#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2uxs s VAL 8 N 0.00 3.66 -0.01 1.61 0.11 -1.26 -5.06 120.40 119.45 2uxs s VAL 8 Ca 0.00 1.24 -0.29 0.00 -2.93 0.00 0.00 61.98 60.00 2uxs s VAL 8 Cb 0.00 -3.62 0.07 0.00 -1.53 0.00 0.00 36.38 31.29 2uxs s VAL 8 CO 0.00 -0.02 0.64 0.00 -3.33 0.00 0.00 175.10 172.39 2uxs s GLN 9 N -2.61 1.07 0.30 1.54 -2.07 -1.26 -4.38 119.66 112.25 2uxs s GLN 9 Ca 0.59 0.11 -0.18 0.00 -1.82 0.00 0.00 55.36 54.07 2uxs s GLN 9 Cb -0.22 0.50 0.02 0.00 -1.09 0.00 0.00 33.01 32.22 2uxs s GLN 9 CO 0.27 -0.36 0.68 -0.59 -1.32 0.00 0.00 175.29 173.98 2uxs s PHE 10 N -1.61 0.02 -0.06 9.60 -0.12 -0.63 -4.99 117.98 120.18 2uxs s PHE 10 Ca -0.09 -0.49 -0.13 0.00 -0.05 0.00 0.00 56.93 56.16 2uxs s PHE 10 Cb -0.00 0.61 -0.05 0.00 -0.63 0.00 0.00 43.02 42.94 2uxs s PHE 10 CO 0.06 -1.25 0.34 -0.51 -0.05 0.00 0.00 175.22 173.81 2uxs s ASP 11 N -2.98 6.65 -0.08 1.98 1.01 -1.26 -0.65 116.67 121.33 2uxs s ASP 11 Ca 0.15 0.77 0.01 0.00 0.71 0.00 0.00 52.55 54.19 2uxs s ASP 11 Cb -0.05 -2.21 -0.03 0.00 1.01 0.00 0.00 42.92 41.65 2uxs s ASP 11 CO 0.09 0.26 -0.10 -0.69 0.21 0.00 0.00 175.17 174.94 2uxs s VAL 12 N -0.60 3.40 -0.40 -1.27 1.01 -0.35 -0.69 120.40 121.50 2uxs s VAL 12 Ca 0.21 -0.58 -0.13 0.00 0.00 0.00 0.00 61.98 61.48 2uxs s VAL 12 Cb -0.15 -2.39 0.03 0.00 0.00 0.00 0.00 36.38 33.87 2uxs s VAL 12 CO 0.09 0.57 0.27 -0.89 0.00 0.00 0.00 175.10 175.14 2uxs s THR 13 N -0.43 4.93 0.02 3.92 2.01 -0.54 -0.82 115.64 124.72 2uxs s THR 13 Ca 0.06 -0.82 -0.30 0.00 0.31 0.00 0.00 61.69 60.93 2uxs s THR 13 Cb -0.12 -3.78 -0.06 0.00 0.01 0.00 0.00 72.50 68.54 2uxs s THR 13 CO 0.02 -0.32 1.50 -0.63 -0.69 0.00 0.00 174.62 174.50 2uxs s ILE 14 N 1.61 3.48 -0.21 1.82 -1.09 -0.82 -2.15 121.20 123.85 2uxs s ILE 14 Ca 0.04 0.87 -0.05 0.00 -2.23 0.00 0.00 60.65 59.28 2uxs s ILE 14 Cb -0.20 -3.56 -0.20 0.00 -1.58 0.00 0.00 42.46 36.93 2uxs s ILE 14 CO 0.08 -0.01 -0.01 -0.62 -1.23 0.00 0.00 174.94 173.16 2uxs n GLU 15 N 5.58 0.67 -3.87 2.79 1.02 0.19 -0.20 120.64 126.83 2uxs n GLU 15 Ca 0.14 0.23 -0.27 0.00 -0.02 0.00 0.00 57.16 57.25 2uxs n GLU 15 Cb 0.42 -1.60 -0.17 0.00 -0.02 0.00 0.00 31.44 30.08 2uxs n GLU 15 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2uxs s ILE 16 N -2.52 0.93 0.50 -3.67 1.01 0.33 -4.35 121.20 113.44 2uxs s ILE 16 Ca -0.31 -0.33 -0.23 0.00 0.00 0.00 0.00 60.65 59.79 2uxs s ILE 16 Cb 0.09 -1.03 -0.06 0.00 0.01 0.00 0.00 42.46 41.46 2uxs s ILE 16 CO 0.64 0.27 1.31 -2.84 0.00 0.00 0.00 174.94 174.32 2uxs s PRO 17 N 1.74 3.43 0.22 2.79 0.02 -1.26 -0.50 135.00 141.43 2uxs s PRO 17 Ca 0.04 2.13 -0.31 0.00 0.02 0.00 0.00 61.00 62.88 2uxs s PRO 17 Cb -0.13 -2.39 -0.15 0.00 0.02 0.00 0.00 34.50 31.85 2uxs s PRO 17 CO -0.08 -0.92 1.18 1.17 -0.33 0.00 0.00 177.00 178.02 2uxs n LYS 18 N -0.69 1.41 0.00 5.54 4.81 -1.25 -2.32 118.16 125.66 2uxs n LYS 18 Ca 0.08 0.50 0.00 0.00 -0.87 0.00 0.00 58.31 58.02 2uxs n LYS 18 Cb 0.45 -2.00 0.00 0.00 0.02 0.00 0.00 35.03 33.50 2uxs n LYS 18 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2uxs n GLY 19 N 1.83 2.93 3.78 3.14 0.00 -0.66 -4.90 105.19 111.31 2uxs n GLY 19 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 2uxs n GLY 19 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2uxs s GLN 20 N -0.67 4.50 -0.02 1.61 -1.52 -0.98 -4.68 119.66 117.90 2uxs s GLN 20 Ca 0.00 1.42 0.13 0.00 -1.95 