#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ux7 s THR 13 N 0.00 2.84 -0.13 1.39 2.01 -0.10 -4.98 115.64 116.67 1ux7 s THR 13 Ca 0.00 -0.92 0.02 0.00 0.31 0.00 0.00 61.69 61.10 1ux7 s THR 13 Cb 0.00 -2.38 0.00 0.00 0.01 0.00 0.00 72.50 70.13 1ux7 s THR 13 CO 0.00 0.29 -0.21 -0.75 -0.69 0.00 0.00 174.62 173.26 1ux7 s LYS 14 N 1.35 3.07 -0.11 4.92 2.20 -1.26 -0.27 119.74 129.64 1ux7 s LYS 14 Ca 0.02 -0.84 0.01 0.00 -0.36 0.00 0.00 55.97 54.80 1ux7 s LYS 14 Cb -0.16 -2.44 0.02 0.00 -1.51 0.00 0.00 37.83 33.74 1ux7 s LYS 14 CO -0.05 0.04 -0.11 0.08 -0.36 0.00 0.00 175.35 174.95 1ux7 s VAL 15 N 0.69 1.21 0.17 4.02 1.01 -0.16 -5.00 120.40 122.35 1ux7 s VAL 15 Ca -0.10 -0.45 -0.30 0.00 0.00 0.00 0.00 61.98 61.14 1ux7 s VAL 15 Cb -0.16 -1.16 -0.08 0.00 0.00 0.00 0.00 36.38 34.98 1ux7 s VAL 15 CO 0.01 0.39 1.19 -1.61 0.00 0.00 0.00 175.10 175.08 1ux7 s GLU 16 N 1.30 4.50 0.28 2.72 0.41 -1.26 -1.38 118.70 125.26 1ux7 s GLU 16 Ca -0.02 1.85 -0.00 0.00 -0.41 0.00 0.00 54.97 56.39 1ux7 s GLU 16 Cb -0.14 -3.25 0.49 0.00 -1.78 0.00 0.00 34.13 29.44 1ux7 s GLU 16 CO -0.05 -0.08 1.86 0.00 -0.49 0.00 0.00 175.26 176.51 1ux7 h ALA 17 N 5.37 1.47 0.00 5.21 0.00 -1.65 -1.77 119.26 127.89 1ux7 h ALA 17 Ca -0.44 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1ux7 h ALA 17 Cb 1.21 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1ux7 h ALA 17 CO 0.75 0.34 0.00 -0.85 0.00 0.00 0.00 179.25 179.49 1ux7 n GLU 18 N -4.55 0.13 0.00 0.00 0.00 -1.26 -1.59 120.64 113.37 1ux7 n GLU 18 Ca 0.17 0.53 0.12 0.00 0.00 0.00 0.00 57.16 57.97 1ux7 n GLU 18 Cb 0.26 -1.84 0.09 0.00 0.00 0.00 0.00 31.44 29.96 1ux7 n GLU 18 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1ux7 n ASN 19 N -2.09 1.87 -4.72 -1.84 3.02 -0.67 -4.98 115.26 105.85 1ux7 n ASN 19 Ca 0.00 -1.41 -0.25 0.00 -0.03 0.00 0.00 54.58 52.89 1ux7 n ASN 19 Cb 0.10 0.37 0.10 0.00 -0.61 0.00 0.00 39.78 39.74 1ux7 n ASN 19 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1ux7 s MET 20 N -2.45 1.81 0.10 3.52 -1.94 -0.62 -5.04 119.30 114.68 1ux7 s MET 20 Ca 0.21 -0.60 -0.31 0.00 -1.71 0.00 0.00 55.69 53.27 1ux7 s MET 20 Cb 0.18 -2.20 -0.07 0.00 2.01 0.00 0.00 34.83 34.75 1ux7 s MET 20 CO 0.54 -1.44 1.34 0.21 -0.01 0.00 0.00 175.02 175.66 1ux7 s LYS 21 N -5.27 4.35 -0.16 2.03 2.20 0.42 -4.85 119.74 118.46 1ux7 s LYS 21 Ca 0.64 2.00 -0.02 0.00 -0.36 0.00 0.00 55.97 58.22 1ux7 s LYS 21 Cb -0.08 -3.28 -0.02 0.00 -1.51 0.00 0.00 37.83 32.94 1ux7 s LYS 21 CO 0.45 -0.40 -0.07 0.42 -0.36 0.00 0.00 175.35 175.39 1ux7 s ILE 22 N 1.14 3.45 0.20 5.43 1.01 -1.26 -0.88 121.20 130.29 1ux7 s ILE 22 Ca 0.63 -0.50 -0.01 0.00 0.00 0.00 0.00 60.65 60.76 1ux7 s ILE 22 Cb -0.35 -2.51 -0.04 0.00 0.01 0.00 0.00 42.46 39.58 1ux7 s ILE 22 CO 0.30 0.49 0.14 -0.83 0.00 0.00 0.00 174.94 175.03 1ux7 s GLY 23 N 0.64 1.38 0.00 6.18 0.00 -0.62 -5.02 107.32 109.87 1ux7 s GLY 23 Ca -0.04 -1.65 0.00 0.00 0.00 0.00 0.00 44.72 43.02 1ux7 s GLY 23 CO 0.02 -1.37 0.00 0.61 0.00 0.00 0.00 173.10 172.36 1ux7 n GLY 24 N -0.26 1.85 0.27 0.20 0.00 -1.26 -1.67 105.19 104.32 1ux7 n GLY 24 Ca 0.01 -2.02 0.04 0.00 0.00 0.00 0.00 46.02 44.05 1ux7 n GLY 24 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1ux7 h THR 25 N 0.00 0.73 0.00 2.61 2.02 -1.89 -3.35 112.91 113.03 1ux7 h THR 25 Ca 0.00 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.01 1ux7 h THR 25 Cb 0.00 0.19 0.00 0.00 -1.74 0.00 0.00 68.15 66.60 1ux7 h THR 25 CO 0.00 0.09 -0.41 -1.22 0.37 0.00 0.00 175.52 174.35 1ux7 n TYR 26 N -4.95 0.00 -1.69 3.16 4.01 -1.26 -5.06 117.16 111.36 1ux7 n TYR 26 Ca 0.13 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.44 1ux7 n TYR 26 Cb 0.36 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.38 1ux7 n TYR 26 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ux7 n ALA 27 N -1.18 1.21 -3.64 -0.72 0.00 -1.26 -4.84 120.51 110.08 1ux7 n ALA 27 Ca 0.00 0.36 -0.08 0.00 0.00 0.00 0.00 53.44 53.73 1ux7 n ALA 27 Cb 0.00 -2.24 -0.02 0.00 0.00 