#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dx9 h LYS 3 N 0.00 0.17 -5.20 1.64 1.79 -1.71 -3.45 116.57 109.80 1dx9 h LYS 3 Ca 0.00 -0.19 -0.65 0.00 -2.18 0.00 0.00 60.65 57.63 1dx9 h LYS 3 Cb 0.00 0.06 -0.26 0.00 -1.58 0.00 0.00 32.23 30.45 1dx9 h LYS 3 CO 0.00 0.95 -0.72 0.42 -1.08 0.00 0.00 179.45 179.02 1dx9 s ILE 4 N -3.00 3.40 -0.31 1.86 1.01 -0.48 -4.04 121.20 119.64 1dx9 s ILE 4 Ca -0.16 -0.52 -0.13 0.00 0.00 0.00 0.00 60.65 59.85 1dx9 s ILE 4 Cb 0.01 -2.49 -0.03 0.00 0.01 0.00 0.00 42.46 39.95 1dx9 s ILE 4 CO 0.74 0.48 0.25 -0.83 0.00 0.00 0.00 174.94 175.59 1dx9 s GLY 5 N 0.75 1.93 -0.43 6.18 0.00 -0.34 -1.25 107.32 114.16 1dx9 s GLY 5 Ca -0.03 -1.18 -0.15 0.00 0.00 0.00 0.00 44.72 43.36 1dx9 s GLY 5 CO 0.02 0.78 0.33 -2.27 0.00 0.00 0.00 173.10 171.96 1dx9 s LEU 6 N 1.82 5.30 -0.28 0.66 0.20 0.06 -1.16 118.68 125.28 1dx9 s LEU 6 Ca 0.08 -1.08 -0.10 0.00 0.69 0.00 0.00 54.13 53.73 1dx9 s LEU 6 Cb -0.17 -2.16 -0.03 0.00 -0.43 0.00 0.00 46.19 43.40 1dx9 s LEU 6 CO 0.11 -0.53 0.15 -0.36 -0.29 0.00 0.00 176.35 175.43 1dx9 s PHE 7 N 1.66 3.17 0.08 5.38 0.40 0.46 -0.36 117.98 128.77 1dx9 s PHE 7 Ca 0.04 -0.21 0.05 0.00 -0.60 0.00 0.00 56.93 56.21 1dx9 s PHE 7 Cb -0.21 -2.34 -0.03 0.00 0.51 0.00 0.00 43.02 40.95 1dx9 s PHE 7 CO 0.08 -0.30 -0.13 1.52 0.70 0.00 0.00 175.22 177.10 1dx9 s TYR 8 N 1.68 1.20 0.19 0.36 1.13 -0.38 -0.31 117.35 121.22 1dx9 s TYR 8 Ca 0.06 -0.52 0.11 0.00 -1.41 0.00 0.00 57.07 55.32 1dx9 s TYR 8 Cb -0.16 -0.66 -0.04 0.00 -1.10 0.00 0.00 41.96 40.00 1dx9 s TYR 8 CO 0.08 0.06 -0.21 0.20 -2.51 0.00 0.00 175.55 173.16 1dx9 s GLY 9 N -2.00 1.72 -0.17 5.49 0.00 -0.75 -0.91 107.32 110.70 1dx9 s GLY 9 Ca 0.01 -1.62 -0.15 0.00 0.00 0.00 0.00 44.72 42.96 1dx9 s GLY 9 CO 0.02 -1.65 0.45 -1.08 0.00 0.00 0.00 173.10 170.84 1dx9 s THR 10 N -1.71 -0.00 -0.17 0.90 -1.32 -1.26 -4.42 115.64 107.66 1dx9 s THR 10 Ca 0.22 0.01 -0.14 0.00 -1.21 0.00 0.00 61.69 60.57 1dx9 s THR 10 Cb -0.08 -0.63 -0.09 0.00 -1.51 0.00 0.00 72.50 70.18 1dx9 s THR 10 CO 0.11 0.01 -0.07 1.67 -2.21 0.00 0.00 174.62 174.12 1dx9 n GLN 11 N 3.07 0.50 -0.24 7.08 -0.06 -1.26 -4.72 117.38 121.76 1dx9 n GLN 11 Ca -0.15 0.51 0.07 0.00 -2.00 0.00 0.00 57.00 55.42 1dx9 n GLN 11 Cb 0.57 -1.68 0.17 0.00 -4.06 0.00 0.00 30.24 25.23 1dx9 n GLN 11 CO 0.00 0.00 0.00 0.25 -0.20 0.00 0.00 177.06 177.11 1dx9 n THR 12 N -4.52 1.62 -0.20 1.69 -2.24 -1.26 -4.98 114.28 104.38 1dx9 n THR 12 Ca -0.19 -1.52 0.00 0.00 -2.27 0.00 0.00 64.05 60.07 1dx9 n THR 12 Cb 0.46 0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 1dx9 n THR 12 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1dx9 n GLY 13 N -0.31 0.86 0.05 3.38 0.00 -1.26 -4.94 105.19 102.97 1dx9 n GLY 13 Ca 0.14 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.04 1dx9 n GLY 13 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1dx9 h LYS 14 N 3.83 0.02 0.00 1.61 1.57 -1.97 -2.12 116.57 119.51 1dx9 h LYS 14 Ca 0.00 -0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.72 1dx9 h LYS 14 Cb 0.00 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1dx9 h LYS 14 CO 0.00 0.08 -0.26 1.15 -0.57 0.00 0.00 179.45 179.85 1dx9 h THR 15 N -0.05 0.95 -0.26 -0.16 2.02 -1.92 -2.50 112.91 110.98 1dx9 h THR 15 Ca 0.00 -0.99 -0.11 0.00 0.77 0.00 0.00 66.41 66.09 1dx9 h THR 15 Cb 0.07 1.57 -0.00 0.00 -1.74 0.00 0.00 68.15 68.04 1dx9 h THR 15 CO -0.00 0.26 -0.27 -0.08 0.37 0.00 0.00 175.52 175.80 1dx9 h GLU 16 N 0.00 0.65 -0.53 6.66 4.81 -1.81 -1.53 114.58 122.82 1dx9 h GLU 16 Ca -0.00 -0.34 0.03 0.00 -0.13 0.00 0.00 59.36 58.91 1dx9 h GLU 16 Cb 0.55 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.91 1dx9 h GLU 16 CO 0.03 0.95 0.32 1.03 -0.73 0.00 0.00 179.01 180.61 1dx9 h SER 17 N 0.37 0.51 1.03 1.04 0.87 -1.10 -2.13 113.55 114.13 1dx9 h SER 17 Ca 0.04 0.01 -0.08 0.00 -1.23 0.00 0.00 61.79 60.53 1dx9 h SER 17 Cb 0.84 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.68 1dx9 h SER 17 CO 0.07 0.36 -0.38 -0.37 -0.53 0.00 0.00 176.83 175.98 1dx9 h VAL 18 N 0.63 0.81 -0.24 2.23 -1.51 -1.39 -2.70 116.25 114.09 1dx9 h VAL 18 Ca 0.22 -1.63 -0.08 0.00 -1.23 0.00 0.00 66.70 63.98 1dx9 h VAL 18 Cb 0.03 2.03 -0.01 0.00 -2.13 0.00 0.00 31.29 31.20 1dx9 h VAL 18 CO -0.10 0.37 -0.20 0.00 -1.23 0.00 0.00 177.57 176.41 1dx9 h ALA 19 N 1.62 1.20 -0.02 5.19 0.00 -0.81 0.33 119.26 126.78 1dx9 h ALA 19 Ca -0.00 -0.31 -0.18 0.00 0.00 0.00 0.00 54.91 54.42 1dx9 h ALA 19 Cb 1.00 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1dx9 h ALA 19 CO 0.05 0.51 -0.79 0.93 0.00 0.00 0.00 179.25 179.96 1dx9 h GLU 20 N 0.39 0.17 -0.38 0.00 5.08 -1.18 -1.49 114.58 117.18 1dx9 h GLU 20 Ca 0.07 -0.16 -0.16 0.00 -1.00 0.00 0.00 59.36 58.10 1dx9 h GLU 20 Cb 0.58 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 1dx9 h GLU 20 CO 0.04 0.87 -0.39 0.82 -1.00 0.00 0.00 179.01 179.35 1dx9 h ILE 21 N 0.11 1.27 -0.55 3.13 2.04 -1.10 -0.95 117.51 121.47 1dx9 h ILE 21 Ca -0.03 -1.57 -0.02 0.00 1.00 0.00 0.00 64.86 64.24 1dx9 h ILE 21 Cb 1.37 1.39 -0.03 0.00 -0.74 0.00 0.00 36.82 38.82 1dx9 h ILE 21 CO 0.12 0.52 0.27 0.40 0.00 0.00 0.00 178.15 179.46 1dx9 h ILE 22 N 0.76 1.20 -0.87 -0.67 2.04 -0.89 -0.02 117.51 119.05 1dx9 h ILE 22 Ca 0.06 -0.56 0.03 0.00 1.00 0.00 0.00 64.86 65.39 1dx9 h ILE 22 Cb 0.99 0.56 -0.05 0.00 -0.74 0.00 0.00 36.82 37.58 1dx9 h ILE 22 CO 0.10 0.22 0.57 -0.09 0.00 0.00 0.00 178.15 178.95 1dx9 h ARG 23 N 0.73 1.08 -0.22 2.37 1.12 -1.13 -2.04 114.38 116.29 1dx9 h ARG 23 Ca 0.19 -0.07 -0.13 0.00 -1.11 0.00 0.00 59.98 58.86 1dx9 h ARG 23 Cb 0.11 -0.24 -0.01 0.00 -0.01 0.00 0.00 29.97 29.82 1dx9 