#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g9h s HIS 5 N 0.00 0.43 -0.03 4.31 3.76 -1.26 -5.09 115.29 117.41 2g9h s HIS 5 Ca 0.00 -0.77 -0.00 0.00 -0.15 0.00 0.00 55.06 54.14 2g9h s HIS 5 Cb 0.00 -0.30 0.03 0.00 1.11 0.00 0.00 32.58 33.41 2g9h s HIS 5 CO 0.00 -0.26 0.03 0.08 -0.85 0.00 0.00 174.74 173.74 2g9h s VAL 6 N -2.57 -0.00 -0.15 -0.90 1.01 -1.26 -5.04 120.40 111.48 2g9h s VAL 6 Ca -0.05 0.24 -0.01 0.00 0.00 0.00 0.00 61.98 62.16 2g9h s VAL 6 Cb -0.02 -0.16 -0.01 0.00 0.00 0.00 0.00 36.38 36.19 2g9h s VAL 6 CO -0.05 0.13 -0.11 -0.63 0.00 0.00 0.00 175.10 174.44 2g9h s ILE 7 N 1.36 3.11 -0.11 2.22 1.01 -1.26 -1.77 121.20 125.75 2g9h s ILE 7 Ca -0.05 -0.62 0.02 0.00 0.00 0.00 0.00 60.65 60.00 2g9h s ILE 7 Cb -0.13 -2.33 0.01 0.00 0.01 0.00 0.00 42.46 40.02 2g9h s ILE 7 CO -0.03 0.50 -0.18 -0.63 0.00 0.00 0.00 174.94 174.60 2g9h s ILE 8 N 0.66 1.73 -0.38 2.92 1.01 -0.58 -4.98 121.20 121.58 2g9h s ILE 8 Ca -0.06 -0.79 -0.20 0.00 0.00 0.00 0.00 60.65 59.60 2g9h s ILE 8 Cb -0.15 -1.55 0.01 0.00 0.01 0.00 0.00 42.46 40.78 2g9h s ILE 8 CO 0.02 0.49 0.59 -1.58 0.00 0.00 0.00 174.94 174.46 2g9h s GLN 9 N 0.80 3.50 -0.12 2.79 0.74 -1.26 -0.80 119.66 125.32 2g9h s GLN 9 Ca -0.09 -0.19 0.03 0.00 0.05 0.00 0.00 55.36 55.15 2g9h s GLN 9 Cb -0.16 -3.86 0.01 0.00 1.10 0.00 0.00 33.01 30.10 2g9h s GLN 9 CO 0.00 -0.80 -0.20 0.00 -0.55 0.00 0.00 175.29 173.74 2g9h s ALA 10 N 2.61 2.04 0.16 1.58 0.00 -0.20 -5.00 121.76 122.95 2g9h s ALA 10 Ca 0.21 -0.94 0.06 0.00 0.00 0.00 0.00 51.96 51.30 2g9h s ALA 10 Cb -0.15 -0.89 -0.04 0.00 0.00 0.00 0.00 23.12 22.04 2g9h s ALA 10 CO 0.16 0.04 -0.13 -1.21 0.00 0.00 0.00 175.76 174.62 2g9h s GLU 11 N 0.73 1.16 0.05 0.00 2.02 -1.26 -1.41 118.70 119.99 2g9h s GLU 11 Ca -0.10 -1.46 -0.11 0.00 0.02 0.00 0.00 54.97 53.32 2g9h s GLU 11 Cb -0.16 -0.88 0.01 0.00 0.10 0.00 0.00 34.13 33.20 2g9h s GLU 11 CO 0.01 0.14 0.24 -0.59 0.02 0.00 0.00 175.26 175.09 2g9h s PHE 12 N -2.91 -0.01 -0.00 1.61 -0.12 -0.94 -4.98 117.98 110.62 2g9h s PHE 12 Ca 0.17 -0.19 0.06 0.00 -0.05 0.00 0.00 56.93 56.92 2g9h s PHE 12 Cb -0.00 0.03 -0.02 0.00 -0.63 0.00 0.00 43.02 42.39 2g9h s PHE 12 CO 0.04 -0.47 -0.19 -0.47 -0.05 0.00 0.00 175.22 174.07 2g9h s TYR 13 N -2.66 1.70 -0.09 3.49 5.04 -1.26 -2.32 117.35 121.25 2g9h s TYR 13 Ca -0.04 -0.33 0.01 0.00 -2.44 0.00 0.00 57.07 54.27 2g9h s TYR 13 Cb -0.01 -1.08 0.02 0.00 0.35 0.00 0.00 41.96 41.25 2g9h s TYR 13 CO -0.04 -0.01 -0.10 -1.17 -1.34 0.00 0.00 175.55 172.89 2g9h s LEU 14 N -0.60 1.44 0.10 6.97 2.96 0.38 -4.99 118.68 124.95 2g9h s LEU 14 Ca 0.07 -0.30 0.06 0.00 -0.22 0.00 0.00 54.13 53.74 2g9h s LEU 14 Cb -0.08 -0.83 -0.04 0.00 0.50 0.00 0.00 46.19 45.75 2g9h s LEU 14 CO -0.00 -0.04 -0.02 0.20 -1.32 0.00 0.00 176.35 175.17 2g9h s ASN 15 N 1.13 4.85 0.00 3.68 0.01 -1.26 0.60 114.94 123.95 2g9h s ASN 15 Ca -0.06 -0.25 0.08 0.00 -0.71 0.00 0.00 52.86 51.92 2g9h s ASN 15 Cb -0.14 -1.09 0.33 0.00 0.41 0.00 0.00 41.25 40.76 2g9h s ASN 15 CO -0.02 0.16 1.24 -0.81 -1.51 0.00 0.00 177.10 176.16 2g9h n PRO 16 N 0.50 1.27 0.22 -0.60 -0.04 -1.26 -4.87 135.00 130.23 2g9h n PRO 16 Ca -0.11 -0.42 0.07 0.00 -0.04 0.00 0.00 63.50 63.00 2g9h n PRO 16 Cb 0.52 -1.15 0.51 0.00 -0.04 0.00 0.00 33.50 33.34 2g9h n PRO 16 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2g9h h ASP 17 N 0.72 0.00 -5.62 3.54 5.19 -2.01 -3.46 116.42 114.78 2g9h h ASP 17 Ca 0.00 0.00 -0.31 0.00 -0.62 0.00 0.00 57.03 56.10 2g9h h ASP 17 Cb 0.16 0.00 0.17 0.00 0.18 0.00 0.00 39.33 39.85 2g9h h ASP 17 CO 0.00 0.26 -0.79 0.00 -3.12 0.00 0.00 179.24 175.58 2g9h n GLN 18 N -3.81 -5.63 -4.47 3.56 6.02 0.20 -5.00 117.38 108.25 2g9h n GLN 18 Ca -0.01 0.85 -0.20 0.00 -0.01 0.00 0.00 57.00 57.62 2g9h n GLN 18 Cb 0.35 -5.85 -0.15 0.00 1.02 0.00 0.00 30.24 25.61 2g9h n GLN 18 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2g9h s SER 19 N -4.15 1.31 0.09 1.08 1.04 -0.98 -4.97 113.70 107.13 2g9h s SER 19 Ca 0.10 -0.20 -0.00 0.00 0.48 0.00 0.00 55.95 56.33 2g9h s SER 19 Cb -0.01 -0.21 -0.04 0.00 0.10 0.00 0.00 66.02 65.86 2g9h s SER 19 CO 0.73 0.12 -0.02 -0.83 0.98 0.00 0.00 173.24 174.23 2g9h s GLY 20 N -0.14 0.75 0.03 7.32 0.00 -1.26 -0.47 107.32 113.55 2g9h s GLY 20 Ca 0.02 -1.35 -0.07 0.00 0.00 0.00 0.00 44.72 43.32 2g9h s GLY 20 CO -0.00 -1.39 0.14 -0.54 0.00 0.00 0.00 173.10 171.31 2g9h s GLU 21 N -3.93 0.59 -0.07 2.90 2.02 -0.98 -4.93 118.70 114.30 2g9h s GLU 21 Ca 0.14 -0.63 -0.02 0.00 0.02 0.00 0.00 54.97 54.48 2g9h s GLU 21 Cb 0.07 0.24 0.03 0.00 0.10 0.00 0.00 34.13 34.57 2g9h s GLU 21 CO -0.04 -0.15 0.05 0.12 0.02 0.00 0.00 175.26 175.25 2g9h s PHE 22 N -2.29 0.28 0.10 1.61 2.19 -1.26 -2.23 117.98 116.38 2g9h s PHE 22 Ca -0.07 0.03 -0.04 0.00 0.33 0.00 0.00 56.93 57.17 2g9h s PHE 22 Cb -0.03 -0.62 -0.03 0.00 -1.31 0.00 0.00 43.02 41.04 2g9h s PHE 22 CO -0.03 -0.29 0.10 0.00 1.83 0.00 0.00 175.22 176.84 2g9h s MET 23 N 2.10 0.86 -0.05 10.12 0.23 -0.50 -1.67 119.30 130.39 2g9h s MET 23 Ca 0.04 -1.23 0.05 0.00 -1.03 0.00 0.00 55.69 53.52 2g9h s MET 23 Cb -0.13 0.28 -0.02 0.00 -1.53 0.00 0.00 34.83 33.43 2g9h s MET 23 CO -0.05 -0.25 -0.18 -0.06 -2.03 0.00 0.00 175.02 172.45 2g9h s PHE 24 N -3.96 2.59 -0.07 3.16 0.40 -0.31 -1.03 117.98 118.76 2g9h s PHE 24 Ca 0.14 -0.33 0.05 0.00 -0.60 0.00 0.00 56.93 56.19 2g9h s PHE 24 Cb 0.06 -1.61 -0.00 0.00 0.51 0.00 0.00 43.02 41.98 2g9h s PHE 24 CO -0.04 0.05 -0.21 0.34 0.70 0.00 0.00 175.22 176.06 2g9h s ASP 25 N -0.55 2.64 -0.22 1.36 -1.08 0.02 -0.17 116.67 118.68 2g9h s ASP 25 Ca 0.08 -0.45 0.02 0.00 -0.52 0.00 0.00 52.55 51.67 2g9h s ASP 25 Cb -0.11 -0.92 0.04 0.00 -1.46 0.00 0.00 42.92 40.47 2g9h s ASP 25 CO 0.01 0.17 -0.15 0.12 0.52 0.00 0.00 175.17 175.84 2g9h s PHE 26 N 0.14 2.94 -1.28 -5.34 5.36 0.14 -1.53 117.98 118.42 2g9h s PHE 26 Ca -0.09 -1.94 -0.11 0.00 -0.96 0.00 0.00 56.93 53.83 2g9h s PHE 26 Cb -0.14 -1.88 0.09 0.00 -0.34 0.00 0.00 43.02 40.74 2g9h s PHE 26 CO 0.05 -0.83 0.49 -0.25 -1.46 0.00 0.00 175.22 173.21 2g9h