#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dv9 n ASN -1 N 0.00 -0.21 -1.31 6.43 2.85 -1.26 -0.61 115.26 121.15 3dv9 n ASN -1 Ca 0.00 0.65 0.00 0.00 -0.11 0.00 0.00 54.58 55.12 3dv9 n ASN -1 Cb 0.00 -0.19 0.00 0.00 1.24 0.00 0.00 39.78 40.83 3dv9 n ASN -1 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3dv9 n ALA 0 N -2.95 1.97 0.00 5.20 0.00 -1.26 -1.90 120.51 121.56 3dv9 n ALA 0 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3dv9 n ALA 0 Cb 0.05 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.24 3dv9 n ALA 0 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3dv9 n PHE 2 N 1.22 0.00 -0.16 0.00 3.72 0.22 -1.62 117.46 120.84 3dv9 n PHE 2 Ca 0.00 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.35 3dv9 n PHE 2 Cb 0.15 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 38.73 3dv9 n PHE 2 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 3dv9 h LYS 3 N 0.00 0.50 -0.08 -1.08 1.79 -1.64 0.12 116.57 116.17 3dv9 h LYS 3 Ca 0.00 -0.03 0.03 0.00 -2.18 0.00 0.00 60.65 58.47 3dv9 h LYS 3 Cb 0.00 -0.11 -0.03 0.00 -1.58 0.00 0.00 32.23 30.51 3dv9 h LYS 3 CO 0.00 0.33 -0.09 1.49 -1.08 0.00 0.00 179.45 180.10 3dv9 h GLU 4 N 0.52 -0.12 -0.17 3.15 4.81 -1.59 0.27 114.58 121.45 3dv9 h GLU 4 Ca 0.21 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.46 3dv9 h GLU 4 Cb 0.10 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.49 3dv9 h GLU 4 CO -0.14 -0.08 0.10 0.00 -0.73 0.00 0.00 179.01 178.16 3dv9 h ALA 5 N 0.94 0.21 0.00 2.92 0.00 -1.75 -0.34 119.26 121.24 3dv9 h ALA 5 Ca 0.06 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.98 3dv9 h ALA 5 Cb 0.21 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3dv9 h ALA 5 CO -0.16 -0.32 -0.05 0.82 0.00 0.00 0.00 179.25 179.54 3dv9 h ILE 6 N 0.21 0.86 -0.45 0.00 2.04 -0.50 -1.99 117.51 117.68 3dv9 h ILE 6 Ca 0.07 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.84 3dv9 h ILE 6 Cb -0.00 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 3dv9 h ILE 6 CO -0.03 0.00 -0.06 0.78 0.00 0.00 0.00 178.15 178.83 3dv9 h ASN 7 N -0.10 0.76 -0.25 1.72 2.35 -0.23 -0.30 115.58 119.53 3dv9 h ASN 7 Ca 0.02 -0.21 0.01 0.00 -0.55 0.00 0.00 56.30 55.57 3dv9 h ASN 7 Cb 0.12 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.27 3dv9 h ASN 7 CO -0.05 0.87 0.16 0.78 -1.65 0.00 0.00 177.43 177.53 3dv9 h ASN 8 N 0.72 0.26 -0.09 5.81 2.35 -0.95 -0.67 115.58 123.02 3dv9 h ASN 8 Ca 0.13 -0.00 0.03 0.00 -0.55 0.00 0.00 56.30 55.91 3dv9 h ASN 8 Cb 0.53 -0.06 -0.04 0.00 0.05 0.00 0.00 38.32 38.80 3dv9 h ASN 8 CO 0.03 0.19 -0.13 0.22 -1.65 0.00 0.00 177.43 176.10 3dv9 h TYR 9 N 0.32 -0.32 -0.42 1.19 3.20 -1.06 -0.87 116.97 119.02 3dv9 h TYR 9 Ca 0.10 0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.01 3dv9 h TYR 9 Cb -0.02 0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.37 3dv9 h TYR 9 CO -0.07 -0.19 0.23 -0.07 -1.64 0.00 0.00 178.16 176.42 3dv9 h LEU 10 N -0.17 0.35 -0.31 2.82 3.38 -0.93 -2.42 115.31 118.03 3dv9 h LEU 10 Ca 0.08 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.07 3dv9 h LEU 10 Cb 0.28 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 3dv9 h LEU 10 CO -0.19 0.25 0.19 -0.74 0.09 0.00 0.00 178.44 178.03 3dv9 h HIS 11 N 0.46 0.35 0.00 1.13 2.76 -0.99 0.57 115.15 119.43 3dv9 h HIS 11 Ca 0.17 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.35 3dv9 h HIS 11 Cb 0.05 -0.12 0.00 0.00 1.55 0.00 0.00 27.41 28.90 3dv9 h HIS 11 CO -0.09 0.22 0.00 1.79 -1.30 0.00 0.00 177.93 178.55 3dv9 h THR 12 N 0.39 0.00 0.00 6.26 1.35 -0.89 -3.14 112.91 116.88 3dv9 h THR 12 Ca 0.12 -0.58 0.00 0.00 -0.55 0.00 0.00 66.41 65.40 3dv9 h THR 12 Cb -0.02 1.54 0.00 0.00 -1.73 0.00 0.00 68.15 67.94 3dv9 h THR 12 CO -0.04 0.00 -0.69 1.41 -0.25 0.00 0.00 175.52 175.94 3dv9 n HIS 13 N -2.90 0.00 -2.47 4.73 8.25 -0.94 -5.01 115.22 116.89 3dv9 n HIS 13 Ca 0.02 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.42 3dv9 n HIS 13 Cb 0.36 -0.02 0.01 0.00 1.12 0.00 0.00 29.99 31.45 3dv9 n HIS 13 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3dv9 n GLY 14 N 1.34 0.37 3.89 -1.41 0.00 0.13 -5.06 105.19 104.46 3dv9 n GLY 14 Ca 0.02 -0.54 -0.28 0.00 0.00 0.00 0.00 46.02 45.22 3dv9 n GLY 14 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dv9 s TYR 15 N -2.70 3.39 0.07 1.61 2.02 -0.80 -5.02 117.35 115.92 3dv9 s TYR 15 Ca 0.08 0.11 -0.11 0.00 -0.37 0.00 0.00 57.07 56.79 3dv9 s TYR 15 Cb -0.04 -1.65 -0.25 0.00 -0.40 0.00 0.00 41.96 39.62 3dv9 s TYR 15 CO 0.10 0.53 1.14 1.49 -1.57 0.00 0.00 175.55 177.25 3dv9 h GLU 16 N 2.52 0.51 -2.81 -0.62 4.81 -1.97 -3.42 114.58 113.60 3dv9 h GLU 16 Ca -0.47 -0.70 0.08 0.00 -0.13 0.00 0.00 59.36 58.14 3dv9 h GLU 16 Cb 1.18 0.23 -0.08 0.00 0.63 0.00 0.00 28.75 30.72 3dv9 h GLU 16 CO 0.69 1.30 0.30 -1.54 -0.73 0.00 0.00 179.01 179.03 3dv9 s SER 17 N -7.32 -0.30 -0.23 1.04 1.04 -1.26 -5.07 113.70 101.59 3dv9 s SER 17 Ca -0.08 -0.42 -0.13 0.00 0.48 0.00 0.00 55.95 55.81 3dv9 s SER 17 Cb 0.06 0.63 -0.04 0.00 0.10 0.00 0.00 66.02 66.77 3dv9 s SER 17 CO 0.91 -1.13 0.28 -0.63 0.98 0.00 0.00 173.24 173.65 3dv9 s ILE 18 N -3.70 5.27 -0.81 -1.02 1.01 -1.26 -4.92 121.20 115.78 3dv9 s ILE 18 Ca 0.09 0.44 -0.04 0.00 0.00 0.00 0.00 60.65 61.14 3dv9 s ILE 18 Cb -0.04 -3.62 0.20 0.00 0.01 0.00 0.00 42.46 39.02 3dv9 s ILE 18 CO 0.01 0.28 0.68 -0.62 0.00 0.00 0.00 174.94 175.29 3dv9 s ASP 19 N 1.16 5.93 -0.01 3.58 2.15 -0.09 -4.68 116.67 124.71 3dv9 s ASP 19 Ca 0.13 -3.26 -0.30 0.00 0.43 0.00 0.00 52.55 49.55 3dv9 s ASP 19 Cb -0.14 -1.95 -0.07 0.00 -0.30 0.00 0.00 42.92 40.46 3dv9 s ASP 19 CO 0.07 -0.31 1.64 -0.22 -0.17 0.00 0.00 175.17 176.18 3dv9 s LEU 20 N -0.68 4.34 0.00 -1.34 2.96 -1.26 -4.24 118.68 118.46 3dv9 s LEU 20 Ca 0.23 2.32 0.00 0.00 -0.22 0.00 0.00 54.13 56.46 3dv9 s LEU 20 Cb -0.13 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 43.02 3dv9 s LEU 20 CO -0.08 -0.90 0.00 0.29 -1.32 0.00 0.00 176.35 174.34 3dv9 n LYS 21 N 6.48 2.40 -3.91 1.98 5.02 0.44 -4.98 118.16 125.59 3dv9 n LYS 21 Ca 0.16 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.35 3dv9 n LYS 21 Cb 0.42 -0.86 -0.10 0.00 -0.02 0.00 0.00 35.03 34.47 3dv9 n LYS 21 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3dv9 s ALA 22 N -1.61 -0.18 -0.13 7.82 0.00 -0.57 -0.99 121.76 126.10 3dv9 s ALA 22 Ca 0.00 -0.31 -0.01 0.00 0.00 0.00 0.00 51.96 51.64 3dv9 s ALA 22 Cb 0.00 0.14 0.04 0.00 0.00 0.00 0.00 23.12 23.30 3dv9 s ALA 22 CO 0.00 -0.21 -0.02 0.08 0.00 0.00 0.00 175.76 175.60 3dv9 s VAL 23 N -1.60 0.76 -0.43 0.00 1.01 -0.69 -2.15 120.40 117.29 3dv9 s VAL 23 Ca -0.14 -0.32 -0.16 0.00 0.00 0.00 0.00 61.98 61.36 3dv9 s VAL 23 Cb -0.07 -0.96 0.03 0.00 0.00 0.00 0.00 36.38 35.38 3dv9 s VAL 23 CO 0.00 0.15 0.36 -0.76 0.00 0.00 0.00 175.10 174.85 3dv9 s LEU 24 N 1.79 5.14 -0.21 3.92 1.02 0.35 -4.33 118.68 126.35 3dv9 s LEU 24 Ca 0.02 -0.92 -0.12 0.00 0.02 0.00 0.00 54.13 53.13 3dv9 s LEU 24 Cb -0.14 -2.23 -0.05 0.00 0.02 0.00 0.00 46.19 43.79 3dv9 s LEU 24 CO -0.07 -0.53 0.22 -0.36 0.02 0.00 0.00 176.35 175.62 3dv9 s PHE 25 N 1.82 3.37 0.00 0.29 0.08 -1.26 -0.90 117.98 121.37 3dv9 s PHE 25 Ca 0.07 0.38 0.00 0.00 0.12 0.00 0.00 56.93 57.49 3dv9 s PHE 25 Cb -0.19 -2.31 0.00 0.00 -0.57 0.00 0.00 43.02 39.95 3dv9 s PHE 25 CO 0.10 0.12 0.00 -3.47 -0.10 0.00 0.00 175.22 171.87 3dv9 n ASP 26 N 4.07 -0.60 0.00 1.36 2.03 -0.42 -0.80 116.55 122.19 3dv9 n ASP 26 Ca -0.13 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.18 3dv9 n ASP 26 Cb 0.52 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.92 3dv9 n ASP 26 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 3dv9 n ASP 28 N -0.90 0.00 0.00 1.67 8.00 -1.26 -3.76 116.55 120.30 3dv9 n ASP 28 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 3dv9 n ASP 28 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 3dv9 n ASP 28 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dv9 n GLY 29 N 0.00 0.73 1.47 0.44 0.00 0.42 -4.82 105.19 103.43 3dv9 n GLY 29 