h ARG 23 CO -0.02 0.72 -0.40 -0.44 -3.11 0.00 0.00 179.97 176.71 1dx9 h ASP 24 N 1.12 0.55 -0.34 -3.80 3.32 -0.64 -0.37 116.42 116.26 1dx9 h ASP 24 Ca 0.34 -0.24 -0.09 0.00 0.02 0.00 0.00 57.03 57.05 1dx9 h ASP 24 Cb -0.04 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 1dx9 h ASP 24 CO -0.10 0.89 -0.12 -0.33 -1.72 0.00 0.00 179.24 177.86 1dx9 h GLU 25 N 0.43 0.78 -0.02 3.56 4.39 -0.46 -2.99 114.58 120.27 1dx9 h GLU 25 Ca 0.04 -0.26 -0.21 0.00 0.34 0.00 0.00 59.36 59.27 1dx9 h GLU 25 Cb 0.89 -0.06 0.02 0.00 -0.10 0.00 0.00 28.75 29.49 1dx9 h GLU 25 CO 0.08 0.86 -0.81 0.74 -1.16 0.00 0.00 179.01 178.72 1dx9 h PHE 26 N 0.70 0.85 0.00 4.33 0.04 -1.30 -3.49 116.94 118.07 1dx9 h PHE 26 Ca 0.12 -0.45 0.00 0.00 2.80 0.00 0.00 57.97 60.44 1dx9 h PHE 26 Cb 0.60 -0.10 0.00 0.00 2.20 0.00 0.00 35.95 38.65 1dx9 h PHE 26 CO 0.03 1.27 0.00 0.41 -0.60 0.00 0.00 178.31 179.43 1dx9 n GLY 27 N 1.03 0.77 3.56 -1.45 0.00 -0.16 -4.87 105.19 104.08 1dx9 n GLY 27 Ca -0.10 -1.22 -0.19 0.00 0.00 0.00 0.00 46.02 44.50 1dx9 n GLY 27 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1dx9 s ASN 28 N -4.00 4.13 -1.06 1.61 0.01 -1.26 -3.15 114.94 111.22 1dx9 s ASN 28 Ca 0.00 0.15 0.00 0.00 -0.71 0.00 0.00 52.86 52.30 1dx9 s ASN 28 Cb 0.00 -2.54 0.00 0.00 0.41 0.00 0.00 41.25 39.12 1dx9 s ASN 28 CO 0.00 -3.58 0.00 0.47 -1.51 0.00 0.00 177.10 172.48 1dx9 n ASP 29 N 17.64 -4.19 -0.04 -1.22 9.92 -1.26 -4.90 116.55 132.50 1dx9 n ASP 29 Ca 0.44 0.24 -0.15 0.00 -0.53 0.00 0.00 54.79 54.79 1dx9 n ASP 29 Cb 0.46 -2.58 -0.14 0.00 -0.64 0.00 0.00 41.12 38.22 1dx9 n ASP 29 CO 0.00 0.00 0.00 0.55 0.13 0.00 0.00 177.20 177.88 1dx9 n VAL 30 N -2.72 1.63 -4.29 2.53 3.14 -1.19 -2.75 118.33 114.67 1dx9 n VAL 30 Ca -0.10 -0.71 -0.34 0.00 -2.96 0.00 0.00 64.34 60.23 1dx9 n VAL 30 Cb 0.33 -1.30 -0.13 0.00 -1.06 0.00 0.00 33.84 31.69 1dx9 n VAL 30 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 1dx9 s VAL 31 N -2.55 3.74 -0.17 1.55 1.01 -1.26 -1.38 120.40 121.33 1dx9 s VAL 31 Ca -0.18 -0.40 -0.06 0.00 0.00 0.00 0.00 61.98 61.34 1dx9 s VAL 31 Cb 0.07 -2.65 -0.04 0.00 0.00 0.00 0.00 36.38 33.76 1dx9 s VAL 31 CO 0.76 0.47 0.03 -0.89 0.00 0.00 0.00 175.10 175.47 1dx9 s THR 32 N 0.68 4.46 -0.07 3.92 2.01 -0.38 -4.65 115.64 121.60 1dx9 s THR 32 Ca -0.02 -0.15 -0.19 0.00 0.31 0.00 0.00 61.69 61.64 1dx9 s THR 32 Cb -0.14 -3.00 -0.05 0.00 0.01 0.00 0.00 72.50 69.32 1dx9 s THR 32 CO 0.02 0.47 0.51 -0.76 -0.69 0.00 0.00 174.62 174.17 1dx9 s LEU 33 N 0.40 4.33 -0.13 4.42 1.02 -1.26 -0.76 118.68 126.71 1dx9 s LEU 33 Ca 0.01 0.93 -0.01 0.00 0.02 0.00 0.00 54.13 55.08 1dx9 s LEU 33 Cb -0.13 -2.76 0.03 0.00 0.02 0.00 0.00 46.19 43.35 1dx9 s LEU 33 CO 0.01 0.05 -0.05 -1.00 0.02 0.00 0.00 176.35 175.39 1dx9 s HIS 34 N 0.25 1.40 -0.10 0.29 3.76 0.51 -4.95 115.29 116.44 1dx9 s HIS 34 Ca 0.28 -0.77 -0.30 0.00 -0.15 0.00 0.00 55.06 54.12 1dx9 s HIS 34 Cb -0.16 -1.18 -0.02 0.00 1.11 0.00 0.00 32.58 32.33 1dx9 s HIS 34 CO 0.13 -0.52 1.10 0.34 -0.85 0.00 0.00 174.74 174.94 1dx9 s ASP 35 N 1.73 7.14 0.00 1.40 -1.08 -1.26 -1.25 116.67 123.35 1dx9 s ASP 35 Ca 0.03 1.64 0.23 0.00 -0.52 0.00 0.00 52.55 53.93 1dx9 s ASP 35 Cb -0.14 -2.55 1.08 0.00 -1.46 0.00 0.00 42.92 39.85 1dx9 s ASP 35 CO -0.08 -0.54 1.75 1.33 0.52 0.00 0.00 175.17 178.15 1dx9 n VAL 36 N 4.71 0.35 0.19 1.11 0.24 -0.08 -1.52 118.33 123.32 1dx9 n VAL 36 Ca 0.10 0.09 0.04 0.00 -2.04 0.00 0.00 64.34 62.53 1dx9 n VAL 36 Cb 0.47 -0.70 0.39 0.00 -1.47 0.00 0.00 33.84 32.54 1dx9 n VAL 36 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1dx9 h SER 37 N 0.00 0.00 -0.01 -1.34 4.64 -1.86 -3.18 113.55 111.81 1dx9 h SER 37 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1dx9 h SER 37 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 1dx9 h SER 37 CO 0.00 0.35 -0.11 0.00 -0.87 0.00 0.00 176.83 176.21 1dx9 n GLN 38 N -3.89 1.36 -2.53 4.77 6.02 -0.69 -5.03 117.38 117.39 1dx9 n GLN 38 Ca -0.01 -0.79 -0.23 0.00 -0.01 0.00 0.00 57.00 55.95 1dx9 n GLN 38 Cb 0.42 -1.11 0.04 0.00 1.02 0.00 0.00 30.24 30.61 1dx9 n GLN 38 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1dx9 s ALA 39 N -1.07 3.58 0.15 -1.58 0.00 -0.57 -5.01 121.76 117.25 1dx9 s ALA 39 Ca 0.09 -1.08 0.09 0.00 0.00 0.00 0.00 51.96 51.06 1dx9 s ALA 39 Cb 0.08 -2.31 -0.04 0.00 0.00 0.00 0.00 23.12 20.84 1dx9 s ALA 39 CO 0.18 -0.86 -0.21 -2.00 0.00 0.00 0.00 175.76 172.87 1dx9 s GLU 40 N -4.90 1.30 0.62 0.00 2.12 -1.26 -4.94 118.70 111.63 1dx9 s GLU 40 Ca 0.56 -1.37 0.39 0.00 0.36 0.00 0.00 54.97 54.91 1dx9 s GLU 40 Cb -0.10 -1.49 2.03 0.00 0.26 0.00 0.00 34.13 34.83 1dx9 s GLU 40 CO 0.41 0.32 2.25 -0.24 -0.54 0.00 0.00 175.26 177.46 1dx9 h VAL 41 N 3.47 0.13 0.00 3.70 3.04 -1.95 -0.50 116.25 124.14 1dx9 h VAL 41 Ca -0.45 -0.17 0.00 0.00 -1.01 0.00 0.00 66.70 65.07 1dx9 h VAL 41 Cb 1.20 1.15 0.00 0.00 -2.01 0.00 0.00 31.29 31.63 1dx9 h VAL 41 CO 0.47 0.02 -0.21 0.35 -1.01 0.00 0.00 177.57 177.18 1dx9 n THR 42 N -3.24 0.44 0.19 3.17 -2.24 -1.26 -2.93 114.28 108.41 1dx9 n THR 42 Ca -0.02 -0.24 0.04 0.00 -2.27 0.00 0.00 64.05 61.56 1dx9 n THR 42 Cb 0.14 -0.40 0.46 0.00 -2.10 0.00 0.00 70.33 68.43 1dx9 n THR 42 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1dx9 h ASP 43 N 0.00 0.07 0.64 3.42 5.19 -1.49 -2.37 116.42 121.88 1dx9 h ASP 43 Ca 0.00 -0.01 -0.01 0.00 -0.62 0.00 0.00 57.03 56.38 1dx9 h ASP 43 Cb 0.71 -0.02 -0.00 0.00 0.18 0.00 0.00 39.33 40.20 1dx9 h ASP 43 CO 0.00 0.26 -0.06 -0.07 -3.12 0.00 0.00 179.24 176.25 1dx9 h LEU 44 N 0.07 0.00 -1.31 1.55 3.38 -1.65 -2.59 115.31 114.76 1dx9 h LEU 44 Ca 0.01 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 