0.00 -0.37 0.00 0.00 57.07 57.30 1cdu s TYR 82 Cb -0.15 -1.89 -0.02 0.00 -0.40 0.00 0.00 41.96 39.49 1cdu s TYR 82 CO 0.09 0.70 -0.21 0.42 -1.57 0.00 0.00 175.55 174.98 1cdu s ILE 83 N -1.17 2.52 -0.19 2.71 1.09 -0.81 -0.65 121.20 124.70 1cdu s ILE 83 Ca 0.21 -0.97 0.00 0.00 -1.10 0.00 0.00 60.65 58.80 1cdu s ILE 83 Cb -0.12 -1.94 0.04 0.00 -1.06 0.00 0.00 42.46 39.38 1cdu s ILE 83 CO 0.11 0.56 -0.09 0.00 -0.10 0.00 0.00 174.94 175.42 1cdu s GLU 85 N 1.48 2.70 -0.35 0.00 2.02 -0.97 -0.16 118.70 123.43 1cdu s GLU 85 Ca -0.00 -1.09 -0.05 0.00 0.02 0.00 0.00 54.97 53.85 1cdu s GLU 85 Cb -0.16 -3.16 0.06 0.00 0.10 0.00 0.00 34.13 30.97 1cdu s GLU 85 CO -0.08 -0.51 0.10 0.08 0.02 0.00 0.00 175.26 174.87 1cdu s VAL 86 N 1.33 3.52 0.00 2.63 1.01 0.43 -2.59 120.40 126.73 1cdu s VAL 86 Ca -0.02 -1.37 0.00 0.00 0.00 0.00 0.00 61.98 60.59 1cdu s VAL 86 Cb -0.18 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.12 1cdu s VAL 86 CO -0.01 -0.26 0.00 1.21 0.00 0.00 0.00 175.10 176.03 1cdu n GLU 87 N 4.73 0.00 0.15 2.72 2.13 0.13 -0.39 120.64 130.11 1cdu n GLU 87 Ca -0.11 0.00 0.12 0.00 0.66 0.00 0.00 57.16 57.83 1cdu n GLU 87 Cb 0.44 0.00 0.07 0.00 0.27 0.00 0.00 31.44 32.22 1cdu n GLU 87 CO 0.00 0.00 0.00 0.22 -0.41 0.00 0.00 177.13 176.94 1cdu h ASP 88 N 0.00 0.00 -3.41 4.31 1.82 -1.94 -3.46 116.42 113.73 1cdu h ASP 88 Ca 0.00 -0.00 -0.54 0.00 -0.39 0.00 0.00 57.03 56.09 1cdu h ASP 88 Cb 0.00 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 39.97 1cdu h ASP 88 CO 0.00 0.00 0.10 -1.58 -1.61 0.00 0.00 179.24 176.15 1cdu s GLN 89 N -3.30 4.43 -0.10 0.28 0.74 0.47 -5.08 119.66 117.10 1cdu s GLN 89 Ca 0.03 1.00 -0.00 0.00 0.05 0.00 0.00 55.36 56.44 1cdu s GLN 89 Cb 0.08 -3.26 0.02 0.00 1.10 0.00 0.00 33.01 30.95 1cdu s GLN 89 CO 0.74 0.59 -0.08 0.21 -0.55 0.00 0.00 175.29 176.20 1cdu s LYS 90 N -1.10 1.51 -0.07 1.67 2.20 -1.26 -0.43 119.74 122.26 1cdu s LYS 90 Ca 0.33 -0.26 0.03 0.00 -0.36 0.00 0.00 55.97 55.71 1cdu s LYS 90 Cb -0.22 -1.52 -0.02 0.00 -1.51 0.00 0.00 37.83 34.56 1cdu s LYS 90 CO 0.23 -0.22 -0.17 -1.21 -0.36 0.00 0.00 175.35 173.62 1cdu s GLU 91 N 1.54 2.76 -0.13 4.03 2.02 0.77 -4.97 118.70 124.73 1cdu s GLU 91 Ca 0.02 -0.75 -0.03 0.00 0.02 0.00 0.00 54.97 54.23 1cdu s GLU 91 Cb -0.13 -2.39 -0.03 0.00 0.10 0.00 0.00 34.13 31.68 1cdu s GLU 91 CO -0.06 0.44 -0.02 -1.21 0.02 0.00 0.00 175.26 174.43 1cdu s GLU 92 N -0.27 3.39 -0.05 1.61 2.02 -1.26 -0.87 118.70 123.26 1cdu s GLU 92 Ca 0.01 -0.47 -0.00 0.00 0.02 0.00 0.00 54.97 54.52 1cdu s GLU 92 Cb -0.13 -2.87 0.03 0.00 0.10 0.00 0.00 34.13 31.26 1cdu s GLU 92 CO 0.03 0.43 -0.00 0.08 0.02 0.00 0.00 175.26 175.82 1cdu s VAL 93 N -0.15 0.30 -0.22 2.63 1.01 0.17 -3.32 120.40 120.82 1cdu s VAL 93 Ca 0.04 0.10 -0.10 0.00 0.00 0.00 0.00 61.98 62.02 1cdu s VAL 93 Cb -0.13 -0.42 -0.05 0.00 0.00 0.00 0.00 36.38 35.78 1cdu s VAL 93 CO 0.02 0.21 0.14 -1.58 0.00 0.00 0.00 175.10 173.89 1cdu s GLN 94 N 1.54 4.13 -0.23 2.72 0.74 -0.02 0.50 119.66 129.03 1cdu s GLN 94 Ca -0.02 -0.25 -0.09 0.00 0.05 0.00 0.00 55.36 55.06 1cdu s GLN 94 Cb -0.13 -3.46 -0.04 0.00 1.10 0.00 0.00 33.01 30.48 1cdu s GLN 94 CO -0.03 