0.00 0.00 19.45 17.19 1ux7 n ALA 27 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1ux7 s GLY 28 N -0.30 -0.35 0.68 0.00 0.00 -1.02 -4.83 107.32 101.50 1ux7 s GLY 28 Ca 0.56 0.30 -0.15 0.00 0.00 0.00 0.00 44.72 45.43 1ux7 s GLY 28 CO 0.62 0.09 1.14 0.54 0.00 0.00 0.00 173.10 175.49 1ux7 s LYS 29 N -3.54 2.60 0.10 2.90 1.02 -1.26 -0.86 119.74 120.69 1ux7 s LYS 29 Ca 0.07 1.53 0.01 0.00 0.02 0.00 0.00 55.97 57.60 1ux7 s LYS 29 Cb -0.02 -1.91 -0.04 0.00 -0.52 0.00 0.00 37.83 35.33 1ux7 s LYS 29 CO -0.03 -1.43 -0.04 0.96 -0.92 0.00 0.00 175.35 173.88 1ux7 s ILE 30 N -2.19 0.57 -0.32 2.17 -4.36 -0.14 -4.73 121.20 112.19 1ux7 s ILE 30 Ca 0.70 -1.91 0.05 0.00 -0.26 0.00 0.00 60.65 59.22 1ux7 s ILE 30 Cb -0.24 -1.72 -0.04 0.00 1.25 0.00 0.00 42.46 41.72 1ux7 s ILE 30 CO 0.42 -0.83 0.30 -1.54 0.24 0.00 0.00 174.94 173.52 1ux7 n SER 31 N -0.04 0.45 -3.84 4.36 3.41 -1.24 -1.75 113.62 114.98 1ux7 n SER 31 Ca -0.11 -0.73 -0.12 0.00 -0.26 0.00 0.00 58.87 57.65 1ux7 n SER 31 Cb 0.61 0.83 -0.13 0.00 -0.26 0.00 0.00 64.21 65.26 1ux7 n SER 31 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ux7 s ALA 32 N -1.31 -0.19 -2.00 7.33 0.00 -1.26 -3.78 121.76 120.55 1ux7 s ALA 32 Ca 0.03 0.23 0.02 0.00 0.00 0.00 0.00 51.96 52.24 1ux7 s ALA 32 Cb 0.04 -0.14 0.10 0.00 0.00 0.00 0.00 23.12 23.12 1ux7 s ALA 32 CO 0.19 -0.04 1.07 -0.35 0.00 0.00 0.00 175.76 176.63 1ux7 n PRO 33 N 3.09 1.13 -3.68 0.00 -0.04 -1.26 -4.97 135.00 129.26 1ux7 n PRO 33 Ca -0.13 -0.19 -0.08 0.00 -0.04 0.00 0.00 63.50 63.06 1ux7 n PRO 33 Cb 0.59 -1.05 -0.02 0.00 -0.04 0.00 0.00 33.50 32.98 1ux7 n PRO 33 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1ux7 s PHE 34 N -1.93 -0.29 -0.09 0.54 -0.12 -1.25 -4.97 117.98 109.87 1ux7 s PHE 34 Ca 0.05 -0.04 -0.29 0.00 -0.05 0.00 0.00 56.93 56.60 1ux7 s PHE 34 Cb 0.02 0.64 -0.05 0.00 -0.63 0.00 0.00 43.02 43.00 1ux7 s PHE 34 CO 0.03 -0.99 1.73 0.34 -0.05 0.00 0.00 175.22 176.28 1ux7 s ASP 35 N -2.83 6.49 0.00 1.98 -1.08 -1.25 -3.65 116.67 116.33 1ux7 s ASP 35 Ca 0.08 2.13 0.00 0.00 -0.52 0.00 0.00 52.55 54.24 1ux7 s ASP 35 Cb -0.03 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.90 1ux7 s ASP 35 CO -0.01 -1.09 0.00 0.61 0.52 0.00 0.00 175.17 175.20 1ux7 n GLY 36 N 4.41 1.45 2.92 2.66 0.00 -0.71 -4.70 105.19 111.22 1ux7 n GLY 36 Ca 0.19 -0.36 -0.16 0.00 0.00 0.00 0.00 46.02 45.69 1ux7 n GLY 36 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ux7 s VAL 37 N -1.22 0.38 -0.11 1.61 1.01 -0.29 -0.97 120.40 120.81 1ux7 s VAL 37 Ca 0.00 -0.15 -0.14 0.00 0.00 0.00 0.00 61.98 61.69 1ux7 s VAL 37 Cb 0.00 -0.36 -0.05 0.00 0.00 0.00 0.00 36.38 35.97 1ux7 s VAL 37 CO 0.00 0.13 0.32 0.00 0.00 0.00 0.00 175.10 175.55 1ux7 s ALA 38 N 0.21 3.64 -0.18 5.51 0.00 -0.04 -0.78 121.76 130.12 1ux7 s ALA 38 Ca -0.02 -0.39 -0.03 0.00 0.00 0.00 0.00 51.96 51.52 1ux7 s ALA 38 Cb -0.06 -2.37 -0.01 0.00 0.00 0.00 0.00 23.12 20.68 1ux7 s ALA 38 CO -0.00 0.24 -0.07 -0.51 0.00 0.00 0.00 175.76 175.42 1ux7 s LEU 39 N -0.08 2.93 -0.13 0.00 1.43 0.58 -2.45 118.68 120.97 1ux7 s LEU 39 Ca 0.19 -0.31 -0.03 0.00 -1.03 0.00 0.00 54.13 52.95 1ux7 s LEU 39 Cb -0.14 -1.71 -0.07 0.00 0.03 0.00 0.00 46.19 44.30 1ux7 s LEU 39 CO 0.07 0.08 -0.14 -1.22 0.23 0.00 0.00 176.35 175.37 1ux7 n TYR 40 N 4.14 0.00 -4.44 0.29 4.01 -1.26 -0.94 117.16 118.96 1ux7 n TYR 40 Ca -0.18 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.34 1ux7 n TYR 40 Cb 0.52 -0.48 -0.10 0.00 -0.31 0.00 0.00 39.34 38.97 1ux7 n TYR 40 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ux7 s ALA 41 N -2.25 2.49 0.34 -0.72 0.00 -1.26 -4.78 121.76 115.59 1ux7 s ALA 41 Ca -0.18 -1.86 -0.28 0.00 0.00 0.00 0.00 51.96 49.64 1ux7 s ALA 41 Cb 0.06 -0.07 -0.12 0.00 0.00 0.00 0.00 23.12 22.98 1ux7 s ALA 41 CO 0.26 0.10 1.29 0.09 0.00 0.00 0.00 175.76 177.50 1ux7 n ASN 42 N -0.58 2.75 0.00 0.00 3.02 -1.26 -1.47 115.26 117.72 1ux7 n ASN 42 Ca -0.06 1.21 0.00 0.00 -0.03 0.00 0.00 54.58 55.70 1ux7 n ASN 42 Cb 0.61 -1.48 