0.00 0.00 55.36 54.95 2uxs s GLN 20 Cb 0.00 -2.79 -0.20 0.00 -0.22 0.00 0.00 33.01 29.80 2uxs s GLN 20 CO 0.00 0.19 0.27 -2.13 -0.25 0.00 0.00 175.29 173.36 2uxs n ARG 21 N 0.50 0.50 -2.04 2.91 0.63 -1.26 -1.92 116.66 115.97 2uxs n ARG 21 Ca 0.02 -0.11 -0.42 0.00 -0.92 0.00 0.00 57.85 56.42 2uxs n ARG 21 Cb 0.49 -1.31 -0.03 0.00 0.45 0.00 0.00 32.46 32.07 2uxs n ARG 21 CO 0.00 0.00 0.00 -0.80 -2.51 0.00 0.00 177.63 174.32 2uxs s ASN 22 N -3.56 6.69 -0.79 6.15 0.01 -1.26 -2.10 114.94 120.09 2uxs s ASN 22 Ca -0.05 2.53 -0.16 0.00 -0.71 0.00 0.00 52.86 54.47 2uxs s ASN 22 Cb 0.08 -2.60 0.18 0.00 0.41 0.00 0.00 41.25 39.32 2uxs s ASN 22 CO 0.54 -0.72 0.79 -0.75 -1.51 0.00 0.00 177.10 175.45 2uxs s LYS 23 N 0.67 3.47 0.53 -0.60 2.47 0.14 -4.96 119.74 121.46 2uxs s LYS 23 Ca 0.65 -2.12 -0.15 0.00 -1.56 0.00 0.00 55.97 52.79 2uxs s LYS 23 Cb -0.41 -4.48 -0.07 0.00 -1.46 0.00 0.00 37.83 31.41 2uxs s LYS 23 CO 0.34 -1.41 0.98 0.71 0.16 0.00 0.00 175.35 176.14 2uxs s TYR 24 N 1.06 3.49 -0.05 4.03 2.02 -1.26 -0.68 117.35 125.97 2uxs s TYR 24 Ca 0.18 1.40 -0.20 0.00 -0.37 0.00 0.00 57.07 58.09 2uxs s TYR 24 Cb -0.13 -2.76 0.04 0.00 -0.40 0.00 0.00 41.96 38.71 2uxs s TYR 24 CO -0.06 -0.43 0.45 -1.83 -1.57 0.00 0.00 175.55 172.11 2uxs s GLU 25 N -4.31 0.76 -0.11 -0.62 -1.05 0.01 -4.65 118.70 108.72 2uxs s GLU 25 Ca 0.58 0.09 -0.17 0.00 -0.15 0.00 0.00 54.97 55.32 2uxs s GLU 25 Cb -0.10 0.35 -0.04 0.00 -0.44 0.00 0.00 34.13 33.89 2uxs s GLU 25 CO 0.36 -0.20 0.44 0.08 0.95 0.00 0.00 175.26 176.90 2uxs s VAL 26 N -1.00 5.18 0.07 1.83 1.01 -1.26 -0.20 120.40 126.03 2uxs s VAL 26 Ca -0.10 0.89 -0.30 0.00 0.00 0.00 0.00 61.98 62.46 2uxs s VAL 26 Cb -0.03 -3.78 -0.05 0.00 0.00 0.00 0.00 36.38 32.51 2uxs s VAL 26 CO 0.05 0.36 1.10 -0.62 0.00 0.00 0.00 175.10 176.00 2uxs s ASP 27 N 0.42 7.22 0.10 3.32 2.15 -0.13 -4.95 116.67 124.80 2uxs s ASP 27 Ca 0.24 1.91 0.24 0.00 0.43 0.00 0.00 52.55 55.38 2uxs s ASP 27 Cb -0.15 -2.58 0.36 0.00 -0.30 0.00 0.00 42.92 40.25 2uxs s ASP 27 CO 0.10 -0.34 1.32 1.41 -0.17 0.00 0.00 175.17 177.48 2uxs n HIS 28 N 3.59 0.45 -0.10 -5.34 8.25 -1.26 -1.75 115.22 119.07 2uxs n HIS 28 Ca 0.07 0.13 -0.18 0.00 -0.26 0.00 0.00 57.72 57.48 2uxs n HIS 28 Cb 0.48 -0.58 -0.08 0.00 1.12 0.00 0.00 29.99 30.92 2uxs n HIS 28 CO 0.00 0.00 0.00 -0.85 0.64 0.00 0.00 176.34 176.13 2uxs n GLU 29 N -2.01 0.54 0.24 -0.41 0.00 -1.26 -4.56 120.64 113.18 2uxs n GLU 29 Ca 0.03 0.48 0.15 0.00 0.00 0.00 0.00 57.16 57.82 2uxs n GLU 29 Cb 0.42 -1.66 0.51 0.00 0.00 0.00 0.00 31.44 30.71 2uxs n GLU 29 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.13 178.92 2uxs h THR 30 N -1.00 0.00 0.00 3.84 1.35 -1.99 -3.46 112.91 111.64 2uxs h THR 30 Ca -0.31 -0.62 0.00 0.00 -0.55 0.00 0.00 66.41 64.94 2uxs h THR 30 Cb 1.15 1.59 0.00 0.00 -1.73 0.00 0.00 68.15 69.16 2uxs h THR 30 CO -0.18 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.70 2uxs n GLY 31 N 0.40 1.56 3.83 5.82 0.00 -0.71 -5.02 105.19 111.07 2uxs n GLY 31 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 2uxs n GLY 31 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2uxs s ARG 32 N -0.11 3.80 -0.02 1.61 0.52 -1.25 -4.72 118.95 118.77 2uxs s ARG 32 Ca 0.00 1.00 -0.04 0.00 -0.52 0.00 0.00 55.73 56.17 2uxs s ARG 32 Cb 0.00 -2.11 -0.04 0.00 0.52 0.00 0.00 34.95 33.32 2uxs s ARG 32 CO 0.00 -0.40 0.19 0.54 0.02 0.00 0.00 175.30 