0.20 0.11 -1.17 -0.55 0.00 0.00 175.29 173.84 1cdu s LEU 95 N 0.65 3.78 -0.17 3.68 0.20 0.27 -0.17 118.68 126.91 1cdu s LEU 95 Ca 0.08 -0.03 0.01 0.00 0.69 0.00 0.00 54.13 54.87 1cdu s LEU 95 Cb -0.12 -2.01 0.01 0.00 -0.43 0.00 0.00 46.19 43.65 1cdu s LEU 95 CO 0.01 0.04 -0.18 -0.76 -0.29 0.00 0.00 176.35 175.17 1cdu s LEU 96 N 1.18 2.24 -0.07 -0.68 2.01 0.31 -0.57 118.68 123.10 1cdu s LEU 96 Ca 0.06 -0.59 0.03 0.00 0.01 0.00 0.00 54.13 53.63 1cdu s LEU 96 Cb -0.14 -1.51 -0.02 0.00 0.01 0.00 0.00 46.19 44.53 1cdu s LEU 96 CO 0.04 0.02 -0.15 -0.69 1.01 0.00 0.00 176.35 176.59 1cdu s VAL 97 N 1.16 2.98 0.12 -1.59 1.01 -1.26 0.10 120.40 122.92 1cdu s VAL 97 Ca 0.02 -0.74 0.08 0.00 0.00 0.00 0.00 61.98 61.34 1cdu s VAL 97 Cb -0.14 -2.18 -0.04 0.00 0.00 0.00 0.00 36.38 34.02 1cdu s VAL 97 CO -0.08 0.57 -0.19 -0.36 0.00 0.00 0.00 175.10 175.04 1cdu s PHE 98 N -0.42 1.73 0.15 5.22 0.08 -0.58 -4.03 117.98 120.12 1cdu s PHE 98 Ca 0.05 -0.45 0.10 0.00 0.12 0.00 0.00 56.93 56.75 1cdu s PHE 98 Cb -0.12 -0.92 -0.04 0.00 -0.57 0.00 0.00 43.02 41.37 1cdu s PHE 98 CO 0.02 0.23 -0.24 0.20 -0.10 0.00 0.00 175.22 175.33 1cdu s GLY 99 N -2.16 1.52 -0.34 4.36 0.00 0.42 -1.05 107.32 110.06 1cdu s GLY 99 Ca 0.09 -1.47 0.01 0.00 0.00 0.00 0.00 44.72 43.34 1cdu s GLY 99 CO 0.05 -1.48 0.27 -2.27 0.00 0.00 0.00 173.10 169.67 1cdu s LEU 100 N -2.29 0.37 0.57 0.66 1.98 -1.25 0.17 118.68 118.88 1cdu s LEU 100 Ca 0.15 -1.66 -0.06 0.00 -2.89 0.00 0.00 54.13 49.67 1cdu s LEU 100 Cb -0.09 0.09 0.00 0.00 0.66 0.00 0.00 46.19 46.85 1cdu s LEU 100 CO 0.07 -0.32 0.88 0.42 -1.89 0.00 0.00 176.35 175.51 1cdu s THR 101 N 1.50 3.87 -0.58 3.68 -4.23 0.29 -4.91 115.64 115.25 1cdu s THR 101 Ca 0.15 0.04 0.04 0.00 -1.18 0.00 0.00 61.69 60.75 1cdu s THR 101 Cb -0.18 -3.52 0.15 0.00 1.34 0.00 0.00 72.50 70.28 1cdu s THR 101 CO -0.10 -0.53 0.35 0.00 -0.54 0.00 0.00 174.62 173.80 1cdu s ALA 102 N -2.95 3.39 0.10 3.99 0.00 -1.26 -2.67 121.76 122.36 1cdu s ALA 102 Ca 0.53 -3.43 -0.27 0.00 0.00 0.00 0.00 51.96 48.79 1cdu s ALA 102 Cb -0.10 -2.13 -0.10 0.00 0.00 0.00 0.00 23.12 20.78 1cdu s ALA 102 CO 0.45 -2.05 1.44 -0.97 0.00 0.00 0.00 175.76 174.63 1cdu h ASN 103 N 6.07 -1.40 -2.89 0.00 -0.73 -1.46 -3.36 115.58 111.82 1cdu h ASN 103 Ca 0.02 0.17 -0.57 0.00 1.87 0.00 0.00 56.30 57.79 1cdu h ASN 103 Cb 0.84 0.55 -0.03 0.00 0.27 0.00 0.00 38.32 39.95 1cdu h ASN 103 CO 0.68 -0.37 1.09 -0.44 -0.37 0.00 0.00 177.43 178.02 1cdu s SER 104 N -4.42 6.42 -0.10 1.15 0.01 -1.20 -4.90 113.70 110.66 1cdu s SER 104 Ca -0.12 1.45 -0.39 0.00 1.31 0.00 0.00 55.95 58.20 1cdu s SER 104 Cb 0.06 -2.53 -0.17 0.00 0.21 0.00 0.00 66.02 63.58 1cdu s SER 104 CO 0.48 -1.25 1.45 -0.67 0.41 0.00 0.00 173.24 173.67 1cdu n ASP 105 N 8.36 1.58 -0.25 2.44 2.03 -1.26 -4.79 116.55 124.66 1cdu n ASP 105 Ca 0.18 1.12 0.22 0.00 0.52 0.00 0.00 54.79 56.82 1cdu n ASP 105 Cb 0.46 -1.10 0.37 0.00 -0.72 0.00 0.00 41.12 40.12 1cdu n ASP 105 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1cdu n THR 106 N 3.15 -0.16 -3.12 5.18 -2.24 -1.26 -3.61 114.28 112.22 1cdu n THR 106 Ca 0.22 1.03 -0.44 0.00 -2.27 0.00 0.00 64.05 62.60 1cdu n THR 