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3dv9 n GLY 29 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3dv9 n VAL 30 N -2.54 0.58 0.01 1.61 0.31 -1.26 -4.66 118.33 112.38 3dv9 n VAL 30 Ca 0.00 0.19 -0.19 0.00 -0.01 0.00 0.00 64.34 64.33 3dv9 n VAL 30 Cb 0.00 -1.10 -0.14 0.00 -0.91 0.00 0.00 33.84 31.69 3dv9 n VAL 30 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3dv9 h LEU 31 N 0.00 0.35 -8.79 7.52 3.38 -1.88 -3.45 115.31 112.44 3dv9 h LEU 31 Ca 0.00 -0.93 -0.69 0.00 0.09 0.00 0.00 57.88 56.34 3dv9 h LEU 31 Cb 0.09 -0.11 -0.25 0.00 0.09 0.00 0.00 40.66 40.47 3dv9 h LEU 31 CO 0.00 1.35 -0.87 -0.36 0.09 0.00 0.00 178.44 178.66 3dv9 s PHE 32 N -2.39 2.36 -1.34 1.13 0.08 -1.26 -4.50 117.98 112.06 3dv9 s PHE 32 Ca -0.16 -0.39 -0.10 0.00 0.12 0.00 0.00 56.93 56.41 3dv9 s PHE 32 Cb 0.01 -1.39 0.13 0.00 -0.57 0.00 0.00 43.02 41.19 3dv9 s PHE 32 CO 0.78 0.16 2.07 -3.47 -0.10 0.00 0.00 175.22 174.67 3dv9 n ASP 33 N 1.68 5.51 -3.64 1.36 2.03 0.72 -0.44 116.55 123.77 3dv9 n ASP 33 Ca -0.17 -3.04 -0.41 0.00 0.52 0.00 0.00 54.79 51.69 3dv9 n ASP 33 Cb 0.52 -1.49 0.02 0.00 -0.72 0.00 0.00 41.12 39.44 3dv9 n ASP 33 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 3dv9 n SER 34 N 3.90 7.40 0.00 1.67 3.41 -1.26 -4.38 113.62 124.36 3dv9 n SER 34 Ca 0.47 -3.63 0.00 0.00 -0.26 0.00 0.00 58.87 55.45 3dv9 n SER 34 Cb 0.34 -1.19 0.00 0.00 -0.26 0.00 0.00 64.21 63.10 3dv9 n SER 34 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 3dv9 n PRO 36 N 0.15 0.00 -0.08 4.33 -0.02 -1.26 -1.48 135.00 136.64 3dv9 n PRO 36 Ca 0.48 0.00 -0.14 0.00 -2.02 0.00 0.00 63.50 61.82 3dv9 n PRO 36 Cb 0.26 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.69 3dv9 n PRO 36 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 3dv9 h ASN 37 N 0.00 0.76 -0.14 2.55 2.35 -1.99 -2.03 115.58 117.08 3dv9 h ASN 37 Ca 0.00 -0.51 0.02 0.00 -0.55 0.00 0.00 56.30 55.26 3dv9 h ASN 37 Cb 0.00 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.14 3dv9 h ASN 37 CO 0.00 1.12 0.02 0.45 -1.65 0.00 0.00 177.43 177.37 3dv9 h HIS 38 N 0.41 0.04 -0.15 1.19 3.86 -1.67 0.08 115.15 118.91 3dv9 h HIS 38 Ca 0.03 0.01 0.01 0.00 -1.16 0.00 0.00 60.37 59.26 3dv9 h HIS 38 Cb 0.95 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.41 3dv9 h HIS 38 CO 0.08 0.01 0.06 0.00 0.86 0.00 0.00 177.93 178.94 3dv9 h ALA 39 N 1.10 0.17 -0.49 2.45 0.00 -1.82 0.08 119.26 120.75 3dv9 h ALA 39 Ca 0.06 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 3dv9 h ALA 39 Cb 0.06 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 3dv9 h ALA 39 CO -0.09 -0.38 0.31 1.49 0.00 0.00 0.00 179.25 180.58 3dv9 h GLU 40 N 0.14 0.66 -0.47 0.00 4.57 -1.31 -0.60 114.58 117.57 3dv9 h GLU 40 Ca 0.06 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.18 3dv9 h GLU 40 Cb 0.03 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.46 3dv9 h GLU 40 CO -0.06 0.47 0.26 0.77 -1.18 0.00 0.00 179.01 179.27 3dv9 h SER 41 N 0.66 0.58 -0.30 1.04 0.02 -0.81 -0.14 113.55 114.60 3dv9 h SER 41 Ca 0.18 -0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 61.02 3dv9 h SER 41 Cb -0.03 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 3dv9 h SER 41 CO -0.04 0.50 0.12 -0.50 -1.14 0.00 0.00 176.83 175.78 3dv9 h TRP 42 N 0.61 0.46 -0.15 3.45 4.06 -0.91 -0.98 115.95 122.49 3dv9 h TRP 42 Ca 0.16 -0.04 0.01 0.00 2.06 0.00 0.00 58.89 61.09 3dv9 h TRP 42 Cb 0.05 -0.14 -0.01 0.00 -1.00 0.00 0.00 29.16 28.06 3dv9 h TRP 42 CO -0.02 0.45 0.06 1.25 -3.56 0.00 0.00 178.44 176.62 3dv9 h HIS 43 N 0.34 0.12 -0.36 0.49 2.76 -0.81 -3.10 115.15 114.58 3dv9 h HIS 43 Ca 0.10 0.01 -0.09 0.00 -2.20 0.00 0.00 60.37 58.19 3dv9 h HIS 43 Cb 0.19 -0.03 -0.01 0.00 1.55 0.00 0.00 27.41 29.10 3dv9 h HIS 43 CO -0.01 0.06 -0.11 -0.22 -1.30 0.00 0.00 177.93 176.36 3dv9 h LYS 44 N 0.14 0.72 -1.38 5.26 3.64 -0.98 -1.86 116.57 122.11 3dv9 h LYS 44 Ca 0.06 -0.28 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 3dv9 h LYS 44 Cb 0.02 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.81 3dv9 h LYS 44 CO -0.05 0.88 0.00 -0.89 -2.27 0.00 0.00 179.45 177.12 3dv9 n ILE 45 N -4.36 0.44 0.00 2.00 2.08 -0.38 -1.87 119.36 117.26 3dv9 n ILE 45 Ca -0.02 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.29 3dv9 n ILE 45 Cb 0.36 -0.69 0.00 0.00 -0.75 0.00 0.00 39.64 38.56 3dv9 n ILE 45 CO 0.00 0.00 0.00 1.17 0.56 0.00 0.00 176.55 178.28 3dv9 n LYS 47 N 0.69 0.00 -0.07 0.38 4.81 -0.70 -2.06 118.16 121.22 3dv9 n LYS 47 Ca 0.00 0.00 0.02 0.00 -0.87 0.00 0.00 58.31 57.46 3dv9 n LYS 47 Cb 0.23 0.00 0.34 0.00 0.02 0.00 0.00 35.03 35.62 3dv9 n LYS 47 CO 0.00 0.00 0.00 -0.09 1.17 0.00 0.00 177.40 178.48 3dv9 h ARG 48 N 0.00 0.68 -0.24 1.64 2.43 -1.65 -1.29 114.38 115.95 3dv9 h ARG 48 Ca 0.00 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 3dv9 h ARG 48 Cb 0.00 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.41 3dv9 h ARG 48 CO 0.00 0.50 0.00 1.19 -1.51 0.00 0.00 179.97 180.15 3dv9 n PHE 49 N -4.41 0.31 -0.71 2.20 3.72 -0.87 -4.92 117.46 112.77 3dv9 n PHE 49 Ca 0.04 -0.16 0.00 0.00 -0.05 0.00 0.00 57.45 57.29 3dv9 n PHE 49 Cb 0.09 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.63 3dv9 n PHE 49 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3dv9 n GLY 50 N 1.01 0.60 3.61 1.37 0.00 -0.49 -5.06 105.19 106.23 3dv9 n GLY 50 Ca 0.12 -0.44 -0.31 0.00 0.00 0.00 0.00 46.02 45.39 3dv9 n GLY 50 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dv9 s PHE 51 N -2.00 2.86 -0.53 1.61 0.08 -1.26 -4.98 117.98 113.76 3dv9 s PHE 51 Ca 0.00 -0.08 -0.13 0.00 0.12 0.00 0.00 56.93 56.84 3dv9 s PHE 51 Cb 0.00 -1.53 0.13 0.00 -0.57 0.00 0.00 43.02 41.05 3dv9 s PHE 51 CO 0.00 0.42 0.46 0.20 -0.10 0.00 0.00 175.22 176.20 3dv9 s GLY 52 N -1.92 2.11 -0.24 4.36 0.00 -1.26 -2.65 107.32 107.72 3dv9 s GLY 52 Ca 0.21 -2.60 0.01 0.00 0.00 0.00 0.00 44.72 42.35 3dv9 s GLY 52 CO 0.12 1.17 -0.08 -2.27 0.00 0.00 0.00 173.10 172.05 3dv9 s LEU 53 N 1.40 2.79 0.68 0.66 2.96 -1.26 -5.04 118.68 120.87 3dv9 s LEU 53 Ca 0.05 -1.21 -0.12 0.00 -0.22 0.00 0.00 54.13 52.64 3dv9 s LEU 53 Cb -0.27 -1.29 0.00 0.00 0.50 0.00 0.00 46.19 45.13 3dv9 s LEU 53 CO 0.01 -0.21 1.06 -0.94 -1.32 0.00 0.00 176.35 174.95 3dv9 s SER 54 N 1.31 5.39 0.26 3.68 1.04 -1.26 -4.25 113.70 119.88 3dv9 s SER 54 Ca -0.06 1.66 -0.01 0.00 0.48 0.00 0.00 55.95 58.02 3dv9 s SER 54 Cb -0.19 -2.50 0.51 0.00 0.10 0.00 0.00 66.02 63.94 3dv9 s SER 54 CO -0.06 -1.43 1.78 0.03 0.98 0.00 0.00 173.24 174.54 3dv9 h ARG 55 N -0.55 0.69 -0.46 4.02 3.08 -1.96 -0.25 114.38 118.94 3dv9 h ARG 55 Ca -0.44 -0.04 -0.08 0.00 0.07 0.00 0.00 59.98 59.49 3dv9 h ARG 55 Cb 1.21 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 31.09 3dv9 h ARG 55 CO 0.56 0.45 -0.02 0.93 -1.07 0.00 0.00 179.97 180.82 3dv9 h GLU 56 N 0.71 0.84 -0.26 0.04 3.07 -1.93 -2.00 114.58 115.05 3dv9 h GLU 56 Ca 0.45 -0.28 -0.07 0.00 -0.50 0.00 0.00 59.36 58.97 3dv9 h GLU 56 Cb 0.57 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.40 3dv9 h GLU 56 CO -0.32 0.90 -0.13 1.49 -1.40 0.00 0.00 179.01 179.55 3dv9 h GLU 57 N 0.68 0.42 -0.87 2.33 4.81 -1.77 -2.21 114.58 117.98 3dv9 h GLU 57 Ca 0.13 -0.12 0.06 0.00 -0.13 0.00 0.00 59.36 59.31 3dv9 h GLU 57 Cb 0.54 -0.05 -0.06 0.00 0.63 0.00 0.00 28.75 29.81 3dv9 h GLU 57 CO 0.03 0.55 0.54 0.00 -0.73 0.00 0.00 179.01 179.40 3dv9 h ALA 58 N 1.48 1.20 0.00 2.92 0.00 -0.72 -0.85 119.26 123.28 3dv9 h ALA 58 Ca 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3dv9 h ALA 58 Cb 0.46 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3dv9 h ALA 58 CO 0.03 0.29 0.00 0.66 0.00 0.00 0.00 179.25 180.23 3dv9 n TYR 59 N -4.61 0.00 0.00 0.00 4.01 -0.78 -1.58 117.16 114.19 3dv9 n TYR 59 Ca 0.13 -0.04 0.00 0.00 -0.16 0.00 0.00 57.90 57.82 3dv9 n TYR 59 Cb 0.18 -0.11 0.00 0.00 -0.31 0.00 0.00 39.34 39.10 3dv9 n TYR 59 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 3dv9 n HIS 61 N 0.94 0.00 -1.64 -0.72 8.25 -0.33 -4.83 115.22 116.90 3dv9 n HIS 61 Ca 0.00 0.00 -0.52 0.00 -0.26 0.00 0.00 57.72 