0.00 0.00 -0.61 0.00 0.00 39.78 38.30 1ux7 n ASN 42 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ux7 n ALA 43 N 0.34 0.00 -1.76 5.41 0.00 0.06 -4.86 120.51 119.70 1ux7 n ALA 43 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.09 1ux7 n ALA 43 Cb 0.36 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.77 1ux7 n ALA 43 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ux7 s ASP 44 N -2.82 7.09 0.22 0.00 1.01 -0.54 -4.13 116.67 117.50 1ux7 s ASP 44 Ca 0.00 2.31 -0.20 0.00 0.71 0.00 0.00 52.55 55.38 1ux7 s ASP 44 Cb 0.00 -2.63 0.03 0.00 1.01 0.00 0.00 42.92 41.34 1ux7 s ASP 44 CO 0.00 -0.27 0.61 -0.72 0.21 0.00 0.00 175.17 175.00 1ux7 s TYR 45 N -1.22 -0.22 0.04 4.23 -0.85 -0.67 -1.65 117.35 117.01 1ux7 s TYR 45 Ca 0.47 -0.13 0.07 0.00 -0.52 0.00 0.00 57.07 56.96 1ux7 s TYR 45 Cb -0.32 0.53 -0.02 0.00 0.38 0.00 0.00 41.96 42.53 1ux7 s TYR 45 CO 0.41 -1.02 -0.19 0.14 -1.52 0.00 0.00 175.55 173.38 1ux7 s VAL 46 N -3.87 1.52 0.06 -3.49 -7.23 -0.47 -1.59 120.40 105.34 1ux7 s VAL 46 Ca 0.08 -1.14 -0.17 0.00 -1.81 0.00 0.00 61.98 58.94 1ux7 s VAL 46 Cb -0.03 -1.34 0.03 0.00 0.56 0.00 0.00 36.38 35.61 1ux7 s VAL 46 CO -0.01 0.16 0.39 -0.94 -0.31 0.00 0.00 175.10 174.38 1ux7 s SER 47 N -1.16 -0.24 0.14 4.85 1.04 -0.06 -1.31 113.70 116.97 1ux7 s SER 47 Ca 0.06 -0.12 -0.22 0.00 0.48 0.00 0.00 55.95 56.15 1ux7 s SER 47 Cb -0.09 0.42 0.06 0.00 0.10 0.00 0.00 66.02 66.52 1ux7 s SER 47 CO 0.02 -0.70 0.57 -0.72 0.98 0.00 0.00 173.24 173.38 1ux7 s TYR 48 N -2.83 -0.49 -0.08 5.02 1.13 -0.65 -0.43 117.35 119.03 1ux7 s TYR 48 Ca -0.03 0.29 -0.19 0.00 -1.41 0.00 0.00 57.07 55.73 1ux7 s TYR 48 Cb -0.00 0.50 -0.04 0.00 -1.10 0.00 0.00 41.96 41.31 1ux7 s TYR 48 CO -0.05 -0.81 0.53 -1.12 -2.51 0.00 0.00 175.55 171.59 1ux7 s SER 49 N -2.67 6.80 -0.07 -0.18 0.01 -1.26 -0.71 113.70 115.61 1ux7 s SER 49 Ca 0.01 0.95 0.04 0.00 1.31 0.00 0.00 55.95 58.26 1ux7 s SER 49 Cb -0.00 -2.32 0.00 0.00 0.21 0.00 0.00 66.02 63.91 1ux7 s SER 49 CO -0.12 0.02 -0.20 -1.58 0.41 0.00 0.00 173.24 171.78 1ux7 s GLN 50 N 0.39 2.40 -0.13 12.44 2.00 -0.06 -4.94 119.66 131.75 1ux7 s GLN 50 Ca 0.29 -0.71 -0.24 0.00 -2.00 0.00 0.00 55.36 52.69 1ux7 s GLN 50 Cb -0.16 -1.91 -0.03 0.00 0.80 0.00 0.00 33.01 31.71 1ux7 s GLN 50 CO 0.13 0.18 0.75 -0.47 -0.50 0.00 0.00 175.29 175.39 1ux7 s TYR 51 N 0.30 3.48 -0.18 1.67 5.04 -1.26 -0.84 117.35 125.55 1ux7 s TYR 51 Ca -0.13 1.22 -0.03 0.00 -2.44 0.00 0.00 57.07 55.69 1ux7 s TYR 51 Cb -0.16 -2.90 -0.01 0.00 0.35 0.00 0.00 41.96 39.23 1ux7 s TYR 51 CO 0.06 -0.10 -0.06 -0.06 -1.34 0.00 0.00 175.55 174.04 1ux7 s PHE 52 N 1.56 2.93 -0.23 4.97 0.08 -0.26 -4.95 117.98 122.08 1ux7 s PHE 52 Ca 0.37 -0.70 0.19 0.00 0.12 0.00 0.00 56.93 56.91 1ux7 s PHE 52 Cb -0.17 -2.00 0.06 0.00 -0.57 0.00 0.00 43.02 40.34 1ux7 s PHE 52 CO 0.15 -0.33 1.21 0.00 -0.10 0.00 0.00 175.22 176.14 1ux7 h ALA 53 N 7.40 0.69 -3.75 5.36 0.00 -1.96 0.12 119.26 127.11 1ux7 h ALA 53 Ca -0.35 -0.32 -0.63 0.00 0.00 0.00 0.00 54.91 53.61 1ux7 h ALA 53 Cb 1.18 0.05 -0.22 0.00 0.00 0.00 0.00 17.79 18.81 1ux7 h ALA 53 CO 0.60 0.38 -0.85 -0.80 0.00 0.00 0.00 179.25 178.58 1ux7 s ASN 54 N -5.92 3.00 0.22 0.00 0.01 -1.26 -4.93 114.94 106.07 1ux7 s ASN 54 Ca 0.02 -0.73 0.21 0.00 -0.71 0.00 0.00 52.86 51.64 1ux7 s ASN 54 Cb 0.08 -0.19 0.04 0.00 0.41 0.00 0.00 41.25 41.59 1ux7 s ASN 54 CO 0.76 0.12 1.13 0.77 -1.51 0.00 0.00 177.10 178.38 1ux7 h SER 55 N 3.90 0.00 -3.34 -1.22 4.64 -1.90 -3.44 113.55 112.19 1ux7 h SER 55 Ca -0.49 0.00 -0.44 0.00 -0.47 0.00 0.00 61.79 60.39 1ux7 h SER 55 Cb 1.18 0.00 -0.36 0.00 -0.31 0.00 0.00 62.40 62.91 1ux7 h SER 55 CO 0.40 0.17 -0.78 -0.89 -0.87 0.00 0.00 176.83 174.86 1ux7 s THR 56 N -3.21 0.58 0.04 2.95 2.01 -1.26 -0.94 115.64 115.81 1ux7 s THR 56 Ca 0.01 -0.07 0.01 0.00 0.31 0.00 0.00 61.69 61.94 1ux7 s THR 56 Cb 0.08 -0.64 -0.03 0.00 0.01 0.00 0.00 72.50 71.93 1ux7 s THR 56 CO 0.77 0.26 -0.05 -1.00 -0.69 0.00 0.00 174.62 173.92 1ux7 s HIS 57 N 