1dx9 h LEU 44 Cb 0.36 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1dx9 h LEU 44 CO 0.02 0.06 -0.27 0.78 0.09 0.00 0.00 178.44 179.12 1dx9 h ASN 45 N 0.00 0.00 0.34 -0.43 -0.26 -1.59 -3.25 115.58 110.39 1dx9 h ASN 45 Ca -0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1dx9 h ASN 45 Cb 0.40 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.66 1dx9 h ASN 45 CO 0.01 0.27 0.00 0.47 -1.06 0.00 0.00 177.43 177.12 1dx9 n ASP 46 N -3.64 0.00 -4.14 5.81 8.00 -0.98 -4.77 116.55 116.84 1dx9 n ASP 46 Ca -0.01 -0.19 -0.22 0.00 0.71 0.00 0.00 54.79 55.09 1dx9 n ASP 46 Cb 0.40 -0.22 -0.14 0.00 -0.02 0.00 0.00 41.12 41.13 1dx9 n ASP 46 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1dx9 s TYR 47 N -2.45 1.31 -0.61 1.24 2.02 -1.23 -5.00 117.35 112.64 1dx9 s TYR 47 Ca 0.24 -0.31 0.22 0.00 -0.37 0.00 0.00 57.07 56.86 1dx9 s TYR 47 Cb 0.15 -0.81 -0.06 0.00 -0.40 0.00 0.00 41.96 40.85 1dx9 s TYR 47 CO 0.33 0.02 0.93 1.04 -1.57 0.00 0.00 175.55 176.30 1dx9 n GLN 48 N 2.23 0.28 -4.04 -0.62 1.13 -1.26 -4.87 117.38 110.23 1dx9 n GLN 48 Ca -0.16 -0.03 -0.31 0.00 -1.94 0.00 0.00 57.00 54.55 1dx9 n GLN 48 Cb 0.55 -1.56 -0.16 0.00 0.11 0.00 0.00 30.24 29.17 1dx9 n GLN 48 CO 0.00 0.00 0.00 0.71 -1.44 0.00 0.00 177.06 176.33 1dx9 s TYR 49 N -3.20 2.45 -0.01 1.08 2.02 -1.26 -0.87 117.35 117.55 1dx9 s TYR 49 Ca 0.03 -1.48 0.05 0.00 -0.37 0.00 0.00 57.07 55.30 1dx9 s TYR 49 Cb 0.15 -1.71 -0.01 0.00 -0.40 0.00 0.00 41.96 39.99 1dx9 s TYR 49 CO 0.83 -0.74 -0.16 -0.51 -1.57 0.00 0.00 175.55 173.41 1dx9 s LEU 50 N 1.39 2.02 -0.14 -1.29 1.43 -0.26 -1.20 118.68 120.64 1dx9 s LEU 50 Ca 0.03 -0.28 0.02 0.00 -1.03 0.00 0.00 54.13 52.87 1dx9 s LEU 50 Cb -0.14 -0.81 0.01 0.00 0.03 0.00 0.00 46.19 45.28 1dx9 s LEU 50 CO -0.10 0.19 -0.22 -0.63 0.23 0.00 0.00 176.35 175.82 1dx9 s ILE 51 N -0.34 2.08 -0.26 -0.59 1.01 -0.31 -0.57 121.20 122.22 1dx9 s ILE 51 Ca 0.05 -0.97 -0.06 0.00 0.00 0.00 0.00 60.65 59.67 1dx9 s ILE 51 Cb -0.06 -1.83 -0.01 0.00 0.01 0.00 0.00 42.46 40.57 1dx9 s ILE 51 CO -0.00 0.55 0.05 -0.63 0.00 0.00 0.00 174.94 174.90 1dx9 s ILE 52 N 0.82 3.94 -0.18 2.92 -1.09 0.11 -0.40 121.20 127.31 1dx9 s ILE 52 Ca -0.07 -0.46 -0.03 0.00 -2.23 0.00 0.00 60.65 57.86 1dx9 s ILE 52 Cb -0.15 -2.91 -0.02 0.00 -1.58 0.00 0.00 42.46 37.80 1dx9 s ILE 52 CO -0.02 0.26 -0.06 -0.83 -1.23 0.00 0.00 174.94 173.06 1dx9 s GLY 53 N 1.54 1.62 -0.18 6.18 0.00 0.58 -0.72 107.32 116.34 1dx9 s GLY 53 Ca 0.05 -1.00 -0.07 0.00 0.00 0.00 0.00 44.72 43.70 1dx9 s GLY 53 CO 0.01 0.13 0.38 0.00 0.00 0.00 0.00 173.10 173.63 1dx9 s PRO 55 N 2.42 3.37 -0.27 0.00 0.04 -1.26 -4.09 135.00 135.21 1dx9 s PRO 55 Ca -0.02 1.22 -0.06 0.00 0.04 0.00 0.00 61.00 62.18 1dx9 s PRO 55 Cb -0.12 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.39 1dx9 s PRO 55 CO -0.12 -0.77 0.05 0.99 0.04 0.00 0.00 177.00 177.19 1dx9 s THR 56 N -2.40 3.85 -0.09 1.26 2.01 -0.60 -3.93 115.64 115.73 1dx9 s THR 56 Ca 0.64 -0.59 -0.25 0.00 0.31 0.00 0.00 61.69 61.80 1dx9 s THR 56 Cb -0.16 -2.91 -0.21 0.00 0.01 0.00 0.00 72.50 69.22 1dx9 s THR 56 CO 0.35 0.19 0.85 0.00 -0.69 0.00 0.00 174.62 175.32 1dx9 h ALA 57 N 8.20 -0.04 -1.22 7.40 0.00 -1.86 -3.42 119.26 128.32 1dx9 h ALA 57 Ca -0.34 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.21 1dx9 h ALA 57 Cb 1.14 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1dx9 h ALA 57 CO 0.60 -0.11 0.00 0.27 0.00 0.00 0.00 179.25 180.01 1dx9 n ASN 58 N -4.73 0.00 0.00 0.00 2.04 -1.26 -4.85 115.26 106.45 1dx9 n ASN 58 Ca -0.09 0.00 0.08 0.00 -0.44 0.00 0.00 54.58 54.14 1dx9 n ASN 58 Cb 0.36 0.26 0.40 0.00 -2.53 0.00 0.00 39.78 38.27 1dx9 n ASN 58 CO 0.00 0.00 0.00 2.30 -0.44 0.00 0.00 177.26 179.12 1dx9 n ILE 59 N -1.89 0.65 -1.38 1.53 -5.35 -1.26 -4.78 119.36 106.88 1dx9 n ILE 59 Ca 0.00 0.16 0.00 0.00 -0.27 0.00 0.00 62.75 62.64 1dx9 n ILE 59 Cb 0.00 -0.87 0.00 0.00 -1.74 0.00 0.00 39.64 37.03 1dx9 n ILE 59 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1dx9 n GLY 60 N 0.24 0.99 3.78 3.28 0.00 -1.26 -4.97 105.19 107.25 1dx9 n GLY 60 Ca 0.06 -0.47 -0.22 0.00 0.00 0.00 0.00 46.02 45.39 1dx9 n GLY 60 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1dx9 s GLU 61 N -2.94 2.60 0.53 1.61 2.12 -1.26 -4.68 118.70 116.68 1dx9 s GLU 61 Ca 0.00 -1.34 -0.22 0.00 0.36 0.00 0.00 54.97 53.77 1dx9 s GLU 61 Cb 0.00 -2.36 -0.05 0.00 0.26 0.00 0.00 34.13 31.98 1dx9 s GLU 61 CO 0.00 0.19 1.36 -0.51 -0.54 0.00 0.00 175.26 175.76 1dx9 s LEU 62 N -3.88 3.89 0.53 2.70 1.02 -1.26 -4.55 118.68 117.13 1dx9 s LEU 62 Ca 0.37 2.76 -0.22 0.00 0.02 0.00 0.00 54.13 57.06 1dx9 s LEU 62 Cb -0.05 -4.23 -0.06 0.00 0.02 0.00 0.00 46.19 41.87 1dx9 s LEU 62 CO 0.24 -1.49 1.27 1.67 0.02 0.00 0.00 176.35 178.06 1dx9 n GLN 63 N -0.89 1.59 -0.01 1.70 0.00 -1.25 -4.63 117.38 113.88 1dx9 n GLN 63 Ca 0.09 0.58 0.04 0.00 -0.00 0.00 0.00 57.00 57.71 1dx9 n GLN 63 Cb 0.45 -2.46 0.41 0.00 0.00 0.00 0.00 30.24 28.64 1dx9 n GLN 63 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1dx9 h SER 64 N 1.39 0.49 -0.37 1.69 4.64 -1.95 0.51 113.55 119.94 1dx9 h SER 64 Ca -0.50 -0.02 -0.13 0.00 -0.47 0.00 0.00 61.79 60.68 1dx9 h SER 64 Cb 1.31 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 63.27 1dx9 h SER 64 CO 0.56 0.36 -0.28 0.44 -0.87 0.00 0.00 176.83 177.05 1dx9 h ASP 65 N 0.57 0.89 0.16 4.97 3.32 -1.95 -2.86 116.42 121.52 1dx9 h ASP 65 Ca 0.15 -0.44 -0.10 0.00 0.02 0.00 0.00 57.03 56.66 1dx9 h ASP 65 Cb -0.05 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.24 1dx9 h ASP 65 CO -0.03 1.14 -0.36 -0.50 -1.72 0.00 0.00 179.24 177.77 1dx9 h