n ASP 27 N 4.55 -3.27 0.00 6.13 8.00 -0.73 -1.28 116.55 129.96 2g9h n ASP 27 Ca -0.17 -0.46 0.00 0.00 0.71 0.00 0.00 54.79 54.87 2g9h n ASP 27 Cb 0.46 -2.72 0.00 0.00 -0.02 0.00 0.00 41.12 38.84 2g9h n ASP 27 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2g9h n GLY 28 N -1.12 0.21 3.57 0.44 0.00 -1.26 -5.06 105.19 101.97 2g9h n GLY 28 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 2g9h n GLY 28 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2g9h s ASP 29 N -2.08 4.56 -0.02 1.61 1.01 -0.40 -5.03 116.67 116.32 2g9h s ASP 29 Ca 0.00 -0.09 -0.30 0.00 0.71 0.00 0.00 52.55 52.87 2g9h s ASP 29 Cb 0.00 -1.09 -0.05 0.00 1.01 0.00 0.00 42.92 42.79 2g9h s ASP 29 CO 0.00 0.33 1.35 -0.70 0.21 0.00 0.00 175.17 176.36 2g9h s GLU 30 N -1.02 4.30 -0.10 8.23 2.12 -1.26 0.26 118.70 131.22 2g9h s GLU 30 Ca 0.14 1.89 -0.16 0.00 0.36 0.00 0.00 54.97 57.20 2g9h s GLU 30 Cb -0.11 -3.58 -0.14 0.00 0.26 0.00 0.00 34.13 30.56 2g9h s GLU 30 CO 0.03 -0.55 0.51 0.82 -0.54 0.00 0.00 175.26 175.54 2g9h h ILE 31 N 4.97 0.88 -2.97 -3.70 2.04 -0.90 -3.40 117.51 114.42 2g9h h ILE 31 Ca -0.37 -1.52 -0.00 0.00 1.00 0.00 0.00 64.86 63.97 2g9h h ILE 31 Cb 1.17 1.61 -0.11 0.00 -0.74 0.00 0.00 36.82 38.75 2g9h h ILE 31 CO 0.90 0.28 0.22 0.72 0.00 0.00 0.00 178.15 180.27 2g9h s PHE 32 N -2.29 -0.49 0.21 1.37 -0.12 -1.20 -0.80 117.98 114.66 2g9h s PHE 32 Ca -0.10 0.25 0.03 0.00 -0.05 0.00 0.00 56.93 57.05 2g9h s PHE 32 Cb -0.01 0.58 -0.05 0.00 -0.63 0.00 0.00 43.02 42.91 2g9h s PHE 32 CO 0.38 -0.89 -0.00 -3.38 -0.05 0.00 0.00 175.22 171.27 2g9h s HIS 33 N -3.75 1.42 -0.19 3.49 -3.43 -0.74 -1.16 115.29 110.92 2g9h s HIS 33 Ca 0.02 -0.96 -0.08 0.00 -0.80 0.00 0.00 55.06 53.25 2g9h s HIS 33 Cb -0.02 -0.81 -0.04 0.00 -1.43 0.00 0.00 32.58 30.28 2g9h s HIS 33 CO -0.10 -0.11 0.09 0.08 -2.00 0.00 0.00 174.74 172.70 2g9h s VAL 34 N -3.51 4.95 -0.44 -5.38 1.01 -0.67 -1.10 120.40 115.25 2g9h s VAL 34 Ca 0.26 0.03 -0.28 0.00 0.00 0.00 0.00 61.98 61.99 2g9h s VAL 34 Cb 0.06 -3.25 -0.00 0.00 0.00 0.00 0.00 36.38 33.18 2g9h s VAL 34 CO 0.07 0.44 1.62 -0.62 0.00 0.00 0.00 175.10 176.60 2g9h s ASP 35 N 0.48 5.98 0.26 3.32 -1.08 0.43 -4.59 116.67 121.47 2g9h s ASP 35 Ca 0.05 0.81 0.03 0.00 -0.52 0.00 0.00 52.55 52.92 2g9h s ASP 35 Cb -0.12 -2.53 0.35 0.00 -1.46 0.00 0.00 42.92 39.15 2g9h s ASP 35 CO 0.00 -1.73 1.65 0.24 0.52 0.00 0.00 175.17 175.86 2g9h h MET 36 N 12.19 0.37 0.08 4.34 2.86 -1.92 -0.15 114.93 132.71 2g9h h MET 36 Ca -0.29 -0.18 -0.00 0.00 -2.06 0.00 0.00 59.70 57.16 2g9h h MET 36 Cb 1.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.79 2g9h h MET 36 CO 1.10 0.72 -0.04 0.00 1.06 0.00 0.00 176.91 179.76 2g9h h ALA 37 N 1.26 -0.11 -0.00 6.32 0.00 -1.97 -3.28 119.26 121.47 2g9h h ALA 37 Ca 0.03 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2g9h h ALA 37 Cb 0.86 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2g9h h ALA 37 CO 0.07 -0.39 -0.17 1.63 0.00 0.00 0.00 179.25 180.39 2g9h n LYS 38 N -4.98 0.38 -3.64 0.00 5.02 -1.22 -4.95 118.16 108.78 2g9h n LYS 38 Ca -0.08 -0.14 -0.21 0.00 -2.02 0.00 0.00 58.31 55.86 2g9h n LYS 38 Cb 0.20 -1.50 0.05 0.00 -0.02 0.00 0.00 35.03 33.77 2g9h n LYS 38 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2g9h n LYS 39 N -1.19 -5.76 -3.93 1.97 4.76 -0.10 -5.01 118.16 108.90 2g9h n LYS 39 Ca 0.11 0.70 -0.10 0.00 -2.87 0.00 0.00 58.31 56.15 2g9h n LYS 39 Cb 0.31 -5.48 -0.10 0.00 -1.84 0.00 0.00 35.03 27.92 2g9h n LYS 39 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 2g9h s GLU 40 N -5.90 0.53 -0.02 1.97 -1.05 -0.97 -4.74 118.70 108.52 2g9h s GLU 40 Ca 0.13 -0.68 -0.30 0.00 -0.15 0.00 0.00 54.97 53.98 2g9h s GLU 40 Cb -0.06 0.21 -0.04 0.00 -0.44 0.00 0.00 34.13 33.80 2g9h s GLU 40 CO 0.78 -0.13 1.13 0.99 0.95 0.00 0.00 175.26 178.98 2g9h s THR 41 N -2.25 4.40 -0.24 1.83 2.01 -1.26 -0.43 115.64 119.70 2g9h s THR 41 Ca -0.08 1.72 0.03 0.00 0.31 0.00 0.00 61.69 63.66 2g9h s THR 41 Cb -0.03 -4.10 0.05 0.00 0.01 0.00 0.00 72.50 68.43 2g9h s THR 41 CO -0.03 0.06 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.15 2g9h s VAL 42 N 1.61 2.15 0.29 3.82 1.01 -0.26 -4.95 120.40 124.07 2g9h s VAL 42 Ca 0.55 -1.48 -0.28 0.00 0.00 0.00 0.00 61.98 60.77 2g9h s VAL 42 Cb -0.24 -2.19 -0.09 0.00 0.00 0.00 0.00 36.38 33.86 2g9h s VAL 42 CO 0.25 0.10 0.96 0.26 0.00 0.00 0.00 175.10 176.67 2g9h s TRP 43 N 1.14 3.79 0.11 5.22 0.52 -1.26 -1.79 118.94 126.67 2g9h s TRP 43 Ca -0.06 1.83 -0.19 0.00 0.02 0.00 0.00 56.10 57.70 2g9h s TRP 43 Cb -0.18 -2.99 -0.06 0.00 -1.15 0.00 0.00 33.47 29.08 2g9h s TRP 43 CO -0.07 0.21 1.68 -0.09 0.02 0.00 0.00 176.95 178.70 2g9h h ARG 44 N 3.63 0.35 -5.29 4.98 9.65 -1.19 -3.39 114.38 123.13 2g9h h ARG 44 Ca -0.46 -0.05 -0.65 0.00 -1.10 0.00 0.00 59.98 57.71 2g9h h ARG 44 Cb 1.20 -0.06 -0.27 0.00 -1.39 0.00 0.00 29.97 29.45 2g9h h ARG 44 CO 0.66 0.35 -0.75 -0.51 2.80 0.00 0.00 179.97 182.52 2g9h s LEU 45 N -9.92 2.77 0.41 3.80 1.43 -1.26 -5.03 118.68 110.88 2g9h s LEU 45 Ca -0.13 -0.32 0.18 0.00 -1.03 0.00 0.00 54.13 52.82 2g9h s LEU 45 Cb 0.08 -1.64 1.08 0.00 0.03 0.00 0.00 46.19 45.74 2g9h s LEU 45 CO 0.71 0.15 1.83 -0.33 0.23 0.00 0.00 176.35 178.94 2g9h h GLU 46 N 6.84 0.41 0.00 1.70 5.08 -1.99 -0.29 114.58 126.33 2g9h h GLU 46 Ca -0.28 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.05 2g9h h GLU 46 Cb 1.21 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.36 2g9h h GLU 46 CO 0.57 0.27 -0.05 1.05 -1.00 0.00 0.00 179.01 179.84 2g9h h GLU 47 N 0.42 0.00 -0.91 2.33 9.09 -1.96 -1.84 114.58 121.72 2g9h h GLU 47 Ca 0.51 0.00 0.12 0.00 0.05 0.00 0.00 59.36 60.03 2g9h h GLU 47 Cb 1.25 0.00 -0.08 0.00 -1.65 0.00 0.00 28.75 28.27 2g9h h GLU 47 CO -0.21 0.05 0.54 0.74 0.05 0.00 0.00 179.01 180.18 2g9h h PHE 48 N 0.00 0.98 0.00 2.06 -1.00 -1.45 -2.19 116.94 115.34 2g9h h PHE 48 Ca -0.00 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.81 2g9h h PHE 48 Cb 0.16 -0.30 0.00 0.00 3.61 0.00 0.00 35.95 39.42 2g9h h PHE 48 CO 0.00 0.37 0.00 0.41 -1.61 