56.94 3dv9 n HIS 61 Cb 0.04 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.10 3dv9 n HIS 61 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 3dv9 n GLU 62 N 0.00 1.39 0.00 -0.41 2.13 -0.62 -1.05 120.64 122.09 3dv9 n GLU 62 Ca 0.00 0.50 0.00 0.00 0.66 0.00 0.00 57.16 58.32 3dv9 n GLU 62 Cb 0.00 -2.19 0.00 0.00 0.27 0.00 0.00 31.44 29.52 3dv9 n GLU 62 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3dv9 n GLY 63 N 3.22 3.35 3.78 8.31 0.00 -1.26 -4.41 105.19 118.18 3dv9 n GLY 63 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 3dv9 n GLY 63 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3dv9 s ARG 64 N -0.72 4.06 0.52 1.61 3.52 -0.21 -3.51 118.95 124.22 3dv9 s ARG 64 Ca 0.00 1.54 -0.23 0.00 -0.13 0.00 0.00 55.73 56.91 3dv9 s ARG 64 Cb 0.00 -2.47 -0.06 0.00 -1.56 0.00 0.00 34.95 30.86 3dv9 s ARG 64 CO 0.00 -0.24 1.36 0.25 -0.81 0.00 0.00 175.30 175.86 3dv9 n THR 65 N -0.24 3.58 -0.27 4.11 -2.24 -1.26 -4.82 114.28 113.14 3dv9 n THR 65 Ca 0.06 -0.50 0.08 0.00 -2.27 0.00 0.00 64.05 61.42 3dv9 n THR 65 Cb 0.50 -1.68 0.22 0.00 -2.10 0.00 0.00 70.33 67.26 3dv9 n THR 65 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 3dv9 h GLY 66 N 1.60 1.16 0.99 3.38 0.00 -1.94 -1.42 103.07 106.84 3dv9 h GLY 66 Ca -0.51 -0.06 -0.02 0.00 0.00 0.00 0.00 47.33 46.75 3dv9 h GLY 66 CO 0.58 -0.23 0.32 0.00 0.00 0.00 0.00 176.54 177.20 3dv9 h ALA 67 N 1.65 0.78 -0.36 3.60 0.00 -1.94 0.07 119.26 123.07 3dv9 h ALA 67 Ca 0.46 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 55.17 3dv9 h ALA 67 Cb 0.82 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 3dv9 h ALA 67 CO -0.53 0.32 -0.12 1.03 0.00 0.00 0.00 179.25 179.94 3dv9 h SER 68 N 0.83 0.73 -0.22 0.00 0.87 -1.73 0.15 113.55 114.18 3dv9 h SER 68 Ca 0.21 -0.38 0.02 0.00 -1.23 0.00 0.00 61.79 60.41 3dv9 h SER 68 Cb 0.07 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 61.81 3dv9 h SER 68 CO -0.03 0.94 0.08 0.74 -0.53 0.00 0.00 176.83 178.03 3dv9 h THR 69 N 0.51 0.95 -0.58 2.23 2.02 -1.08 0.23 112.91 117.19 3dv9 h THR 69 Ca 0.09 -0.07 -0.00 0.00 0.77 0.00 0.00 66.41 67.20 3dv9 h THR 69 Cb 0.64 0.75 -0.03 0.00 -1.74 0.00 0.00 68.15 67.77 3dv9 h THR 69 CO 0.04 0.03 0.35 0.40 0.37 0.00 0.00 175.52 176.72 3dv9 h ILE 70 N 0.19 1.17 -0.22 3.11 2.04 -0.81 -2.72 117.51 120.27 3dv9 h ILE 70 Ca 0.10 -0.38 -0.10 0.00 1.00 0.00 0.00 64.86 65.48 3dv9 h ILE 70 Cb 0.06 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 36.51 3dv9 h ILE 70 CO -0.09 0.18 -0.29 0.78 0.00 0.00 0.00 178.15 178.73 3dv9 h ASN 71 N 0.78 0.45 0.05 1.72 2.35 -0.34 0.11 115.58 120.71 3dv9 h ASN 71 Ca 0.21 -0.16 0.01 0.00 -0.55 0.00 0.00 56.30 55.80 3dv9 h ASN 71 Cb -0.02 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.22 3dv9 h ASN 71 CO -0.04 0.72 -0.07 0.40 -1.65 0.00 0.00 177.43 176.79 3dv9 h ILE 72 N 0.39 0.83 -0.45 2.81 2.04 -0.83 0.12 117.51 122.42 3dv9 h ILE 72 Ca 0.05 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.78 3dv9 h ILE 72 Cb 0.70 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 3dv9 h ILE 72 CO 0.05 0.00 -0.25 0.58 0.00 0.00 0.00 178.15 178.54 3dv9 h VAL 73 N -0.15 1.27 -0.26 1.67 2.07 -1.20 -2.83 116.25 116.82 3dv9 h VAL 73 Ca 0.01 -1.41 -0.01 0.00 0.82 0.00 0.00 66.70 66.11 3dv9 h VAL 73 Cb 0.16 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 3dv9 h VAL 73 CO -0.03 0.48 0.11 -1.28 0.02 0.00 0.00 177.57 176.87 3dv9 h SER 74 N 0.80 0.36 -0.65 0.57 0.87 -0.65 -2.01 113.55 112.85 3dv9 h SER 74 Ca 0.10 -0.16 0.05 0.00 -1.23 0.00 0.00 61.79 60.55 3dv9 h SER 74 Cb 0.82 -0.09 -0.05 0.00 -0.44 0.00 0.00 62.40 62.63 3dv9 h SER 74 CO 0.07 0.42 0.37 0.03 -0.53 0.00 0.00 176.83 177.19 3dv9 h ARG 75 N 0.28 0.68 -0.01 2.24 3.08 -0.74 0.35 114.38 120.26 3dv9 h ARG 75 Ca 0.09 -0.04 -0.16 0.00 0.07 0.00 0.00 59.98 59.94 3dv9 h ARG 75 Cb 0.17 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 3dv9 h ARG 75 CO -0.01 0.45 -0.74 0.07 -1.07 0.00 0.00 179.97 178.67 3dv9 h ARG 76 N 0.70 0.05 0.00 0.04 0.11 -1.41 0.51 114.38 114.39 3dv9 h ARG 76 Ca 0.28 -0.05 -0.28 0.00 0.10 0.00 0.00 59.98 60.03 3dv9 h ARG 76 Cb 0.13 0.01 -0.05 0.00 1.11 0.00 0.00 29.97 31.18 3dv9 h ARG 76 CO -0.16 0.77 -1.63 0.93 0.10 0.00 0.00 179.97 179.98 3dv9 h GLU 77 N 0.03 0.00 0.00 0.08 5.08 -1.02 -3.41 114.58 115.35 3dv9 h GLU 77 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3dv9 h GLU 77 Cb 1.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.56 3dv9 h GLU 77 CO 0.10 0.54 -0.26 0.54 -1.00 0.00 0.00 179.01 178.93 3dv9 n ARG 78 N -3.07 3.89 -1.02 2.33 1.74 0.12 -5.04 116.66 115.62 3dv9 n ARG 78 Ca -0.15 0.00 -0.01 0.00 -0.77 0.00 0.00 57.85 56.92 3dv9 n ARG 78 Cb 1.04 -0.55 -0.00 0.00 -1.02 0.00 0.00 32.46 31.93 3dv9 n ARG 78 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dv9 n GLY 79 N 1.13 0.46 3.24 -0.13 0.00 0.18 -4.97 105.19 105.09 3dv9 n GLY 79 Ca 0.00 -0.16 -0.10 0.00 0.00 0.00 0.00 46.02 45.76 3dv9 n GLY 79 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3dv9 s HIS 80 N -1.90 -0.01 0.80 1.61 -3.43 -1.25 -4.93 115.29 106.18 3dv9 s HIS 80 Ca 0.00 -0.28 -0.13 0.00 -0.80 0.00 0.00 55.06 53.85 3dv9 s HIS 80 Cb 0.00 0.05 0.08 0.00 -1.43 0.00 0.00 32.58 31.28 3dv9 s HIS 80 CO 0.00 -0.55 1.17 -0.51 -2.00 0.00 0.00 174.74 172.85 3dv9 s ASP 81 N -2.49 3.83 0.65 7.38 1.01 -1.26 -2.66 116.67 123.13 3dv9 s ASP 81 Ca 0.00 2.22 -0.14 0.00 0.71 0.00 0.00 52.55 55.34 3dv9 s ASP 81 Cb 0.02 -2.57 -0.01 0.00 1.01 0.00 0.00 42.92 41.37 3dv9 s ASP 81 CO -0.08 -2.50 1.07 0.00 0.21 0.00 0.00 175.17 173.88 3dv9 s ALA 82 N -2.34 2.61 0.67 5.23 0.00 -1.26 -4.94 121.76 121.72 3dv9 s ALA 82 Ca 0.70 0.34 -0.10 0.00 0.00 0.00 0.00 51.96 52.89 3dv9 s ALA 82 Cb -0.25 -3.24 0.01 0.00 0.00 0.00 0.00 23.12 19.63 3dv9 s ALA 82 CO 0.51 -1.13 1.05 0.95 0.00 0.00 0.00 175.76 177.15 3dv9 s THR 83 N -2.62 3.69 0.21 0.00 -4.23 -1.26 -4.91 115.64 106.52 3dv9 s THR 83 Ca 0.63 0.45 -0.09 0.00 -1.18 0.00 0.00 61.69 61.50 3dv9 s THR 83 Cb -0.17 -3.53 0.14 0.00 1.34 0.00 0.00 72.50 70.29 3dv9 s THR 83 CO 0.44 -0.67 1.77 -0.33 -0.54 0.00 0.00 174.62 175.29 3dv9 h GLU 84 N -0.53 0.48 -0.30 3.99 5.08 -1.99 -1.66 114.58 119.64 3dv9 h GLU 84 Ca -0.45 -0.03 0.03 0.00 -1.00 0.00 0.00 59.36 57.91 3dv9 h GLU 84 Cb 1.25 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 30.35 3dv9 h GLU 84 CO 0.63 0.32 0.11 1.49 -1.00 0.00 0.00 179.01 180.56 3dv9 h GLU 85 N 0.50 0.24 -0.37 2.33 4.81 -2.00 -1.24 114.58 118.85 3dv9 h GLU 85 Ca 0.30 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.51 3dv9 h GLU 85 Cb 0.32 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 3dv9 h GLU 85 CO -0.26 0.16 0.22 0.93 -0.73 0.00 0.00 179.01 179.32 3dv9 h GLU 86 N 0.25 0.51 -0.41 1.92 5.08 -1.81 -2.18 114.58 117.94 3dv9 h GLU 86 Ca 0.13 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 3dv9 h GLU 86 Cb 0.10 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 3dv9 h GLU 86 CO -0.13 0.40 0.19 0.82 -1.00 0.00 0.00 179.01 179.28 3dv9 h ILE 87 N 0.48 1.18 -0.84 3.13 2.04 -1.04 0.20 117.51 122.66 3dv9 h ILE 87 Ca 0.13 -0.51 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 3dv9 h ILE 87 Cb 0.03 0.76 -0.04 0.00 -0.74 0.00 0.00 36.82 36.83 3dv9 h ILE 87 CO -0.02 0.19 0.49 0.50 0.00 0.00 0.00 178.15 179.31 3dv9 h LYS 88 N 0.52 1.15 -0.43 2.37 3.64 -1.14 -0.21 116.57 122.46 3dv9 h LYS 88 Ca 0.14 -0.12 -0.04 0.00 -1.27 0.00 0.00 60.65 59.37 3dv9 h LYS 88 Cb 0.13 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 31.70 3dv9 h LYS 88 CO -0.02 0.82 0.12 0.00 -2.27 0.00 0.00 179.45 178.10 3dv9 h ALA 89 N 1.26 0.56 -0.00 5.00 0.00 -0.97 -1.67 119.26 123.44 3dv9 h ALA 89 Ca 0.30 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3dv9 h ALA 89 Cb -0.02 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 3dv9 h ALA 89 CO -0.05 0.23 -0.00 0.82 0.00 0.00 0.00 179.25 180.25 3dv9 h ILE 90 N 0.55 1.27 -0.83 0.00 2.04 -0.82 -1.34 117.51 118.39 3dv9 h ILE 90 Ca 0.14 -0.81 0.04 0.00 1.00 0.00 0.00 64.86 65.23 3dv9 h ILE 90 