1.40 0.48 -0.04 4.92 0.09 -0.41 -4.75 115.29 116.98 1ux7 s HIS 57 Ca -0.03 -0.63 -0.25 0.00 -0.00 0.00 0.00 55.06 54.15 1ux7 s HIS 57 Cb -0.13 -0.31 -0.04 0.00 -0.00 0.00 0.00 32.58 32.10 1ux7 s HIS 57 CO -0.03 -0.18 0.76 -0.80 -0.00 0.00 0.00 174.74 174.50 1ux7 s ASN 58 N -1.83 7.09 -0.12 1.40 0.01 -0.17 -0.64 114.94 120.68 1ux7 s ASN 58 Ca -0.09 1.32 0.02 0.00 -0.71 0.00 0.00 52.86 53.40 1ux7 s ASN 58 Cb -0.06 -2.45 0.01 0.00 0.41 0.00 0.00 41.25 39.16 1ux7 s ASN 58 CO -0.02 -0.13 -0.17 -0.63 -1.51 0.00 0.00 177.10 174.65 1ux7 s ILE 59 N 0.72 1.64 -0.01 0.60 1.01 0.47 -1.42 121.20 124.20 1ux7 s ILE 59 Ca 0.40 -0.73 0.06 0.00 0.00 0.00 0.00 60.65 60.39 1ux7 s ILE 59 Cb -0.19 -1.49 -0.03 0.00 0.01 0.00 0.00 42.46 40.77 1ux7 s ILE 59 CO 0.21 0.47 -0.20 -0.44 0.00 0.00 0.00 174.94 174.98 1ux7 s SER 60 N 0.98 3.61 -0.07 3.58 0.01 -0.04 -0.34 113.70 121.43 1ux7 s SER 60 Ca -0.06 -0.36 0.02 0.00 1.31 0.00 0.00 55.95 56.86 1ux7 s SER 60 Cb -0.15 -0.60 0.01 0.00 0.21 0.00 0.00 66.02 65.50 1ux7 s SER 60 CO -0.02 0.31 -0.12 -0.69 0.41 0.00 0.00 173.24 173.13 1ux7 s VAL 61 N -0.74 1.13 -0.03 3.43 1.01 -0.21 -0.33 120.40 124.66 1ux7 s VAL 61 Ca 0.12 -0.46 -0.21 0.00 0.00 0.00 0.00 61.98 61.43 1ux7 s VAL 61 Cb -0.10 -1.04 -0.05 0.00 0.00 0.00 0.00 36.38 35.19 1ux7 s VAL 61 CO 0.01 0.36 0.62 -0.60 0.00 0.00 0.00 175.10 175.49 1ux7 s ARG 62 N 0.79 4.36 0.21 2.72 3.52 -0.96 -1.32 118.95 128.27 1ux7 s ARG 62 Ca -0.12 0.76 -0.11 0.00 -0.13 0.00 0.00 55.73 56.12 1ux7 s ARG 62 Cb -0.15 -3.38 0.04 0.00 -1.56 0.00 0.00 34.95 29.90 1ux7 s ARG 62 CO 0.02 0.27 0.58 0.41 -0.81 0.00 0.00 175.30 175.77 1ux7 n GLY 63 N 2.69 1.15 3.41 8.12 0.00 -0.55 -0.80 105.19 119.21 1ux7 n GLY 63 Ca -0.05 -1.14 -0.11 0.00 0.00 0.00 0.00 46.02 44.72 1ux7 n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ux7 s ALA 64 N -1.70 -1.14 0.42 4.61 0.00 -0.26 -1.27 121.76 122.41 1ux7 s ALA 64 Ca 0.12 0.07 -0.04 0.00 0.00 0.00 0.00 51.96 52.11 1ux7 s ALA 64 Cb -0.03 0.80 -0.04 0.00 0.00 0.00 0.00 23.12 23.85 1ux7 s ALA 64 CO 0.06 -0.73 0.70 0.45 0.00 0.00 0.00 175.76 176.24 1ux7 s SER 65 N -2.81 6.32 0.30 0.00 0.15 -0.69 -1.11 113.70 115.86 1ux7 s SER 65 Ca 0.04 0.81 0.26 0.00 0.70 0.00 0.00 55.95 57.76 1ux7 s SER 65 Cb 0.00 -2.19 0.93 0.00 -1.71 0.00 0.00 66.02 63.05 1ux7 s SER 65 CO -0.10 -0.44 1.76 0.77 1.20 0.00 0.00 173.24 176.44 1ux7 h SER 66 N 0.66 0.00 -0.52 5.45 4.64 -1.63 -3.35 113.55 118.80 1ux7 h SER 66 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1ux7 h SER 66 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1ux7 h SER 66 CO 0.62 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.12 1ux7 n ASN 67 N -2.43 0.00 0.12 4.97 0.23 -1.26 -4.89 115.26 111.99 1ux7 n ASN 67 Ca 0.03 -0.39 0.11 0.00 -0.53 0.00 0.00 54.58 53.81 1ux7 n ASN 67 Cb 0.33 0.00 0.48 0.00 -2.08 0.00 0.00 39.78 38.50 1ux7 n ASN 67 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ux7 n ALA 68 N -3.00 1.64 -1.30 -2.53 0.00 -1.26 -2.88 120.51 111.18 1ux7 n ALA 68 Ca 0.00 0.08 -0.29 0.00 0.00 0.00 0.00 53.44 53.23 1ux7 n ALA 68 Cb 0.00 -1.37 0.18 0.00 0.00 0.00 0.00 19.45 18.26 1ux7 n ALA 68 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1ux7 s GLY 69 N -3.50 1.58 -0.42 0.00 0.00 -1.26 -3.73 107.32 99.99 1ux7 s GLY 69 Ca 0.04 -0.63 -0.13 0.00 0.00 0.00 0.00 44.72 44.01 1ux7 s GLY 69 CO 0.37 0.06 0.30 -1.59 0.00 0.00 0.00 173.10 172.24 1ux7 s THR 70 N -3.13 4.89 0.04 0.90 2.01 -1.26 -2.41 115.64 116.68 1ux7 s THR 70 Ca 0.67 -0.97 -0.27 0.00 0.31 0.00 0.00 61.69 61.42 1ux7 s THR 70 Cb -0.14 -3.84 -0.05 0.00 0.01 0.00 0.00 72.50 68.48 1ux7 s THR 70 CO 0.56 -0.41 0.86 0.00 -0.69 0.00 0.00 174.62 174.93 1ux7 s ALA 71 N 1.59 3.28 -0.10 7.40 0.00 0.39 -4.86 121.76 129.45 1ux7 s ALA 71 Ca 0.03 0.41 0.04 0.00 0.00 0.00 0.00 51.96 52.44 1ux7 s ALA 71 Cb -0.21 -3.15 -0.00 0.00 0.00 0.00 0.00 23.12 19.76 1ux7 s ALA 71 CO 0.07 -0.04 -0.23 0.21 0.00 0.00 0.00 175.76 175.76 1ux7 s LYS 72 N 0.28 3.08 -0.13 