TRP 66 N 0.64 0.33 -1.00 4.55 4.06 -1.68 -2.84 115.95 120.01 1dx9 h TRP 66 Ca 0.07 -0.08 0.19 0.00 2.06 0.00 0.00 58.89 61.13 1dx9 h TRP 66 Cb 0.85 -0.08 -0.10 0.00 -1.00 0.00 0.00 29.16 28.84 1dx9 h TRP 66 CO 0.06 0.61 0.61 1.49 -3.56 0.00 0.00 178.44 177.66 1dx9 h GLU 67 N 0.24 0.70 -0.42 0.49 4.81 -0.71 -1.12 114.58 118.59 1dx9 h GLU 67 Ca 0.03 -0.04 -0.14 0.00 -0.13 0.00 0.00 59.36 59.08 1dx9 h GLU 67 Cb 0.75 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.96 1dx9 h GLU 67 CO 0.06 0.47 -0.29 0.78 -0.73 0.00 0.00 179.01 179.30 1dx9 h GLY 68 N 0.73 1.01 1.81 1.92 0.00 -1.37 -3.19 103.07 103.98 1dx9 h GLY 68 Ca 0.57 -0.96 -0.15 0.00 0.00 0.00 0.00 47.33 46.78 1dx9 h GLY 68 CO -0.35 0.87 -0.65 1.41 0.00 0.00 0.00 176.54 177.82 1dx9 h LEU 69 N 0.75 0.22 -1.78 3.11 4.07 -1.48 -3.31 115.31 116.89 1dx9 h LEU 69 Ca 0.08 -0.13 0.18 0.00 0.08 0.00 0.00 57.88 58.09 1dx9 h LEU 69 Cb 0.87 -0.06 -0.04 0.00 1.08 0.00 0.00 40.66 42.50 1dx9 h LEU 69 CO 0.08 0.81 0.50 0.22 -1.08 0.00 0.00 178.44 178.97 1dx9 h TYR 70 N 0.13 0.25 -0.55 1.13 3.20 -1.20 0.66 116.97 120.60 1dx9 h TYR 70 Ca -0.01 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.76 1dx9 h TYR 70 Cb 1.17 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 39.35 1dx9 h TYR 70 CO 0.02 0.09 -0.08 0.77 -1.64 0.00 0.00 178.16 177.31 1dx9 h SER 71 N 0.21 1.00 -0.06 -2.11 0.02 -1.70 -3.15 113.55 107.76 1dx9 h SER 71 Ca 0.36 -0.32 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1dx9 h SER 71 Cb 1.10 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.37 1dx9 h SER 71 CO -0.07 1.10 0.00 -0.62 -1.14 0.00 0.00 176.83 176.10 1dx9 n GLU 72 N -4.15 1.67 0.20 3.45 1.02 0.18 -4.15 120.64 118.86 1dx9 n GLU 72 Ca 0.02 -0.99 0.14 0.00 -0.02 0.00 0.00 57.16 56.31 1dx9 n GLU 72 Cb 0.38 -1.45 0.71 0.00 -0.02 0.00 0.00 31.44 31.06 1dx9 n GLU 72 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1dx9 h LEU 73 N 2.26 0.00 -0.20 -4.62 3.38 -1.40 -0.75 115.31 113.98 1dx9 h LEU 73 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1dx9 h LEU 73 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1dx9 h LEU 73 CO 0.00 0.00 0.00 0.44 0.09 0.00 0.00 178.44 178.97 1dx9 h ASP 74 N 0.00 0.00 1.05 -0.43 3.32 -1.82 -3.04 116.42 115.50 1dx9 h ASP 74 Ca 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 1dx9 h ASP 74 Cb 0.09 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.64 1dx9 h ASP 74 CO 0.00 0.00 -0.01 0.44 -1.72 0.00 0.00 179.24 177.95 1dx9 h ASP 75 N 0.00 0.00 -3.30 6.45 5.19 -1.44 -3.43 116.42 119.88 1dx9 h ASP 75 Ca 0.00 0.00 -0.63 0.00 -0.62 0.00 0.00 57.03 55.78 1dx9 h ASP 75 Cb 0.84 0.00 -0.21 0.00 0.18 0.00 0.00 39.33 40.14 1dx9 h ASP 75 CO 0.00 0.01 -0.66 0.54 -3.12 0.00 0.00 179.24 176.01 1dx9 s VAL 76 N -3.66 3.96 -0.25 -1.35 0.11 -1.15 -5.08 120.40 112.98 1dx9 s VAL 76 Ca 0.01 -0.33 -0.23 0.00 -2.93 0.00 0.00 61.98 58.50 1dx9 s VAL 76 Cb 0.09 -2.74 -0.01 0.00 -1.53 0.00 0.00 36.38 32.19 1dx9 s VAL 76 CO 0.55 0.49 0.77 -0.62 -3.33 0.00 0.00 175.10 172.96 1dx9 s ASP 77 N 0.37 6.75 0.00 3.54 2.15 -1.26 -4.94 116.67 123.28 1dx9 s ASP 77 Ca -0.04 0.93 0.21 0.00 0.43 0.00 0.00 52.55 54.08 1dx9 s ASP 77 Cb -0.14 -2.41 0.59 0.00 -0.30 0.00 0.00 42.92 40.66 1dx9 s ASP 77 CO 0.03 -0.48 1.49 0.49 -0.17 0.00 0.00 175.17 176.53 1dx9 n PHE 78 N 5.93 0.89 -1.89 -5.34 3.72 -0.85 -4.97 117.46 114.95 1dx9 n PHE 78 Ca 0.04 -0.49 -0.42 0.00 -0.05 0.00 0.00 57.45 56.52 1dx9 n PHE 78 Cb 0.48 -0.01 -0.03 0.00 -0.94 0.00 0.00 39.48 38.98 1dx9 n PHE 78 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 1dx9 s ASN 79 N -1.01 6.56 0.00 4.37 -0.87 -1.23 -2.09 114.94 120.67 1dx9 s ASN 79 Ca 0.45 2.56 0.00 0.00 -1.57 0.00 0.00 52.86 54.30 1dx9 s ASN 79 Cb 0.23 -2.57 0.00 0.00 -0.02 0.00 0.00 41.25 38.89 1dx9 s ASN 79 CO 0.30 -0.90 0.00 0.61 -2.57 0.00 0.00 177.10 174.55 1dx9 n GLY 80 N 3.99 2.28 3.79 0.66 0.00 -1.26 -4.99 105.19 109.68 1dx9 n GLY 80 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 1dx9 n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dx9 s LYS 81 N -0.71 4.42 -0.21 1.61 1.02 -0.89 -4.96 119.74 120.02 1dx9 s LYS 81 Ca 0.00 1.04 -0.09 0.00 0.02 0.00 0.00 55.97 56.94 1dx9 s LYS 81 Cb 0.00 -3.05 -0.04 0.00 -0.52 0.00 0.00 37.83 34.22 1dx9 s LYS 81 CO 0.00 0.47 0.11 -0.51 -0.92 0.00 0.00 175.35 174.49 1dx9 s LEU 82 N -1.60 3.95 -0.07 3.17 1.02 -0.05 -1.26 118.68 123.83 1dx9 s LEU 82 Ca 0.40 0.09 0.02 0.00 0.02 0.00 0.00 54.13 54.67 1dx9 s LEU 82 Cb -0.20 -2.03 0.01 0.00 0.02 0.00 0.00 46.19 44.00 1dx9 s LEU 82 CO 0.23 0.12 -0.13 -0.69 0.02 0.00 0.00 176.35 175.91 1dx9 s VAL 83 N 0.70 1.19 0.21 -1.59 1.01 -0.11 -1.10 120.40 120.71 1dx9 s VAL 83 Ca 0.06 -0.51 0.10 0.00 0.00 0.00 0.00 61.98 61.62 1dx9 s VAL 83 Cb -0.13 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.12 1dx9 s VAL 83 CO 0.01 0.37 -0.13 0.00 0.00 0.00 0.00 175.10 175.36 1dx9 s ALA 84 N 0.65 2.86 0.00 5.51 0.00 0.27 -0.98 121.76 130.06 1dx9 s ALA 84 Ca -0.15 -1.59 0.04 0.00 0.00 0.00 0.00 51.96 50.27 1dx9 s ALA 84 Cb -0.16 -0.59 -0.01 0.00 0.00 0.00 0.00 23.12 22.36 1dx9 s ALA 84 CO 0.04 0.41 -0.14 0.71 0.00 0.00 0.00 175.76 176.78 1dx9 s TYR 85 N -1.89 1.20 0.04 0.00 1.51 -1.26 0.04 117.35 117.00 1dx9 s TYR 85 Ca 0.26 -0.25 -0.09 0.00 -1.01 0.00 0.00 57.07 55.98 1dx9 s TYR 85 Cb -0.08 -0.76 0.00 0.00 -0.11 0.00 0.00 41.96 41.01 1dx9 s TYR 85 CO 0.15 -0.01 0.18 -0.59 -1.11 0.00 0.00 175.55 174.16 1dx9 s PHE 86 N -0.42 0.09 0.20 2.71 -0.71 0.10 -1.49 117.98 118.46 1dx9 s PHE 86 Ca 0.04 -0.35 -0.22 0.00 -1.04 0.00 0.00 56.93 55.37 1dx9 s PHE 86 Cb -0.06 -0.05 0.05 0.00 -1.21 0.00 