Cb 0.30 1.81 -0.05 0.00 -0.74 0.00 0.00 36.82 38.14 3dv9 h ILE 90 CO -0.00 0.21 0.53 0.22 0.00 0.00 0.00 178.15 179.11 3dv9 h TYR 91 N -0.33 1.00 -0.48 1.37 3.20 -1.04 -0.66 116.97 120.01 3dv9 h TYR 91 Ca 0.00 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.87 3dv9 h TYR 91 Cb 0.34 -0.33 -0.02 0.00 1.54 0.00 0.00 36.73 38.26 3dv9 h TYR 91 CO 0.04 0.57 0.20 0.37 -1.64 0.00 0.00 178.16 177.69 3dv9 h GLN 92 N 1.03 0.72 -0.67 1.82 4.15 -1.20 -0.15 115.11 120.81 3dv9 h GLN 92 Ca 0.34 -0.13 -0.04 0.00 0.77 0.00 0.00 58.65 59.59 3dv9 h GLN 92 Cb 0.03 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 27.57 3dv9 h GLN 92 CO -0.12 0.64 0.26 0.00 -1.93 0.00 0.00 178.83 177.69 3dv9 h ALA 93 N 1.04 1.21 -0.33 3.38 0.00 -0.77 -1.78 119.26 122.01 3dv9 h ALA 93 Ca 0.16 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 3dv9 h ALA 93 Cb 0.19 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3dv9 h ALA 93 CO -0.01 0.58 -0.12 -0.22 0.00 0.00 0.00 179.25 179.47 3dv9 h LYS 94 N 0.97 0.66 -0.08 0.00 3.64 -0.73 -0.54 116.57 120.48 3dv9 h LYS 94 Ca 0.23 -0.28 0.03 0.00 -1.27 0.00 0.00 60.65 59.36 3dv9 h LYS 94 Cb 0.19 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.95 3dv9 h LYS 94 CO -0.02 0.86 -0.08 1.15 -2.27 0.00 0.00 179.45 179.09 3dv9 h THR 95 N 0.44 0.76 -0.61 1.00 2.02 -0.83 -0.60 112.91 115.08 3dv9 h THR 95 Ca 0.08 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.22 3dv9 h THR 95 Cb 0.64 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.78 3dv9 h THR 95 CO 0.04 0.00 0.22 -0.33 0.37 0.00 0.00 175.52 175.82 3dv9 h GLU 96 N -0.11 0.91 -0.24 6.66 5.08 -1.23 -1.87 114.58 123.79 3dv9 h GLU 96 Ca 0.06 -0.16 -0.05 0.00 -1.00 0.00 0.00 59.36 58.21 3dv9 h GLU 96 Cb 0.20 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 3dv9 h GLU 96 CO -0.15 0.76 -0.05 1.49 -1.00 0.00 0.00 179.01 180.06 3dv9 h GLU 97 N 0.89 0.45 -0.57 2.33 4.57 -0.81 -2.96 114.58 118.48 3dv9 h GLU 97 Ca 0.21 -0.17 0.07 0.00 -1.18 0.00 0.00 59.36 58.28 3dv9 h GLU 97 Cb 0.21 -0.03 -0.06 0.00 -0.16 0.00 0.00 28.75 28.71 3dv9 h GLU 97 CO -0.01 0.68 0.25 0.35 -1.18 0.00 0.00 179.01 179.10 3dv9 h PHE 98 N 0.20 0.46 0.00 0.92 3.57 -0.93 -2.21 116.94 118.94 3dv9 h PHE 98 Ca 0.06 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.59 3dv9 h PHE 98 Cb 0.51 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.13 3dv9 h PHE 98 CO 0.05 0.17 0.00 0.09 -2.23 0.00 0.00 178.31 176.39 3dv9 n ASN 99 N -4.93 0.00 -0.30 0.41 3.02 -0.72 -3.01 115.26 109.74 3dv9 n ASN 99 Ca 0.07 -0.22 0.12 0.00 -0.03 0.00 0.00 54.58 54.52 3dv9 n ASN 99 Cb 0.21 -0.08 0.13 0.00 -0.61 0.00 0.00 39.78 39.43 3dv9 n ASN 99 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3dv9 n LYS 100 N -1.08 0.80 -3.76 3.52 5.02 -0.83 -4.92 118.16 116.91 3dv9 n LYS 100 Ca 0.08 -0.60 -0.19 0.00 -2.02 0.00 0.00 58.31 55.58 3dv9 n LYS 100 Cb 0.05 -1.49 -0.05 0.00 -0.02 0.00 0.00 35.03 33.53 3dv9 n LYS 100 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3dv9 n PRO 102 N -0.72 1.04 -1.57 0.00 -0.04 -1.26 -4.91 135.00 127.54 3dv9 n PRO 102 Ca -0.07 0.37 -0.52 0.00 -0.04 0.00 0.00 63.50 63.24 3dv9 n PRO 102 Cb 0.44 -1.72 -0.06 0.00 -0.04 0.00 0.00 33.50 32.12 3dv9 n PRO 102 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 3dv9 n LYS 103 N 0.61 0.98 -2.06 0.54 5.02 -1.26 -4.90 118.16 117.09 3dv9 n LYS 103 Ca 0.11 0.35 -0.41 0.00 -2.02 0.00 0.00 58.31 56.34 3dv9 n LYS 103 Cb 0.34 -1.94 -0.02 0.00 -0.02 0.00 0.00 35.03 33.39 3dv9 n LYS 103 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3dv9 s ALA 104 N 0.27 3.56 0.63 7.82 0.00 -1.26 -4.97 121.76 127.81 3dv9 s ALA 104 Ca 0.83 1.30 -0.18 0.00 0.00 0.00 0.00 51.96 53.91 3dv9 s ALA 104 Cb -0.98 -3.52 -0.02 0.00 0.00 0.00 0.00 23.12 18.60 3dv9 s ALA 104 CO 0.49 -0.71 1.26 -1.21 0.00 0.00 0.00 175.76 175.59 3dv9 s GLU 105 N -1.08 2.68 0.00 0.00 2.02 -1.26 -4.76 118.70 116.29 3dv9 s GLU 105 Ca 0.54 1.96 0.00 0.00 0.02 0.00 0.00 54.97 57.49 3dv9 s GLU 105 Cb -0.41 -1.87 0.00 0.00 0.10 0.00 0.00 34.13 31.95 3dv9 s GLU 105 CO 0.48 -1.47 0.00 0.54 0.02 0.00 0.00 175.26 174.83 3dv9 n ARG 106 N -1.84 0.00 -4.59 1.61 1.74 -1.26 -0.20 116.66 112.11 3dv9 n ARG 106 Ca 0.15 0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 56.89 3dv9 n ARG 106 Cb 0.49 0.00 -0.11 0.00 -1.02 0.00 0.00 32.46 31.82 3dv9 n ARG 106 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 3dv9 s PRO 108 N 0.00 2.81 0.00 5.56 0.02 -1.26 -4.64 135.00 137.49 3dv9 s PRO 108 Ca 0.00 -0.53 0.00 0.00 0.02 0.00 0.00 61.00 60.49 3dv9 s PRO 108 Cb 0.00 -2.62 0.00 0.00 0.02 0.00 0.00 34.50 31.90 3dv9 s PRO 108 CO 0.00 0.65 0.00 0.41 -0.33 0.00 0.00 177.00 177.73 3dv9 n GLY 109 N 2.27 3.21 0.06 0.52 0.00 -1.26 -3.18 105.19 106.80 3dv9 n GLY 109 Ca -0.18 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.71 3dv9 n GLY 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dv9 h ALA 110 N 0.00 -0.02 -0.74 4.61 0.00 -1.91 -1.31 119.26 119.90 3dv9 h ALA 110 Ca 0.00 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 3dv9 h ALA 110 Cb 0.00 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3dv9 h ALA 110 CO 0.00 -0.27 0.35 1.25 0.00 0.00 0.00 179.25 180.58 3dv9 h LEU 111 N -0.49 0.97 -0.08 0.00 5.85 -1.91 -1.68 115.31 117.97 3dv9 h LEU 111 Ca -0.00 -0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.58 3dv9 h LEU 111 Cb 0.48 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.25 3dv9 h LEU 111 CO 0.00 0.84 0.05 -0.08 -0.34 0.00 0.00 178.44 178.91 3dv9 h GLU 112 N 1.04 0.11 -0.49 1.25 4.81 -1.96 -1.38 114.58 117.96 3dv9 h GLU 112 Ca 0.25 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.41 3dv9 h GLU 112 Cb 0.13 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 3dv9 h GLU 112 CO -0.03 0.13 0.05 -0.24 -0.73 0.00 0.00 179.01 178.19 3dv9 h VAL 113 N 0.06 1.23 -0.59 0.32 3.04 -1.08 -2.42 116.25 116.81 3dv9 h VAL 113 Ca 0.03 -0.91 -0.06 0.00 -1.01 0.00 0.00 66.70 64.75 3dv9 h VAL 113 Cb 0.05 0.81 -0.03 0.00 -2.01 0.00 0.00 31.29 30.11 3dv9 h VAL 113 CO -0.01 0.33 0.12 -0.07 -1.01 0.00 0.00 177.57 176.93 3dv9 h LEU 114 N 0.74 0.87 -0.89 3.16 3.38 -1.15 -0.98 115.31 120.45 3dv9 h LEU 114 Ca 0.15 -0.18 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 3dv9 h LEU 114 Cb 0.38 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 3dv9 h LEU 114 CO 0.01 0.86 -0.01 0.74 0.09 0.00 0.00 178.44 180.13 3dv9 h THR 115 N 0.88 1.25 -0.26 0.22 2.02 -1.00 0.14 112.91 116.15 3dv9 h THR 115 Ca 0.19 -1.03 -0.07 0.00 0.77 0.00 0.00 66.41 66.26 3dv9 h THR 115 Cb 0.35 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 3dv9 h THR 115 CO 0.00 0.36 -0.12 0.11 0.37 0.00 0.00 175.52 176.25 3dv9 h LYS 116 N 0.76 0.54 -0.08 6.66 1.57 -0.95 -1.19 116.57 123.88 3dv9 h LYS 116 Ca 0.14 -0.23 -0.00 0.00 -1.87 0.00 0.00 60.65 58.69 3dv9 h LYS 116 Cb 0.47 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.76 3dv9 h LYS 116 CO 0.02 0.79 0.04 0.82 -0.57 0.00 0.00 179.45 180.55 3dv9 h ILE 117 N 0.27 1.12 -0.77 1.86 2.04 -0.93 -1.81 117.51 119.29 3dv9 h ILE 117 Ca 0.06 -0.35 0.02 0.00 1.00 0.00 0.00 64.86 65.59 3dv9 h ILE 117 Cb 0.62 1.21 -0.04 0.00 -0.74 0.00 0.00 36.82 37.87 3dv9 h ILE 117 CO 0.04 0.10 0.50 0.50 0.00 0.00 0.00 178.15 179.29 3dv9 h LYS 118 N -0.00 0.96 -0.10 2.37 1.63 -0.97 -2.53 116.57 117.93 3dv9 h LYS 118 Ca 0.03 -0.06 -0.03 0.00 -0.85 0.00 0.00 60.65 59.74 3dv9 h LYS 118 Cb 0.13 -0.22 -0.01 0.00 -0.60 0.00 0.00 32.23 31.54 3dv9 h LYS 118 CO -0.00 0.64 -0.06 0.77 -3.45 0.00 0.00 179.45 177.35 3dv9 h SER 119 N 0.99 0.13 -0.00 4.20 0.02 -0.83 -1.79 113.55 116.27 3dv9 h SER 119 Ca 0.30 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.23 3dv9 h SER 119 Cb -0.05 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.46 3dv9 h SER 119 CO -0.09 0.21 0.00 -0.62 -1.14 0.00 0.00 176.83 175.20 3dv9 n GLU 120 N -4.39 1.08 -0.69 3.45 1.02 -0.72 -4.87 120.64 115.53 3dv9 n GLU 120 Ca -0.01 -0.11 0.00 0.00 -0.02 0.00 0.00 57.16 57.01 3dv9 n GLU 120 Cb 0.18 