175.65 2uxs s VAL 33 N -2.61 5.42 -0.02 3.52 0.11 -1.26 -0.96 120.40 124.61 2uxs s VAL 33 Ca 0.60 -0.03 0.02 0.00 -2.93 0.00 0.00 61.98 59.64 2uxs s VAL 33 Cb -0.11 -3.52 0.00 0.00 -1.53 0.00 0.00 36.38 31.22 2uxs s VAL 33 CO 0.33 0.38 -0.06 -0.60 -3.33 0.00 0.00 175.10 171.82 2uxs s ARG 34 N -1.75 0.63 -0.69 1.54 3.52 0.72 -4.96 118.95 117.95 2uxs s ARG 34 Ca 0.25 -0.20 -0.25 0.00 -0.13 0.00 0.00 55.73 55.41 2uxs s ARG 34 Cb -0.13 -0.62 0.05 0.00 -1.56 0.00 0.00 34.95 32.69 2uxs s ARG 34 CO 0.16 0.08 1.10 -1.17 -0.81 0.00 0.00 175.30 174.66 2uxs s LEU 35 N 0.16 3.84 -0.01 -0.88 1.98 -1.26 -0.81 118.68 121.70 2uxs s LEU 35 Ca -0.02 -0.73 -0.22 0.00 -2.89 0.00 0.00 54.13 50.27 2uxs s LEU 35 Cb -0.06 -2.49 -0.12 0.00 0.66 0.00 0.00 46.19 44.17 2uxs s LEU 35 CO -0.00 -1.61 0.92 -0.78 -1.89 0.00 0.00 176.35 172.99 2uxs h ASP 36 N 9.77 -0.64 -4.93 3.68 3.58 -1.23 -3.49 116.42 123.16 2uxs h ASP 36 Ca -0.28 0.01 0.05 0.00 0.42 0.00 0.00 57.03 57.23 2uxs h ASP 36 Cb 1.06 0.17 -0.11 0.00 1.72 0.00 0.00 39.33 42.16 2uxs h ASP 36 CO 1.22 -0.24 0.33 0.00 -2.88 0.00 0.00 179.24 177.67 2uxs s ARG 37 N -4.12 1.21 -0.15 0.28 1.70 -1.21 -5.03 118.95 111.64 2uxs s ARG 37 Ca -0.12 -0.52 -0.20 0.00 -0.47 0.00 0.00 55.73 54.43 2uxs s ARG 37 Cb 0.01 0.51 -0.04 0.00 -0.57 0.00 0.00 34.95 34.87 2uxs s ARG 37 CO 0.36 -0.54 0.55 -0.47 -1.08 0.00 0.00 175.30 174.12 2uxs s TYR 38 N -3.54 3.46 0.54 5.89 5.04 -1.26 0.24 117.35 127.72 2uxs s TYR 38 Ca 0.05 0.92 -0.21 0.00 -2.44 0.00 0.00 57.07 55.39 2uxs s TYR 38 Cb -0.02 -2.67 -0.06 0.00 0.35 0.00 0.00 41.96 39.57 2uxs s TYR 38 CO -0.07 0.02 1.23 1.28 -1.34 0.00 0.00 175.55 176.67 2uxs n LEU 39 N 4.24 4.76 0.05 6.97 4.77 -0.89 -4.89 117.00 132.00 2uxs n LEU 39 Ca -0.04 0.95 0.13 0.00 -0.03 0.00 0.00 56.01 57.01 2uxs n LEU 39 Cb 0.51 -1.51 0.33 0.00 -2.33 0.00 0.00 43.42 40.42 2uxs n LEU 39 CO 0.44 -0.97 0.62 -1.22 -1.33 0.00 0.00 177.39 174.92 2uxs n TYR 40 N -1.12 0.42 -4.12 -1.77 4.02 -1.26 -4.84 117.16 108.48 2uxs n TYR 40 Ca 0.11 0.12 -0.25 0.00 -0.01 0.00 0.00 57.90 57.88 2uxs n TYR 40 Cb 0.44 -0.61 -0.06 0.00 -0.02 0.00 0.00 39.34 39.10 2uxs n TYR 40 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 2uxs s THR 41 N -3.08 4.29 -1.25 -0.72 -4.23 -1.26 -4.87 115.64 104.52 2uxs s THR 41 Ca 0.10 -1.28 -0.09 0.00 -1.18 0.00 0.00 61.69 59.23 2uxs s THR 41 Cb 0.15 -3.23 -0.12 0.00 1.34 0.00 0.00 72.50 70.64 2uxs s THR 41 CO 0.65 -0.20 3.10 -0.81 -0.54 0.00 0.00 174.62 176.82 2uxs n PRO 42 N -0.60 3.34 -4.46 3.99 -0.04 -1.26 -4.86 135.00 131.12 2uxs n PRO 42 Ca -0.08 -1.97 -0.23 0.00 -0.04 0.00 0.00 63.50 61.19 2uxs n PRO 42 Cb 0.56 -2.61 -0.10 0.00 -0.04 0.00 0.00 33.50 31.30 2uxs n PRO 42 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2uxs s MET 43 N 1.80 1.62 -0.05 0.54 -1.94 -1.26 -5.16 119.30 114.85 2uxs s MET 43 Ca 0.69 -1.80 -0.07 0.00 -1.71 0.00 0.00 55.69 52.80 2uxs s MET 43 Cb 0.21 -1.41 0.01 0.00 2.01 0.00 0.00 34.83 35.65 2uxs s MET 43 CO -0.05 0.14 0.19 0.00 -0.01 0.00 0.00 175.02 175.29 2uxs s ALA 44 N -2.80 -0.45 -0.02 3.03 0.00 -1.26 -4.59 121.76 115.67 2uxs s ALA 44 Ca 0.29 0.34 -0.35 0.00 0.00 0.00 0.00 51.96 52.24 2uxs s ALA 44 Cb 0.01 -0.17 -0.14 0.00 0.00 0.00 0.00 23.12 22.82 2uxs s ALA 44 CO 0.13 -0.14 1.69 0.66 0.00 0.00 0.00 175.76 178.10 2uxs n TYR 45 N 2.44 2.15 0.21 0.00 4.02 -0.81 -4.67 117.16 120.50 2uxs