0.00 0.00 178.31 177.48 2g9h n GLY 49 N -1.33 -1.18 0.13 -1.45 0.00 -0.69 -2.06 105.19 98.61 2g9h n GLY 49 Ca 0.17 0.11 0.13 0.00 0.00 0.00 0.00 46.02 46.43 2g9h n GLY 49 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2g9h h ARG 50 N 0.00 0.00 0.00 1.61 3.08 -1.49 -3.37 114.38 114.21 2g9h h ARG 50 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2g9h h ARG 50 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.33 2g9h h ARG 50 CO 0.00 0.00 -0.12 1.19 -1.07 0.00 0.00 179.97 179.97 2g9h n PHE 51 N -2.42 0.00 -3.83 3.04 3.72 -0.87 -5.06 117.46 112.03 2g9h n PHE 51 Ca 0.05 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.36 2g9h n PHE 51 Cb 0.45 -0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.92 2g9h n PHE 51 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2g9h s ALA 52 N -1.16 -0.34 0.07 4.37 0.00 -1.06 -5.15 121.76 118.49 2g9h s ALA 52 Ca 0.00 -0.55 0.01 0.00 0.00 0.00 0.00 51.96 51.43 2g9h s ALA 52 Cb 0.01 0.60 -0.04 0.00 0.00 0.00 0.00 23.12 23.69 2g9h s ALA 52 CO 0.04 -0.57 -0.06 -1.54 0.00 0.00 0.00 175.76 173.64 2g9h s SER 53 N -2.87 0.86 -0.02 0.00 1.04 -1.26 -4.55 113.70 106.90 2g9h s SER 53 Ca 0.07 -0.85 0.00 0.00 0.48 0.00 0.00 55.95 55.65 2g9h s SER 53 Cb 0.04 0.10 0.03 0.00 0.10 0.00 0.00 66.02 66.29 2g9h s SER 53 CO -0.09 -0.41 0.02 0.12 0.98 0.00 0.00 173.24 173.85 2g9h s PHE 54 N -2.94 0.10 -0.59 5.02 5.36 -1.26 -5.11 117.98 118.56 2g9h s PHE 54 Ca 0.03 0.08 -0.27 0.00 -0.96 0.00 0.00 56.93 55.81 2g9h s PHE 54 Cb 0.01 -0.25 0.00 0.00 -0.34 0.00 0.00 43.02 42.44 2g9h s PHE 54 CO -0.04 -0.09 1.56 -2.00 -1.46 0.00 0.00 175.22 173.19 2g9h s GLU 55 N 0.92 3.07 0.35 10.12 2.56 -1.26 -4.67 118.70 129.79 2g9h s GLU 55 Ca -0.08 0.47 0.09 0.00 0.00 0.00 0.00 54.97 55.45 2g9h s GLU 55 Cb -0.11 -4.22 0.83 0.00 2.00 0.00 0.00 34.13 32.63 2g9h s GLU 55 CO -0.02 -2.21 1.85 0.00 -0.56 0.00 0.00 175.26 174.31 2g9h h ALA 56 N 12.26 1.85 -0.41 6.30 0.00 -1.94 -2.38 119.26 134.94 2g9h h ALA 56 Ca -0.27 0.03 0.11 0.00 0.00 0.00 0.00 54.91 54.78 2g9h h ALA 56 Cb 1.11 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 2g9h h ALA 56 CO 1.20 -0.12 0.29 1.96 0.00 0.00 0.00 179.25 182.58 2g9h h GLN 57 N 0.68 0.03 -0.21 0.00 4.20 -1.91 -0.85 115.11 117.05 2g9h h GLN 57 Ca 0.48 -0.00 -0.03 0.00 0.06 0.00 0.00 58.65 59.15 2g9h h GLN 57 Cb 0.81 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.57 2g9h h GLN 57 CO -0.23 0.02 -0.01 0.78 -0.67 0.00 0.00 178.83 178.72 2g9h h GLY 58 N 0.03 0.33 0.94 3.46 0.00 -1.85 -0.95 103.07 105.03 2g9h h GLY 58 Ca 0.19 -0.17 -0.08 0.00 0.00 0.00 0.00 47.33 47.28 2g9h h GLY 58 CO -0.01 0.16 -0.08 0.00 0.00 0.00 0.00 176.54 176.62 2g9h h ALA 59 N 1.70 0.49 -0.72 3.60 0.00 -1.31 -2.24 119.26 120.77 2g9h h ALA 59 Ca 0.07 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.62 2g9h h ALA 59 Cb 0.22 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 2g9h h ALA 59 CO 0.01 0.33 0.19 -0.07 0.00 0.00 0.00 179.25 179.70 2g9h h LEU 60 N 0.47 1.08 -0.21 0.00 -0.00 -1.34 -0.05 115.31 115.26 2g9h h LEU 60 Ca 0.09 -0.22 -0.02 0.00 -0.00 0.00 0.00 57.88 57.73 2g9h h LEU 60 Cb 0.58 -0.28 -0.01 0.00 -0.00 0.00 0.00 40.66 40.95 2g9h h LEU 60 CO 0.03 1.02 0.05 0.00 -0.00 0.00 0.00 178.44 179.55 2g9h h ALA 61 N 1.11 0.28 -0.95 1.53 0.00 -1.22 -2.19 119.26 117.82 2g9h h ALA 61 Ca 0.23 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 55.02 2g9h h ALA 61 Cb 0.35 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.01 2g9h h ALA 61 CO -0.00 -0.08 0.62 -0.91 0.00 0.00 0.00 179.25 178.88 2g9h h ASN 62 N 0.16 1.03 -0.39 0.00 4.21 -1.22 -2.79 115.58 116.59 2g9h h ASN 62 Ca 0.07 -0.01 -0.06 0.00 1.21 0.00 0.00 56.30 57.51 2g9h h ASN 62 Cb 0.27 -0.24 -0.02 0.00 -1.12 0.00 0.00 38.32 37.21 2g9h h ASN 62 CO 0.00 0.71 0.05 0.40 -1.29 0.00 0.00 177.43 177.30 2g9h h ILE 63 N 1.20 1.22 -0.49 2.81 1.08 -0.84 -1.74 117.51 120.76 2g9h h ILE 63 Ca 0.37 -0.87 0.01 0.00 -0.39 0.00 0.00 64.86 63.98 2g9h h ILE 63 Cb -0.01 0.81 -0.02 0.00 -3.07 0.00 0.00 36.82 34.52 2g9h h ILE 63 CO -0.12 0.31 0.32 0.00 -0.69 0.00 0.00 178.15 177.98 2g9h h ALA 64 N 1.36 0.63 -0.58 1.87 0.00 -1.13 0.54 119.26 121.95 2g9h h ALA 64 Ca 0.15 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 2g9h h ALA 64 Cb 0.36 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 2g9h h ALA 64 CO 0.01 0.07 0.19 0.28 0.00 0.00 0.00 179.25 179.79 2g9h h VAL 65 N 0.66 1.22 -0.36 0.00 2.07 -1.35 -2.42 116.25 116.07 2g9h h VAL 65 Ca 0.18 -0.74 -0.08 0.00 0.82 0.00 0.00 66.70 66.88 2g9h h VAL 65 Cb -0.07 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 2g9h h VAL 65 CO -0.04 0.29 -0.09 0.44 0.02 0.00 0.00 177.57 178.18 2g9h h ASP 66 N 0.84 0.69 0.18 0.57 3.32 -0.67 -1.09 116.42 120.27 2g9h h ASP 66 Ca 0.19 -0.36 -0.01 0.00 0.02 0.00 0.00 57.03 56.87 2g9h h ASP 66 Cb 0.23 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.59 2g9h h ASP 66 CO -0.01 0.90 -0.09 0.50 -1.72 0.00 0.00 179.24 178.81 2g9h h LYS 67 N 0.48 -0.25 -0.80 3.56 3.64 -0.78 -0.56 116.57 121.86 2g9h h LYS 67 Ca 0.09 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 2g9h h LYS 67 Cb 0.60 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.43 2g9h h LYS 67 CO 0.04 -0.17 0.52 0.00 -2.27 0.00 0.00 179.45 177.57 2g9h h ALA 68 N 0.56 1.40 -0.19 5.00 0.00 -1.42 -2.84 119.26 121.77 2g9h h ALA 68 Ca -0.02 -0.07 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 2g9h h ALA 68 Cb 0.20 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2g9h h ALA 68 CO 0.04 0.54 -0.47 -0.91 0.00 0.00 0.00 179.25 178.45 2g9h h ASN 69 N 1.09 0.54 -0.60 0.00 2.35 -0.99 -2.42 115.58 115.55 2g9h h ASN 69 Ca 0.29 -0.26 0.04 0.00 -0.55 0.00 0.00 56.30 55.82 2g9h h ASN 69 Cb -0.11 -0.15 -0.04 0.00 0.05 0.00 0.00 38.32 38.07 2g9h h ASN 69 CO -0.06 0.93 0.35 0.25 -1.65 0.00 0.00 177.43 177.25 2g9h h LEU 70 N 0.40 0.56 -0.75 1.61 5.85 -0.89 -0.73 115.31 121.36 2g9h h LEU 70 Ca 0.02 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 2g9h h LEU 70 Cb 0.98 