0.00 43.02 41.75 1dx9 s PHE 86 CO -0.00 -0.43 0.65 0.20 -1.34 0.00 0.00 175.22 174.30 1dx9 s GLY 87 N -2.16 -0.42 0.08 1.99 0.00 -0.83 -1.53 107.32 104.45 1dx9 s GLY 87 Ca -0.04 0.20 0.06 0.00 0.00 0.00 0.00 44.72 44.93 1dx9 s GLY 87 CO -0.05 0.07 -0.06 -0.51 0.00 0.00 0.00 173.10 172.55 1dx9 s THR 88 N -3.81 3.63 0.28 0.90 -4.23 -1.26 -0.85 115.64 110.31 1dx9 s THR 88 Ca 0.05 -1.08 -0.20 0.00 -1.18 0.00 0.00 61.69 59.28 1dx9 s THR 88 Cb -0.03 -2.69 0.04 0.00 1.34 0.00 0.00 72.50 71.17 1dx9 s THR 88 CO -0.05 0.17 0.82 -0.83 -0.54 0.00 0.00 174.62 174.19 1dx9 s GLY 89 N -2.07 0.05 -0.39 3.99 0.00 -0.52 -1.56 107.32 106.81 1dx9 s GLY 89 Ca 0.22 -0.38 -0.03 0.00 0.00 0.00 0.00 44.72 44.53 1dx9 s GLY 89 CO 0.14 0.12 0.17 -0.35 0.00 0.00 0.00 173.10 173.18 1dx9 s ASP 90 N -3.02 5.20 0.54 1.64 -1.08 -1.26 -4.23 116.67 114.46 1dx9 s ASP 90 Ca 0.14 -1.88 0.32 0.00 -0.52 0.00 0.00 52.55 50.61 1dx9 s ASP 90 Cb -0.05 -1.81 1.36 0.00 -1.46 0.00 0.00 42.92 40.96 1dx9 s ASP 90 CO 0.07 -0.49 1.98 0.06 0.52 0.00 0.00 175.17 177.32 1dx9 h GLN 91 N 8.04 0.00 0.05 4.34 3.07 -1.86 -2.36 115.11 126.39 1dx9 h GLN 91 Ca -0.14 0.00 -0.34 0.00 0.09 0.00 0.00 58.65 58.25 1dx9 h GLN 91 Cb 1.05 0.00 -0.04 0.00 0.08 0.00 0.00 27.48 28.57 1dx9 h GLN 91 CO 0.67 0.04 -1.91 -0.89 0.09 0.00 0.00 178.83 176.83 1dx9 n ILE 92 N -3.17 1.62 -0.16 1.86 5.41 -1.26 -3.37 119.36 120.29 1dx9 n ILE 92 Ca 0.00 -0.40 -0.11 0.00 1.00 0.00 0.00 62.75 63.24 1dx9 n ILE 92 Cb 0.31 -1.81 -0.00 0.00 -0.71 0.00 0.00 39.64 37.42 1dx9 n ILE 92 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 1dx9 h GLY 93 N 0.22 1.04 -5.83 7.39 0.00 -1.98 -3.35 103.07 100.56 1dx9 h GLY 93 Ca -0.47 -0.91 -0.56 0.00 0.00 0.00 0.00 47.33 45.40 1dx9 h GLY 93 CO -0.12 0.83 -0.85 -1.72 0.00 0.00 0.00 176.54 174.68 1dx9 n TYR 94 N -4.16 2.18 0.29 5.60 4.01 -0.89 -4.94 117.16 119.25 1dx9 n TYR 94 Ca -0.00 -3.91 0.18 0.00 -0.16 0.00 0.00 57.90 54.01 1dx9 n TYR 94 Cb 0.44 -0.46 0.82 0.00 -0.31 0.00 0.00 39.34 39.82 1dx9 n TYR 94 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1dx9 h ALA 95 N 3.50 1.01 0.00 -0.72 0.00 -1.70 -2.81 119.26 118.53 1dx9 h ALA 95 Ca 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1dx9 h ALA 95 Cb 0.73 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1dx9 h ALA 95 CO 0.68 0.01 -0.39 -0.25 0.00 0.00 0.00 179.25 179.31 1dx9 n ASP 96 N -3.12 0.43 -1.66 0.00 8.00 -1.26 -0.68 116.55 118.27 1dx9 n ASP 96 Ca -0.00 0.03 0.01 0.00 0.71 0.00 0.00 54.79 55.54 1dx9 n ASP 96 Cb 0.25 0.01 0.06 0.00 -0.02 0.00 0.00 41.12 41.42 1dx9 n ASP 96 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1dx9 n ASN 97 N -1.65 1.54 -4.64 -2.24 4.13 -1.06 -4.33 115.26 106.99 1dx9 n ASN 97 Ca 0.05 -2.48 -0.43 0.00 1.68 0.00 0.00 54.58 53.41 1dx9 n ASN 97 Cb 0.36 -0.38 -0.03 0.00 -1.54 0.00 0.00 39.78 38.19 1dx9 n ASN 97 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1dx9 s PHE 98 N -1.66 1.96 -1.33 3.10 5.36 -1.17 -2.60 117.98 121.64 1dx9 s PHE 98 Ca 0.34 0.34 0.00 0.00 -0.96 0.00 0.00 56.93 56.66 1dx9 s PHE 98 Cb 0.37 -3.95 0.00 0.00 -0.34 0.00 0.00 43.02 39.10 1dx9 s PHE 98 CO -0.11 -3.54 0.00 1.04 -1.46 0.00 0.00 175.22 171.15 1dx9 n GLN 99 N 7.46 -1.14 -0.33 10.12 1.13 -1.26 -4.48 117.38 128.88 1dx9 n GLN 99 Ca 0.19 0.79 -0.01 0.00 -1.94 0.00 0.00 57.00 56.02 1dx9 n GLN 99 Cb 0.44 -5.06 0.15 0.00 0.11 0.00 0.00 30.24 25.89 1dx9 n GLN 99 CO 0.00 0.00 0.00 -0.44 -1.44 0.00 0.00 177.06 175.18 1dx9 h ASP 100 N 0.00 1.07 -0.82 1.08 5.19 -1.85 -3.12 116.42 117.96 1dx9 h ASP 100 Ca -0.34 -0.02 0.01 0.00 -0.62 0.00 0.00 57.03 56.06 1dx9 h ASP 100 Cb 1.18 -0.26 -0.04 0.00 0.18 0.00 0.00 39.33 40.39 1dx9 h ASP 100 CO 0.42 0.77 0.54 0.00 -3.12 0.00 0.00 179.24 177.85 1dx9 h ALA 101 N 1.42 1.05 0.00 3.45 0.00 -1.83 -0.44 119.26 122.91 1dx9 h ALA 101 Ca 0.35 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.15 1dx9 h ALA 101 Cb -0.12 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.33 1dx9 h ALA 101 CO -0.08 0.44 -0.26 -0.84 0.00 0.00 0.00 179.25 178.51 1dx9 h ILE 102 N 1.11 0.53 -0.60 0.00 3.07 -1.78 -1.37 117.51 118.48 1dx9 h ILE 102 Ca 0.30 -1.41 -0.09 0.00 1.55 0.00 0.00 64.86 65.22 1dx9 h ILE 102 Cb -0.12 1.99 -0.02 0.00 -0.27 0.00 0.00 36.82 38.40 1dx9 h ILE 102 CO -0.07 0.26 0.02 1.23 -1.05 0.00 0.00 178.15 178.54 1dx9 h GLY 103 N 2.80 1.11 0.87 0.16 0.00 -1.22 -0.92 103.07 105.89 1dx9 h GLY 103 Ca -0.00 -0.79 -0.09 0.00 0.00 0.00 0.00 47.33 46.45 1dx9 h GLY 103 CO 0.03 0.73 -0.21 -2.22 0.00 0.00 0.00 176.54 174.87 1dx9 h ILE 104 N 0.95 1.32 -0.14 2.60 2.04 -0.83 -2.69 117.51 120.76 1dx9 h ILE 104 Ca 0.17 -1.36 -0.00 0.00 1.00 0.00 0.00 64.86 64.67 1dx9 h ILE 104 Cb 0.52 1.68 -0.01 0.00 -0.74 0.00 0.00 36.82 38.28 1dx9 h ILE 104 CO 0.03 0.42 0.08 -0.07 0.00 0.00 0.00 178.15 178.61 1dx9 h LEU 105 N 0.25 0.17 -0.96 1.44 3.38 -1.25 -3.06 115.31 115.30 1dx9 h LEU 105 Ca 0.04 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 1dx9 h LEU 105 Cb 0.76 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 41.42 1dx9 h LEU 105 CO 0.05 0.19 0.51 -0.08 0.09 0.00 0.00 178.44 179.21 1dx9 h GLU 106 N 0.15 1.24 -0.78 1.13 4.22 -1.17 -1.34 114.58 118.03 1dx9 h GLU 106 Ca 0.05 -0.13 -0.04 0.00 0.08 0.00 0.00 59.36 59.32 1dx9 h GLU 106 Cb 0.05 -0.25 -0.04 0.00 0.50 0.00 0.00 28.75 29.01 1dx9 h GLU 106 CO -0.01 0.89 0.33 1.05 -2.18 0.00 0.00 179.01 179.09 1dx9 h GLU 107 N 1.26 1.15 -0.02 1.92 4.11 -1.44 0.15 114.58 121.71 1dx9 h GLU 107 Ca 0.32 -0.19 -0.01 0.00 0.07 0.00 0.00 59.36 59.55 1dx9 h GLU 107 Cb -0.01 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.05 1dx9 