0.00 2.20 -1.26 -0.61 119.74 123.30 1ux7 s LYS 72 Ca 0.44 -0.86 0.01 0.00 -0.36 0.00 0.00 55.97 55.20 1ux7 s LYS 72 Cb -0.21 -2.34 0.02 0.00 -1.51 0.00 0.00 37.83 33.79 1ux7 s LYS 72 CO 0.25 0.17 -0.15 0.08 -0.36 0.00 0.00 175.35 175.35 1ux7 s VAL 73 N 0.37 1.57 0.25 4.02 1.01 -0.05 -4.68 120.40 122.89 1ux7 s VAL 73 Ca -0.18 -0.65 -0.30 0.00 0.00 0.00 0.00 61.98 60.85 1ux7 s VAL 73 Cb -0.18 -1.45 -0.09 0.00 0.00 0.00 0.00 36.38 34.66 1ux7 s VAL 73 CO 0.08 0.46 0.97 -1.81 0.00 0.00 0.00 175.10 174.80 1ux7 s ASP 74 N 1.26 7.55 -0.25 3.32 1.01 -0.20 -0.90 116.67 128.47 1ux7 s ASP 74 Ca -0.00 2.01 -0.09 0.00 0.71 0.00 0.00 52.55 55.18 1ux7 s ASP 74 Cb -0.14 -2.61 -0.04 0.00 1.01 0.00 0.00 42.92 41.14 1ux7 s ASP 74 CO -0.07 0.09 0.12 -0.22 0.21 0.00 0.00 175.17 175.30 1ux7 s LEU 75 N -1.28 3.74 -0.12 1.23 2.96 -0.18 -1.43 118.68 123.60 1ux7 s LEU 75 Ca 0.42 -0.08 0.02 0.00 -0.22 0.00 0.00 54.13 54.28 1ux7 s LEU 75 Cb -0.27 -2.01 0.01 0.00 0.50 0.00 0.00 46.19 44.42 1ux7 s LEU 75 CO 0.33 -0.01 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.48 1ux7 s VAL 76 N 1.47 1.79 -0.17 1.68 1.01 0.17 -1.08 120.40 125.28 1ux7 s VAL 76 Ca 0.06 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.23 1ux7 s VAL 76 Cb -0.15 -1.60 0.03 0.00 0.00 0.00 0.00 36.38 34.65 1ux7 s VAL 76 CO 0.06 0.50 -0.14 -0.63 0.00 0.00 0.00 175.10 174.89 1ux7 s ILE 77 N 0.89 1.67 -1.78 2.22 1.01 -0.23 -0.57 121.20 124.41 1ux7 s ILE 77 Ca -0.07 -0.77 0.00 0.00 0.00 0.00 0.00 60.65 59.81 1ux7 s ILE 77 Cb -0.15 -1.60 0.00 0.00 0.01 0.00 0.00 42.46 40.72 1ux7 s ILE 77 CO -0.02 0.40 0.00 0.61 0.00 0.00 0.00 174.94 175.94 1ux7 n GLY 78 N 4.73 0.11 1.89 6.18 0.00 0.23 -2.20 105.19 116.13 1ux7 n GLY 78 Ca -0.17 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1ux7 n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ux7 n GLY 79 N -0.91 1.40 3.54 -0.02 0.00 -1.26 -4.97 105.19 102.97 1ux7 n GLY 79 Ca -0.23 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.44 1ux7 n GLY 79 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ux7 s VAL 80 N -2.92 4.45 -0.13 1.61 1.01 -0.93 -5.04 120.40 118.45 1ux7 s VAL 80 Ca 0.00 -0.14 -0.29 0.00 0.00 0.00 0.00 61.98 61.54 1ux7 s VAL 80 Cb 0.00 -3.02 -0.02 0.00 0.00 0.00 0.00 36.38 33.34 1ux7 s VAL 80 CO 0.00 0.42 1.29 -0.89 0.00 0.00 0.00 175.10 175.93 1ux7 s THR 81 N 0.81 4.19 -0.84 3.92 2.01 -1.26 -1.07 115.64 123.39 1ux7 s THR 81 Ca 0.03 1.46 0.11 0.00 0.31 0.00 0.00 61.69 63.60 1ux7 s THR 81 Cb -0.14 -3.94 -0.05 0.00 0.01 0.00 0.00 72.50 68.38 1ux7 s THR 81 CO 0.02 -0.10 0.60 1.33 -0.69 0.00 0.00 174.62 175.78 1ux7 n VAL 82 N 5.22 0.00 -1.94 3.82 0.24 -0.24 -4.99 118.33 120.44 1ux7 n VAL 82 Ca 0.14 -0.32 0.00 0.00 -2.04 0.00 0.00 64.34 62.12 1ux7 n VAL 82 Cb 0.45 1.08 0.00 0.00 -1.47 0.00 0.00 33.84 33.90 1ux7 n VAL 82 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ux7 n GLY 83 N 1.09 -1.83 3.19 7.63 0.00 -1.23 -5.03 105.19 109.01 1ux7 n GLY 83 Ca 0.04 -1.16 -0.09 0.00 0.00 0.00 0.00 46.02 44.81 1ux7 n GLY 83 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ux7 s SER 84 N -2.11 0.17 -0.06 1.61 1.04 -1.26 -1.01 113.70 112.07 1ux7 s SER 84 Ca 0.00 -0.70 0.05 0.00 0.48 0.00 0.00 55.95 55.78 1ux7 s SER 84 Cb 0.00 0.32 -0.00 0.00 0.10 0.00 0.00 66.02 66.44 1ux7 s SER 84 CO 0.00 -0.71 -0.21 -0.36 0.98 0.00 0.00 173.24 172.94 1ux7 s PHE 85 N -3.87 2.14 -0.15 5.02 0.08 -0.08 -4.95 117.98 116.17 1ux7 s PHE 85 Ca 0.05 -0.70 -0.01 0.00 0.12 0.00 0.00 56.93 56.39 1ux7 s PHE 85 Cb 0.05 -1.43 -0.01 0.00 -0.57 0.00 0.00 43.02 41.06 1ux7 s PHE 85 CO -0.11 -0.25 -0.12 -0.80 -0.10 0.00 0.00 175.22 173.84 1ux7 s ASN 86 N 0.09 3.95 -0.21 1.36 0.01 -1.26 -0.87 114.94 118.01 1ux7 s ASN 86 Ca -0.08 -0.38 0.02 0.00 -0.71 0.00 0.00 52.86 51.71 1ux7 s ASN 86 Cb -0.14 -1.62 0.04 0.00 0.41 0.00 0.00 41.25 39.94 1ux7 s ASN 86 CO 0.04 0.11 -0.16 -0.36 -1.51 0.00 0.00 177.10 175.22 1ux7 s PHE 87 N 0.67 2.95 -0.14 2.20 0.08 0.22 -4.93 117.98 119.03 1ux7 s