106 Cb 0.13 -1.69 -0.06 0.00 -2.10 0.00 0.00 70.33 66.62 1cdu n THR 106 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1cdu s HIS 107 N -4.58 3.01 0.23 4.78 3.76 -1.25 0.11 115.29 121.35 1cdu s HIS 107 Ca -0.04 -0.61 0.03 0.00 -0.15 0.00 0.00 55.06 54.29 1cdu s HIS 107 Cb 0.18 -3.70 -0.05 0.00 1.11 0.00 0.00 32.58 30.12 1cdu s HIS 107 CO 0.45 -1.13 0.00 -0.51 -0.85 0.00 0.00 174.74 172.71 1cdu s LEU 108 N 2.75 2.16 0.27 0.89 1.02 0.19 -4.93 118.68 121.04 1cdu s LEU 108 Ca 0.15 -1.23 -0.19 0.00 0.02 0.00 0.00 54.13 52.88 1cdu s LEU 108 Cb -0.20 -0.25 -0.09 0.00 0.02 0.00 0.00 46.19 45.67 1cdu s LEU 108 CO 0.11 -0.53 0.76 -0.76 0.02 0.00 0.00 176.35 175.95 1cdu s LEU 109 N -3.30 4.24 0.77 1.79 2.01 -1.26 0.14 118.68 123.07 1cdu s LEU 109 Ca 0.29 1.44 -0.15 0.00 0.01 0.00 0.00 54.13 55.71 1cdu s LEU 109 Cb 0.06 -3.83 0.03 0.00 0.01 0.00 0.00 46.19 42.46 1cdu s LEU 109 CO 0.09 -0.07 0.99 0.00 1.01 0.00 0.00 176.35 178.36 1cdu n GLN 110 N 0.31 0.34 -0.92 1.70 10.64 0.98 -2.39 117.38 128.04 1cdu n GLN 110 Ca 0.00 0.18 0.00 0.00 -1.83 0.00 0.00 57.00 55.35 1cdu n GLN 110 Cb 0.52 -2.25 0.00 0.00 -0.86 0.00 0.00 30.24 27.65 1cdu n GLN 110 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1cdu n GLY 111 N 0.97 0.79 3.86 2.61 0.00 0.12 -4.85 105.19 108.70 1cdu n GLY 111 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 1cdu n GLY 111 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1cdu s GLN 112 N -0.19 3.59 0.74 1.61 0.74 -1.00 -4.46 119.66 120.69 1cdu s GLN 112 Ca 0.00 0.01 -0.13 0.00 0.05 0.00 0.00 55.36 55.29 1cdu s GLN 112 Cb 0.00 -3.21 0.04 0.00 1.10 0.00 0.00 33.01 30.94 1cdu s GLN 112 CO 0.00 0.74 1.12 -1.12 -0.55 0.00 0.00 175.29 175.48 1cdu s SER 113 N -0.99 4.55 -0.04 6.67 0.01 -1.23 -2.78 113.70 119.89 1cdu s SER 113 Ca 0.17 2.00 0.01 0.00 1.31 0.00 0.00 55.95 59.43 1cdu s SER 113 Cb -0.13 -2.55 0.02 0.00 0.21 0.00 0.00 66.02 63.57 1cdu s SER 113 CO 0.06 -2.01 -0.04 -0.22 0.41 0.00 0.00 173.24 171.44 1cdu s LEU 114 N -5.47 1.30 0.05 2.44 2.96 -1.06 -4.90 118.68 114.00 1cdu s LEU 114 Ca 0.66 -0.12 0.08 0.00 -0.22 0.00 0.00 54.13 54.53 1cdu s LEU 114 Cb -0.20 -0.42 -0.03 0.00 0.50 0.00 0.00 46.19 46.03 1cdu s LEU 114 CO 0.49 -0.06 -0.23 -0.89 -1.32 0.00 0.00 176.35 174.34 1cdu s THR 115 N 0.95 1.86 0.00 3.68 2.01 -1.26 -0.33 115.64 122.55 1cdu s THR 115 Ca -0.11 -1.32 0.01 0.00 0.31 0.00 0.00 61.69 60.59 1cdu s THR 115 Cb -0.14 -1.61 -0.01 0.00 0.01 0.00 0.00 72.50 70.75 1cdu s THR 115 CO -0.00 0.23 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.35 1cdu s LEU 116 N -1.31 2.05 -0.11 4.42 1.02 -0.44 -1.06 118.68 123.25 1cdu s LEU 116 Ca 0.09 -0.16 0.02 0.00 0.02 0.00 0.00 54.13 54.10 1cdu s LEU 116 Cb -0.09 -0.22 0.01 0.00 0.02 0.00 0.00 46.19 45.91 1cdu s LEU 116 CO 0.02 0.01 -0.18 0.42 0.02 0.00 0.00 176.35 176.64 1cdu s THR 117 N -0.33 1.69 -0.22 5.49 -4.23 -1.09 -1.74 115.64 115.22 1cdu s THR 117 Ca -0.00 -0.77 -0.19 0.00 -1.18 0.00 0.00 61.69 59.55 1cdu s THR 117 Cb -0.03 -1.51 -0.03 0.00 1.34 0.00 0.00 72.50 72.27 1cdu s THR 117 CO -0.00 0.48 0.53 -0.22 -0.54 0.00 0.00 174.62 174.87 1cdu s LEU 118 N 0.80 4.11 0.09 