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.11 3dv9 n GLU 120 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dv9 n GLY 121 N 1.02 0.70 3.87 0.62 0.00 -0.67 -5.05 105.19 105.67 3dv9 n GLY 121 Ca 0.23 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.95 3dv9 n GLY 121 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dv9 s LEU 122 N 0.00 3.56 -0.43 0.99 1.43 -0.99 -5.02 118.68 118.22 3dv9 s LEU 122 Ca 0.00 1.33 -0.13 0.00 -1.03 0.00 0.00 54.13 54.29 3dv9 s LEU 122 Cb 0.00 -4.28 0.05 0.00 0.03 0.00 0.00 46.19 41.99 3dv9 s LEU 122 CO 0.00 -0.62 0.31 -0.89 0.23 0.00 0.00 176.35 175.38 3dv9 s THR 123 N -2.74 4.95 0.85 5.49 2.01 -0.16 -4.31 115.64 121.73 3dv9 s THR 123 Ca 0.54 -0.98 -0.14 0.00 0.31 0.00 0.00 61.69 61.42 3dv9 s THR 123 Cb -0.10 -3.88 0.20 0.00 0.01 0.00 0.00 72.50 68.73 3dv9 s THR 123 CO 0.40 -0.43 1.06 -2.65 -0.69 0.00 0.00 174.62 172.30 3dv9 n PRO 124 N 5.11 -1.44 -3.80 4.92 -0.02 -1.26 -1.70 135.00 136.80 3dv9 n PRO 124 Ca -0.12 -1.64 -0.13 0.00 -2.02 0.00 0.00 63.50 59.59 3dv9 n PRO 124 Cb 0.45 -1.18 -0.14 0.00 -0.02 0.00 0.00 33.50 32.61 3dv9 n PRO 124 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3dv9 s VAL 126 N -3.24 -0.03 -0.22 -1.45 1.01 -1.22 -4.71 120.40 110.55 3dv9 s VAL 126 Ca 0.61 0.11 -0.01 0.00 0.00 0.00 0.00 61.98 62.69 3dv9 s VAL 126 Cb -0.02 -0.13 0.06 0.00 0.00 0.00 0.00 36.38 36.29 3dv9 s VAL 126 CO 0.44 0.05 0.01 -0.69 0.00 0.00 0.00 175.10 174.90 3dv9 s VAL 127 N 0.63 0.92 0.00 2.92 1.01 0.02 -0.62 120.40 125.28 3dv9 s VAL 127 Ca -0.05 -0.87 0.02 0.00 0.00 0.00 0.00 61.98 61.07 3dv9 s VAL 127 Cb -0.07 -1.36 -0.01 0.00 0.00 0.00 0.00 36.38 34.94 3dv9 s VAL 127 CO -0.02 -0.21 -0.05 0.28 0.00 0.00 0.00 175.10 175.09 3dv9 s THR 128 N 1.67 0.38 -2.18 3.92 -1.32 0.58 -4.20 115.64 114.49 3dv9 s THR 128 Ca -0.02 -0.33 0.27 0.00 -1.21 0.00 0.00 61.69 60.40 3dv9 s THR 128 Cb -0.18 -0.35 0.68 0.00 -1.51 0.00 0.00 72.50 71.14 3dv9 s THR 128 CO -0.09 0.03 1.91 0.61 -2.21 0.00 0.00 174.62 174.87 3dv9 n GLY 129 N 2.74 -0.54 3.76 6.08 0.00 -1.26 -2.68 105.19 113.29 3dv9 n GLY 129 Ca -0.14 -0.29 -0.39 0.00 0.00 0.00 0.00 46.02 45.20 3dv9 n GLY 129 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3dv9 s SER 130 N -1.87 7.13 -0.69 1.61 0.15 -1.26 -4.51 113.70 114.25 3dv9 s SER 130 Ca 0.40 2.22 0.04 0.00 0.70 0.00 0.00 55.95 59.30 3dv9 s SER 130 Cb 0.20 -2.62 0.17 0.00 -1.71 0.00 0.00 66.02 62.06 3dv9 s SER 130 CO 0.32 -0.24 0.49 -0.83 1.20 0.00 0.00 173.24 174.18 3dv9 s GLY 131 N -1.05 2.86 -0.22 9.45 0.00 -1.26 -2.15 107.32 114.95 3dv9 s GLY 131 Ca 0.48 -3.72 -0.12 0.00 0.00 0.00 0.00 44.72 41.36 3dv9 s GLY 131 CO 0.38 1.08 0.53 -2.27 0.00 0.00 0.00 173.10 172.82 3dv9 s LEU 135 N -1.18 -0.46 0.31 0.66 2.96 -1.26 -5.05 118.68 114.66 3dv9 s LEU 135 Ca 0.23 1.16 0.09 0.00 -0.22 0.00 0.00 54.13 55.40 3dv9 s LEU 135 Cb -0.09 1.80 0.51 0.00 0.50 0.00 0.00 46.19 48.91 3dv9 s LEU 135 CO -0.12 -0.21 1.72 0.25 -1.32 0.00 0.00 176.35 176.66 3dv9 h LEU 136 N 7.07 0.14 -0.36 -0.68 5.85 -2.02 0.86 115.31 126.17 3dv9 h LEU 136 Ca -0.34 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.33 3dv9 h LEU 136 Cb 1.20 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.18 3dv9 h LEU 136 CO 0.24 0.56 0.24 0.44 -0.34 0.00 0.00 178.44 179.57 3dv9 h ASP 137 N 0.11 0.41 -0.45 1.25 3.45 -2.02 0.48 116.42 119.65 3dv9 h ASP 137 Ca 0.01 -0.01 -0.03 0.00 0.43 0.00 0.00 57.03 57.43 3dv9 h ASP 137 Cb 0.82 -0.10 -0.02 0.00 -0.56 0.00 0.00 39.33 39.46 3dv9 h ASP 137 CO 0.06 0.30 0.16 -0.09 -1.57 0.00 0.00 179.24 178.10 3dv9 h ARG 138 N 0.48 0.68 -0.59 3.56 9.65 -1.81 -0.97 114.38 125.38 3dv9 h ARG 138 Ca 0.13 -0.13 -0.03 0.00 -1.10 0.00 0.00 59.98 58.85 3dv9 h ARG 138 Cb -0.06 -0.10 -0.03 0.00 -1.39 0.00 0.00 29.97 28.39 3dv9 h ARG 138 CO -0.03 0.64 0.27 -0.07 2.80 0.00 0.00 179.97 183.58 3dv9 h LEU 139 N 0.58 0.79 -0.81 3.80 3.38 0.78 -2.77 115.31 121.06 3dv9 h LEU 139 Ca 0.15 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 3dv9 h LEU 139 Cb 0.22 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.73 3dv9 h LEU 139 CO -0.01 0.71 0.49 -1.13 0.09 0.00 0.00 178.44 178.59 3dv9 h ASN 140 N 0.81 0.97 1.45 -0.43 -1.24 0.18 0.21 115.58 117.53 3dv9 h ASN 140 Ca 0.20 -0.06 0.00 0.00 0.71 0.00 0.00 56.30 57.15 3dv9 h ASN 140 Cb 0.14 -0.24 0.00 0.00 0.73 0.00 0.00 38.32 38.95 3dv9 h ASN 140 CO -0.02 0.75 0.00 0.45 -1.29 0.00 0.00 177.43 177.31 3dv9 h HIS 141 N 1.11 0.00 0.00 0.67 3.86 -1.07 -3.05 115.15 116.66 3dv9 h HIS 141 Ca 0.29 0.00 -0.27 0.00 -1.16 0.00 0.00 60.37 59.23 3dv9 h HIS 141 Cb -0.04 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 28.38 3dv9 h HIS 141 CO -0.01 0.00 -2.17 0.09 0.86 0.00 0.00 177.93 176.70 3dv9 n ASN 142 N -2.87 0.55 -3.30 2.45 3.02 -1.05 -4.70 115.26 109.36 3dv9 n ASN 142 Ca 0.03 0.00 -0.25 0.00 -0.03 0.00 0.00 54.58 54.33 3dv9 n ASN 142 Cb 0.41 1.13 -0.08 0.00 -0.61 0.00 0.00 39.78 40.63 3dv9 n ASN 142 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3dv9 n PHE 143 N -2.57 1.20 -1.83 3.10 3.72 0.70 -4.93 117.46 116.84 3dv9 n PHE 143 Ca -0.24 -3.79 -0.42 0.00 -0.05 0.00 0.00 57.45 52.94 3dv9 n PHE 143 Cb 0.98 -0.42 -0.03 0.00 -0.94 0.00 0.00 39.48 39.07 3dv9 n PHE 143 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 176.76 174.57 3dv9 s PRO 144 N -1.64 4.17 -0.16 -1.08 0.02 -1.15 -1.84 135.00 133.31 3dv9 s PRO 144 Ca 0.37 2.44 0.00 0.00 0.02 0.00 0.00 61.00 63.83 3dv9 s PRO 144 Cb 0.15 -3.65 0.00 0.00 0.02 0.00 0.00 34.50 31.02 3dv9 s PRO 144 CO -0.08 -0.79 0.00 0.41 -0.33 0.00 0.00 177.00 176.21 3dv9 n GLY 145 N 4.13 0.38 0.10 0.52 0.00 -1.26 -4.90 105.19 104.16 3dv9 n GLY 145 Ca 0.17 -0.07 -0.19 0.00 0.00 0.00 0.00 46.02 45.92 3dv9 n GLY 145 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3dv9 h ILE 146 N 0.00 1.29 -2.90 -0.61 1.08 -1.73 -3.47 117.51 111.16 3dv9 h ILE 146 Ca -0.03 -2.32 -0.60 0.00 -0.39 0.00 0.00 64.86 61.52 3dv9 h ILE 146 Cb 0.55 2.82 -0.08 0.00 -3.07 0.00 0.00 36.82 37.04 3dv9 h ILE 146 CO 0.05 0.54 -0.58 -0.36 -0.69 0.00 0.00 178.15 177.11 3dv9 s PHE 147 N -2.35 3.15 -0.01 1.37 0.08 -1.26 -4.64 117.98 114.33 3dv9 s PHE 147 Ca -0.22 0.01 0.07 0.00 0.12 0.00 0.00 56.93 56.92 3dv9 s PHE 147 Cb 0.02 -1.55 -0.02 0.00 -0.57 0.00 0.00 43.02 40.90 3dv9 s PHE 147 CO 0.69 0.52 -0.23 -0.65 -0.10 0.00 0.00 175.22 175.44 3dv9 s GLN 148 N -2.81 1.82 0.33 0.44 -0.21 -1.26 -5.00 119.66 112.96 3dv9 s GLN 148 Ca 0.30 -0.87 0.02 0.00 0.02 0.00 0.00 55.36 54.83 3dv9 s GLN 148 Cb -0.11 -1.80 0.58 0.00 1.00 0.00 0.00 33.01 32.68 3dv9 s GLN 148 CO 0.23 0.49 1.96 0.00 -2.12 0.00 0.00 175.29 175.84 3dv9 h ALA 149 N 5.42 1.54 0.00 6.09 0.00 -2.00 0.76 119.26 131.08 3dv9 h ALA 149 Ca -0.42 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3dv9 h ALA 149 Cb 1.13 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.66 3dv9 h ALA 149 CO 0.47 0.37 0.00 0.27 0.00 0.00 0.00 179.25 180.36 3dv9 n ASN 150 N -4.46 0.00 -3.65 0.00 6.94 -1.26 -4.92 115.26 107.91 3dv9 n ASN 150 Ca 0.10 0.40 -0.27 0.00 -0.02 0.00 0.00 54.58 54.79 3dv9 n ASN 150 Cb 0.13 -0.46 -0.10 0.00 -2.36 0.00 0.00 39.78 37.00 3dv9 n ASN 150 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 3dv9 n LEU 151 N -1.46 3.07 -3.49 -4.53 4.77 0.26 -4.80 117.00 110.83 3dv9 n LEU 151 Ca 0.06 -5.25 0.00 0.00 -0.03 0.00 0.00 56.01 50.78 3dv9 n LEU 151 Cb 0.21 -0.61 -0.05 0.00 -2.33 0.00 0.00 43.42 40.65 3dv9 n LEU 151 CO 0.18 1.90 0.57 -0.69 -1.33 0.00 0.00 177.39 178.02 3dv9 s VAL 153 N -1.81 -0.46 0.40 4.08 1.01 0.21 -3.40 120.40 120.43 3dv9 s VAL 153 Ca 0.32 0.00 0.03 0.00 0.00 0.00 0.00 61.98 62.33 3dv9 s VAL 153 Cb 0.05 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.39 3dv9 s VAL 153 CO -0.10 0.00 0.09 0.42 0.00 0.00 0.00 175.10 175.50 3dv9 s THR 154 N 2.28 0.89 0.45 3.92 -4.23 -1.26 -0.31 115.64 117.39 3dv9 s THR 154 Ca -0.04 -2.00 0.26 0.00 -1.18 0.00 0.00 61.69 58.72 3dv9 s THR 154 Cb -0.06 -2.47 0.45 0.00 1.34 0.00 0.00 72.50 71.76 3dv9 s THR 154 CO -0.17 