PHE 87 Ca -0.06 -1.91 -0.03 0.00 0.12 0.00 0.00 56.93 55.05 1ux7 s PHE 87 Cb -0.15 -1.91 -0.03 0.00 -0.57 0.00 0.00 43.02 40.35 1ux7 s PHE 87 CO 0.02 -0.83 -0.04 0.99 -0.10 0.00 0.00 175.22 175.26 1ux7 s THR 88 N 1.22 3.90 0.00 0.64 2.01 -1.26 -0.46 115.64 121.68 1ux7 s THR 88 Ca -0.01 -0.36 0.00 0.00 0.31 0.00 0.00 61.69 61.63 1ux7 s THR 88 Cb -0.16 -2.69 0.00 0.00 0.01 0.00 0.00 72.50 69.66 1ux7 s THR 88 CO -0.10 0.51 0.00 0.61 -0.69 0.00 0.00 174.62 174.96 1ux7 n GLY 89 N 3.29 -2.01 0.15 4.40 0.00 -1.01 -4.72 105.19 105.28 1ux7 n GLY 89 Ca -0.18 -1.50 0.03 0.00 0.00 0.00 0.00 46.02 44.38 1ux7 n GLY 89 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ux7 h LYS 90 N 0.00 0.00 -6.39 1.61 1.57 -1.70 -1.83 116.57 109.84 1ux7 h LYS 90 Ca 0.00 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.24 1ux7 h LYS 90 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1ux7 h LYS 90 CO 0.00 0.45 0.86 0.99 -0.57 0.00 0.00 179.45 181.18 1ux7 s THR 91 N -2.99 3.61 0.39 -0.16 2.01 -1.26 -4.67 115.64 112.57 1ux7 s THR 91 Ca 0.04 1.01 -0.27 0.00 0.31 0.00 0.00 61.69 62.78 1ux7 s THR 91 Cb 0.07 -3.65 -0.11 0.00 0.01 0.00 0.00 72.50 68.83 1ux7 s THR 91 CO 0.74 -0.00 1.39 -2.65 -0.69 0.00 0.00 174.62 173.40 1ux7 n PRO 92 N 5.39 2.33 -4.22 4.92 -0.02 -1.26 -4.81 135.00 137.34 1ux7 n PRO 92 Ca 0.13 0.82 -0.14 0.00 -2.02 0.00 0.00 63.50 62.30 1ux7 n PRO 92 Cb 0.43 -2.52 -0.10 0.00 -0.02 0.00 0.00 33.50 31.29 1ux7 n PRO 92 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1ux7 s THR 93 N -1.14 1.04 -0.25 3.45 -4.23 -0.40 -4.97 115.64 109.15 1ux7 s THR 93 Ca 0.56 -1.90 -0.11 0.00 -1.18 0.00 0.00 61.69 59.06 1ux7 s THR 93 Cb -0.50 -1.67 -0.05 0.00 1.34 0.00 0.00 72.50 71.62 1ux7 s THR 93 CO 0.61 -0.69 0.19 -0.69 -0.54 0.00 0.00 174.62 173.50 1ux7 s VAL 94 N -3.05 5.33 -0.05 2.29 1.01 -1.26 -1.48 120.40 123.20 1ux7 s VAL 94 Ca 0.12 0.22 0.03 0.00 0.00 0.00 0.00 61.98 62.35 1ux7 s VAL 94 Cb 0.01 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.84 1ux7 s VAL 94 CO -0.00 0.31 -0.11 -1.10 0.00 0.00 0.00 175.10 174.20 1ux7 s GLN 95 N 1.25 2.57 -0.03 2.72 -1.52 -0.44 -4.97 119.66 119.25 1ux7 s GLN 95 Ca 0.08 -0.66 0.02 0.00 -1.95 0.00 0.00 55.36 52.86 1ux7 s GLN 95 Cb -0.14 -2.46 0.01 0.00 -0.22 0.00 0.00 33.01 30.20 1ux7 s GLN 95 CO 0.06 0.63 -0.08 0.99 -0.25 0.00 0.00 175.29 176.64 1ux7 s THR 96 N -0.80 0.74 -0.20 -0.19 2.01 -1.26 -1.04 115.64 114.91 1ux7 s THR 96 Ca 0.12 -0.31 -0.07 0.00 0.31 0.00 0.00 61.69 61.75 1ux7 s THR 96 Cb -0.11 -0.69 -0.04 0.00 0.01 0.00 0.00 72.50 71.68 1ux7 s THR 96 CO 0.02 0.25 0.06 -0.76 -0.69 0.00 0.00 174.62 173.49 1ux7 s LEU 97 N 0.42 3.70 -0.12 4.42 1.43 0.54 -4.98 118.68 124.09 1ux7 s LEU 97 Ca -0.07 -0.00 -0.12 0.00 -1.03 0.00 0.00 54.13 52.91 1ux7 s LEU 97 Cb -0.11 -1.95 -0.05 0.00 0.03 0.00 0.00 46.19 44.12 1ux7 s LEU 97 CO 0.01 0.12 0.27 -0.94 0.23 0.00 0.00 176.35 176.04 1ux7 s SER 98 N 0.68 6.49 -1.28 2.29 1.04 -1.26 -0.40 113.70 121.26 1ux7 s SER 98 Ca 0.03 0.58 -0.03 0.00 0.48 0.00 0.00 55.95 57.01 1ux7 s SER 98 Cb -0.13 -2.16 0.01 0.00 0.10 0.00 0.00 66.02 63.83 1ux7 s SER 98 CO 0.02 0.24 1.00 0.59 0.98 0.00 0.00 173.24 176.07 1ux7 n ASN 99 N 2.76 -3.21 -4.69 7.02 5.03 -1.11 -4.92 115.26 116.13 1ux7 n ASN 99 Ca -0.15 -0.64 -0.42 0.00 0.87 0.00 0.00 54.58 54.25 1ux7 n ASN 99 Cb 0.53 -4.86 -0.03 0.00 -1.02 0.00 0.00 39.78 34.39 1ux7 n ASN 99 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1ux7 s ILE 100 N -3.39 4.86 -0.08 2.41 -1.09 0.18 -4.81 121.20 119.29 1ux7 s ILE 100 Ca 0.20 1.84 -0.11 0.00 -2.23 0.00 0.00 60.65 60.34 1ux7 s ILE 100 Cb -0.09 -4.22 -0.05 0.00 -1.58 0.00 0.00 42.46 36.52 1ux7 s ILE 100 CO 0.75 0.07 0.27 -0.89 -1.23 0.00 0.00 174.94 173.90 1ux7 s THR 101 N 1.74 5.29 0.36 2.92 2.01 -1.26 -1.29 115.64 125.41 1ux7 s THR 101 Ca 0.44 0.50 -0.07 0.00 0.31 0.00 0.00 61.69 62.87 1ux7 s THR 101 Cb -0.18 -3.56 0.02 0.00 0.01 0.00 0.00 72.50 68.80 1ux7 s THR 101 CO 0.18 0.57 0.59 -1.38 -0.69 0.00 