4.79 2.96 -0.58 -0.55 118.68 130.30 1cdu s LEU 118 Ca -0.10 0.64 -0.23 0.00 -0.22 0.00 0.00 54.13 54.23 1cdu s LEU 118 Cb -0.16 -2.72 -0.07 0.00 0.50 0.00 0.00 46.19 43.75 1cdu s LEU 118 CO 0.01 -0.23 0.70 -1.61 -1.32 0.00 0.00 176.35 173.89 1cdu s GLU 119 N 1.93 4.42 0.06 1.98 2.02 0.44 -4.82 118.70 124.74 1cdu s GLU 119 Ca 0.24 0.97 -0.04 0.00 0.02 0.00 0.00 54.97 56.15 1cdu s GLU 119 Cb -0.15 -3.29 -0.02 0.00 0.10 0.00 0.00 34.13 30.76 1cdu s GLU 119 CO 0.09 0.49 0.07 -1.12 0.02 0.00 0.00 175.26 174.81 1cdu s SER 120 N -0.74 0.30 0.74 -0.19 0.01 -1.26 -0.44 113.70 112.13 1cdu s SER 120 Ca 0.34 -0.79 -0.11 0.00 1.31 0.00 0.00 55.95 56.70 1cdu s SER 120 Cb -0.21 0.25 0.04 0.00 0.21 0.00 0.00 66.02 66.31 1cdu s SER 120 CO 0.22 -0.63 1.08 -2.84 0.41 0.00 0.00 173.24 171.49 1cdu s PRO 121 N -3.66 2.47 -1.34 12.44 0.02 -1.26 -4.89 135.00 138.79 1cdu s PRO 121 Ca 0.04 1.13 -0.15 0.00 0.02 0.00 0.00 61.00 62.05 1cdu s PRO 121 Cb 0.05 -1.92 -0.01 0.00 0.02 0.00 0.00 34.50 32.64 1cdu s PRO 121 CO -0.09 -1.48 2.24 -0.35 -0.33 0.00 0.00 177.00 176.98 1cdu n PRO 122 N -3.33 2.67 0.00 5.54 -0.04 -1.26 -3.26 135.00 135.32 1cdu n PRO 122 Ca 0.09 -2.41 0.00 0.00 -0.04 0.00 0.00 63.50 61.13 1cdu n PRO 122 Cb 0.53 -3.17 0.00 0.00 -0.04 0.00 0.00 33.50 30.82 1cdu n PRO 122 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1cdu n GLY 123 N 4.12 0.00 3.64 0.55 0.00 -1.26 -5.15 105.19 107.09 1cdu n GLY 123 Ca 0.54 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.48 1cdu n GLY 123 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1cdu s SER 124 N 0.00 -0.78 -0.42 1.61 0.15 -1.20 -5.08 113.70 107.98 1cdu s SER 124 Ca 0.00 1.31 0.03 0.00 0.70 0.00 0.00 55.95 57.99 1cdu s SER 124 Cb 0.00 1.32 0.12 0.00 -1.71 0.00 0.00 66.02 65.75 1cdu s SER 124 CO 0.00 -0.21 0.16 -0.55 1.20 0.00 0.00 173.24 173.84 1cdu s SER 125 N 1.23 4.39 0.86 5.45 0.15 -1.26 -4.70 113.70 119.82 1cdu s SER 125 Ca -0.07 -2.50 -0.08 0.00 0.70 0.00 0.00 55.95 54.00 1cdu s SER 125 Cb -0.05 -1.49 0.17 0.00 -1.71 0.00 0.00 66.02 62.95 1cdu s SER 125 CO -0.14 -0.31 1.10 -0.81 1.20 0.00 0.00 173.24 174.28 1cdu n PRO 126 N 3.77 -0.63 -3.85 5.44 -0.04 -1.26 -5.06 135.00 133.37 1cdu n PRO 126 Ca 0.04 -2.29 -0.36 0.00 -0.04 0.00 0.00 63.50 60.86 1cdu n PRO 126 Cb 0.37 -0.95 -0.13 0.00 -0.04 0.00 0.00 33.50 32.75 1cdu n PRO 126 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1cdu s SER 127 N -5.23 4.65 -0.31 3.54 0.01 -1.04 -4.73 113.70 110.59 1cdu s SER 127 Ca 0.67 -0.57 -0.10 0.00 1.31 0.00 0.00 55.95 57.26 1cdu s SER 127 Cb -0.03 -1.79 -0.02 0.00 0.21 0.00 0.00 66.02 64.40 1cdu s SER 127 CO 0.46 -0.10 0.17 -0.69 0.41 0.00 0.00 173.24 173.49 1cdu s VAL 128 N 1.47 4.88 -0.30 3.43 1.01 -0.96 -1.21 120.40 128.70 1cdu s VAL 128 Ca 0.04 -0.24 0.02 0.00 0.00 0.00 0.00 61.98 61.80 1cdu s VAL 128 Cb -0.16 -3.44 0.09 0.00 0.00 0.00 0.00 36.38 32.87 1cdu s VAL 128 CO -0.01 0.11 0.02 0.00 0.00 0.00 0.00 175.10 175.22 1cdu s GLN 129 N 1.67 1.42 0.20 2.72 -2.07 0.21 -0.87 119.66 122.94 1cdu s GLN 129 Ca 0.06 -1.45 0.03 0.00 -1.82 0.00 0.00 55.36 52.17 1cdu s GLN 129 Cb -0.17 -2.77 -0.03 0.00 -1.09 0.00 0.00 