n TYR 45 Ca -0.16 0.26 0.07 0.00 -0.01 0.00 0.00 57.90 58.07 2uxs n TYR 45 Cb 0.58 -2.55 0.45 0.00 -0.02 0.00 0.00 39.34 37.80 2uxs n TYR 45 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 2uxs h PRO 46 N 7.18 0.00 -4.63 -0.72 0.13 -1.93 -1.75 132.00 130.28 2uxs h PRO 46 Ca -0.47 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.36 2uxs h PRO 46 Cb 1.28 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.27 2uxs h PRO 46 CO 0.91 0.29 -0.55 0.95 -0.23 0.00 0.00 178.00 179.37 2uxs s THR 47 N -3.84 0.00 0.30 1.56 -4.23 -1.26 -4.84 115.64 103.32 2uxs s THR 47 Ca -0.01 -1.96 -0.29 0.00 -1.18 0.00 0.00 61.69 58.24 2uxs s THR 47 Cb 0.12 -2.49 -0.11 0.00 1.34 0.00 0.00 72.50 71.36 2uxs s THR 47 CO 0.66 0.00 1.46 -1.81 -0.54 0.00 0.00 174.62 174.39 2uxs s ASP 48 N -3.22 6.55 -0.02 3.99 1.11 -1.20 -3.94 116.67 119.94 2uxs s ASP 48 Ca 0.39 2.81 0.02 0.00 0.18 0.00 0.00 52.55 55.94 2uxs s ASP 48 Cb 0.05 -2.64 0.00 0.00 1.07 0.00 0.00 42.92 41.41 2uxs s ASP 48 CO 0.17 -0.75 -0.07 -0.47 1.18 0.00 0.00 175.17 175.23 2uxs s TYR 49 N -0.44 0.78 0.00 4.23 5.04 0.34 -1.21 117.35 126.08 2uxs s TYR 49 Ca 0.57 -0.18 0.00 0.00 -2.44 0.00 0.00 57.07 55.01 2uxs s TYR 49 Cb -0.44 -0.57 0.00 0.00 0.35 0.00 0.00 41.96 41.30 2uxs s TYR 49 CO 0.50 -0.09 0.00 0.41 -1.34 0.00 0.00 175.55 175.03 2uxs n GLY 50 N 3.34 3.02 3.28 8.97 0.00 -0.45 0.57 105.19 123.92 2uxs n GLY 50 Ca -0.18 -0.10 -0.13 0.00 0.00 0.00 0.00 46.02 45.61 2uxs n GLY 50 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2uxs s PHE 51 N 0.22 -0.20 -0.25 1.61 -0.12 -0.91 -1.52 117.98 116.80 2uxs s PHE 51 Ca 0.00 0.19 -0.29 0.00 -0.05 0.00 0.00 56.93 56.78 2uxs s PHE 51 Cb 0.00 0.15 0.01 0.00 -0.63 0.00 0.00 43.02 42.55 2uxs s PHE 51 CO 0.00 -0.49 1.08 0.42 -0.05 0.00 0.00 175.22 176.18 2uxs s ILE 52 N -2.09 4.58 0.23 -4.49 1.01 0.74 -1.47 121.20 119.70 2uxs s ILE 52 Ca -0.08 1.88 -0.32 0.00 0.00 0.00 0.00 60.65 62.13 2uxs s ILE 52 Cb -0.02 -4.30 -0.12 0.00 0.01 0.00 0.00 42.46 38.03 2uxs s ILE 52 CO -0.00 -0.26 1.66 1.21 0.00 0.00 0.00 174.94 177.54 2uxs n GLU 53 N 6.53 2.65 -2.99 2.79 4.07 0.13 -2.88 120.64 130.93 2uxs n GLU 53 Ca 0.12 0.95 -0.12 0.00 -0.06 0.00 0.00 57.16 58.05 2uxs n GLU 53 Cb 0.46 -2.76 0.04 0.00 -0.06 0.00 0.00 31.44 29.12 2uxs n GLU 53 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 2uxs n ASP 54 N 3.28 -4.24 -4.37 4.31 8.00 -1.26 -4.74 116.55 117.53 2uxs n ASP 54 Ca 0.14 -0.26 -0.20 0.00 0.71 0.00 0.00 54.79 55.18 2uxs n ASP 54 Cb 0.35 -2.88 -0.10 0.00 -0.02 0.00 0.00 41.12 38.46 2uxs n ASP 54 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2uxs s THR 55 N -3.11 1.92 -0.05 -3.53 -4.23 -1.14 -4.53 115.64 100.98 2uxs s THR 55 Ca 0.28 -2.18 -0.02 0.00 -1.18 0.00 0.00 61.69 58.58 2uxs s THR 55 Cb -0.12 -2.05 0.03 0.00 1.34 0.00 0.00 72.50 71.70 2uxs s THR 55 CO 0.34 -0.48 0.08 -0.22 -0.54 0.00 0.00 174.62 173.80 2uxs s LEU 56 N -3.20 0.27 0.00 4.79 2.96 0.06 -4.03 118.68 119.52 2uxs s LEU 56 Ca 0.22 0.14 0.00 0.00 -0.22 0.00 0.00 54.13 54.28 2uxs s LEU 56 Cb -0.03 -0.01 0.00 0.00 0.50 0.00 0.00 46.19 46.65 2uxs s LEU 56 CO 0.09 -0.22 0.00 0.61 -1.32 0.00 0.00 176.35 175.50 2uxs n GLY 57 N 5.07 -0.49 0.28 7.98 0.00 0.87 -4.37 105.19 114.53 2uxs n GLY 57 Ca -0.09 -1.74 0.17 0.00 0.00 0.00 0.00 46.02 44.37 2uxs n GLY 57 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2uxs h ASP 58 