0.00 174.62 173.89 1ux7 s HIS 102 N -0.81 0.71 0.55 4.92 -3.43 -0.12 -5.01 115.29 112.11 1ux7 s HIS 102 Ca 0.18 -1.11 -0.19 0.00 -0.80 0.00 0.00 55.06 53.14 1ux7 s HIS 102 Cb -0.14 0.26 -0.05 0.00 -1.43 0.00 0.00 32.58 31.22 1ux7 s HIS 102 CO 0.08 -1.30 1.15 0.00 -2.00 0.00 0.00 174.74 172.67 1ux7 s ALA 103 N -2.78 2.66 0.53 -1.38 0.00 -1.26 -4.68 121.76 114.85 1ux7 s ALA 103 Ca 0.25 0.88 0.07 0.00 0.00 0.00 0.00 51.96 53.16 1ux7 s ALA 103 Cb -0.02 -3.39 0.05 0.00 0.00 0.00 0.00 23.12 19.76 1ux7 s ALA 103 CO 0.17 -0.88 0.72 0.95 0.00 0.00 0.00 175.76 176.73 1ux7 s THR 104 N -1.71 2.56 0.00 0.00 -4.23 -1.26 -4.87 115.64 106.13 1ux7 s THR 104 Ca 0.74 -0.91 0.00 0.00 -1.18 0.00 0.00 61.69 60.34 1ux7 s THR 104 Cb -0.26 -2.65 0.00 0.00 1.34 0.00 0.00 72.50 70.93 1ux7 s THR 104 CO 0.29 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.98 1ux7 n GLY 105 N -2.16 -1.61 3.67 3.99 0.00 0.03 -4.81 105.19 104.29 1ux7 n GLY 105 Ca 0.11 -1.37 -0.43 0.00 0.00 0.00 0.00 46.02 44.33 1ux7 n GLY 105 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ux7 s ASP 106 N -4.00 7.03 -0.01 1.61 1.01 -1.26 -1.10 116.67 119.95 1ux7 s ASP 106 Ca 0.00 1.68 0.02 0.00 0.71 0.00 0.00 52.55 54.95 1ux7 s ASP 106 Cb 0.00 -2.55 -0.00 0.00 1.01 0.00 0.00 42.92 41.38 1ux7 s ASP 106 CO 0.00 -0.66 -0.05 -1.10 0.21 0.00 0.00 175.17 173.56 1ux7 s GLN 107 N 2.89 0.49 0.10 8.23 -1.52 -0.02 -4.96 119.66 124.87 1ux7 s GLN 107 Ca 0.53 -0.19 -0.31 0.00 -1.95 0.00 0.00 55.36 53.44 1ux7 s GLN 107 Cb -0.21 -0.49 -0.07 0.00 -0.22 0.00 0.00 33.01 32.01 1ux7 s GLN 107 CO 0.16 0.10 1.33 -2.00 -0.25 0.00 0.00 175.29 174.63 1ux7 s GLU 108 N -0.01 4.36 -0.22 2.91 2.12 -1.26 -0.89 118.70 125.72 1ux7 s GLU 108 Ca 0.01 1.98 -0.08 0.00 0.36 0.00 0.00 54.97 57.24 1ux7 s GLU 108 Cb -0.04 -3.27 -0.04 0.00 0.26 0.00 0.00 34.13 31.04 1ux7 s GLU 108 CO -0.00 -0.38 0.08 0.42 -0.54 0.00 0.00 175.26 174.84 1ux7 s ILE 109 N 1.05 4.67 -0.03 -3.70 -1.09 0.11 -0.60 121.20 121.61 1ux7 s ILE 109 Ca 0.62 -0.06 0.02 0.00 -2.23 0.00 0.00 60.65 59.00 1ux7 s ILE 109 Cb -0.35 -3.14 0.01 0.00 -1.58 0.00 0.00 42.46 37.40 1ux7 s ILE 109 CO 0.30 0.40 -0.07 -0.75 -1.23 0.00 0.00 174.94 173.59 1ux7 s LYS 110 N 0.95 0.87 -0.23 2.79 2.20 0.27 -1.63 119.74 124.95 1ux7 s LYS 110 Ca 0.04 -0.22 -0.06 0.00 -0.36 0.00 0.00 55.97 55.38 1ux7 s LYS 110 Cb -0.14 -0.83 -0.02 0.00 -1.51 0.00 0.00 37.83 35.33 1ux7 s LYS 110 CO 0.03 0.04 0.02 -0.51 -0.36 0.00 0.00 175.35 174.56 1ux7 s LEU 111 N 0.43 3.20 0.02 5.43 1.43 -0.43 -0.66 118.68 128.11 1ux7 s LEU 111 Ca -0.06 -0.28 0.01 0.00 -1.03 0.00 0.00 54.13 52.76 1ux7 s LEU 111 Cb -0.10 -1.84 -0.02 0.00 0.03 0.00 0.00 46.19 44.26 1ux7 s LEU 111 CO 0.00 -0.02 -0.04 0.00 0.23 0.00 0.00 176.35 176.53 1ux7 s ALA 112 N 1.49 0.24 -0.10 4.21 0.00 -0.51 -1.37 121.76 125.72 1ux7 s ALA 112 Ca 0.06 -0.52 -0.19 0.00 0.00 0.00 0.00 51.96 51.31 1ux7 s ALA 112 Cb -0.15 0.08 -0.04 0.00 0.00 0.00 0.00 23.12 23.01 1ux7 s ALA 112 CO 0.01 -0.08 0.50 -0.51 0.00 0.00 0.00 175.76 175.68 1ux7 s LEU 113 N -1.17 4.30 0.00 0.00 1.43 -0.66 -1.03 118.68 121.55 1ux7 s LEU 113 Ca -0.11 0.88 0.00 0.00 -1.03 0.00 0.00 54.13 53.87 1ux7 s LEU 113 Cb -0.08 -2.74 0.00 0.00 0.03 0.00 0.00 46.19 43.40 1ux7 s LEU 113 CO -0.00 0.01 0.09 0.35 0.23 0.00 0.00 176.35 177.03 1ux7 n THR 114 N 3.54 0.00 -0.96 5.49 -2.24 -1.26 -0.76 114.28 118.09 1ux7 n THR 114 Ca -0.07 -0.23 0.05 0.00 -2.27 0.00 0.00 64.05 61.53 1ux7 n THR 114 Cb 0.52 1.21 0.07 0.00 -2.10 0.00 0.00 70.33 70.02 1ux7 n THR 114 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1ux7 n SER 115 N -0.28 1.63 -4.75 3.42 3.41 -1.26 -4.97 113.62 110.82 1ux7 n SER 115 Ca 0.00 -2.44 -0.41 0.00 -0.26 0.00 0.00 58.87 55.77 1ux7 n SER 115 Cb 0.05 -0.24 0.01 0.00 -0.26 0.00 0.00 64.21 63.77 1ux7 n SER 115 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1ux7 n ASP 116 N -0.82 3.31 -0.96 4.04 2.03 -1.26 -4.92 116.55 117.96 1ux7 n ASP 116 Ca 0.08 1.17 0.02 0.00 0.52 0.00 0.00 54.79 