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.87 2g9h h LEU 70 CO 0.09 0.38 0.40 -0.33 -0.34 0.00 0.00 178.44 178.64 2g9h h GLU 71 N 0.69 1.06 -0.21 1.25 5.08 -1.39 0.14 114.58 121.19 2g9h h GLU 71 Ca 0.25 -0.13 0.04 0.00 -1.00 0.00 0.00 59.36 58.51 2g9h h GLU 71 Cb 0.07 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.08 2g9h h GLU 71 CO -0.12 0.80 -0.00 0.82 -1.00 0.00 0.00 179.01 179.50 2g9h h ILE 72 N 1.04 0.85 -0.22 3.13 2.04 -0.99 -2.91 117.51 120.45 2g9h h ILE 72 Ca 0.26 -0.02 -0.13 0.00 1.00 0.00 0.00 64.86 65.97 2g9h h ILE 72 Cb 0.06 0.78 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 2g9h h ILE 72 CO -0.04 0.01 -0.41 0.24 0.00 0.00 0.00 178.15 177.95 2g9h h MET 73 N 0.06 0.52 -0.89 2.37 2.86 -0.80 -1.08 114.93 117.98 2g9h h MET 73 Ca 0.10 -0.26 0.08 0.00 -2.06 0.00 0.00 59.70 57.56 2g9h h MET 73 Cb 0.13 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 31.73 2g9h h MET 73 CO -0.17 0.84 0.57 1.15 1.06 0.00 0.00 176.91 180.36 2g9h h THR 74 N 0.43 1.01 0.22 2.22 2.02 -0.66 -1.42 112.91 116.72 2g9h h THR 74 Ca 0.04 -0.32 -0.32 0.00 0.77 0.00 0.00 66.41 66.58 2g9h h THR 74 Cb 0.90 -0.01 0.03 0.00 -1.74 0.00 0.00 68.15 67.33 2g9h h THR 74 CO 0.08 0.17 -1.47 0.11 0.37 0.00 0.00 175.52 174.78 2g9h h LYS 75 N 0.93 0.46 -0.36 6.66 1.57 -1.30 0.22 116.57 124.75 2g9h h LYS 75 Ca 0.40 -0.78 -0.03 0.00 -1.87 0.00 0.00 60.65 58.37 2g9h h LYS 75 Cb 0.32 0.29 -0.02 0.00 0.08 0.00 0.00 32.23 32.90 2g9h h LYS 75 CO -0.16 1.37 0.10 -0.09 -0.57 0.00 0.00 179.45 180.10 2g9h h ARG 76 N 0.04 0.52 -0.07 3.15 2.43 -1.00 -1.32 114.38 118.12 2g9h h ARG 76 Ca -0.27 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 58.82 2g9h h ARG 76 Cb 2.06 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 31.51 2g9h h ARG 76 CO 0.22 0.47 0.00 -1.13 -1.51 0.00 0.00 179.97 178.02 2g9h n SER 77 N -4.35 0.62 -3.55 -3.80 3.41 -0.55 -4.90 113.62 100.49 2g9h n SER 77 Ca 0.02 -1.59 -0.21 0.00 -0.26 0.00 0.00 58.87 56.83 2g9h n SER 77 Cb 0.17 -0.04 0.08 0.00 -0.26 0.00 0.00 64.21 64.16 2g9h n SER 77 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2g9h n ASN 78 N -0.35 -3.64 -3.29 4.04 3.02 -0.50 -3.27 115.26 111.27 2g9h n ASN 78 Ca 0.13 -0.62 -0.23 0.00 -0.03 0.00 0.00 54.58 53.83 2g9h n ASN 78 Cb 0.15 -4.91 0.05 0.00 -0.61 0.00 0.00 39.78 34.47 2g9h n ASN 78 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2g9h n TYR 79 N -4.49 -2.38 -2.29 3.10 4.02 0.78 -4.97 117.16 110.93 2g9h n TYR 79 Ca -0.17 0.75 -0.43 0.00 -0.01 0.00 0.00 57.90 58.04 2g9h n TYR 79 Cb 0.62 -4.72 -0.02 0.00 -0.02 0.00 0.00 39.34 35.20 2g9h n TYR 79 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 2g9h s THR 80 N -3.24 4.04 0.60 -0.72 2.01 -1.20 -5.03 115.64 112.09 2g9h s THR 80 Ca 0.44 1.28 -0.00 0.00 0.31 0.00 0.00 61.69 63.71 2g9h s THR 80 Cb -0.19 -3.82 0.05 0.00 0.01 0.00 0.00 72.50 68.54 2g9h s THR 80 CO 0.54 -0.10 0.84 -2.16 -0.69 0.00 0.00 174.62 173.06 2g9h s PRO 81 N 3.50 2.37 0.41 4.92 0.04 -1.26 -4.98 135.00 140.01 2g9h s PRO 81 Ca 0.61 -0.73 -0.23 0.00 0.04 0.00 0.00 61.00 60.69 2g9h s PRO 81 Cb -0.26 -2.41 -0.09 0.00 0.04 0.00 0.00 34.50 31.78 2g9h s PRO 81 CO 0.20 -0.90 1.03 -1.50 0.04 0.00 0.00 177.00 175.87 2g9h s ILE 82 N -2.90 3.83 -0.31 0.56 2.07 -1.26 -5.03 121.20 118.16 2g9h s ILE 82 Ca 0.59 1.33 -0.23 0.00 -1.41 0.00 0.00 60.65 60.93 2g9h s ILE 82 Cb -0.10 -3.65 -0.00 0.00 0.13 0.00 0.00 42.46 38.84 2g9h s ILE 82 CO 0.40 -0.06 0.75 -0.89 -1.91 0.00 0.00 174.94 173.23 2g9h s THR 83 N -1.76 4.82 0.12 4.00 2.01 -1.26 -5.05 115.64 118.52 2g9h s THR 83 Ca 0.59 1.06 -0.35 0.00 0.31 0.00 0.00 61.69 63.30 2g9h s THR 83 Cb -0.19 -4.12 -0.15 0.00 0.01 0.00 0.00 72.50 68.04 2g9h s THR 83 CO 0.24 -0.25 1.45 0.59 -0.69 0.00 0.00 174.62 175.97 2g9h n ASN 84 N 6.15 2.31 -4.11 3.53 3.02 -1.26 -4.76 115.26 120.14 2g9h n ASN 84 Ca 0.02 1.10 -0.33 0.00 -0.03 0.00 0.00 54.58 55.35 2g9h n ASN 84 Cb 0.48 -1.30 -0.16 0.00 -0.61 0.00 0.00 39.78 38.20 2g9h n ASN 84 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2g9h s VAL 85 N 0.70 2.03 0.52 2.41 1.01 0.43 -4.85 120.40 122.65 2g9h s VAL 85 Ca 0.82 -0.99 -0.20 0.00 0.00 0.00 0.00 61.98 61.61 2g9h s VAL 85 Cb -0.83 -1.87 -0.06 0.00 0.00 0.00 0.00 36.38 33.61 2g9h s VAL 85 CO 0.43 0.48 1.14 -2.16 0.00 0.00 0.00 175.10 174.98 2g9h s PRO 86 N 1.29 3.47 0.42 2.72 0.04 -1.26 -2.15 135.00 139.52 2g9h s PRO 86 Ca 0.04 1.65 -0.22 0.00 0.04 0.00 0.00 61.00 62.50 2g9h s PRO 86 Cb -0.14 -2.11 -0.09 0.00 0.04 0.00 0.00 34.50 32.20 2g9h s PRO 86 CO -0.12 -0.76 1.01 -1.25 0.04 0.00 0.00 177.00 175.91 2g9h s PRO 87 N -3.13 4.14 -0.10 0.56 0.04 -1.26 -4.32 135.00 130.92 2g9h s PRO 87 Ca 0.70 1.35 -0.19 0.00 0.04 0.00 0.00 61.00 62.90 2g9h s PRO 87 Cb -0.25 -2.36 -0.04 0.00 0.04 0.00 0.00 34.50 31.89 2g9h s PRO 87 CO 0.29 -0.14 0.51 -2.00 0.04 0.00 0.00 177.00 175.70 2g9h s GLU 88 N -2.82 4.34 -0.04 4.56 2.12 -0.17 -4.91 118.70 121.80 2g9h s GLU 88 Ca 0.60 0.53 0.05 0.00 0.36 0.00 0.00 54.97 56.51 2g9h s GLU 88 Cb -0.17 -3.43 -0.03 0.00 0.26 0.00 0.00 34.13 30.77 2g9h s GLU 88 CO 0.21 0.17 -0.16 0.08 -0.54 0.00 0.00 175.26 175.02 2g9h s VAL 89 N 0.56 2.88 -0.05 3.70 1.01 -1.26 -1.33 120.40 125.92 2g9h s VAL 89 Ca 0.28 -0.81 -0.00 0.00 0.00 0.00 0.00 61.98 61.45 2g9h s VAL 89 Cb -0.16 -2.12 0.03 0.00 0.00 0.00 0.00 36.38 34.13 2g9h s VAL 89 CO 0.12 0.58 -0.01 -0.89 0.00 0.00 0.00 175.10 174.89 2g9h s THR 90 N -0.72 0.34 -0.17 3.92 2.01 -0.39 -5.00 115.64 115.63 2g9h s THR 90 Ca 0.11 0.04 -0.06 0.00 0.31 0.00 0.00 61.69 62.10 2g9h s THR 90 Cb -0.10 -0.44 -0.04 0.00 0.01 0.00 0.00 72.50 71.93 2g9h s THR 90 CO 0.01 0.21 0.03 -0.69 -0.69 0.00 0.00 174.62 173.48 2g9h s VAL 91 N 1.31 4.52 0.29 3.82 1.01 -1.26 -0.45 120.40 129.64 2g9h s VAL 91 Ca -0.05 -0.14 -0.08 0.00 0.00 0.00 0.00 61.98 61.72 2g9h s VAL 91 Cb -0.13 -3.01 -0.00 0.00 0.00 0.00 0.00 36.38 33.23 2g9h s VAL 91 CO -0.02 0.48 0.45 -1.48 0.00 0.00 0.00 175.10 174.53 2g9h s LEU 92 N 0.25 0.67 0.39 3.92 2.34 -0.58 -4.99 118.68 120.68 2g9h