N 0.00 0.00 0.00 1.61 5.19 -1.97 -3.24 116.42 118.01 2uxs h ASP 58 Ca 0.00 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2uxs h ASP 58 Cb 0.00 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.50 2uxs h ASP 58 CO 0.00 0.03 -0.41 -0.90 -3.12 0.00 0.00 179.24 174.84 2uxs n ASP 59 N -3.16 1.81 -0.37 6.45 5.75 -1.26 -4.94 116.55 120.83 2uxs n ASP 59 Ca -0.00 -3.72 -0.05 0.00 -0.01 0.00 0.00 54.79 51.01 2uxs n ASP 59 Cb 0.28 -0.51 -0.02 0.00 -1.03 0.00 0.00 41.12 39.84 2uxs n ASP 59 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2uxs n GLY 60 N -1.15 0.58 3.37 6.12 0.00 -1.22 -4.98 105.19 107.91 2uxs n GLY 60 Ca 0.18 -0.09 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 2uxs n GLY 60 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2uxs s ASP 61 N -2.26 3.50 0.67 1.61 1.01 -1.26 -4.88 116.67 115.06 2uxs s ASP 61 Ca 0.00 -0.36 -0.17 0.00 0.71 0.00 0.00 52.55 52.73 2uxs s ASP 61 Cb 0.00 -0.70 -0.00 0.00 1.01 0.00 0.00 42.92 43.23 2uxs s ASP 61 CO 0.00 0.31 1.24 -0.81 0.21 0.00 0.00 175.17 176.12 2uxs n PRO 62 N 2.54 0.94 -1.96 8.23 -0.04 -1.26 -0.09 135.00 143.36 2uxs n PRO 62 Ca -0.17 0.38 -0.42 0.00 -0.04 0.00 0.00 63.50 63.26 2uxs n PRO 62 Cb 0.52 -2.47 -0.02 0.00 -0.04 0.00 0.00 33.50 31.48 2uxs n PRO 62 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2uxs s LEU 63 N -4.26 4.37 0.54 1.53 2.96 -1.26 -4.69 118.68 117.87 2uxs s LEU 63 Ca 0.81 2.68 -0.19 0.00 -0.22 0.00 0.00 54.13 57.21 2uxs s LEU 63 Cb -0.37 -3.61 -0.06 0.00 0.50 0.00 0.00 46.19 42.65 2uxs s LEU 63 CO 0.43 -0.77 1.10 -1.81 -1.32 0.00 0.00 176.35 173.97 2uxs s ASP 64 N 0.67 5.83 -0.04 3.68 1.01 -1.24 -0.19 116.67 126.40 2uxs s ASP 64 Ca 0.64 2.06 -0.03 0.00 0.71 0.00 0.00 52.55 55.93 2uxs s ASP 64 Cb -0.43 -2.57 0.02 0.00 1.01 0.00 0.00 42.92 40.95 2uxs s ASP 64 CO 0.39 -1.14 0.09 0.00 0.21 0.00 0.00 175.17 174.73 2uxs s ALA 65 N -1.94 -0.20 -0.20 5.23 0.00 -0.58 -1.76 121.76 122.32 2uxs s ALA 65 Ca 0.70 0.34 -0.09 0.00 0.00 0.00 0.00 51.96 52.92 2uxs s ALA 65 Cb -0.21 -0.22 -0.05 0.00 0.00 0.00 0.00 23.12 22.65 2uxs s ALA 65 CO 0.27 -0.07 0.10 -0.51 0.00 0.00 0.00 175.76 175.55 2uxs s LEU 66 N 0.39 4.00 -0.10 0.00 1.43 0.92 -1.34 118.68 123.98 2uxs s LEU 66 Ca -0.03 0.14 0.04 0.00 -1.03 0.00 0.00 54.13 53.25 2uxs s LEU 66 Cb -0.04 -2.03 -0.00 0.00 0.03 0.00 0.00 46.19 44.15 2uxs s LEU 66 CO -0.02 0.16 -0.23 -0.69 0.23 0.00 0.00 176.35 175.81 2uxs s VAL 67 N 0.44 2.16 -0.19 -1.59 1.01 -0.35 0.27 120.40 122.16 2uxs s VAL 67 Ca 0.06 -0.98 -0.23 0.00 0.00 0.00 0.00 61.98 60.83 2uxs s VAL 67 Cb -0.12 -1.83 -0.02 0.00 0.00 0.00 0.00 36.38 34.41 2uxs s VAL 67 CO -0.00 0.56 0.71 -0.76 0.00 0.00 0.00 175.10 175.60 2uxs s LEU 68 N 0.36 4.15 0.04 3.92 1.02 -0.36 -3.25 118.68 124.56 2uxs s LEU 68 Ca -0.18 0.96 0.02 0.00 0.02 0.00 0.00 54.13 54.95 2uxs s LEU 68 Cb -0.18 -3.02 -0.02 0.00 0.02 0.00 0.00 46.19 42.99 2uxs s LEU 68 CO 0.08 -0.33 -0.08 -0.76 0.02 0.00 0.00 176.35 175.28 2uxs s LEU 69 N 2.07 2.25 0.27 1.79 1.43 -1.26 -4.27 118.68 120.96 2uxs s LEU 69 Ca 0.32 -0.54 -0.02 0.00 -1.03 0.00 0.00 54.13 52.86 2uxs s LEU 69 Cb -0.16 -0.17 0.36 0.00 0.03 0.00 0.00 46.19 46.25 2uxs s LEU 69 CO 0.11 -0.20 1.79 1.55 0.23 0.00 0.00 176.35 179.83 2uxs h PRO 70 N 4.53 0.82 -3.82 1.29 0.13 -2.04 -3.45 132.00 129.46 2uxs h PRO 70 Ca -0.36 -0.19 -0.36 0.00 -0.87 0.00 0.00 66.00 64.21 2uxs h