56.57 1ux7 n ASP 116 Cb 0.54 -1.58 0.01 0.00 -0.72 0.00 0.00 41.12 39.37 1ux7 n ASP 116 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 1ux7 n ASP 117 N 0.20 0.44 -0.16 1.67 5.68 -1.26 -4.82 116.55 118.29 1ux7 n ASP 117 Ca 0.04 -1.98 -0.02 0.00 -0.50 0.00 0.00 54.79 52.33 1ux7 n ASP 117 Cb 0.40 -0.23 -0.01 0.00 -1.14 0.00 0.00 41.12 40.13 1ux7 n ASP 117 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ux7 n GLY 118 N 0.23 0.56 0.07 6.12 0.00 -1.26 -4.93 105.19 105.97 1ux7 n GLY 118 Ca 0.02 -0.70 0.04 0.00 0.00 0.00 0.00 46.02 45.38 1ux7 n GLY 118 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ux7 n THR 119 N -2.90 0.00 -3.68 2.61 -2.24 -1.26 -5.06 114.28 101.75 1ux7 n THR 119 Ca -0.02 -0.36 -0.07 0.00 -2.27 0.00 0.00 64.05 61.32 1ux7 n THR 119 Cb 0.09 1.04 -0.02 0.00 -2.10 0.00 0.00 70.33 69.34 1ux7 n THR 119 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 1ux7 s TRP 120 N -1.48 -0.27 0.22 4.78 1.48 -1.26 -4.84 118.94 117.56 1ux7 s TRP 120 Ca 0.04 -0.04 0.09 0.00 -1.06 0.00 0.00 56.10 55.13 1ux7 s TRP 120 Cb 0.06 0.63 -0.05 0.00 -1.16 0.00 0.00 33.47 32.95 1ux7 s TRP 120 CO 0.26 -0.93 -0.17 -0.51 -4.06 0.00 0.00 176.95 171.54 1ux7 s ASP 121 N -2.82 2.91 -0.11 -2.66 1.01 -1.26 -4.82 116.67 108.92 1ux7 s ASP 121 Ca 0.08 -0.99 -0.01 0.00 0.71 0.00 0.00 52.55 52.35 1ux7 s ASP 121 Cb -0.03 -0.19 -0.02 0.00 1.01 0.00 0.00 42.92 43.69 1ux7 s ASP 121 CO -0.01 -0.08 -0.09 0.00 0.21 0.00 0.00 175.17 175.21 1ux7 s ALA 122 N -2.63 2.85 -0.15 5.23 0.00 -0.12 -1.74 121.76 125.19 1ux7 s ALA 122 Ca 0.23 -0.88 -0.02 0.00 0.00 0.00 0.00 51.96 51.30 1ux7 s ALA 122 Cb -0.03 -1.29 -0.02 0.00 0.00 0.00 0.00 23.12 21.78 1ux7 s ALA 122 CO 0.09 0.37 -0.09 0.71 0.00 0.00 0.00 175.76 176.84 1ux7 s TYR 123 N -0.10 2.90 -0.10 0.00 2.02 -0.27 -0.30 117.35 121.50 1ux7 s TYR 123 Ca 0.00 -0.54 0.03 0.00 -0.37 0.00 0.00 57.07 56.20 1ux7 s TYR 123 Cb -0.13 -1.91 0.01 0.00 -0.40 0.00 0.00 41.96 39.52 1ux7 s TYR 123 CO 0.03 -0.17 -0.21 0.08 -1.57 0.00 0.00 175.55 173.71 1ux7 s VAL 124 N 0.44 1.85 -0.24 0.71 1.01 0.04 -1.11 120.40 123.10 1ux7 s VAL 124 Ca -0.07 -0.88 -0.15 0.00 0.00 0.00 0.00 61.98 60.87 1ux7 s VAL 124 Cb -0.15 -1.62 -0.11 0.00 0.00 0.00 0.00 36.38 34.51 1ux7 s VAL 124 CO 0.04 0.51 -0.32 -0.67 0.00 0.00 0.00 175.10 174.67 1ux7 n ASP 125 N 3.72 1.94 -3.65 3.32 2.03 0.02 -1.14 116.55 122.80 1ux7 n ASP 125 Ca -0.20 0.35 -0.07 0.00 0.52 0.00 0.00 54.79 55.40 1ux7 n ASP 125 Cb 0.52 -0.81 -0.02 0.00 -0.72 0.00 0.00 41.12 40.10 1ux7 n ASP 125 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 1ux7 s PHE 126 N -2.60 -0.26 0.05 -0.67 -0.12 -1.23 -1.88 117.98 111.26 1ux7 s PHE 126 Ca -0.35 -0.00 0.09 0.00 -0.05 0.00 0.00 56.93 56.62 1ux7 s PHE 126 Cb 0.11 0.61 -0.03 0.00 -0.63 0.00 0.00 43.02 43.08 1ux7 s PHE 126 CO 0.47 -0.80 -0.25 -1.50 -0.05 0.00 0.00 175.22 173.09 1ux7 s ILE 127 N -3.39 2.25 -0.05 -4.49 2.07 -0.48 -2.26 121.20 114.86 1ux7 s ILE 127 Ca 0.08 -1.37 0.01 0.00 -1.41 0.00 0.00 60.65 57.96 1ux7 s ILE 127 Cb -0.02 -1.89 0.02 0.00 0.13 0.00 0.00 42.46 40.70 1ux7 s ILE 127 CO -0.03 0.35 -0.06 -0.70 -1.91 0.00 0.00 174.94 172.60 1ux7 s GLU 128 N -1.30 1.00 -0.11 3.50 2.12 0.55 -0.98 118.70 123.47 1ux7 s GLU 128 Ca 0.12 -0.16 -0.02 0.00 0.36 0.00 0.00 54.97 55.27 1ux7 s GLU 128 Cb -0.10 -0.97 -0.03 0.00 0.26 0.00 0.00 34.13 33.29 1ux7 s GLU 128 CO 0.03 -0.07 -0.03 -0.06 -0.54 0.00 0.00 175.26 174.59 1ux7 s PHE 129 N 0.91 3.05 0.02 5.30 0.40 0.63 -0.86 117.98 127.43 1ux7 s PHE 129 Ca -0.11 -0.06 0.02 0.00 -0.60 0.00 0.00 56.93 56.19 1ux7 s PHE 129 Cb -0.15 -1.85 -0.01 0.00 0.51 0.00 0.00 43.02 41.52 1ux7 s PHE 129 CO 0.00 0.21 -0.08 -1.54 0.70 0.00 0.00 175.22 174.52 1ux7 s SER 130 N -0.30 0.90 0.00 1.36 1.04 -0.51 -0.92 113.70 115.26 1ux7 s SER 130 Ca 0.05 -0.33 0.00 0.00 0.48 0.00 0.00 55.95 56.15 1ux7 s SER 130 Cb -0.12 -0.04 0.00 0.00 0.10 0.00 0.00 66.02 65.96 1ux7 s SER 130 CO 0.02 -0.04 0.00 0.18 0.98 0.00 0.00 173.24 174.38