s LEU 92 Ca 0.02 -1.21 0.08 0.00 0.06 0.00 0.00 54.13 53.07 2g9h s LEU 92 Cb -0.13 1.54 -0.03 0.00 -0.56 0.00 0.00 46.19 47.02 2g9h s LEU 92 CO 0.01 -1.20 0.29 0.42 -1.06 0.00 0.00 176.35 174.81 2g9h s THR 93 N -3.57 2.74 -1.38 5.48 -4.23 -1.26 0.17 115.64 113.59 2g9h s THR 93 Ca 0.27 -1.48 0.27 0.00 -1.18 0.00 0.00 61.69 59.57 2g9h s THR 93 Cb 0.00 -3.02 0.23 0.00 1.34 0.00 0.00 72.50 71.05 2g9h s THR 93 CO 0.14 -0.05 1.64 -0.46 -0.54 0.00 0.00 174.62 175.35 2g9h n ASN 94 N -1.40 0.57 -3.56 3.99 0.23 -1.05 -4.86 115.26 109.18 2g9h n ASN 94 Ca 0.01 -0.42 -0.07 0.00 -0.53 0.00 0.00 54.58 53.57 2g9h n ASN 94 Cb 0.62 0.04 -0.02 0.00 -2.08 0.00 0.00 39.78 38.34 2g9h n ASN 94 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 2g9h s SER 95 N -2.72 -0.33 0.68 0.53 1.04 -1.26 -5.10 113.70 106.54 2g9h s SER 95 Ca 0.20 -0.09 -0.17 0.00 0.48 0.00 0.00 55.95 56.38 2g9h s SER 95 Cb 0.19 0.41 -0.02 0.00 0.10 0.00 0.00 66.02 66.69 2g9h s SER 95 CO 0.57 -0.68 0.85 -2.65 0.98 0.00 0.00 173.24 172.30 2g9h n PRO 96 N -0.30 0.57 -3.72 4.02 -0.02 -1.26 -4.95 135.00 129.35 2g9h n PRO 96 Ca -0.08 0.24 -0.37 0.00 -2.02 0.00 0.00 63.50 61.27 2g9h n PRO 96 Cb 0.62 -2.09 -0.11 0.00 -0.02 0.00 0.00 33.50 31.90 2g9h n PRO 96 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2g9h s VAL 97 N -1.74 5.02 -0.05 -1.45 1.01 -1.26 -5.06 120.40 116.87 2g9h s VAL 97 Ca 0.72 0.06 0.06 0.00 0.00 0.00 0.00 61.98 62.83 2g9h s VAL 97 Cb -0.37 -3.35 -0.01 0.00 0.00 0.00 0.00 36.38 32.65 2g9h s VAL 97 CO 0.51 0.33 -0.25 -1.61 0.00 0.00 0.00 175.10 174.09 2g9h s GLU 98 N 1.28 2.41 -0.38 2.72 0.41 -1.26 -5.07 118.70 118.80 2g9h s GLU 98 Ca 0.06 -0.89 -0.42 0.00 -0.41 0.00 0.00 54.97 53.31 2g9h s GLU 98 Cb -0.14 -2.09 -0.17 0.00 -1.78 0.00 0.00 34.13 29.94 2g9h s GLU 98 CO 0.06 0.41 1.78 -0.11 -0.49 0.00 0.00 175.26 176.91 2g9h n LEU 99 N 2.85 1.84 -2.95 1.80 7.94 -1.26 -1.54 117.00 125.67 2g9h n LEU 99 Ca -0.17 1.01 -0.20 0.00 -1.11 0.00 0.00 56.01 55.54 2g9h n LEU 99 Cb 0.52 -1.04 0.01 0.00 0.53 0.00 0.00 43.42 43.43 2g9h n LEU 99 CO 0.25 -0.61 -0.07 -2.11 -1.11 0.00 0.00 177.39 173.73 2g9h n ARG 100 N 5.43 -3.51 -3.86 1.96 1.85 -0.61 -4.98 116.66 112.95 2g9h n ARG 100 Ca 0.32 0.71 -0.36 0.00 -1.00 0.00 0.00 57.85 57.53 2g9h n ARG 100 Cb 0.06 -5.45 -0.14 0.00 -1.05 0.00 0.00 32.46 25.89 2g9h n ARG 100 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 2g9h s GLU 101 N -5.60 3.24 0.18 2.89 2.02 -0.59 -4.91 118.70 115.94 2g9h s GLU 101 Ca 0.24 -0.73 -0.31 0.00 0.02 0.00 0.00 54.97 54.19 2g9h s GLU 101 Cb -0.12 -3.13 -0.16 0.00 0.10 0.00 0.00 34.13 30.82 2g9h s GLU 101 CO 0.30 -0.29 0.90 -2.30 0.02 0.00 0.00 175.26 173.89 2g9h n PRO 102 N 4.81 0.66 -3.05 0.39 -0.02 -1.26 -4.41 135.00 132.10 2g9h n PRO 102 Ca -0.17 0.23 -0.09 0.00 -2.02 0.00 0.00 63.50 61.45 2g9h n PRO 102 Cb 0.49 -1.53 -0.03 0.00 -0.02 0.00 0.00 33.50 32.41 2g9h n PRO 102 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2g9h n ASN 103 N 1.77 -0.49 -3.74 2.55 2.85 -0.28 -5.00 115.26 112.93 2g9h n ASN 103 Ca 0.16 -2.09 -0.16 0.00 -0.11 0.00 0.00 54.58 52.37 2g9h n ASN 103 Cb 0.24 1.03 -0.16 0.00 1.24 0.00 0.00 39.78 42.13 2g9h n ASN 103 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 2g9h s VAL 104 N -2.68 -0.08 -0.09 3.44 1.01 -1.26 -1.14 120.40 119.61 2g9h s VAL 104 Ca 0.19 0.27 -0.23 0.00 0.00 0.00 0.00 61.98 62.21 2g9h s VAL 104 Cb 0.01 -0.12 -0.04 0.00 0.00 0.00 0.00 36.38 36.23 2g9h s VAL 104 CO 0.13 0.11 0.68 -0.76 0.00 0.00 0.00 175.10 175.26 2g9h s LEU 105 N 1.39 4.29 -0.18 3.92 1.43 0.52 -2.54 118.68 127.51 2g9h s LEU 105 Ca -0.05 1.13 -0.04 0.00 -1.03 0.00 0.00 54.13 54.13 2g9h s LEU 105 Cb -0.13 -3.04 -0.03 0.00 0.03 0.00 0.00 46.19 43.03 2g9h s LEU 105 CO -0.03 -0.13 -0.02 -0.63 0.23 0.00 0.00 176.35 175.77 2g9h s ILE 106 N 0.92 3.95 -0.35 -0.59 1.01 0.13 -1.22 121.20 125.04 2g9h s ILE 106 Ca 0.36 -0.33 -0.07 0.00 0.00 0.00 0.00 60.65 60.61 2g9h s ILE 106 Cb -0.17 -2.76 0.04 0.00 0.01 0.00 0.00 42.46 39.58 2g9h s ILE 106 CO 0.17 0.46 0.14 0.00 0.00 0.00 0.00 174.94 175.70 2g9h s PHE 108 N 1.42 3.20 -0.15 0.00 5.36 0.40 -1.05 117.98 127.16 2g9h s PHE 108 Ca -0.01 0.02 -0.02 0.00 -0.96 0.00 0.00 56.93 55.96 2g9h s PHE 108 Cb -0.20 -2.34 -0.02 0.00 -0.34 0.00 0.00 43.02 40.12 2g9h s PHE 108 CO 0.03 -0.18 -0.07 0.42 -1.46 0.00 0.00 175.22 173.96 2g9h s ILE 109 N 1.66 3.52 0.03 3.12 1.01 0.29 -1.26 121.20 129.56 2g9h s ILE 109 Ca 0.07 -0.49 -0.03 0.00 0.00 0.00 0.00 60.65 60.20 2g9h s ILE 109 Cb -0.16 -2.53 -0.02 0.00 0.01 0.00 0.00 42.46 39.77 2g9h s ILE 109 CO 0.09 0.50 0.03 -0.62 0.00 0.00 0.00 174.94 174.94 2g9h s ASP 110 N 0.46 0.24 -1.20 3.58 2.15 -0.44 -0.44 116.67 121.02 2g9h s ASP 110 Ca -0.06 -0.57 -0.05 0.00 0.43 0.00 0.00 52.55 52.30 2g9h s ASP 110 Cb -0.15 0.18 0.01 0.00 -0.30 0.00 0.00 42.92 42.65 2g9h s ASP 110 CO 0.04 -0.44 1.03 0.29 -0.17 0.00 0.00 175.17 175.92 2g9h n LYS 111 N 1.01 -6.93 -4.24 4.34 5.02 -0.69 -0.99 118.16 115.68 2g9h n LYS 111 Ca -0.20 0.78 -0.16 0.00 -2.02 0.00 0.00 58.31 56.70 2g9h n LYS 111 Cb 0.57 -5.65 -0.11 0.00 -0.02 0.00 0.00 35.03 29.83 2g9h n LYS 111 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 2g9h s PHE 112 N -3.31 1.33 -0.15 2.13 -0.71 -1.21 -4.41 117.98 111.64 2g9h s PHE 112 Ca 0.32 -0.62 -0.29 0.00 -1.04 0.00 0.00 56.93 55.31 2g9h s PHE 112 Cb -0.14 -0.69 0.09 0.00 -1.21 0.00 0.00 43.02 41.07 2g9h s PHE 112 CO 0.68 0.12 0.78 -0.08 -1.34 0.00 0.00 175.22 175.38 2g9h s THR 113 N -2.52 0.00 0.90 -4.49 -1.32 -0.92 -1.00 115.64 106.30 2g9h s THR 113 Ca 0.11 0.00 -0.12 0.00 -1.21 0.00 0.00 61.69 60.47 2g9h s THR 113 Cb -0.03 -1.00 0.13 0.00 -1.51 0.00 0.00 72.50 70.10 2g9h s THR 113 CO 0.02 0.00 1.09 -2.16 -2.21 0.00 0.00 174.62 171.37 2g9h s PRO 114 N -0.60 1.19 -1.32 7.08 0.04 -1.26 -0.43 135.00 139.70 2g9h s PRO 114 Ca -0.05 0.73 -0.16 0.00 0.04 0.00 0.00 61.00 61.56 2g9h s PRO 114 Cb -0.02 -1.81 0.02 0.00 0.04 0.00 0.00 34.50 32.73 2g9h s PRO 114 CO 0.04 -2.26 2.05 -0.35 0.04 0.00 0.00 