0.00 1.78 0.00 -0.54 0.00 0.00 174.62 175.68 3dv9 h ALA 155 N 1.82 2.58 -0.01 3.99 0.00 -1.21 0.23 119.26 126.67 3dv9 h ALA 155 Ca -0.38 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3dv9 h ALA 155 Cb 1.27 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.12 3dv9 h ALA 155 CO 0.64 -0.98 -0.07 1.97 0.00 0.00 0.00 179.25 180.81 3dv9 n PHE 156 N -4.47 0.00 0.14 0.00 -0.00 -1.26 -3.62 117.46 108.25 3dv9 n PHE 156 Ca 0.26 0.00 0.06 0.00 -0.00 0.00 0.00 57.45 57.77 3dv9 n PHE 156 Cb 1.04 -0.04 0.04 0.00 -0.00 0.00 0.00 39.48 40.52 3dv9 n PHE 156 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.76 176.32 3dv9 h ASP 157 N 1.87 0.00 -4.94 5.98 5.19 -0.92 -3.48 116.42 120.12 3dv9 h ASP 157 Ca 0.00 0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 56.22 3dv9 h ASP 157 Cb 0.47 0.00 -0.20 0.00 0.18 0.00 0.00 39.33 39.78 3dv9 h ASP 157 CO 0.00 0.29 -0.71 0.68 -3.12 0.00 0.00 179.24 176.39 3dv9 s VAL 158 N -3.09 0.26 -0.09 -1.35 -7.23 -1.23 -4.99 120.40 102.67 3dv9 s VAL 158 Ca 0.03 -1.11 -0.27 0.00 -1.81 0.00 0.00 61.98 58.82 3dv9 s VAL 158 Cb 0.07 -0.57 -0.25 0.00 0.56 0.00 0.00 36.38 36.20 3dv9 s VAL 158 CO 0.75 -0.55 0.91 0.11 -0.31 0.00 0.00 175.10 176.01 3dv9 h LYS 159 N 4.35 0.07 -5.59 4.82 1.57 -1.93 -3.46 116.57 116.41 3dv9 h LYS 159 Ca -0.33 -0.09 -0.65 0.00 -1.87 0.00 0.00 60.65 57.71 3dv9 h LYS 159 Cb 1.20 0.03 -0.19 0.00 0.08 0.00 0.00 32.23 33.35 3dv9 h LYS 159 CO 0.45 0.93 -0.64 0.71 -0.57 0.00 0.00 179.45 180.33 3dv9 s TYR 160 N -2.73 3.08 0.60 -1.35 2.02 -1.26 -5.10 117.35 112.61 3dv9 s TYR 160 Ca -0.17 -0.07 0.09 0.00 -0.37 0.00 0.00 57.07 56.55 3dv9 s TYR 160 Cb -0.01 -1.90 0.10 0.00 -0.40 0.00 0.00 41.96 39.75 3dv9 s TYR 160 CO 0.71 0.18 0.83 0.20 -1.57 0.00 0.00 175.55 175.90 3dv9 s GLY 161 N -0.13 1.70 0.26 0.71 0.00 -1.26 -4.25 107.32 104.34 3dv9 s GLY 161 Ca 0.04 -2.20 -0.29 0.00 0.00 0.00 0.00 44.72 42.27 3dv9 s GLY 161 CO 0.02 -1.69 0.97 0.28 0.00 0.00 0.00 173.10 172.68 3dv9 n LYS 162 N -2.33 1.16 -0.16 2.90 5.02 -1.23 -0.56 118.16 122.96 3dv9 n LYS 162 Ca 0.17 0.41 0.06 0.00 -2.02 0.00 0.00 58.31 56.92 3dv9 n LYS 162 Cb 0.62 -1.75 0.18 0.00 -0.02 0.00 0.00 35.03 34.06 3dv9 n LYS 162 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 3dv9 n PRO 163 N 0.90 1.76 -1.85 1.97 -0.04 -1.26 -3.90 135.00 132.59 3dv9 n PRO 163 Ca 0.11 -1.18 -0.41 0.00 -0.04 0.00 0.00 63.50 61.99 3dv9 n PRO 163 Cb 0.30 -1.27 -0.01 0.00 -0.04 0.00 0.00 33.50 32.48 3dv9 n PRO 163 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 3dv9 s ASN 164 N -1.07 6.42 0.00 3.54 3.84 0.28 -3.49 114.94 124.45 3dv9 s ASN 164 Ca 0.24 2.96 0.12 0.00 0.21 0.00 0.00 52.86 56.38 3dv9 s ASN 164 Cb 0.12 -2.65 0.52 0.00 -0.55 0.00 0.00 41.25 38.69 3dv9 s ASN 164 CO 0.17 -0.84 1.37 -0.81 -2.79 0.00 0.00 177.10 174.20 3dv9 n PRO 165 N 1.07 0.02 -0.31 0.43 -0.04 -1.26 -4.23 135.00 130.68 3dv9 n PRO 165 Ca 0.03 0.28 0.02 0.00 -0.04 0.00 0.00 63.50 63.79 3dv9 n PRO 165 Cb 0.39 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.44 3dv9 n PRO 165 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 3dv9 h GLU 166 N 0.00 -0.02 -0.66 0.54 4.57 -1.89 -1.07 114.58 116.04 3dv9 h GLU 166 Ca 0.00 0.00 0.08 0.00 -1.18 0.00 0.00 59.36 58.26 3dv9 h GLU 166 Cb 0.20 0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 28.73 3dv9 h GLU 166 CO 0.00 -0.02 0.33 -1.35 -1.18 0.00 0.00 179.01 176.79 3dv9 h PRO 167 N -0.02 0.57 -0.21 0.92 0.11 -1.74 -2.74 132.00 128.88 3dv9 h PRO 167 Ca 0.38 -0.03 -0.20 0.00 0.11 0.00 0.00 66.00 66.25 3dv9 h PRO 167 Cb 0.62 -0.13 0.01 0.00 0.11 0.00 0.00 31.00 31.60 3dv9 h PRO 167 CO -0.88 0.38 -0.66 1.88 -0.21 0.00 0.00 178.00 178.50 3dv9 h TYR 168 N 0.58 1.07 0.00 0.65 0.05 -1.59 -1.27 116.97 116.47 3dv9 h TYR 168 Ca 0.32 -0.43 0.00 0.00 0.05 0.00 0.00 58.73 58.66 3dv9 h TYR 168 Cb 0.30 -0.18 0.00 0.00 1.01 0.00 0.00 36.73 37.85 3dv9 h TYR 168 CO -0.11 1.27 0.00 1.28 -1.05 0.00 0.00 178.16 179.55 3dv9 n LEU 169 N -3.99 0.00 0.00 3.88 4.77 -0.51 -1.39 117.00 119.76 3dv9 n LEU 169 Ca -0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 3dv9 n LEU 169 Cb 0.69 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.78 3dv9 n LEU 169 CO 0.52 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.58 3dv9 n ALA 171 N 0.73 0.00 -0.30 -1.18 0.00 -0.48 -1.32 120.51 117.96 3dv9 n ALA 171 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 3dv9 n ALA 171 Cb 0.00 0.00 0.10 0.00 0.00 0.00 0.00 19.45 19.55 3dv9 n ALA 171 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3dv9 h LEU 172 N 0.00 0.87 -0.15 0.00 3.38 -1.52 -1.75 115.31 116.14 3dv9 h LEU 172 Ca 0.00 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3dv9 h LEU 172 Cb 0.00 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 3dv9 h LEU 172 CO 0.00 0.60 0.07 0.50 0.09 0.00 0.00 178.44 179.69 3dv9 h LYS 173 N 1.02 0.22 -0.67 1.13 3.64 -1.45 0.72 116.57 121.18 3dv9 h LYS 173 Ca 0.33 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.65 3dv9 h LYS 173 Cb 0.02 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.77 3dv9 h LYS 173 CO -0.12 0.29 0.31 0.87 -2.27 0.00 0.00 179.45 178.54 3dv9 h LYS 174 N 0.10 0.95 0.00 1.90 1.57 -1.78 -2.84 116.57 116.47 3dv9 h LYS 174 Ca 0.05 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 3dv9 h LYS 174 Cb 0.15 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.28 3dv9 h LYS 174 CO -0.01 0.74 -0.65 0.78 -0.57 0.00 0.00 179.45 179.74 3dv9 h GLY 175 N 1.02 0.00 -1.15 3.86 0.00 -1.14 -3.48 103.07 102.18 3dv9 h GLY 175 Ca 0.23 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.46 3dv9 h GLY 175 CO -0.03 0.00 -0.14 0.61 0.00 0.00 0.00 176.54 176.98 3dv9 n GLY 176 N 1.33 0.31 3.75 4.60 0.00 0.08 -5.06 105.19 110.19 3dv9 n GLY 176 Ca 0.03 -0.61 -0.31 0.00 0.00 0.00 0.00 46.02 45.13 3dv9 n GLY 176 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dv9 s PHE 177 N -2.51 3.17 0.51 1.61 0.08 -0.22 -5.04 117.98 115.59 3dv9 s PHE 177 Ca 0.04 0.10 -0.11 0.00 0.12 0.00 0.00 56.93 57.09 3dv9 s PHE 177 Cb -0.02 -1.65 -0.05 0.00 -0.57 0.00 0.00 43.02 40.73 3dv9 s PHE 177 CO 0.05 0.52 0.90 0.15 -0.10 0.00 0.00 175.22 176.74 3dv9 s LYS 178 N -2.11 3.70 0.48 0.44 1.02 -1.26 -4.59 119.74 117.42 3dv9 s LYS 178 Ca 0.26 0.59 0.14 0.00 0.02 0.00 0.00 55.97 56.97 3dv9 s LYS 178 Cb -0.12 -2.24 1.14 0.00 -0.52 0.00 0.00 37.83 36.09 3dv9 s LYS 178 CO 0.18 -0.29 2.10 -1.35 -0.92 0.00 0.00 175.35 175.07 3dv9 h PRO 179 N 0.44 0.19 -0.25 -1.68 0.11 -1.91 -1.15 132.00 127.74 3dv9 h PRO 179 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3dv9 h PRO 179 Cb 1.19 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3dv9 h PRO 179 CO 0.62 0.12 0.00 0.27 -0.21 0.00 0.00 178.00 178.81 3dv9 n ASN 180 N -4.51 0.87 -0.54 -2.05 6.94 -1.26 -3.23 115.26 111.48 3dv9 n ASN 180 Ca 0.00 -2.03 0.06 0.00 -0.02 0.00 0.00 54.58 52.60 3dv9 n ASN 180 Cb 0.12 -0.16 0.09 0.00 -2.36 0.00 0.00 39.78 37.48 3dv9 n ASN 180 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 3dv9 n GLU 181 N -0.08 1.44 -4.24 -3.83 1.02 -0.43 -0.92 120.64 113.60 3dv9 n GLU 181 Ca 0.04 -1.52 -0.14 0.00 -0.02 0.00 0.00 57.16 55.53 3dv9 n GLU 181 Cb 0.16 -1.24 -0.10 0.00 -0.02 0.00 0.00 31.44 30.23 3dv9 n GLU 181 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3dv9 s ALA 182 N -0.98 1.37 0.09 0.62 0.00 -1.20 -0.42 121.76 121.24 3dv9 s ALA 182 Ca 0.17 -1.48 0.09 0.00 0.00 0.00 0.00 51.96 50.75 3dv9 s ALA 182 Cb 0.11 0.11 -0.03 0.00 0.00 0.00 0.00 23.12 23.31 3dv9 s ALA 182 CO 0.15 -0.14 -0.24 -0.51 0.00 0.00 0.00 175.76 175.02 3dv9 s LEU 183 N -3.15 2.25 -0.16 0.00 1.43 -0.92 -4.16 118.68 113.97 3dv9 s LEU 183 Ca 0.17 -0.65 -0.05 0.00 -1.03 0.00 0.00 54.13 52.56 3dv9 s LEU 183 Cb 0.03 -1.11 -0.03 0.00 0.03 0.00 0.00 46.19 45.11 3dv9 s LEU 183 CO -0.00 0.17 0.01 -0.69 0.23 0.00 0.00 176.35 176.07 3dv9 s VAL 184 N -0.97 4.36 -0.32 -1.59 1.01 -0.28 -0.50 120.40 122.12 3dv9 s VAL 184 Ca 0.10 -0.19 -0.04 0.00 0.00 0.00 0.00 61.98 61.85 3dv9 s VAL 184 Cb -0.10 -2.93 0.04 0.00 0.00 0.00 0.00 36.38 33.40 3dv9 s VAL 184 CO 0.04 0.49 0.05 -0.63 0.00 0.00 0.00 175.10 175.05 3dv9 s ILE 185 N 0.22 3.40 0.13 2.22 -1.09 -0.08 -0.11 121.20 125.89 3dv9 s ILE 185 Ca 0.01 -1.24 0.06 0.00 -2.23 0.00 0.00 60.65 57.25 3dv9 s ILE 185 Cb -0.13 -2.93 -0.04 0.00 -1.58 0.00 0.00 42.46 37.78 3dv9 s ILE 185 CO 0.02 -0.13 -0.14 -1.61 -1.23 0.00 0.00 174.94 171.84 3dv9 s GLU 186 N 1.33 1.05 0.00 2.79 0.41 0.02 -1.30 118.70 123.01 3dv9 s GLU 186 Ca -0.03 -1.28 0.00 0.00 -0.41 0.00 0.00 54.97 53.24 3dv9 s GLU 186 Cb -0.20 -0.90 0.00 0.00 -1.78 0.00 0.00 34.13 31.25 3dv9 s GLU 186 CO 0.01 0.17 0.31 0.27 -0.49 0.00 0.00 175.26 175.52 3dv9 n ASN 187 N 0.41 0.61 -4.26 -0.19 6.94 -1.26 0.02 115.26 117.54 3dv9 n ASN 187 Ca -0.14 -0.91 -0.21 0.00 -0.02 0.00 0.00 54.58 53.29 3dv9 n ASN 187 Cb 0.57 0.10 -0.12 0.00 -2.36 0.00 0.00 39.78 37.97 3dv9 n ASN 187 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3dv9 s ALA 188 N -0.10 1.62 0.20 -2.53 0.00 -1.26 -4.60 121.76 115.09 3dv9 s ALA 188 Ca 0.00 -1.21 -0.11 0.00 0.00 0.00 0.00 51.96 50.63 3dv9 s ALA 188 Cb 0.00 -0.18 0.13 0.00 0.00 0.00 0.00 23.12 23.07 3dv9 s ALA 188 CO 0.00 0.26 1.85 -1.00 0.00 0.00 0.00 175.76 176.88 3dv9 h PRO 189 N 3.97 0.93 0.00 0.00 0.13 -1.88 -0.48 132.00 134.67 3dv9 h PRO 189 Ca -0.44 -0.07 -0.09 0.00 -0.87 0.00 0.00 66.00 64.53 3dv9 h PRO 189 Cb 1.19 -0.20 -0.01 0.00 0.13 0.00 0.00 31.00 32.10 3dv9 h PRO 189 CO 0.42 0.63 -0.44 -0.07 -0.23 0.00 0.00 178.00 178.32 3dv9 h LEU 190 N 0.94 0.00 -0.21 1.56 3.38 -1.93 -0.76 115.31 118.29 3dv9 h LEU 190 Ca 0.25 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.18 3dv9 h LEU 190 Cb -0.07 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3dv9 h LEU 190 CO -0.05 0.44 -0.04 1.23 0.09 0.00 0.00 178.44 180.11 3dv9 h GLY 191 N 1.56 0.42 0.92 0.83 0.00 -1.64 -1.74 103.07 103.43 3dv9 h GLY 191 Ca -0.00 -0.34 0.01 0.00 0.00 0.00 0.00 47.33 47.00 3dv9 h GLY 191 CO 0.06 0.31 0.20 -2.08 0.00 0.00 0.00 176.54 175.03 3dv9 h VAL 192 N 0.12 1.04 -0.69 4.60 2.07 -0.89 -1.50 116.25 121.00 3dv9 h VAL 192 Ca 0.05 -0.14 0.06 0.00 0.82 0.00 0.00 66.70 67.49 3dv9 h VAL 192 Cb 0.48 0.59 -0.06 0.00 -1.52 0.00 0.00 31.29 30.78 3dv9 h VAL 192 CO 0.02 0.08 0.38 -0.61 0.02 0.00 0.00 177.57 177.46 3dv9 h GLN 193 N 0.42 0.68 -0.32 1.57 4.15 -1.03 -0.78 115.11 119.80 3dv9 h GLN 193 Ca 0.14 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.50 3dv9 h GLN 193 Cb -0.00 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.52 3dv9 h GLN 193 CO -0.06 0.45 0.15 0.00 -1.93 0.00 0.00 178.83 177.43 3dv9 h ALA 194 N 1.36 0.42 -0.53 3.38 0.00 -0.92 0.55 119.26 123.52 3dv9 h ALA 194 Ca 0.31 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 3dv9 h ALA 194 Cb 0.21 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3dv9 h ALA 194 CO -0.19 -0.01 0.25 0.78 0.00 0.00 0.00 179.25 180.08 3dv9 h GLY 195 N 0.38 0.82 1.02 0.00 0.00 -0.82 -0.01 103.07 104.45 3dv9 h GLY 195 Ca 0.11 -0.41 -0.09 0.00 0.00 0.00 0.00 47.33 46.94 3dv9 h GLY 195 CO -0.01 0.39 -0.04 -2.08 0.00 0.00 0.00 176.54 174.80 3dv9 h VAL 196 N 0.71 1.27 0.00 4.60 2.07 -1.04 -2.40 116.25 121.45 3dv9 h VAL 196 Ca 0.18 -1.13 -0.06 0.00 0.82 0.00 0.00 66.70 66.51 3dv9 h VAL 196 Cb 0.13 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 3dv9 h VAL 196 CO -0.02 0.39 -0.26 0.00 0.02 0.00 0.00 177.57 177.70 3dv9 h ALA 197 N 0.91 1.51 0.00 1.67 0.00 -0.62 -0.82 119.26 121.91 3dv9 h ALA 197 Ca 0.13 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3dv9 h ALA 197 Cb 0.57 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3dv9 h ALA 197 CO 0.03 0.33 0.00 0.00 0.00 0.00 0.00 179.25 179.61 3dv9 n ALA 198 N -2.46 2.31 -2.11 0.00 0.00 -0.04 -4.88 120.51 113.32 3dv9 n ALA 198 Ca -0.02 -0.12 -0.11 0.00 0.00 0.00 0.00 53.44 53.19 3dv9 n ALA 198 Cb 0.32 -1.42 -0.01 0.00 0.00 0.00 0.00 19.45 18.34 3dv9 n ALA 198 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dv9 n GLY 199 N 0.90 0.05 3.66 0.00 0.00 -0.31 -4.93 105.19 104.56 3dv9 n GLY 199 Ca 0.13 -0.44 -0.34 0.00 0.00 0.00 0.00 46.02 45.36 3dv9 n GLY 199 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dv9 s ILE 200 N -2.53 4.13 -0.02 -0.61 1.01 -1.07 -4.69 121.20 117.43 3dv9 s ILE 200 Ca 0.00 -0.39 -0.33 0.00 0.00 0.00 0.00 60.65 59.93 3dv9 s ILE 200 Cb 0.00 -2.75 -0.11 0.00 0.01 0.00 0.00 42.46 39.60 3dv9 s ILE 200 CO 0.00 0.55 1.85 0.33 0.00 0.00 0.00 174.94 177.67 3dv9 n PHE 201 N 1.97 2.38 -4.45 3.97 7.35 -1.26 -4.38 117.46 123.04 3dv9 n PHE 201 Ca -0.17 -0.05 -0.33 0.00 -0.76 0.00 0.00 57.45 56.14 3dv9 n PHE 201 Cb 0.53 -2.68 -0.16 0.00 0.35 0.00 0.00 39.48 37.53 3dv9 n PHE 201 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 3dv9 s THR 202 N 3.59 2.50 -0.21 -2.13 2.01 -1.26 -1.12 115.64 119.02 3dv9 s THR 202 Ca 0.89 -0.82 -0.05 0.00 0.31 0.00 0.00 61.69 62.03 3dv9 s THR 202 Cb -0.63 -2.05 -0.02 0.00 0.01 0.00 0.00 72.50 69.81 3dv9 s THR 202 CO 0.47 0.52 -0.01 -0.63 -0.69 0.00 0.00 174.62 174.28 3dv9 s ILE 203 N 0.93 3.80 0.06 1.82 1.01 0.85 0.20 121.20 129.87 3dv9 s ILE 203 Ca -0.03 -0.36 -0.19 0.00 0.00 0.00 0.00 60.65 60.07 3dv9 s ILE 203 Cb -0.15 -2.73 -0.07 0.00 0.01 0.00 0.00 42.46 39.53 3dv9 s ILE 203 CO -0.03 0.42 0.55 0.00 0.00 0.00 0.00 174.94 175.88 3dv9 s ALA 204 N 1.22 3.60 -0.19 9.38 0.00 0.32 -0.80 121.76 135.29 3dv9 s ALA 204 Ca 0.03 0.01 -0.00 0.00 0.00 0.00 0.00 51.96 51.99 3dv9 s ALA 204 Cb -0.15 -2.61 0.05 0.00 0.00 0.00 0.00 23.12 20.41 3dv9 s ALA 204 CO 0.01 0.40 -0.04 0.08 0.00 0.00 0.00 175.76 176.20 3dv9 s VAL 205 N -1.07 1.16 -0.74 0.00 1.01 0.10 -0.14 120.40 120.74 3dv9 s VAL 205 Ca 0.28 -0.80 -0.24 0.00 0.00 0.00 0.00 61.98 61.23 3dv9 s VAL 205 Cb -0.19 -1.41 0.06 0.00 0.00 0.00 0.00 36.38 34.84 3dv9 s VAL 205 CO 0.18 0.02 1.13 0.21 0.00 0.00 0.00 175.10 176.65 3dv9 s ASN 206 N 1.59 6.23 0.00 3.32 3.84 -0.54 -4.15 114.94 125.22 3dv9 s ASN 206 Ca -0.01 -0.90 0.12 0.00 0.21 0.00 0.00 52.86 52.28 3dv9 s ASN 206 Cb -0.17 -2.48 0.28 0.00 -0.55 0.00 0.00 41.25 38.33 3dv9 s ASN 206 CO -0.07 -1.57 1.18 0.35 -2.79 0.00 0.00 177.10 174.20 3dv9 n THR 207 N 6.14 0.74 -2.96 -5.21 -2.24 -1.26 -4.32 114.28 105.17 3dv9 n THR 207 Ca 0.04 -0.87 0.00 0.00 -2.27 0.00 0.00 64.05 60.95 3dv9 n THR 207 Cb 0.47 0.70 0.00 0.00 -2.10 0.00 0.00 70.33 69.40 3dv9 n THR 207 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dv9 n GLY 208 N 0.65 7.60 0.12 3.38 0.00 -1.26 -5.06 105.19 110.62 3dv9 n GLY 208 Ca 0.11 -1.98 0.13 0.00 0.00 0.00 0.00 46.02 44.28 3dv9 n GLY 208 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3dv9 n PRO 209 N 0.00 0.51 -2.42 1.61 -0.04 -1.26 -4.95 135.00 128.45 3dv9 n PRO 209 Ca 0.00 -0.25 -0.31 0.00 -0.04 0.00 0.00 63.50 62.90 3dv9 n PRO 209 Cb 0.00 -1.49 -0.02 0.00 -0.04 0.00 0.00 33.50 31.94 3dv9 n PRO 209 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3dv9 s LEU 210 N -2.66 3.60 0.40 1.53 1.43 -1.26 -5.05 118.68 116.68 3dv9 s LEU 210 Ca 0.22 1.40 -0.25 0.00 -1.03 0.00 0.00 54.13 54.47 3dv9 s LEU 210 Cb 0.19 -4.35 -0.08 0.00 0.03 0.00 0.00 46.19 41.98 3dv9 s LEU 210 CO 0.55 -0.60 1.18 -2.28 0.23 0.00 0.00 176.35 175.44 3dv9 s HIS 211 N -2.68 3.03 0.32 0.29 5.65 -1.26 -4.92 115.29 115.72 3dv9 s HIS 211 Ca 0.56 1.54 0.11 0.00 0.25 0.00 0.00 55.06 57.51 3dv9 s HIS 211 Cb -0.10 -3.42 0.96 0.00 -1.18 0.00 0.00 32.58 28.83 3dv9 s HIS 211 CO 0.36 -1.41 1.69 -0.44 -0.65 0.00 0.00 174.74 174.30 3dv9 h ASP 212 N 2.60 0.53 -0.23 9.88 3.32 -1.99 -1.18 116.42 129.37 3dv9 h ASP 212 Ca -0.49 0.17 0.07 0.00 0.02 0.00 0.00 57.03 56.79 3dv9 h ASP 212 Cb 1.24 0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.88 3dv9 h ASP 212 CO 0.62 -0.03 0.18 0.78 -1.72 0.00 0.00 179.24 179.07 3dv9 h ASN 213 N 0.43 0.00 -0.18 6.45 2.35 -1.98 -0.33 115.58 122.30 3dv9 h ASN 213 Ca 0.67 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 56.40 3dv9 h ASN 213 Cb 1.41 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.77 3dv9 h ASN 213 CO -0.55 0.00 0.07 