33.01 28.95 1cdu s GLN 129 CO 0.08 -0.84 0.34 0.00 -1.32 0.00 0.00 175.29 173.55 1cdu s ARG 131 N -3.63 0.32 0.63 0.00 1.70 -0.10 0.88 118.95 118.75 1cdu s ARG 131 Ca 0.35 0.47 -0.11 0.00 -0.47 0.00 0.00 55.73 55.97 1cdu s ARG 131 Cb -0.10 0.09 -0.03 0.00 -0.57 0.00 0.00 34.95 34.34 1cdu s ARG 131 CO 0.29 -0.08 1.04 -1.54 -1.08 0.00 0.00 175.30 173.93 1cdu s SER 132 N 0.49 6.10 0.63 -2.89 1.04 -1.16 -2.44 113.70 115.47 1cdu s SER 132 Ca -0.03 1.43 0.30 0.00 0.48 0.00 0.00 55.95 58.14 1cdu s SER 132 Cb -0.04 -2.45 1.64 0.00 0.10 0.00 0.00 66.02 65.26 1cdu s SER 132 CO -0.03 -0.95 1.97 -0.65 0.98 0.00 0.00 173.24 174.56 1cdu h PRO 133 N -0.38 0.00 -0.80 4.02 0.11 -1.82 0.50 132.00 133.63 1cdu h PRO 133 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1cdu h PRO 133 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1cdu h PRO 133 CO 0.61 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.94 1cdu n ARG 134 N -3.25 0.88 0.00 1.05 5.12 -1.26 -4.85 116.66 114.34 1cdu n ARG 134 Ca 0.01 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.93 1cdu n ARG 134 Cb 0.43 -1.40 0.00 0.00 -1.16 0.00 0.00 32.46 30.33 1cdu n ARG 134 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1cdu n GLY 135 N 0.09 0.81 3.56 -0.13 0.00 0.18 -4.89 105.19 104.81 1cdu n GLY 135 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1cdu n GLY 135 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1cdu s LYS 136 N 0.00 2.58 0.06 1.61 2.47 -1.26 -4.71 119.74 120.50 1cdu s LYS 136 Ca 0.00 1.27 -0.27 0.00 -1.56 0.00 0.00 55.97 55.41 1cdu s LYS 136 Cb 0.00 -4.44 -0.05 0.00 -1.46 0.00 0.00 37.83 31.88 1cdu s LYS 136 CO 0.00 -2.74 0.86 1.21 0.16 0.00 0.00 175.35 174.84 1cdu s ASN 137 N 9.54 7.33 0.21 1.43 3.84 -1.26 -2.99 114.94 133.04 1cdu s ASN 137 Ca 0.87 1.59 0.11 0.00 0.21 0.00 0.00 52.86 55.64 1cdu s ASN 137 Cb -0.19 -2.52 -0.04 0.00 -0.55 0.00 0.00 41.25 37.94 1cdu s ASN 137 CO 0.27 -0.05 -0.21 -0.63 -2.79 0.00 0.00 177.10 173.69 1cdu s ILE 138 N 0.10 2.51 0.20 -5.21 1.01 0.26 -4.97 121.20 115.10 1cdu s ILE 138 Ca 0.43 -2.04 -0.09 0.00 0.00 0.00 0.00 60.65 58.95 1cdu s ILE 138 Cb -0.22 -2.23 -0.01 0.00 0.01 0.00 0.00 42.46 40.01 1cdu s ILE 138 CO 0.26 -0.17 0.33 -1.10 0.00 0.00 0.00 174.94 174.26 1cdu s GLN 139 N -2.85 1.31 0.00 2.79 1.11 -1.26 0.12 119.66 120.88 1cdu s GLN 139 Ca 0.23 -1.27 0.00 0.00 0.01 0.00 0.00 55.36 54.33 1cdu s GLN 139 Cb -0.08 0.40 0.00 0.00 -1.01 0.00 0.00 33.01 32.32 1cdu s GLN 139 CO 0.12 -0.50 0.00 0.41 0.01 0.00 0.00 175.29 175.33 1cdu n GLY 140 N -0.29 -1.25 0.00 3.09 0.00 -0.05 -4.92 105.19 101.78 1cdu n GLY 140 Ca -0.04 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 44.92 1cdu n GLY 140 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cdu n GLY 141 N 0.00 0.62 0.18 -0.02 0.00 -1.26 -2.27 105.19 102.43 1cdu n GLY 141 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 1cdu n GLY 141 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1cdu h LYS 142 N 0.00 0.06 -5.01 1.61 1.57 -1.89 -3.41 116.57 109.50 1cdu h LYS 142 Ca 0.00 -0.00 -0.66 0.00 -1.87 0.00 0.00 60.65 58.12 1cdu h LYS 142 Cb 0.00 -0.01 -0.28 0.00 0.08 0.00 