177.00 176.52 2g9h n PRO 115 N -3.89 2.72 -3.71 0.56 -0.04 -1.26 -4.82 135.00 124.56 2g9h n PRO 115 Ca 0.07 -2.68 -0.13 0.00 -0.04 0.00 0.00 63.50 60.71 2g9h n PRO 115 Cb 0.56 -3.32 -0.14 0.00 -0.04 0.00 0.00 33.50 30.56 2g9h n PRO 115 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2g9h s VAL 116 N 4.09 -0.15 0.02 0.52 1.01 -1.26 -5.07 120.40 119.56 2g9h s VAL 116 Ca 0.51 0.20 -0.12 0.00 0.00 0.00 0.00 61.98 62.57 2g9h s VAL 116 Cb 0.11 -0.37 0.02 0.00 0.00 0.00 0.00 36.38 36.14 2g9h s VAL 116 CO -0.01 0.08 0.26 0.68 0.00 0.00 0.00 175.10 176.12 2g9h s VAL 117 N 1.61 0.08 -0.22 2.92 -7.23 -1.26 -4.69 120.40 111.61 2g9h s VAL 117 Ca -0.06 -0.66 0.02 0.00 -1.81 0.00 0.00 61.98 59.47 2g9h s VAL 117 Cb -0.11 -0.78 0.04 0.00 0.56 0.00 0.00 36.38 36.10 2g9h s VAL 117 CO -0.08 -0.36 -0.14 0.21 -0.31 0.00 0.00 175.10 174.42 2g9h s ASN 118 N -1.76 3.73 -0.14 4.85 2.47 -0.84 -4.98 114.94 118.27 2g9h s ASN 118 Ca -0.09 -1.02 -0.01 0.00 0.42 0.00 0.00 52.86 52.16 2g9h s ASN 118 Cb -0.03 -1.44 -0.02 0.00 -1.45 0.00 0.00 41.25 38.31 2g9h s ASN 118 CO -0.00 -0.11 -0.10 -0.69 -3.72 0.00 0.00 177.10 172.47 2g9h s VAL 119 N 1.24 3.33 -0.06 -5.21 1.01 -1.26 -1.51 120.40 117.94 2g9h s VAL 119 Ca -0.02 -0.56 0.02 0.00 0.00 0.00 0.00 61.98 61.42 2g9h s VAL 119 Cb -0.17 -2.42 0.01 0.00 0.00 0.00 0.00 36.38 33.80 2g9h s VAL 119 CO -0.09 0.51 -0.12 -0.89 0.00 0.00 0.00 175.10 174.52 2g9h s THR 120 N 0.41 1.06 0.00 3.92 2.01 -0.45 -5.00 115.64 117.60 2g9h s THR 120 Ca -0.08 -0.45 -0.18 0.00 0.31 0.00 0.00 61.69 61.28 2g9h s THR 120 Cb -0.15 -0.97 -0.06 0.00 0.01 0.00 0.00 72.50 71.33 2g9h s THR 120 CO 0.04 0.33 0.53 0.26 -0.69 0.00 0.00 174.62 175.09 2g9h s TRP 121 N 0.57 3.70 -0.02 4.92 0.52 -1.26 -0.43 118.94 126.95 2g9h s TRP 121 Ca -0.12 1.13 0.05 0.00 0.02 0.00 0.00 56.10 57.17 2g9h s TRP 121 Cb -0.14 -2.50 -0.01 0.00 -1.15 0.00 0.00 33.47 29.67 2g9h s TRP 121 CO 0.03 0.46 -0.15 -0.51 0.02 0.00 0.00 176.95 176.79 2g9h s LEU 122 N -0.52 2.00 -0.19 2.99 1.43 -0.38 -1.39 118.68 122.61 2g9h s LEU 122 Ca 0.28 -0.29 0.01 0.00 -1.03 0.00 0.00 54.13 53.10 2g9h s LEU 122 Cb -0.18 -0.81 0.02 0.00 0.03 0.00 0.00 46.19 45.25 2g9h s LEU 122 CO 0.16 0.18 -0.18 -0.60 0.23 0.00 0.00 176.35 176.14 2g9h s ARG 123 N -0.28 2.92 -1.40 1.70 3.52 0.52 -1.33 118.95 124.60 2g9h s ARG 123 Ca 0.04 -0.88 -0.07 0.00 -0.13 0.00 0.00 55.73 54.69 2g9h s ARG 123 Cb -0.07 -2.64 0.04 0.00 -1.56 0.00 0.00 34.95 30.72 2g9h s ARG 123 CO -0.00 -0.26 0.93 0.09 -0.81 0.00 0.00 175.30 175.25 2g9h n ASN 124 N 4.61 -3.64 0.00 -2.12 3.02 0.80 -2.16 115.26 115.76 2g9h n ASN 124 Ca -0.20 -0.73 0.00 0.00 -0.03 0.00 0.00 54.58 53.62 2g9h n ASN 124 Cb 0.49 -4.28 0.00 0.00 -0.61 0.00 0.00 39.78 35.38 2g9h n ASN 124 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2g9h n GLY 125 N -1.66 2.94 3.83 7.41 0.00 -1.26 -5.03 105.19 111.42 2g9h n GLY 125 Ca -0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.54 2g9h n GLY 125 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2g9h s LYS 126 N -0.19 3.84 0.43 1.61 3.01 -0.92 -4.97 119.74 122.55 2g9h s LYS 126 Ca 0.00 0.20 -0.25 0.00 -1.01 0.00 0.00 55.97 54.90 2g9h s LYS 126 Cb 0.00 -3.25 -0.08 0.00 -1.01 0.00 0.00 37.83 33.49 2g9h s LYS 126 CO 0.00 0.63 1.33 -2.14 0.51 0.00 0.00 175.35 175.68 2g9h s PRO 127 N -0.78 3.81 -0.07 -1.68 0.02 -1.26 -0.35 135.00 134.68 2g9h s PRO 127 Ca 0.20 2.20 0.02 0.00 0.02 0.00 0.00 61.00 63.44 2g9h s PRO 127 Cb -0.15 -2.66 0.01 0.00 0.02 0.00 0.00 34.50 31.73 2g9h s PRO 127 CO 0.09 -0.64 -0.12 0.08 -0.33 0.00 0.00 177.00 176.08 2g9h s VAL 128 N -1.27 1.11 0.00 3.83 1.01 -0.49 -4.82 120.40 119.78 2g9h s VAL 128 Ca 0.60 -0.45 0.00 0.00 0.00 0.00 0.00 61.98 62.12 2g9h s VAL 128 Cb -0.39 -1.03 0.00 0.00 0.00 0.00 0.00 36.38 34.96 2g9h s VAL 128 CO 0.50 0.35 0.00 0.35 0.00 0.00 0.00 175.10 176.30 2g9h n THR 129 N 3.94 0.00 -1.58 3.92 -2.24 -1.26 -4.46 114.28 112.60 2g9h n THR 129 Ca -0.22 -0.09 -0.50 0.00 -2.27 0.00 0.00 64.05 60.97 2g9h n THR 129 Cb 0.51 0.54 -0.06 0.00 -2.10 0.00 0.00 70.33 69.23 2g9h n THR 129 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2g9h n THR 130 N -1.14 0.36 -0.92 4.28 -1.04 -1.26 -1.95 114.28 112.61 2g9h n THR 130 Ca 0.00 -0.20 0.00 0.00 -2.04 0.00 0.00 64.05 61.81 2g9h n THR 130 Cb 0.00 -1.76 0.00 0.00 -1.82 0.00 0.00 70.33 66.75 2g9h n THR 130 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2g9h n GLY 131 N 5.38 0.65 3.76 3.41 0.00 -1.26 -4.68 105.19 112.46 2g9h n GLY 131 Ca 0.31 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.98 2g9h n GLY 131 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2g9h s VAL 132 N -2.83 2.89 0.32 1.61 -7.23 -0.82 -4.52 120.40 109.81 2g9h s VAL 132 Ca 0.00 0.53 -0.10 0.00 -1.81 0.00 0.00 61.98 60.60 2g9h s VAL 132 Cb 0.00 -3.17 0.01 0.00 0.56 0.00 0.00 36.38 33.78 2g9h s VAL 132 CO 0.00 -0.15 0.57 -0.94 -0.31 0.00 0.00 175.10 174.27 2g9h s SER 133 N -1.82 0.29 0.06 4.85 1.04 -1.02 -5.00 113.70 112.09 2g9h s SER 133 Ca 0.74 -1.17 -0.26 0.00 0.48 0.00 0.00 55.95 55.74 2g9h s SER 133 Cb -0.26 0.69 0.08 0.00 0.10 0.00 0.00 66.02 66.62 2g9h s SER 133 CO 0.33 -1.35 0.69 -1.83 0.98 0.00 0.00 173.24 172.05 2g9h s GLU 134 N -3.23 1.11 0.80 4.02 -1.05 -1.26 -0.71 118.70 118.38 2g9h s GLU 134 Ca 0.23 -0.21 -0.08 0.00 -0.15 0.00 0.00 54.97 54.76 2g9h s GLU 134 Cb -0.02 0.52 0.13 0.00 -0.44 0.00 0.00 34.13 34.32 2g9h s GLU 134 CO 0.14 -0.44 1.11 0.95 0.95 0.00 0.00 175.26 177.96 2g9h s THR 135 N -2.79 2.13 0.61 1.83 -4.23 0.19 -4.99 115.64 108.40 2g9h s THR 135 Ca -0.02 -0.29 -0.08 0.00 -1.18 0.00 0.00 61.69 60.12 2g9h s THR 135 Cb -0.01 -2.85 0.14 0.00 1.34 0.00 0.00 72.50 71.12 2g9h s THR 135 CO -0.05 0.00 0.83 1.33 -0.54 0.00 0.00 174.62 176.19 2g9h n VAL 136 N -3.18 0.00 -2.56 2.29 0.24 -1.26 -4.74 118.33 109.12 2g9h n VAL 136 Ca 0.13 -0.75 -0.43 0.00 -2.04 0.00 0.00 64.34 61.25 2g9h n VAL 136 Cb 0.60 -1.52 -0.02 0.00 -1.47 0.00 0.00 33.84 31.43 2g9h n VAL 136 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 