PRO 70 Cb 1.20 -0.11 -0.34 0.00 0.13 0.00 0.00 31.00 31.88 2uxs h PRO 70 CO 0.41 0.78 -0.76 -1.14 -0.23 0.00 0.00 178.00 177.06 2uxs s GLN 71 N -5.10 0.48 0.63 0.86 2.00 -1.26 -5.14 119.66 112.12 2uxs s GLN 71 Ca -0.10 0.01 -0.18 0.00 -2.00 0.00 0.00 55.36 53.09 2uxs s GLN 71 Cb 0.15 -0.60 -0.02 0.00 0.80 0.00 0.00 33.01 33.34 2uxs s GLN 71 CO 0.81 -0.12 1.28 -1.25 -0.50 0.00 0.00 175.29 175.51 2uxs s PRO 72 N 0.98 2.68 0.23 1.67 0.04 -1.26 -5.05 135.00 134.30 2uxs s PRO 72 Ca -0.10 2.02 0.04 0.00 0.04 0.00 0.00 61.00 63.00 2uxs s PRO 72 Cb -0.14 -1.89 0.04 0.00 0.04 0.00 0.00 34.50 32.55 2uxs s PRO 72 CO -0.01 -1.48 0.32 1.33 0.04 0.00 0.00 177.00 177.20 2uxs n VAL 73 N -1.78 0.00 -3.88 -0.36 0.24 -1.26 -5.02 118.33 106.27 2uxs n VAL 73 Ca 0.15 -0.77 -0.31 0.00 -2.04 0.00 0.00 64.34 61.37 2uxs n VAL 73 Cb 0.48 -0.81 -0.04 0.00 -1.47 0.00 0.00 33.84 32.00 2uxs n VAL 73 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 2uxs s PHE 74 N -0.44 3.52 0.29 6.34 0.40 -1.26 -4.52 117.98 122.31 2uxs s PHE 74 Ca 0.24 0.32 -0.30 0.00 -0.60 0.00 0.00 56.93 56.59 2uxs s PHE 74 Cb -0.02 -1.81 -0.13 0.00 0.51 0.00 0.00 43.02 41.57 2uxs s PHE 74 CO 0.15 0.58 1.35 -2.30 0.70 0.00 0.00 175.22 175.70 2uxs n PRO 75 N 0.38 2.07 0.00 0.24 -0.02 -1.26 -1.83 135.00 134.57 2uxs n PRO 75 Ca -0.06 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 2uxs n PRO 75 Cb 0.51 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 2uxs n PRO 75 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2uxs n GLY 76 N 1.55 1.68 3.74 -1.23 0.00 0.72 -4.99 105.19 106.67 2uxs n GLY 76 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 2uxs n GLY 76 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2uxs s VAL 77 N -2.36 3.77 0.06 1.61 1.01 -0.76 -4.81 120.40 118.91 2uxs s VAL 77 Ca 0.00 1.57 -0.22 0.00 0.00 0.00 0.00 61.98 63.33 2uxs s VAL 77 Cb 0.00 -4.00 -0.06 0.00 0.00 0.00 0.00 36.38 32.32 2uxs s VAL 77 CO 0.00 0.29 0.66 -0.76 0.00 0.00 0.00 175.10 175.29 2uxs s LEU 78 N -0.59 4.48 -0.06 3.92 1.43 -1.26 -1.95 118.68 124.66 2uxs s LEU 78 Ca 0.48 1.34 0.01 0.00 -1.03 0.00 0.00 54.13 54.93 2uxs s LEU 78 Cb -0.30 -3.05 0.02 0.00 0.03 0.00 0.00 46.19 42.89 2uxs s LEU 78 CO 0.36 0.14 -0.06 0.54 0.23 0.00 0.00 176.35 177.56 2uxs s VAL 79 N -0.56 0.73 -0.01 -1.59 0.11 -0.00 -4.99 120.40 114.09 2uxs s VAL 79 Ca 0.33 -0.21 -0.30 0.00 -2.93 0.00 0.00 61.98 58.87 2uxs s VAL 79 Cb -0.20 -0.73 -0.04 0.00 -1.53 0.00 0.00 36.38 33.88 2uxs s VAL 79 CO 0.21 0.28 1.12 0.00 -3.33 0.00 0.00 175.10 173.38 2uxs s ALA 80 N 1.05 3.37 0.17 1.54 0.00 -1.26 -1.21 121.76 125.42 2uxs s ALA 80 Ca -0.09 0.65 -0.08 0.00 0.00 0.00 0.00 51.96 52.44 2uxs s ALA 80 Cb -0.14 -3.44 -0.01 0.00 0.00 0.00 0.00 23.12 19.52 2uxs s ALA 80 CO -0.00 -0.51 0.27 0.00 0.00 0.00 0.00 175.76 175.52 2uxs s ALA 81 N 1.52 0.14 0.02 0.00 0.00 0.17 -1.55 121.76 122.07 2uxs s ALA 81 Ca 0.55 -1.00 0.01 0.00 0.00 0.00 0.00 51.96 51.52 2uxs s ALA 81 Cb -0.25 0.92 -0.02 0.00 0.00 0.00 0.00 23.12 23.77 2uxs s ALA 81 CO 0.25 -0.65 -0.04 -0.98 0.00 0.00 0.00 175.76 174.35 2uxs s ARG 82 N -3.99 0.33 0.14 0.00 1.70 0.09 -1.60 118.95 115.61 2uxs s ARG 82 Ca 0.20 -0.55 -0.19 0.00 -0.47 0.00 0.00 55.73 54.72 2uxs s ARG 82 Cb 0.04 -0.02 -0.07 0.00 -0.57 0.00 0.00 34.95 34.32 2uxs s ARG 82 CO 0.02 -0.01 0.63 -1.25 -1.08 0.00 0.00 175.30 173.61 2uxs s PRO 83 N -1.24 