0.00 32.23 32.02 1cdu h LYS 142 CO 0.00 0.04 -0.73 0.99 -0.57 0.00 0.00 179.45 179.18 1cdu s THR 143 N -6.19 3.32 -0.09 -0.16 2.01 -1.26 -1.53 115.64 111.74 1cdu s THR 143 Ca -0.14 -0.51 -0.03 0.00 0.31 0.00 0.00 61.69 61.32 1cdu s THR 143 Cb 0.15 -2.50 -0.04 0.00 0.01 0.00 0.00 72.50 70.12 1cdu s THR 143 CO 0.71 0.43 0.05 -0.76 -0.69 0.00 0.00 174.62 174.36 1cdu s LEU 144 N 1.44 3.84 -0.05 4.42 1.02 -0.71 -4.83 118.68 123.81 1cdu s LEU 144 Ca 0.05 0.24 -0.05 0.00 0.02 0.00 0.00 54.13 54.40 1cdu s LEU 144 Cb -0.14 -1.91 0.01 0.00 0.02 0.00 0.00 46.19 44.17 1cdu s LEU 144 CO -0.03 0.38 0.14 -0.44 0.02 0.00 0.00 176.35 176.42 1cdu s SER 145 N -0.96 -0.12 -0.16 2.29 0.01 -1.26 -1.33 113.70 112.18 1cdu s SER 145 Ca 0.14 0.22 -0.04 0.00 1.31 0.00 0.00 55.95 57.58 1cdu s SER 145 Cb -0.12 0.28 -0.03 0.00 0.21 0.00 0.00 66.02 66.37 1cdu s SER 145 CO 0.03 -0.10 -0.04 -0.69 0.41 0.00 0.00 173.24 172.86 1cdu s VAL 146 N -0.14 3.88 0.01 3.43 1.01 0.55 -4.97 120.40 124.17 1cdu s VAL 146 Ca -0.02 -0.36 -0.05 0.00 0.00 0.00 0.00 61.98 61.54 1cdu s VAL 146 Cb -0.02 -2.70 -0.02 0.00 0.00 0.00 0.00 36.38 33.64 1cdu s VAL 146 CO 0.00 0.49 1.08 0.28 0.00 0.00 0.00 175.10 176.96 1cdu h SER 147 N 6.70 -0.23 -3.96 3.32 0.02 -1.91 -2.81 113.55 114.67 1cdu h SER 147 Ca -0.31 0.02 -0.23 0.00 -0.84 0.00 0.00 61.79 60.43 1cdu h SER 147 Cb 1.19 0.08 -0.27 0.00 0.14 0.00 0.00 62.40 63.54 1cdu h SER 147 CO 0.63 -0.10 -0.72 -1.10 -1.14 0.00 0.00 176.83 174.40 1cdu s GLN 148 N -3.43 0.11 -0.23 3.45 -0.21 -1.26 -3.49 119.66 114.60 1cdu s GLN 148 Ca -0.03 -0.13 -0.15 0.00 0.02 0.00 0.00 55.36 55.07 1cdu s GLN 148 Cb 0.01 -0.04 -0.04 0.00 1.00 0.00 0.00 33.01 33.94 1cdu s GLN 148 CO 0.09 0.01 0.39 -0.51 -2.12 0.00 0.00 175.29 173.15 1cdu s LEU 149 N -0.27 4.11 0.40 2.90 1.02 -1.12 -4.80 118.68 120.92 1cdu s LEU 149 Ca -0.02 0.44 -0.14 0.00 0.02 0.00 0.00 54.13 54.42 1cdu s LEU 149 Cb -0.02 -2.48 -0.08 0.00 0.02 0.00 0.00 46.19 43.63 1cdu s LEU 149 CO -0.00 -0.11 0.81 -1.61 0.02 0.00 0.00 176.35 175.46 1cdu s GLU 150 N 1.57 3.92 0.51 1.70 2.02 -1.26 0.13 118.70 127.29 1cdu s GLU 150 Ca 0.18 0.68 0.32 0.00 0.02 0.00 0.00 54.97 56.16 1cdu s GLU 150 Cb -0.15 -2.34 1.72 0.00 0.10 0.00 0.00 34.13 33.46 1cdu s GLU 150 CO 0.08 -0.01 1.96 -0.07 0.02 0.00 0.00 175.26 177.24 1cdu h LEU 151 N 1.59 0.00 -3.26 1.80 4.07 -1.95 -1.52 115.31 116.04 1cdu h LEU 151 Ca -0.47 0.00 -0.32 0.00 0.08 0.00 0.00 57.88 57.17 1cdu h LEU 151 Cb 1.18 0.00 -0.17 0.00 1.08 0.00 0.00 40.66 42.75 1cdu h LEU 151 CO 0.64 0.00 0.41 0.00 -1.08 0.00 0.00 178.44 178.40 1cdu n GLN 152 N -2.66 1.78 0.00 1.13 1.13 -1.26 -3.59 117.38 113.91 1cdu n GLN 152 Ca -0.02 -1.73 0.00 0.00 -1.94 0.00 0.00 57.00 53.31 1cdu n GLN 152 Cb 0.12 -1.68 0.00 0.00 0.11 0.00 0.00 30.24 28.79 1cdu n GLN 152 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1cdu n ASP 153 N -0.24 0.23 -4.71 1.08 8.00 -0.57 -4.31 116.55 116.03 1cdu n ASP 153 Ca 0.34 -0.59 -0.42 0.00 0.71 0.00 0.00 54.79 54.83 1cdu n ASP 153 Cb 0.98 0.68 -0.03 0.00 -0.02 0.00 0.00 41.12 42.72 1cdu n ASP 153 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1cdu s SER 154 N -0.68 