2g9h s PHE 137 N -2.70 3.21 0.04 6.34 0.40 -1.26 -4.65 117.98 119.36 2g9h s PHE 137 Ca 0.49 1.31 0.01 0.00 -0.60 0.00 0.00 56.93 58.14 2g9h s PHE 137 Cb -0.02 -3.35 -0.04 0.00 0.51 0.00 0.00 43.02 40.13 2g9h s PHE 137 CO 0.34 -0.94 0.10 -0.51 0.70 0.00 0.00 175.22 174.91 2g9h s LEU 138 N 2.83 3.95 0.73 -0.37 1.43 -0.09 -4.92 118.68 122.24 2g9h s LEU 138 Ca 0.50 0.10 -0.11 0.00 -1.03 0.00 0.00 54.13 53.60 2g9h s LEU 138 Cb -0.20 -2.49 0.03 0.00 0.03 0.00 0.00 46.19 43.56 2g9h s LEU 138 CO 0.14 0.21 1.07 -2.16 0.23 0.00 0.00 176.35 175.84 2g9h s PRO 139 N -2.16 2.69 0.11 1.29 0.04 -1.26 -1.43 135.00 134.28 2g9h s PRO 139 Ca 0.28 0.87 0.03 0.00 0.04 0.00 0.00 61.00 62.23 2g9h s PRO 139 Cb -0.12 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.41 2g9h s PRO 139 CO 0.20 -1.26 -0.09 1.03 0.04 0.00 0.00 177.00 176.92 2g9h s ARG 140 N -5.07 0.90 0.44 4.56 0.52 -1.04 -4.65 118.95 114.61 2g9h s ARG 140 Ca 0.59 -1.30 0.30 0.00 -0.52 0.00 0.00 55.73 54.80 2g9h s ARG 140 Cb -0.14 -0.45 1.24 0.00 0.52 0.00 0.00 34.95 36.12 2g9h s ARG 140 CO 0.55 0.05 1.89 0.93 0.02 0.00 0.00 175.30 178.73 2g9h h GLU 141 N 3.14 0.00 -0.23 3.54 5.08 -1.98 -1.73 114.58 122.40 2g9h h GLU 141 Ca -0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.00 2g9h h GLU 141 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 2g9h h GLU 141 CO 0.60 0.00 0.00 -0.40 -1.00 0.00 0.00 179.01 178.21 2g9h n ASP 142 N -2.75 2.43 0.00 1.42 5.68 -1.26 -4.95 116.55 117.13 2g9h n ASP 142 Ca 0.01 -1.83 0.00 0.00 -0.50 0.00 0.00 54.79 52.47 2g9h n ASP 142 Cb 0.27 -0.14 0.00 0.00 -1.14 0.00 0.00 41.12 40.11 2g9h n ASP 142 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 2g9h n HIS 143 N 0.84 0.00 -1.63 2.11 8.25 -0.65 -5.03 115.22 119.11 2g9h n HIS 143 Ca 0.17 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.42 2g9h n HIS 143 Cb 0.46 -0.28 0.15 0.00 1.12 0.00 0.00 29.99 31.43 2g9h n HIS 143 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2g9h n LEU 144 N 0.00 0.00 -4.39 2.41 4.77 -1.26 -4.85 117.00 113.68 2g9h n LEU 144 Ca 0.00 -1.04 -0.22 0.00 -0.03 0.00 0.00 56.01 54.71 2g9h n LEU 144 Cb 0.06 -0.73 -0.11 0.00 -2.33 0.00 0.00 43.42 40.31 2g9h n LEU 144 CO 0.00 -1.21 -0.48 -0.36 -1.33 0.00 0.00 177.39 174.01 2g9h s PHE 145 N -3.07 1.99 0.21 -1.77 0.40 -0.17 -2.51 117.98 113.07 2g9h s PHE 145 Ca 0.54 -0.44 0.11 0.00 -0.60 0.00 0.00 56.93 56.54 2g9h s PHE 145 Cb -0.02 -0.94 -0.05 0.00 0.51 0.00 0.00 43.02 42.53 2g9h s PHE 145 CO 0.38 0.47 -0.22 1.03 0.70 0.00 0.00 175.22 177.58 2g9h s ARG 146 N -3.17 1.51 -0.17 0.44 0.52 -0.51 -1.71 118.95 115.85 2g9h s ARG 146 Ca 0.22 -1.56 -0.23 0.00 -0.52 0.00 0.00 55.73 53.64 2g9h s ARG 146 Cb -0.05 -1.72 0.06 0.00 0.52 0.00 0.00 34.95 33.76 2g9h s ARG 146 CO 0.09 0.36 0.60 0.21 0.02 0.00 0.00 175.30 176.59 2g9h s LYS 147 N -2.90 0.80 -0.05 3.54 2.20 0.41 -0.91 119.74 122.83 2g9h s LYS 147 Ca 0.22 0.62 0.05 0.00 -0.36 0.00 0.00 55.97 56.50 2g9h s LYS 147 Cb -0.07 0.38 -0.02 0.00 -1.51 0.00 0.00 37.83 36.62 2g9h s LYS 147 CO 0.10 -0.15 -0.21 -0.06 -0.36 0.00 0.00 175.35 174.67 2g9h s PHE 148 N -0.20 2.53 0.09 4.03 0.40 -1.26 -0.55 117.98 123.02 2g9h s PHE 148 Ca -0.04 -0.48 0.10 0.00 -0.60 0.00 0.00 56.93 55.91 2g9h s PHE 148 Cb -0.03 -1.61 -0.04 0.00 0.51 0.00 0.00 43.02 41.85 2g9h s PHE 148 CO 0.03 -0.05 -0.25 -1.01 0.70 0.00 0.00 175.22 174.64 2g9h s HIS 149 N -0.39 2.36 -0.02 0.36 3.76 -0.21 -0.64 115.29 120.51 2g9h s HIS 149 Ca 0.03 -0.37 0.03 0.00 -0.15 0.00 0.00 55.06 54.60 2g9h s HIS 149 Cb -0.12 -1.33 -0.00 0.00 1.11 0.00 0.00 32.58 32.24 2g9h s HIS 149 CO 0.02 0.26 -0.09 0.71 -0.85 0.00 0.00 174.74 174.78 2g9h s TYR 150 N -0.96 0.92 -0.23 1.40 2.02 0.12 -0.81 117.35 119.80 2g9h s TYR 150 Ca 0.14 -0.20 -0.02 0.00 -0.37 0.00 0.00 57.07 56.62 2g9h s TYR 150 Cb -0.10 -0.62 0.07 0.00 -0.40 0.00 0.00 41.96 40.90 2g9h s TYR 150 CO 0.05 -0.06 0.03 -1.17 -1.57 0.00 0.00 175.55 172.83 2g9h s LEU 151 N -0.01 1.65 0.30 -1.29 2.96 -0.36 -2.43 118.68 119.50 2g9h s LEU 151 Ca 0.00 -1.07 -0.30 0.00 -0.22 0.00 0.00 54.13 52.55 2g9h s LEU 151 Cb -0.06 -0.75 -0.11 0.00 0.50 0.00 0.00 46.19 45.76 2g9h s LEU 151 CO 0.00 -0.32 1.53 -2.84 -1.32 0.00 0.00 176.35 173.40 2g9h s PRO 152 N 1.73 4.16 0.14 0.98 0.02 -1.26 -0.36 135.00 140.41 2g9h s PRO 152 Ca 0.01 2.50 -0.11 0.00 0.02 0.00 0.00 61.00 63.41 2g9h s PRO 152 Cb -0.17 -3.03 0.01 0.00 0.02 0.00 0.00 34.50 31.32 2g9h s PRO 152 CO -0.12 -0.55 0.31 -0.59 -0.33 0.00 0.00 177.00 175.72 2g9h s PHE 153 N -0.28 0.13 -0.36 6.54 -0.71 -0.29 -4.92 117.98 118.09 2g9h s PHE 153 Ca 0.60 -0.51 -0.10 0.00 -1.04 0.00 0.00 56.93 55.88 2g9h s PHE 153 Cb -0.46 0.06 0.03 0.00 -1.21 0.00 0.00 43.02 41.44 2g9h s PHE 153 CO 0.50 -0.69 0.18 -1.17 -1.34 0.00 0.00 175.22 172.71 2g9h s LEU 154 N -2.89 4.60 0.16 -1.99 2.96 -1.26 -1.12 118.68 119.14 2g9h s LEU 154 Ca 0.09 -1.01 -0.34 0.00 -0.22 0.00 0.00 54.13 52.65 2g9h s LEU 154 Cb 0.03 -1.99 -0.14 0.00 0.50 0.00 0.00 46.19 44.59 2g9h s LEU 154 CO -0.06 -0.37 1.55 -2.65 -1.32 0.00 0.00 176.35 173.51 2g9h n PRO 155 N 4.95 2.08 -3.88 0.98 -0.02 -1.26 -4.84 135.00 133.01 2g9h n PRO 155 Ca -0.12 0.75 -0.09 0.00 -2.02 0.00 0.00 63.50 62.02 2g9h n PRO 155 Cb 0.46 -2.51 -0.08 0.00 -0.02 0.00 0.00 33.50 31.35 2g9h n PRO 155 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2g9h s SER 156 N 0.85 0.15 0.41 2.55 1.04 -1.26 -1.57 113.70 115.87 2g9h s SER 156 Ca 0.79 -0.65 0.22 0.00 0.48 0.00 0.00 55.95 56.79 2g9h s SER 156 Cb -0.69 0.32 0.44 0.00 0.10 0.00 0.00 66.02 66.18 2g9h s SER 156 CO 0.39 -0.69 1.63 0.71 0.98 0.00 0.00 173.24 176.26 2g9h h THR 157 N 2.91 0.29 0.00 2.02 1.35 -1.95 -3.33 112.91 114.19 2g9h h THR 157 Ca -0.34 -1.29 0.00 0.00 -0.55 0.00 0.00 66.41 64.23 2g9h h THR 157 Cb 1.19 2.04 0.00 0.00 -1.73 0.00 0.00 68.15 69.65 2g9h h THR 157 CO 0.56 0.16 -0.55 -0.62 -0.25 0.00 0.00 175.52 174.81 2g9h n GLU 158 N -3.16 0.11 -3.52 4.72 -0.58 -1.26 -4.86 120.64 112.09 2g9h n GLU 158 Ca 0.03 0.03 -0.36 0.00 -0.42 0.00 