4.21 0.00 3.89 0.04 -1.26 -1.44 135.00 139.20 2uxs s PRO 83 Ca -0.12 0.77 0.00 0.00 0.04 0.00 0.00 61.00 61.70 2uxs s PRO 83 Cb -0.08 -3.08 0.00 0.00 0.04 0.00 0.00 34.50 31.38 2uxs s PRO 83 CO -0.01 0.53 0.20 1.33 0.04 0.00 0.00 177.00 179.10 2uxs n VAL 84 N 1.23 0.00 -1.49 -0.36 0.24 0.77 -4.89 118.33 113.82 2uxs n VAL 84 Ca -0.06 -0.37 0.00 0.00 -2.04 0.00 0.00 64.34 61.87 2uxs n VAL 84 Cb 0.51 1.15 0.00 0.00 -1.47 0.00 0.00 33.84 34.03 2uxs n VAL 84 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2uxs n GLY 85 N 0.33 -1.56 3.24 7.63 0.00 -1.18 -1.31 105.19 112.35 2uxs n GLY 85 Ca 0.00 -1.05 -0.12 0.00 0.00 0.00 0.00 46.02 44.85 2uxs n GLY 85 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2uxs s MET 86 N -1.44 0.39 -0.36 1.61 1.75 -0.68 -0.13 119.30 120.44 2uxs s MET 86 Ca 0.00 0.65 -0.21 0.00 -1.25 0.00 0.00 55.69 54.87 2uxs s MET 86 Cb 0.00 0.06 0.01 0.00 2.84 0.00 0.00 34.83 37.73 2uxs s MET 86 CO 0.00 -0.12 0.67 0.12 -0.65 0.00 0.00 175.02 175.05 2uxs s PHE 87 N 0.90 3.13 -0.08 4.11 5.36 0.20 -0.78 117.98 130.82 2uxs s PHE 87 Ca -0.06 0.37 -0.19 0.00 -0.96 0.00 0.00 56.93 56.10 2uxs s PHE 87 Cb -0.06 -3.22 -0.04 0.00 -0.34 0.00 0.00 43.02 39.35 2uxs s PHE 87 CO -0.07 -0.67 0.53 1.03 -1.46 0.00 0.00 175.22 174.58 2uxs s ARG 88 N 2.82 4.32 -0.10 10.12 0.52 0.23 -1.19 118.95 135.67 2uxs s ARG 88 Ca 0.26 0.57 -0.10 0.00 -0.52 0.00 0.00 55.73 55.94 2uxs s ARG 88 Cb -0.14 -3.41 0.03 0.00 0.52 0.00 0.00 34.95 31.95 2uxs s ARG 88 CO 0.16 0.22 0.29 1.41 0.02 0.00 0.00 175.30 177.39 2uxs s MET 89 N 0.39 0.35 -0.22 3.54 -2.45 -0.92 -0.28 119.30 119.71 2uxs s MET 89 Ca 0.29 0.36 0.01 0.00 -1.25 0.00 0.00 55.69 55.10 2uxs s MET 89 Cb -0.16 0.17 0.04 0.00 1.25 0.00 0.00 34.83 36.12 2uxs s MET 89 CO 0.13 -0.05 -0.15 0.08 1.05 0.00 0.00 175.02 176.08 2uxs s VAL 90 N 0.05 2.19 0.00 10.11 1.01 -1.26 0.88 120.40 133.39 2uxs s VAL 90 Ca -0.01 -1.21 0.00 0.00 0.00 0.00 0.00 61.98 60.76 2uxs s VAL 90 Cb -0.02 -2.08 0.00 0.00 0.00 0.00 0.00 36.38 34.27 2uxs s VAL 90 CO 0.01 0.29 0.00 -0.90 0.00 0.00 0.00 175.10 174.49 2uxs n ASP 91 N 4.55 0.05 0.20 3.32 5.68 -0.23 -0.72 116.55 129.40 2uxs n ASP 91 Ca -0.18 0.00 0.12 0.00 -0.50 0.00 0.00 54.79 54.24 2uxs n ASP 91 Cb 0.47 0.00 0.24 0.00 -1.14 0.00 0.00 41.12 40.69 2uxs n ASP 91 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 2uxs h GLU 92 N 0.00 0.00 -0.68 0.11 9.09 -1.88 -1.72 114.58 119.50 2uxs h GLU 92 Ca 0.00 0.00 -0.10 0.00 0.05 0.00 0.00 59.36 59.31 2uxs h GLU 92 Cb 0.00 0.00 -0.06 0.00 -1.65 0.00 0.00 28.75 27.04 2uxs h GLU 92 CO 0.00 0.00 0.12 0.72 0.05 0.00 0.00 179.01 179.90 2uxs n HIS 93 N -2.94 2.19 -4.04 2.06 8.25 -1.26 -5.06 115.22 114.42 2uxs n HIS 93 Ca 0.04 -0.91 0.00 0.00 -0.26 0.00 0.00 57.72 56.59 2uxs n HIS 93 Cb 0.50 -0.58 0.00 0.00 1.12 0.00 0.00 29.99 31.03 2uxs n HIS 93 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2uxs n GLY 94 N 0.27 -1.05 3.61 -1.41 0.00 -0.65 -4.92 105.19 101.04 2uxs n GLY 94 Ca 0.33 -1.23 -0.42 0.00 0.00 0.00 0.00 46.02 44.70 2uxs n GLY 94 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2uxs n GLY 95 N 0.00 -0.19 3.60 -0.02 0.00 -1.26 -1.06 105.19 106.25 2uxs n GLY 95 Ca 0.00 0.20 -0.01 0.00 0.00 0.00 0.00 46.02 46.21 2uxs n GLY 95 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2uxs s ASP 96 N -0.66 -1.02 0.16 1.61 -1.08 0.25 -4.85 116.67 111.09 2uxs