0.58 -1.65 0.00 0.00 177.43 175.88 3dv9 h VAL 214 N 0.00 1.12 0.04 2.81 2.07 -1.59 0.40 116.25 121.10 3dv9 h VAL 214 Ca 0.11 -0.41 -0.19 0.00 0.82 0.00 0.00 66.70 67.02 3dv9 h VAL 214 Cb 0.47 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 3dv9 h VAL 214 CO -0.00 0.15 -1.02 -0.07 0.02 0.00 0.00 177.57 176.64 3dv9 h LEU 215 N 0.35 0.14 -1.27 2.57 3.38 -1.22 -3.36 115.31 115.90 3dv9 h LEU 215 Ca 0.09 -0.75 0.08 0.00 0.09 0.00 0.00 57.88 57.38 3dv9 h LEU 215 Cb 0.13 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 40.78 3dv9 h LEU 215 CO -0.00 1.42 0.54 -0.07 0.09 0.00 0.00 178.44 180.41 3dv9 h LEU 216 N -0.75 0.76 -0.36 1.67 3.38 -1.21 -2.31 115.31 116.50 3dv9 h LEU 216 Ca -0.25 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.73 3dv9 h LEU 216 Cb 1.40 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.00 3dv9 h LEU 216 CO -0.06 0.48 0.00 0.59 0.09 0.00 0.00 178.44 179.53 3dv9 n ASN 217 N -4.50 0.38 -0.75 -0.43 3.02 0.12 -1.39 115.26 111.71 3dv9 n ASN 217 Ca 0.13 0.59 0.10 0.00 -0.03 0.00 0.00 54.58 55.37 3dv9 n ASN 217 Cb 0.25 -0.67 0.30 0.00 -0.61 0.00 0.00 39.78 39.05 3dv9 n ASN 217 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3dv9 n GLU 218 N -1.91 1.98 -0.58 3.52 -0.58 -0.87 -4.95 120.64 117.25 3dv9 n GLU 218 Ca 0.03 -1.48 0.00 0.00 -0.42 0.00 0.00 57.16 55.29 3dv9 n GLU 218 Cb 0.22 -1.41 0.00 0.00 -0.57 0.00 0.00 31.44 29.67 3dv9 n GLU 218 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3dv9 n GLY 219 N 1.24 0.96 3.70 0.62 0.00 -0.48 -4.31 105.19 106.91 3dv9 n GLY 219 Ca 0.17 -0.43 -0.43 0.00 0.00 0.00 0.00 46.02 45.33 3dv9 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dv9 n ALA 220 N -0.84 1.62 0.08 4.61 0.00 -1.24 -4.88 120.51 119.87 3dv9 n ALA 220 Ca 0.00 0.38 -0.06 0.00 0.00 0.00 0.00 53.44 53.76 3dv9 n ALA 220 Cb 0.08 -2.33 -0.03 0.00 0.00 0.00 0.00 19.45 17.17 3dv9 n ALA 220 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 3dv9 h ASN 221 N 3.86 0.06 -5.12 0.00 4.21 -0.64 -3.46 115.58 114.50 3dv9 h ASN 221 Ca -0.46 -0.06 -0.11 0.00 1.21 0.00 0.00 56.30 56.88 3dv9 h ASN 221 Cb 1.26 -0.02 -0.16 0.00 -1.12 0.00 0.00 38.32 38.28 3dv9 h ASN 221 CO 0.73 0.93 -0.47 -0.76 -1.29 0.00 0.00 177.43 176.56 3dv9 s LEU 222 N -7.07 1.68 -0.05 1.61 1.43 -1.18 -4.75 118.68 110.35 3dv9 s LEU 222 Ca -0.00 -0.58 0.02 0.00 -1.03 0.00 0.00 54.13 52.54 3dv9 s LEU 222 Cb 0.11 0.75 0.02 0.00 0.03 0.00 0.00 46.19 47.09 3dv9 s LEU 222 CO 0.81 -0.59 -0.07 -0.22 0.23 0.00 0.00 176.35 176.51 3dv9 s LEU 223 N -2.40 1.52 0.19 1.79 0.20 -1.26 -0.52 118.68 118.21 3dv9 s LEU 223 Ca -0.01 -0.18 0.09 0.00 0.69 0.00 0.00 54.13 54.71 3dv9 s LEU 223 Cb 0.01 -0.56 -0.04 0.00 -0.43 0.00 0.00 46.19 45.17 3dv9 s LEU 223 CO -0.07 -0.00 -0.06 -0.36 -0.29 0.00 0.00 176.35 175.57 3dv9 s PHE 224 N 0.68 2.69 -0.91 5.38 0.08 0.81 -4.98 117.98 121.73 3dv9 s PHE 224 Ca -0.11 -0.20 0.26 0.00 0.12 0.00 0.00 56.93 57.00 3dv9 s PHE 224 Cb -0.14 -1.29 0.72 0.00 -0.57 0.00 0.00 43.02 41.74 3dv9 s PHE 224 CO 0.01 0.53 1.58 0.72 -0.10 0.00 0.00 175.22 177.96 3dv9 n HIS 225 N -0.15 0.18 0.00 0.36 8.25 -1.26 -1.47 115.22 121.14 3dv9 n HIS 225 Ca -0.10 0.05 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 3dv9 n HIS 225 Cb 0.56 -0.46 0.00 0.00 1.12 0.00 0.00 29.99 31.21 3dv9 n HIS 225 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 3dv9 n SER 226 N -1.68 0.00 0.00 0.41 3.41 -1.26 -4.45 113.62 110.05 3dv9 n SER 226 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 3dv9 n SER 226 Cb 0.36 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.31 3dv9 n SER 226 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 3dv9 n PRO 228 N 0.00 0.00 -0.17 4.33 -0.02 -1.19 -1.46 135.00 136.50 3dv9 n PRO 228 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.38 3dv9 n PRO 228 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 3dv9 n PRO 228 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3dv9 h ASP 229 N 0.00 0.79 -0.19 2.55 5.19 -1.94 0.49 116.42 123.30 3dv9 h ASP 229 Ca 0.00 -0.28 0.01 0.00 -0.62 0.00 0.00 57.03 56.14 3dv9 h ASP 229 Cb 0.00 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 39.28 3dv9 h ASP 229 CO 0.00 0.88 0.11 0.15 -3.12 0.00 0.00 179.24 177.25 3dv9 h PHE 230 N 0.68 0.20 -0.31 4.55 3.57 -1.63 -1.96 116.94 122.04 3dv9 h PHE 230 Ca 0.14 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.68 3dv9 h PHE 230 Cb 0.45 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.09 3dv9 h PHE 230 CO 0.03 0.12 0.12 -0.97 -2.23 0.00 0.00 178.31 175.38 3dv9 h ASN 231 N 0.22 0.15 -0.24 0.41 -1.24 -1.79 -1.76 115.58 111.33 3dv9 h ASN 231 Ca 0.08 0.03 -0.01 0.00 0.71 0.00 0.00 56.30 57.10 3dv9 h ASN 231 Cb 0.00 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.04 3dv9 h ASN 231 CO -0.04 0.12 0.12 0.50 -1.29 0.00 0.00 177.43 176.84 3dv9 h LYS 232 N 0.26 0.40 -0.01 6.67 3.64 -0.54 -2.24 116.57 124.76 3dv9 h LYS 232 Ca 0.13 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3dv9 h LYS 232 Cb 0.09 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 3dv9 h LYS 232 CO -0.12 0.33 -0.09 0.09 -2.27 0.00 0.00 179.45 177.39 3dv9 n ASN 233 N -4.42 1.18 0.06 4.20 3.02 -0.77 -4.50 115.26 114.03 3dv9 n ASN 233 Ca 0.01 -1.20 -0.11 0.00 -0.03 0.00 0.00 54.58 53.24 3dv9 n ASN 233 Cb 0.13 0.03 -0.05 0.00 -0.61 0.00 0.00 39.78 39.28 3dv9 n ASN 233 CO 0.00 0.00 0.00 -0.25 -2.62 0.00 0.00 177.26 174.39 3dv9 h TRP 234 N 1.71 -0.25 -0.47 3.10 2.91 -0.70 -0.36 115.95 121.89 3dv9 h TRP 234 Ca 0.00 0.01 0.08 0.00 1.13 0.00 0.00 58.89 60.10 3dv9 h TRP 234 Cb 0.46 0.11 -0.06 0.00 -0.51 0.00 0.00 29.16 29.15 3dv9 h TRP 234 CO 0.00 -0.15 0.10 0.93 -1.03 0.00 0.00 178.44 178.28 3dv9 h GLU 235 N -0.18 0.22 -0.51 2.65 3.07 -1.80 0.28 114.58 118.31 3dv9 h GLU 235 Ca 0.03 -0.01 -0.09 0.00 -0.50 0.00 0.00 59.36 58.79 3dv9 h GLU 235 Cb 0.22 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.06 3dv9 h GLU 235 CO -0.08 0.15 -0.04 1.15 -1.40 0.00 0.00 179.01 178.78 3dv9 h THR 236 N 0.23 1.26 -0.02 1.13 2.02 -1.80 -1.47 112.91 114.26 3dv9 h THR 236 Ca 0.23 -1.12 -0.01 0.00 0.77 0.00 0.00 66.41 66.28 3dv9 h THR 236 Cb 0.30 0.90 -0.00 0.00 -1.74 0.00 0.00 68.15 67.62 3dv9 h THR 236 CO -0.30 0.40 -0.02 0.25 0.37 0.00 0.00 175.52 176.21 3dv9 h LEU 237 N 0.82 0.05 -0.90 2.58 5.85 -0.29 -1.13 115.31 122.29 3dv9 h LEU 237 Ca 0.15 -0.53 0.08 0.00 0.84 0.00 0.00 57.88 58.42 3dv9 h LEU 237 Cb 0.54 -0.01 -0.07 0.00 0.37 0.00 0.00 40.66 41.49 3dv9 h LEU 237 CO 0.03 0.57 0.55 -0.61 -0.34 0.00 0.00 178.44 178.64 3dv9 h GLN 238 N -0.47 0.93 -0.63 1.25 4.15 -0.40 -1.12 115.11 118.83 3dv9 h GLN 238 Ca 0.00 -0.06 0.01 0.00 0.77 0.00 0.00 58.65 59.37 3dv9 h GLN 238 Cb 0.56 -0.21 -0.03 0.00 0.21 0.00 0.00 27.48 28.01 3dv9 h GLN 238 CO 0.01 0.62 0.42 0.77 -1.93 0.00 0.00 178.83 178.71 3dv9 h SER 239 N 0.96 0.72 -0.31 -0.69 0.02 -1.20 -2.40 113.55 110.65 3dv9 h SER 239 Ca 0.41 -0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.33 3dv9 h SER 239 Cb 0.28 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.62 3dv9 h SER 239 CO -0.21 0.53 0.16 0.00 -1.14 0.00 0.00 176.83 176.17 3dv9 h ALA 240 N 1.23 1.65 0.00 3.77 0.00 -0.29 -2.45 119.26 123.16 3dv9 h ALA 240 Ca 0.23 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 3dv9 h ALA 240 Cb -0.10 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 3dv9 h ALA 240 CO -0.05 0.29 -0.09 -0.07 0.00 0.00 0.00 179.25 179.33 3dv9 h LEU 241 N 0.48 0.00 -8.91 0.00 3.38 -0.89 -3.44 115.31 105.93 3dv9 h LEU 241 Ca 0.12 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.50 3dv9 h LEU 241 Cb 0.06 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.72 3dv9 h LEU 241 CO -0.02 0.09 0.59 -0.54 0.09 0.00 0.00 178.44 178.66 3dv9 s LYS 242 N -3.28 3.97 0.00 1.13 1.02 -0.92 -4.47 119.74 117.18 3dv9 s LYS 242 Ca 0.05 0.75 0.22 0.00 0.02 0.00 0.00 55.97 57.01 3dv9 s LYS 242 Cb 0.06 -3.75 1.32 0.00 -0.52 0.00 0.00 37.83 34.95 3dv9 s LYS 242 CO 0.66 -0.81 1.70 0.00 -0.92 0.00 0.00 175.35 175.98