h GLU 107 CO -0.06 0.92 -0.01 -0.22 0.07 0.00 0.00 179.01 179.71 1dx9 h LYS 108 N 1.13 0.04 -0.28 1.06 1.63 -1.38 -1.45 116.57 117.32 1dx9 h LYS 108 Ca 0.26 -0.02 -0.07 0.00 -0.85 0.00 0.00 60.65 59.97 1dx9 h LYS 108 Cb 0.19 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.80 1dx9 h LYS 108 CO -0.02 0.50 -0.14 0.82 -3.45 0.00 0.00 179.45 177.16 1dx9 h ILE 109 N -0.42 1.23 -0.33 2.00 2.04 -1.11 -1.31 117.51 119.62 1dx9 h ILE 109 Ca 0.00 -1.03 -0.15 0.00 1.00 0.00 0.00 64.86 64.68 1dx9 h ILE 109 Cb 0.49 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 1dx9 h ILE 109 CO 0.00 0.34 -0.39 0.28 0.00 0.00 0.00 178.15 178.38 1dx9 h SER 110 N 0.45 0.84 -0.87 1.72 0.02 -0.72 -0.32 113.55 114.67 1dx9 h SER 110 Ca 0.08 -0.38 0.06 0.00 -0.84 0.00 0.00 61.79 60.71 1dx9 h SER 110 Cb 0.51 -0.24 -0.06 0.00 0.14 0.00 0.00 62.40 62.75 1dx9 h SER 110 CO 0.03 1.13 0.57 -0.61 -1.14 0.00 0.00 176.83 176.81 1dx9 h GLN 111 N 0.65 0.95 -0.25 3.45 4.15 -0.67 -1.42 115.11 121.97 1dx9 h GLN 111 Ca 0.05 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1dx9 h GLN 111 Cb 0.95 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 28.43 1dx9 h GLN 111 CO 0.09 0.63 0.00 0.54 -1.93 0.00 0.00 178.83 178.16 1dx9 n ARG 112 N -4.48 1.51 0.00 1.69 5.12 -0.55 -4.88 116.66 115.07 1dx9 n ARG 112 Ca 0.13 -0.74 0.00 0.00 -1.93 0.00 0.00 57.85 55.31 1dx9 n ARG 112 Cb 0.20 -1.19 0.00 0.00 -1.16 0.00 0.00 32.46 30.31 1dx9 n ARG 112 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1dx9 n GLY 113 N 0.78 0.47 3.77 -0.13 0.00 -0.53 -2.01 105.19 107.54 1dx9 n GLY 113 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 1dx9 n GLY 113 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1dx9 s GLY 114 N -1.37 2.98 -0.27 -0.02 0.00 -0.16 -3.89 107.32 104.59 1dx9 s GLY 114 Ca 0.00 1.22 -0.13 0.00 0.00 0.00 0.00 44.72 45.81 1dx9 s GLY 114 CO 0.00 1.84 0.27 1.25 0.00 0.00 0.00 173.10 176.46 1dx9 s LYS 115 N -1.90 4.00 -0.04 2.90 2.20 -0.39 -4.27 119.74 122.24 1dx9 s LYS 115 Ca 0.51 -0.14 -0.29 0.00 -0.36 0.00 0.00 55.97 55.68 1dx9 s LYS 115 Cb -0.38 -3.64 -0.02 0.00 -1.51 0.00 0.00 37.83 32.27 1dx9 s LYS 115 CO 0.51 -0.19 0.96 0.99 -0.36 0.00 0.00 175.35 177.25 1dx9 s THR 116 N 1.80 4.86 0.04 3.43 2.01 -1.26 -0.93 115.64 125.59 1dx9 s THR 116 Ca 0.11 1.98 0.06 0.00 0.31 0.00 0.00 61.69 64.15 1dx9 s THR 116 Cb -0.16 -4.29 -0.02 0.00 0.01 0.00 0.00 72.50 68.04 1dx9 s THR 116 CO 0.10 0.12 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.30 1dx9 s VAL 117 N 1.32 1.26 0.00 3.82 1.01 -0.15 -4.89 120.40 122.77 1dx9 s VAL 117 Ca 0.49 -1.06 0.00 0.00 0.00 0.00 0.00 61.98 61.41 1dx9 s VAL 117 Cb -0.20 -1.13 0.00 0.00 0.00 0.00 0.00 36.38 35.05 1dx9 s VAL 117 CO 0.24 0.05 0.00 0.61 0.00 0.00 0.00 175.10 176.00 1dx9 n GLY 118 N 1.87 1.75 3.66 4.51 0.00 -1.26 -4.12 105.19 111.59 1dx9 n GLY 118 Ca -0.18 -0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 1dx9 n GLY 118 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1dx9 n TYR 119 N -1.41 1.77 -4.59 1.61 4.01 -1.26 -4.26 117.16 113.03 1dx9 n TYR 119 Ca 0.00 0.55 -0.22 0.00 -0.16 0.00 0.00 57.90 58.07 1dx9 n TYR 119 Cb 0.05 -2.32 -0.15 0.00 -0.31 0.00 0.00 39.34 36.61 1dx9 n TYR 119 CO 0.00 0.00 0.00 -0.46 -0.46 0.00 0.00 176.86 175.94 1dx9 s TRP 120 N -1.19 1.22 0.35 -0.72 -0.11 -0.13 -4.92 118.94 113.44 1dx9 s TRP 120 Ca 0.60 -0.27 -0.28 0.00 1.22 0.00 0.00 56.10 57.37 1dx9 s TRP 120 Cb -0.56 -0.81 -0.11 0.00 -1.50 0.00 0.00 33.47 30.50 1dx9 s TRP 120 CO 0.59 -0.06 1.45 0.45 -4.62 0.00 0.00 176.95 174.75 1dx9 s SER 121 N -0.13 6.46 0.00 5.86 0.15 -1.26 -0.20 113.70 124.58 1dx9 s SER 121 Ca 0.02 2.94 0.27 0.00 0.70 0.00 0.00 55.95 59.88 1dx9 s SER 121 Cb -0.07 -2.66 1.24 0.00 -1.71 0.00 0.00 66.02 62.82 1dx9 s SER 121 CO 0.00 -0.79 1.84 0.35 1.20 0.00 0.00 173.24 175.84 1dx9 n THR 122 N 0.78 0.03 -1.79 6.45 -2.24 -1.26 -4.80 114.28 111.46 1dx9 n THR 122 Ca 0.02 -0.18 -0.42 0.00 -2.27 0.00 0.00 64.05 61.20 1dx9 n THR 122 Cb 0.40 0.13 -0.03 0.00 -2.10 0.00 0.00 70.33 68.73 1dx9 n THR 122 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1dx9 s ASP 123 N -1.89 6.48 0.00 3.42 2.15 -1.26 -2.88 116.67 122.69 1dx9 s ASP 123 Ca 0.39 2.69 0.00 0.00 0.43 0.00 0.00 52.55 56.06 1dx9 s ASP 123 Cb 0.20 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 40.25 1dx9 s ASP 123 CO 0.32 -0.95 0.00 0.61 -0.17 0.00 0.00 175.17 174.98 1dx9 n GLY 124 N 4.08 0.84 3.30 2.66 0.00 -1.26 -5.08 105.19 109.73 1dx9 n GLY 124 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 1dx9 n GLY 124 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1dx9 s TYR 125 N -2.01 2.34 -0.36 1.61 1.51 -1.14 -5.10 117.35 114.20 1dx9 s TYR 125 Ca 0.00 -0.51 -0.05 0.00 -1.01 0.00 0.00 57.07 55.50 1dx9 s TYR 125 Cb 0.00 -1.51 0.07 0.00 -0.11 0.00 0.00 41.96 40.40 1dx9 s TYR 125 CO 0.00 -0.08 0.13 -0.51 -1.11 0.00 0.00 175.55 173.98 1dx9 s ASP 126 N -0.50 5.26 0.20 2.29 1.01 -1.26 -5.07 116.67 118.60 1dx9 s ASP 126 Ca 0.07 -1.46 -0.10 0.00 0.71 0.00 0.00 52.55 51.77 1dx9 s ASP 126 Cb -0.11 -1.84 -0.01 0.00 1.01 0.00 0.00 42.92 41.97 1dx9 s ASP 126 CO 0.00 -0.41 0.34 0.72 0.21 0.00 0.00 175.17 176.03 1dx9 s PHE 127 N 1.31 0.47 -0.26 4.23 -0.71 -1.26 -4.50 117.98 117.26 1dx9 s PHE 127 Ca 0.01 -0.81 -0.06 0.00 -1.04 0.00 0.00 56.93 55.02 1dx9 s PHE 127 Cb -0.21 -0.02 -0.16 0.00 -1.21 0.00 0.00 43.02 41.42 1dx9 s PHE 127 CO -0.00 -0.81 -0.22 0.09 -1.34 0.00 0.00 175.22 172.94 1dx9 n ASN 128 N -0.28 1.97 -3.69 1.98 3.02 0.15 -5.03 115.26 113.37 1dx9 n ASN 128 Ca -0.04 0.11 -0.10 0.00 -0.03 0.00 0.00 54.58 54.52 1dx9 n ASN 128 Cb 0.63 -0.64 -0.03 0.00 -0.61 0.00 0.00 39.78 39.13 1dx9 n ASN 128 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1dx9 s ASP 129 N -6.98 -0.32 -0.26 6.41 2.15 -1.04 -4.98 116.67 111.65 1dx9 s ASP 129 Ca -0.36 -0.40 -0.21 0.00 0.43 0.00 0.00 52.55 52.02 1dx9 s ASP 129 Cb 0.11 0.60 0.07 0.00 -0.30 0.00 0.00 42.92 43.40 1dx9 s ASP 129 CO 0.56 -1.07 0.67 -0.55 -0.17 0.00 0.00 175.17 174.61 1dx9 s SER 130 N -2.85 -0.77 0.00 -0.34 0.15 -1.26 -3.06 113.70 105.57 1dx9 s SER 130 Ca 0.08 1.39 0.24 0.00 0.70 0.00 0.00 55.95 58.36 1dx9 s SER 130 Cb -0.02 1.36 1.18 0.00 -1.71 0.00 0.00 66.02 66.83 1dx9 s SER 130 CO -0.04 -0.24 1.80 0.29 1.20 0.00 0.00 173.24 176.26 1dx9 n LYS 131 N 3.26 0.25 0.00 5.44 5.02 -1.26 -3.32 118.16 127.54 1dx9 n LYS 131 Ca -0.16 0.06 0.14 0.00 -2.02 0.00 0.00 58.31 56.33 1dx9 n LYS 131 Cb 0.56 -1.50 0.55 0.00 -0.02 0.00 0.00 35.03 34.62 1dx9 n LYS 131 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1dx9 n ALA 132 N -1.35 2.72 -2.37 7.82 0.00 -1.26 -4.49 120.51 121.58 1dx9 n ALA 132 Ca 0.10 -0.39 -0.42 0.00 0.00 0.00 0.00 53.44 52.73 1dx9 n ALA 132 Cb 0.22 -1.22 -0.03 0.00 0.00 0.00 0.00 19.45 18.43 1dx9 n ALA 132 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1dx9 s LEU 133 N -2.17 4.27 -0.50 0.00 1.02 -1.21 -0.56 118.68 119.53 1dx9 s LEU 133 Ca 0.35 1.88 0.03 0.00 0.02 0.00 0.00 54.13 56.41 1dx9 s LEU 133 Cb 0.21 -3.55 0.14 0.00 0.02 0.00 0.00 46.19 43.00 1dx9 s LEU 133 CO 0.40 -0.68 0.28 -0.13 0.02 0.00 0.00 176.35 176.24 1dx9 s ARG 134 N 2.67 1.63 -0.83 1.70 1.81 0.14 -4.90 118.95 121.15 1dx9 s ARG 134 Ca 0.58 -2.38 -0.03 0.00 -1.72 0.00 0.00 55.73 52.19 1dx9 s ARG 134 Cb -0.26 -2.73 -0.01 0.00 -0.45 0.00 0.00 34.95 31.50 1dx9 s ARG 134 CO 0.22 -1.17 0.73 -1.71 -0.68 0.00 0.00 175.30 172.69 1dx9 n ASN 135 N 3.16 -7.08 0.00 0.23 5.15 -1.26 -2.53 115.26 112.93 1dx9 n ASN 135 Ca 0.10 -0.36 0.00 0.00 -0.60 0.00 0.00 54.58 53.72 1dx9 n ASN 135 Cb 0.35 -4.74 0.00 0.00 -0.53 0.00 0.00 39.78 34.86 1dx9 n ASN 135 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1dx9 n GLY 136 N -1.66 0.49 3.23 8.20 0.00 -1.26 -4.97 105.19 109.22 1dx9 n GLY 136 Ca -0.06 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.73 1dx9 n GLY 136 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dx9 s LYS 137 N -0.54 1.14 0.42 1.61 -0.14 -1.05 -4.48 119.74 116.69 1dx9 s LYS 137 Ca 0.00 -0.99 -0.24 0.00 -1.36 0.00 0.00 55.97 53.39 1dx9 s LYS 137 Cb 0.00 -1.27 -0.09 0.00 -1.68 0.00 0.00 37.83 34.79 1dx9 s LYS 137 CO 0.00 0.31 1.08 -0.06 -0.76 0.00 0.00 175.35 175.92 1dx9 s PHE 138 N -1.00 3.15 0.14 3.18 0.08 0.72 0.23 117.98 124.48 1dx9 s PHE 138 Ca 0.05 1.61 0.35 0.00 0.12 0.00 0.00 56.93 59.05 1dx9 s PHE 138 Cb -0.09 -3.20 1.52 0.00 -0.57 0.00 0.00 43.02 40.68 1dx9 s PHE 138 CO 0.03 -0.89 2.02 -0.24 -0.10 0.00 0.00 175.22 176.04 1dx9 h VAL 139 N 2.08 0.00 -1.84 -0.44 3.04 -1.12 -0.33 116.25 117.64 1dx9 h VAL 139 Ca -0.49 -0.38 0.00 0.00 -1.01 0.00 0.00 66.70 64.82 1dx9 h VAL 139 Cb 1.22 1.34 0.00 0.00 -2.01 0.00 0.00 31.29 31.85 1dx9 h VAL 139 CO 0.62 0.00 0.00 0.61 -1.01 0.00 0.00 177.57 177.79 1dx9 n GLY 140 N -0.20 1.80 3.68 3.17 0.00 -1.26 -4.05 105.19 108.33 1dx9 n GLY 140 Ca 0.00 -0.98 -0.42 0.00 0.00 0.00 0.00 46.02 44.62 1dx9 n GLY 140 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1dx9 s LEU 141 N 0.00 4.33 -0.27 0.99 2.96 -0.55 -4.33 118.68 121.82 1dx9 s LEU 141 Ca 0.00 2.26 -0.09 0.00 -0.22 0.00 0.00 54.13 56.08 1dx9 s LEU 141 Cb 0.00 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 43.10 1dx9 s LEU 141 CO 0.00 -0.82 0.13 0.00 -1.32 0.00 0.00 176.35 174.34 1dx9 s ALA 142 N 2.79 3.32 0.11 5.97 0.00 -1.26 -1.96 121.76 130.74 1dx9 s ALA 142 Ca 0.69 -1.13 0.08 0.00 0.00 0.00 0.00 51.96 51.60 1dx9 s ALA 142 Cb -0.34 -2.27 -0.04 0.00 0.00 0.00 0.00 23.12 20.47 1dx9 s ALA 142 CO 0.29 -0.55 -0.14 -0.51 0.00 0.00 0.00 175.76 174.85 1dx9 s LEU 143 N 1.67 2.86 -0.28 0.00 1.43 -0.03 -5.00 118.68 119.32 1dx9 s LEU 143 Ca 0.07 -0.48 -0.03 0.00 -1.03 0.00 0.00 54.13 52.65 1dx9 s LEU 143 Cb -0.16 -1.68 0.10 0.00 0.03 0.00 0.00 46.19 44.48 1dx9 s LEU 143 CO 0.07 0.18 0.11 -0.62 0.23 0.00 0.00 176.35 176.32 1dx9 s ASP 144 N -2.17 3.58 0.12 2.29 -1.08 -1.26 -1.44 116.67 116.71 1dx9 s ASP 144 Ca 0.19 -1.33 0.26 0.00 -0.52 0.00 0.00 52.55 51.16 1dx9 s ASP 144 Cb -0.11 -0.49 0.83 0.00 -1.46 0.00 0.00 42.92 41.68 1dx9 s ASP 144 CO 0.12 -0.42 1.71 1.21 0.52 0.00 0.00 175.17 178.31 1dx9 n GLU 145 N 5.13 0.17 0.11 4.34 4.07 -1.26 -1.03 120.64 132.18 1dx9 n GLU 145 Ca -0.05 0.12 -0.23 0.00 -0.06 0.00 0.00 57.16 56.94 1dx9 n GLU 145 Cb 0.43 -1.68 -0.15 0.00 -0.06 0.00 0.00 31.44 29.98 1dx9 n GLU 145 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 1dx9 h ASP 146 N 0.00 0.71 0.00 4.31 3.32 -1.94 -3.36 116.42 119.45 1dx9 h ASP 146 Ca 0.00 -0.87 -0.01 0.00 0.02 0.00 0.00 57.03 56.17 1dx9 h ASP 146 Cb 0.65 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.97 1dx9 h ASP 146 CO 0.00 1.71 -1.19 0.59 -1.72 0.00 0.00 179.24 178.62 1dx9 n ASN 147 N -3.64 4.12 -2.73 6.45 3.02 -1.24 -4.80 115.26 116.45 1dx9 n ASN 147 Ca -0.19 0.00 -0.04 0.00 -0.03 0.00 0.00 54.58 54.31 1dx9 n ASN 147 Cb 1.09 1.05 0.04 0.00 -0.61 0.00 0.00 39.78 41.35 1dx9 n ASN 147 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1dx9 n GLN 148 N -1.74 1.83 0.31 3.52 6.02 -0.19 -4.89 117.38 122.22 1dx9 n GLN 148 Ca -0.02 -3.54 0.19 0.00 -0.01 0.00 0.00 57.00 53.62 1dx9 n GLN 148 Cb 0.21 -1.61 0.96 0.00 1.02 0.00 0.00 30.24 30.81 1dx9 n GLN 148 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1dx9 h SER 149 N 2.64 0.00 0.67 1.08 4.64 -1.66 -1.70 113.55 119.23 1dx9 h SER 149 Ca -0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 1dx9 h SER 149 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1dx9 h SER 149 CO 0.31 0.02 0.00 -0.90 -0.87 0.00 0.00 176.83 175.39 1dx9 n ASP 150 N -3.20 0.00 -0.06 4.97 5.75 -1.26 -3.36 116.55 119.39 1dx9 n ASP 150 Ca -0.02 0.02 0.08 0.00 -0.01 0.00 0.00 54.79 54.86 1dx9 n ASP 150 Cb 0.18 -0.34 -0.08 0.00 -1.03 0.00 0.00 41.12 39.85 1dx9 n ASP 150 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1dx9 n LEU 151 N -1.34 0.88 -0.17 -2.12 4.77 -0.64 -4.68 117.00 113.71 1dx9 n LEU 151 Ca 0.12 -0.54 -0.08 0.00 -0.03 0.00 0.00 56.01 55.48 1dx9 n LEU 151 Cb 0.26 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.36 1dx9 n LEU 151 CO 0.24 0.21 0.97 0.74 -1.33 0.00 0.00 177.39 178.21 1dx9 h THR 152 N 0.28 1.20 -0.62 -5.08 2.02 -1.61 -1.22 112.91 107.87 1dx9 h THR 152 Ca 0.00 -0.59 -0.09 0.00 0.77 0.00 0.00 66.41 66.50 1dx9 h THR 152 Cb 0.40 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 67.49 1dx9 h THR 152 CO 0.00 0.23 0.04 0.44 0.37 0.00 0.00 175.52 176.59 1dx9 h ASP 153 N 0.64 1.04 0.11 4.18 3.32 -1.83 -1.03 116.42 122.85 1dx9 h ASP 153 Ca 0.16 -0.28 -0.17 0.00 0.02 0.00 0.00 57.03 56.76 1dx9 h ASP 153 Cb 0.16 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.43 1dx9 h ASP 153 CO -0.02 1.06 -0.64 0.44 -1.72 0.00 0.00 179.24 178.37 1dx9 h ASP 154 N 0.98 0.58 -0.31 6.45 3.32 -1.81 -1.35 116.42 124.29 1dx9 h ASP 154 Ca 0.18 -0.34 -0.03 0.00 0.02 0.00 0.00 57.03 56.87 1dx9 h ASP 154 Cb 0.51 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 1dx9 h ASP 154 CO 0.02 1.07 0.09 0.03 -1.72 0.00 0.00 179.24 178.73 1dx9 h ARG 155 N 0.37 0.48 -0.22 3.56 3.08 -1.02 -1.94 114.38 118.68 1dx9 h ARG 155 Ca -0.01 -0.10 -0.00 0.00 0.07 0.00 0.00 59.98 59.93 1dx9 h ARG 155 Cb 1.20 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 31.17 1dx9 h ARG 155 CO 0.12 0.53 0.12 0.82 -1.07 0.00 0.00 179.97 180.49 1dx9 h ILE 156 N 0.33 1.11 -0.51 2.04 2.04 -1.04 0.77 117.51 122.25 1dx9 h ILE 156 Ca 0.10 -0.28 0.04 0.00 1.00 0.00 0.00 64.86 65.72 1dx9 h ILE 156 Cb 0.25 0.90 -0.04 0.00 -0.74 0.00 0.00 36.82 37.19 1dx9 h ILE 156 CO -0.00 0.10 0.26 0.11 0.00 0.00 0.00 178.15 178.63 1dx9 h LYS 157 N 0.25 0.50 -0.40 2.37 1.57 -1.23 0.60 116.57 120.23 1dx9 h LYS 157 Ca 0.08 -0.03 -0.11 0.00 -1.87 0.00 0.00 60.65 58.72 1dx9 h LYS 157 Cb 0.06 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 1dx9 h LYS 157 CO -0.01 0.33 -0.20 1.03 -0.57 0.00 0.00 179.45 180.03 1dx9 h SER 158 N 0.52 0.79 -0.10 0.86 0.87 -1.11 -2.39 113.55 112.98 1dx9 h SER 158 Ca 0.22 -0.27 -0.21 0.00 -1.23 0.00 0.00 61.79 60.30 1dx9 h SER 158 Cb 0.11 -0.22 0.01 0.00 -0.44 0.00 0.00 62.40 61.87 1dx9 h SER 158 CO -0.15 0.97 -0.76 -0.25 -0.53 0.00 0.00 176.83 176.12 1dx9 h TRP 159 N 0.69 0.96 -0.90 2.24 7.01 -0.27 -2.62 115.95 123.05 1dx9 h TRP 159 Ca 0.10 -0.45 -0.01 0.00 2.11 0.00 0.00 58.89 60.64 1dx9 h TRP 159 Cb 0.70 -0.14 -0.04 0.00 -2.10 0.00 0.00 29.16 27.58 1dx9 h TRP 159 CO 0.04 1.27 0.52 0.28 -2.79 0.00 0.00 178.44 177.76 1dx9 h VAL 160 N 0.37 1.25 -0.83 2.65 2.07 -0.86 -0.77 116.25 120.13 1dx9 h VAL 160 Ca -0.07 -0.58 0.04 0.00 0.82 0.00 0.00 66.70 66.91 1dx9 h VAL 160 Cb 1.40 0.01 -0.05 0.00 -1.52 0.00 0.00 31.29 31.13 1dx9 h VAL 160 CO 0.15 0.27 0.52 0.00 0.02 0.00 0.00 177.57 178.54 1dx9 h ALA 161 N 1.28 1.10 -0.48 1.67 0.00 -1.36 -0.64 119.26 120.84 1dx9 h ALA 161 Ca 0.32 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.17 1dx9 h ALA 161 Cb -0.02 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1dx9 h ALA 161 CO -0.06 0.33 0.16 0.37 0.00 0.00 0.00 179.25 180.05 1dx9 h GLN 162 N 1.00 0.73 -0.17 0.00 4.15 -1.00 -3.11 115.11 116.72 1dx9 h GLN 162 Ca 0.34 -0.15 -0.07 0.00 0.77 0.00 0.00 58.65 59.54 1dx9 h GLN 162 Cb 0.05 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.62 1dx9 h GLN 162 CO -0.13 0.68 -0.20 -0.07 -1.93 0.00 0.00 178.83 177.18 1dx9 h LEU 163 N 0.63 0.28 -1.16 -2.39 3.38 -0.42 -2.15 115.31 113.49 1dx9 h LEU 163 Ca 0.16 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 1dx9 h LEU 163 Cb 0.24 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1dx9 h LEU 163 CO -0.01 0.49 0.14 0.11 0.09 0.00 0.00 178.44 179.26 1dx9 h LYS 164 N 0.26 0.73 -0.35 1.13 1.57 -1.07 0.51 116.57 119.35 1dx9 h LYS 164 Ca 0.05 -0.13 -0.16 0.00 -1.87 0.00 0.00 60.65 58.54 1dx9 h LYS 164 Cb 0.50 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.69 1dx9 h LYS 164 CO 0.03 0.65 -0.41 0.77 -0.57 0.00 0.00 179.45 179.92 1dx9 h SER 165 N 0.71 0.96 1.27 0.86 0.02 -1.43 0.53 113.55 116.47 1dx9 h SER 165 Ca 0.16 -0.48 -0.14 0.00 -0.84 0.00 0.00 61.79 60.49 1dx9 h SER 165 Cb 0.24 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 1dx9 h SER 165 CO -0.01 1.25 -0.67 -0.33 -1.14 0.00 0.00 176.83 175.94 1dx9 h GLU 166 N 0.69 0.00 0.00 3.45 5.08 -0.90 -3.17 114.58 119.74 1dx9 h GLU 166 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1dx9 h GLU 166 Cb 1.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.26 1dx9 h GLU 166 CO 0.10 0.67 -0.67 1.19 -1.00 0.00 0.00 179.01 179.30 1dx9 n PHE 167 N -3.30 0.26 -1.91 4.33 3.72 0.17 -4.98 117.46 115.76 1dx9 n PHE 167 Ca 0.01 0.08 0.00 0.00 -0.05 0.00 0.00 57.45 57.49 1dx9 n PHE 167 Cb 0.79 -0.43 0.00 0.00 -0.94 0.00 0.00 39.48 38.90 1dx9 n PHE 167 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1dx9 n GLY 168 N 1.41 0.87 0.39 1.37 0.00 -0.78 -5.05 105.19 103.39 1dx9 n GLY 168 Ca 0.04 -0.51 0.05 0.00 0.00 0.00 0.00 46.02 45.60 1dx9 n GLY 168 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36