6.47 0.00 -2.24 0.01 -1.24 -4.65 113.70 111.38 1cdu s SER 154 Ca 0.00 2.75 0.00 0.00 1.31 0.00 0.00 55.95 60.01 1cdu s SER 154 Cb 0.00 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.64 1cdu s SER 154 CO 0.00 -0.93 0.00 0.61 0.41 0.00 0.00 173.24 173.33 1cdu n GLY 155 N 3.96 0.64 3.60 3.44 0.00 0.24 -4.89 105.19 112.18 1cdu n GLY 155 Ca 0.16 -2.27 -0.43 0.00 0.00 0.00 0.00 46.02 43.48 1cdu n GLY 155 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1cdu s THR 156 N -0.68 3.14 0.79 2.61 2.01 -1.25 -1.46 115.64 120.79 1cdu s THR 156 Ca 0.00 0.14 -0.04 0.00 0.31 0.00 0.00 61.69 62.10 1cdu s THR 156 Cb 0.00 -3.19 0.16 0.00 0.01 0.00 0.00 72.50 69.48 1cdu s THR 156 CO 0.00 -0.13 1.08 0.79 -0.69 0.00 0.00 174.62 175.67 1cdu n TRP 157 N 11.61 -3.17 -3.74 4.92 7.02 0.19 -4.47 117.44 129.81 1cdu n TRP 157 Ca 0.28 -1.65 -0.13 0.00 -1.02 0.00 0.00 57.50 54.99 1cdu n TRP 157 Cb 0.46 -0.80 -0.11 0.00 -2.42 0.00 0.00 31.31 28.44 1cdu n TRP 157 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 1cdu s THR 158 N -3.30 -0.01 -0.06 -0.99 2.01 -1.02 -3.15 115.64 109.12 1cdu s THR 158 Ca 0.69 0.02 0.02 0.00 0.31 0.00 0.00 61.69 62.73 1cdu s THR 158 Cb -0.03 -0.51 0.02 0.00 0.01 0.00 0.00 72.50 71.98 1cdu s THR 158 CO 0.46 0.01 -0.09 0.00 -0.69 0.00 0.00 174.62 174.31 1cdu s THR 160 N 0.80 3.77 -0.20 0.00 2.01 -0.61 -1.21 115.64 120.20 1cdu s THR 160 Ca -0.13 -0.37 -0.05 0.00 0.31 0.00 0.00 61.69 61.45 1cdu s THR 160 Cb -0.15 -2.71 -0.03 0.00 0.01 0.00 0.00 72.50 69.62 1cdu s THR 160 CO 0.02 0.42 0.00 -0.69 -0.69 0.00 0.00 174.62 173.68 1cdu s VAL 161 N 1.19 4.03 -0.11 3.82 1.01 -1.03 -0.62 120.40 128.69 1cdu s VAL 161 Ca 0.03 -0.29 0.02 0.00 0.00 0.00 0.00 61.98 61.74 1cdu s VAL 161 Cb -0.15 -2.82 -0.01 0.00 0.00 0.00 0.00 36.38 33.41 1cdu s VAL 161 CO 0.01 0.43 -0.17 -0.76 0.00 0.00 0.00 175.10 174.61 1cdu s LEU 162 N 0.91 2.49 -0.09 3.92 1.43 -0.35 -2.65 118.68 124.33 1cdu s LEU 162 Ca 0.01 -0.40 -0.03 0.00 -1.03 0.00 0.00 54.13 52.68 1cdu s LEU 162 Cb -0.14 -1.53 0.05 0.00 0.03 0.00 0.00 46.19 44.60 1cdu s LEU 162 CO 0.02 0.19 0.17 -1.58 0.23 0.00 0.00 176.35 175.38 1cdu s GLN 163 N 0.20 0.07 -1.13 1.70 2.00 -0.48 -2.51 119.66 119.52 1cdu s GLN 163 Ca -0.11 0.55 -0.25 0.00 -2.00 0.00 0.00 55.36 53.55 1cdu s GLN 163 Cb -0.16 -0.22 0.02 0.00 0.80 0.00 0.00 33.01 33.46 1cdu s GLN 163 CO 0.06 -0.27 0.71 0.09 -0.50 0.00 0.00 175.29 175.38 1cdu n ASN 164 N 5.06 -4.70 0.00 6.67 4.13 -1.26 -1.31 115.26 123.86 1cdu n ASN 164 Ca -0.10 -1.14 0.00 0.00 1.68 0.00 0.00 54.58 55.02 1cdu n ASN 164 Cb 0.50 -2.26 0.00 0.00 -1.54 0.00 0.00 39.78 36.48 1cdu n ASN 164 CO 0.00 0.00 0.00 1.67 0.28 0.00 0.00 177.26 179.21 1cdu n GLN 165 N -4.38 0.00 -2.74 3.52 7.27 -1.26 -4.94 117.38 114.85 1cdu n GLN 165 Ca -0.13 0.00 -0.21 0.00 0.07 0.00 0.00 57.00 56.73 1cdu n GLN 165 Cb 0.59 -1.76 0.05 0.00 2.41 0.00 0.00 30.24 31.52 1cdu n GLN 165 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 1cdu s LYS 166 N 0.00 2.44 -0.09 3.69 -0.14 -0.43 -5.13 119.74 120.08 1cdu s LYS 166 Ca 0.00 -1.01 -0.28 0.00 -1.36 0.00 0.00 55.97 53.32 1cdu s LYS 166 Cb 0.00 -2.53 0.07 0.00 -1.68 