0.00 57.16 56.44 2g9h n GLU 158 Cb 0.55 -1.56 -0.06 0.00 -0.57 0.00 0.00 31.44 29.80 2g9h n GLU 158 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2g9h s ASP 159 N -3.45 6.71 -0.12 1.62 -0.00 -1.25 -5.04 116.67 115.14 2g9h s ASP 159 Ca 0.09 0.88 0.01 0.00 -0.00 0.00 0.00 52.55 53.53 2g9h s ASP 159 Cb 0.16 -2.21 0.02 0.00 -0.00 0.00 0.00 42.92 40.89 2g9h s ASP 159 CO 0.71 0.20 -0.14 -0.69 -0.00 0.00 0.00 175.17 175.24 2g9h s VAL 160 N -1.34 1.47 0.16 -1.27 1.01 -1.26 -4.47 120.40 114.70 2g9h s VAL 160 Ca 0.32 -0.60 0.05 0.00 0.00 0.00 0.00 61.98 61.75 2g9h s VAL 160 Cb -0.15 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.83 2g9h s VAL 160 CO 0.17 0.44 0.10 -0.31 0.00 0.00 0.00 175.10 175.50 2g9h s TYR 161 N 1.21 3.10 -0.01 5.22 2.02 -0.01 -0.14 117.35 128.74 2g9h s TYR 161 Ca -0.02 -0.03 0.02 0.00 -0.37 0.00 0.00 57.07 56.67 2g9h s TYR 161 Cb -0.14 -1.50 -0.01 0.00 -0.40 0.00 0.00 41.96 39.92 2g9h s TYR 161 CO -0.05 0.52 -0.07 -0.51 -1.57 0.00 0.00 175.55 173.87 2g9h s ASP 162 N -3.00 0.82 -0.38 2.29 1.01 -0.44 -0.94 116.67 116.04 2g9h s ASP 162 Ca 0.30 -0.13 -0.12 0.00 0.71 0.00 0.00 52.55 53.31 2g9h s ASP 162 Cb -0.10 -0.09 0.02 0.00 1.01 0.00 0.00 42.92 43.76 2g9h s ASP 162 CO 0.22 0.08 0.24 0.00 0.21 0.00 0.00 175.17 175.92 2g9h s ARG 164 N 1.61 4.02 -0.11 0.00 3.52 0.43 -1.30 118.95 127.12 2g9h s ARG 164 Ca 0.03 0.01 0.04 0.00 -0.13 0.00 0.00 55.73 55.68 2g9h s ARG 164 Cb -0.19 -3.64 0.00 0.00 -1.56 0.00 0.00 34.95 29.56 2g9h s ARG 164 CO 0.08 -0.24 -0.23 0.08 -0.81 0.00 0.00 175.30 174.18 2g9h s VAL 165 N 1.94 2.10 -0.13 7.11 1.01 0.51 -1.34 120.40 131.61 2g9h s VAL 165 Ca 0.14 -1.00 0.01 0.00 0.00 0.00 0.00 61.98 61.13 2g9h s VAL 165 Cb -0.16 -1.81 -0.01 0.00 0.00 0.00 0.00 36.38 34.41 2g9h s VAL 165 CO 0.10 0.56 -0.16 -1.61 0.00 0.00 0.00 175.10 173.99 2g9h s GLU 166 N 0.42 3.28 -0.09 2.72 2.02 -0.57 -0.65 118.70 125.83 2g9h s GLU 166 Ca -0.17 -0.74 -0.16 0.00 0.02 0.00 0.00 54.97 53.93 2g9h s GLU 166 Cb -0.17 -2.57 0.04 0.00 0.10 0.00 0.00 34.13 31.52 2g9h s GLU 166 CO 0.07 0.15 0.39 -1.58 0.02 0.00 0.00 175.26 174.31 2g9h s HIS 167 N 0.49 -0.36 0.56 1.61 2.46 -1.26 -1.99 115.29 116.80 2g9h s HIS 167 Ca -0.11 0.76 0.27 0.00 0.47 0.00 0.00 55.06 56.46 2g9h s HIS 167 Cb -0.16 0.15 1.48 0.00 -0.13 0.00 0.00 32.58 33.92 2g9h s HIS 167 CO 0.05 -0.32 2.00 -1.49 -2.47 0.00 0.00 174.74 172.50 2g9h h TRP 168 N 4.63 0.00 0.00 3.88 6.55 -1.95 -2.07 115.95 126.99 2g9h h TRP 168 Ca -0.28 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.56 2g9h h TRP 168 Cb 1.18 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.48 2g9h h TRP 168 CO 0.45 0.00 0.00 0.41 -1.05 0.00 0.00 178.44 178.25 2g9h n GLY 169 N -1.55 -1.13 3.88 1.49 0.00 -1.26 -4.80 105.19 101.82 2g9h n GLY 169 Ca 0.08 -0.06 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 2g9h n GLY 169 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2g9h s LEU 170 N -3.03 4.39 0.40 0.99 1.43 -0.78 -4.38 118.68 117.71 2g9h s LEU 170 Ca 0.09 0.49 0.21 0.00 -1.03 0.00 0.00 54.13 53.89 2g9h s LEU 170 Cb 0.12 -2.29 0.77 0.00 0.03 0.00 0.00 46.19 44.81 2g9h s LEU 170 CO 0.33 0.35 1.76 0.44 0.23 0.00 0.00 176.35 179.47 2g9h h ASP 171 N 4.60 0.00 -5.05 2.29 3.32 -1.87 -3.45 116.42 116.26 2g9h h ASP 171 Ca -0.53 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.49 2g9h h ASP 171 Cb 1.22 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.65 2g9h h ASP 171 CO 0.61 0.30 0.07 -1.83 -1.72 0.00 0.00 179.24 176.67 2g9h s GLU 172 N -3.60 1.27 0.28 3.56 -1.05 -1.26 -5.13 118.70 112.77 2g9h s GLU 172 Ca 0.01 -0.69 -0.30 0.00 -0.15 0.00 0.00 54.97 53.84 2g9h s GLU 172 Cb 0.10 0.53 -0.13 0.00 -0.44 0.00 0.00 34.13 34.19 2g9h s GLU 172 CO 0.66 -0.53 1.32 -2.30 0.95 0.00 0.00 175.26 175.36 2g9h n PRO 173 N -0.32 1.97 -2.93 -4.83 -0.02 -1.26 -4.93 135.00 122.69 2g9h n PRO 173 Ca -0.14 0.70 -0.42 0.00 -2.02 0.00 0.00 63.50 61.62 2g9h n PRO 173 Cb 0.64 -2.29 -0.05 0.00 -0.02 0.00 0.00 33.50 31.77 2g9h n PRO 173 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2g9h s LEU 174 N -0.23 4.09 -0.30 2.45 2.96 0.18 -4.89 118.68 122.93 2g9h s LEU 174 Ca 0.63 0.53 -0.10 0.00 -0.22 0.00 0.00 54.13 54.97 2g9h s LEU 174 Cb -0.63 -3.09 -0.02 0.00 0.50 0.00 0.00 46.19 42.95 2g9h s LEU 174 CO 0.55 -0.70 0.16 -0.76 -1.32 0.00 0.00 176.35 174.28 2g9h s LEU 175 N 3.10 4.08 -0.33 -0.68 1.02 -1.26 -0.36 118.68 124.25 2g9h s LEU 175 Ca 0.33 -0.37 -0.05 0.00 0.02 0.00 0.00 54.13 54.06 2g9h s LEU 175 Cb -0.13 -2.04 0.04 0.00 0.02 0.00 0.00 46.19 44.08 2g9h s LEU 175 CO 0.15 -0.16 0.07 -0.75 0.02 0.00 0.00 176.35 175.69 2g9h s LYS 176 N 1.66 2.55 0.37 1.70 2.47 -0.42 -4.94 119.74 123.13 2g9h s LYS 176 Ca 0.06 -1.22 -0.24 0.00 -1.56 0.00 0.00 55.97 53.00 2g9h s LYS 176 Cb -0.17 -3.38 -0.10 0.00 -1.46 0.00 0.00 37.83 32.73 2g9h s LYS 176 CO 0.08 -0.66 0.97 -1.58 0.16 0.00 0.00 175.35 174.32 2g9h s HIS 177 N 1.35 3.48 -0.14 4.03 2.46 -1.26 -0.77 115.29 124.44 2g9h s HIS 177 Ca -0.03 1.70 -0.08 0.00 0.47 0.00 0.00 55.06 57.13 2g9h s HIS 177 Cb -0.20 -2.96 0.05 0.00 -0.13 0.00 0.00 32.58 29.34 2g9h s HIS 177 CO 0.02 -0.10 0.33 -0.46 -2.47 0.00 0.00 174.74 172.06 2g9h s TRP 178 N -1.76 -0.46 0.05 3.88 -0.00 -0.11 -4.92 118.94 115.62 2g9h s TRP 178 Ca 0.55 1.02 -0.00 0.00 -0.00 0.00 0.00 56.10 57.67 2g9h s TRP 178 Cb -0.17 0.16 -0.04 0.00 -0.00 0.00 0.00 33.47 33.42 2g9h s TRP 178 CO 0.22 -0.28 -0.04 -1.83 -0.00 0.00 0.00 176.95 175.03 2g9h s GLU 179 N 1.23 0.57 -0.53 5.86 -1.05 -1.26 -0.83 118.70 122.69 2g9h s GLU 179 Ca -0.09 -1.08 -0.22 0.00 -0.15 0.00 0.00 54.97 53.43 2g9h s GLU 179 Cb -0.09 0.11 0.05 0.00 -0.44 0.00 0.00 34.13 33.76 2g9h s GLU 179 CO -0.10 -0.08 0.81 0.12 0.95 0.00 0.00 175.26 176.96 2g9h s PHE 180 N -3.22 2.90 0.00 4.83 5.36 -1.26 -5.08 117.98 121.51 2g9h s PHE 180 Ca 0.02 -0.21 0.00 0.00 -0.96 0.00 0.00 56.93 55.78 2g9h s PHE 180 Cb 0.03 -3.84 0.00 0.00 -0.34 0.00 0.00 43.02 38.87 2g9h s PHE 180 CO -0.07 -1.21 0.34 -0.40 -1.46 0.00 0.00 175.22 172.43