0.00 0.00 37.83 33.68 1cdu s LYS 166 CO 0.00 -0.76 0.65 -1.59 -0.76 0.00 0.00 175.35 172.89 1cdu s LYS 167 N -4.73 0.97 0.22 1.68 -2.85 -1.26 -1.38 119.74 112.39 1cdu s LYS 167 Ca 0.59 0.37 0.11 0.00 -1.00 0.00 0.00 55.97 56.04 1cdu s LYS 167 Cb -0.09 0.46 -0.05 0.00 -2.06 0.00 0.00 37.83 36.09 1cdu s LYS 167 CO 0.38 -0.27 -0.22 0.14 0.10 0.00 0.00 175.35 175.49 1cdu s VAL 168 N -0.87 2.35 -0.30 1.79 -7.23 -1.08 -4.97 120.40 110.09 1cdu s VAL 168 Ca -0.09 -2.16 0.00 0.00 -1.81 0.00 0.00 61.98 57.92 1cdu s VAL 168 Cb -0.01 -2.17 0.09 0.00 0.56 0.00 0.00 36.38 34.85 1cdu s VAL 168 CO 0.08 -0.24 0.07 -0.70 -0.31 0.00 0.00 175.10 173.99 1cdu s GLU 169 N -3.00 0.99 0.49 4.82 2.12 -1.26 -2.48 118.70 120.38 1cdu s GLU 169 Ca 0.24 -1.24 -0.15 0.00 0.36 0.00 0.00 54.97 54.18 1cdu s GLU 169 Cb -0.07 -2.36 -0.07 0.00 0.26 0.00 0.00 34.13 31.89 1cdu s GLU 169 CO 0.11 -0.92 0.93 -0.06 -0.54 0.00 0.00 175.26 174.78 1cdu s PHE 170 N 1.43 3.46 0.05 5.30 0.40 -0.35 -4.86 117.98 123.40 1cdu s PHE 170 Ca 0.08 1.35 0.04 0.00 -0.60 0.00 0.00 56.93 57.80 1cdu s PHE 170 Cb -0.18 -2.69 -0.02 0.00 0.51 0.00 0.00 43.02 40.63 1cdu s PHE 170 CO -0.18 -0.30 -0.12 0.15 0.70 0.00 0.00 175.22 175.46 1cdu s LYS 171 N -4.03 0.78 0.06 0.44 -0.14 -1.26 -0.31 119.74 115.28 1cdu s LYS 171 Ca 0.57 -0.77 0.02 0.00 -1.36 0.00 0.00 55.97 54.42 1cdu s LYS 171 Cb -0.10 -0.73 -0.03 0.00 -1.68 0.00 0.00 37.83 35.29 1cdu s LYS 171 CO 0.32 0.17 -0.07 0.42 -0.76 0.00 0.00 175.35 175.43 1cdu s ILE 172 N -1.03 0.56 -0.18 2.17 1.09 -1.19 -4.97 121.20 117.65 1cdu s ILE 172 Ca -0.02 -1.38 0.01 0.00 -1.10 0.00 0.00 60.65 58.16 1cdu s ILE 172 Cb -0.08 -0.98 0.03 0.00 -1.06 0.00 0.00 42.46 40.37 1cdu s ILE 172 CO 0.01 -0.57 -0.16 -1.81 -0.10 0.00 0.00 174.94 172.31 1cdu s ASP 173 N -2.10 3.15 -0.28 3.58 1.01 -1.26 0.57 116.67 121.34 1cdu s ASP 173 Ca -0.03 -0.71 -0.08 0.00 0.71 0.00 0.00 52.55 52.45 1cdu s ASP 173 Cb -0.04 -1.35 -0.01 0.00 1.01 0.00 0.00 42.92 42.53 1cdu s ASP 173 CO -0.02 -0.06 0.09 -0.63 0.21 0.00 0.00 175.17 174.76 1cdu s ILE 174 N 1.35 4.23 -0.88 0.77 -1.09 -0.54 -4.75 121.20 120.29 1cdu s ILE 174 Ca 0.03 -0.44 -0.19 0.00 -2.23 0.00 0.00 60.65 57.81 1cdu s ILE 174 Cb -0.14 -3.10 0.12 0.00 -1.58 0.00 0.00 42.46 37.76 1cdu s ILE 174 CO -0.11 0.17 1.09 -0.69 -1.23 0.00 0.00 174.94 174.18 1cdu s VAL 175 N 1.57 4.67 -1.00 2.92 1.01 0.29 0.81 120.40 130.67 1cdu s VAL 175 Ca 0.04 -1.40 -0.22 0.00 0.00 0.00 0.00 61.98 60.41 1cdu s VAL 175 Cb -0.16 -4.76 0.07 0.00 0.00 0.00 0.00 36.38 31.53 1cdu s VAL 175 CO 0.04 -1.49 1.37 -0.69 0.00 0.00 0.00 175.10 174.32 1cdu s VAL 176 N 2.88 4.17 0.41 2.92 1.01 -1.26 -0.63 120.40 129.89 1cdu s VAL 176 Ca 0.31 -1.04 -0.25 0.00 0.00 0.00 0.00 61.98 61.00 1cdu s VAL 176 Cb -0.07 -4.98 -0.08 0.00 0.00 0.00 0.00 36.38 31.25 1cdu s VAL 176 CO -0.06 -1.82 1.20 -0.22 0.00 0.00 0.00 175.10 174.20 1cdu s LEU 177 N 4.27 4.17 0.00 3.92 2.96 0.38 -4.74 118.68 129.64 1cdu s LEU 177 Ca 0.42 2.41 0.28 0.00 -0.22 0.00 0.00 54.13 57.03 1cdu s LEU 177 Cb -0.01 -4.03 1.07 0.00 0.50 0.00 0.00 46.19 43.73 1cdu s LEU 177 CO -0.09 -0.75 1.76 0.00 -1.32 0.00 0.00 176.35 175.94