s ASP 96 Ca 0.61 1.40 0.09 0.00 -0.52 0.00 0.00 52.55 54.14 2uxs s ASP 96 Cb -0.59 2.13 -0.04 0.00 -1.46 0.00 0.00 42.92 42.95 2uxs s ASP 96 CO 0.58 -0.20 -0.14 -1.81 0.52 0.00 0.00 175.17 174.12 2uxs s ASP 97 N 2.74 4.01 -0.20 -0.34 1.01 -1.26 -2.16 116.67 120.47 2uxs s ASP 97 Ca -0.05 -0.62 -0.04 0.00 0.71 0.00 0.00 52.55 52.54 2uxs s ASP 97 Cb -0.10 -0.59 0.07 0.00 1.01 0.00 0.00 42.92 43.30 2uxs s ASP 97 CO -0.19 0.13 0.08 -0.54 0.21 0.00 0.00 175.17 174.86 2uxs s LYS 98 N -2.61 0.28 0.07 8.23 1.02 -0.34 -3.58 119.74 122.82 2uxs s LYS 98 Ca 0.22 -0.30 -0.31 0.00 0.02 0.00 0.00 55.97 55.61 2uxs s LYS 98 Cb -0.09 -1.82 -0.07 0.00 -0.52 0.00 0.00 37.83 35.32 2uxs s LYS 98 CO 0.13 -0.73 1.45 0.08 -0.92 0.00 0.00 175.35 175.36 2uxs s VAL 99 N 2.03 3.34 -0.18 3.17 1.01 -0.72 -0.63 120.40 128.42 2uxs s VAL 99 Ca 0.03 0.88 -0.22 0.00 0.00 0.00 0.00 61.98 62.66 2uxs s VAL 99 Cb -0.16 -3.56 -0.02 0.00 0.00 0.00 0.00 36.38 32.63 2uxs s VAL 99 CO -0.14 0.03 0.67 -0.22 0.00 0.00 0.00 175.10 175.45 2uxs s LEU 100 N 1.77 4.17 0.12 3.92 2.96 0.82 -0.06 118.68 132.38 2uxs s LEU 100 Ca 0.66 0.93 0.07 0.00 -0.22 0.00 0.00 54.13 55.57 2uxs s LEU 100 Cb -0.36 -2.97 -0.04 0.00 0.50 0.00 0.00 46.19 43.32 2uxs s LEU 100 CO 0.29 -0.28 -0.17 0.00 -1.32 0.00 0.00 176.35 174.87 2uxs s VAL 102 N -1.63 2.32 0.21 0.00 -7.23 -0.52 -1.22 120.40 112.33 2uxs s VAL 102 Ca 0.07 -1.94 -0.31 0.00 -1.81 0.00 0.00 61.98 58.00 2uxs s VAL 102 Cb -0.08 -2.89 -0.10 0.00 0.56 0.00 0.00 36.38 33.88 2uxs s VAL 102 CO 0.04 -0.09 1.52 -2.84 -0.31 0.00 0.00 175.10 173.41 2uxs s PRO 103 N -3.75 4.23 0.39 4.82 0.02 -1.26 -0.73 135.00 138.72 2uxs s PRO 103 Ca 0.36 2.36 -0.24 0.00 0.02 0.00 0.00 61.00 63.50 2uxs s PRO 103 Cb 0.04 -3.12 -0.09 0.00 0.02 0.00 0.00 34.50 31.35 2uxs s PRO 103 CO 0.19 -0.53 1.06 0.00 -0.33 0.00 0.00 177.00 177.40 2uxs s ALA 104 N 0.56 3.11 -1.59 -1.55 0.00 -0.59 -3.71 121.76 117.99 2uxs s ALA 104 Ca 0.65 0.74 0.00 0.00 0.00 0.00 0.00 51.96 53.35 2uxs s ALA 104 Cb -0.43 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.40 2uxs s ALA 104 CO 0.38 -0.25 0.00 0.41 0.00 0.00 0.00 175.76 176.30 2uxs n GLY 105 N 0.42 1.12 3.30 0.00 0.00 -1.26 -4.90 105.19 103.87 2uxs n GLY 105 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 2uxs n GLY 105 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2uxs s ASP 106 N -2.27 5.74 0.50 1.61 -1.08 -1.24 -4.99 116.67 114.94 2uxs s ASP 106 Ca 0.00 -1.42 0.34 0.00 -0.52 0.00 0.00 52.55 50.95 2uxs s ASP 106 Cb 0.00 -2.03 1.76 0.00 -1.46 0.00 0.00 42.92 41.19 2uxs s ASP 106 CO 0.00 -0.54 2.02 1.55 0.52 0.00 0.00 175.17 178.72 2uxs h PRO 107 N 8.47 0.00 0.00 4.34 0.13 -1.92 -1.49 132.00 141.53 2uxs h PRO 107 Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 2uxs h PRO 107 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2uxs h PRO 107 CO 0.77 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.54 2uxs h ARG 108 N 0.00 0.00 -0.29 0.86 3.08 -1.97 -1.95 114.38 114.11 2uxs h ARG 108 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2uxs h ARG 108 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.12 2uxs h ARG 108 CO 0.00 0.00 0.00 0.91 -1.07 0.00 0.00 179.97 179.81 2uxs n TRP 109 N -2.36 0.39 0.27 3.04 7.02 -0.56 -4.66 117.44 120.57 2uxs n TRP 109 Ca -0.00 -0.47 0.11 0.00 -1.02 0.00 0.00 57.50 56.12 2uxs n TRP 109 Cb 0.11 -0.03 0.74 0.00 -2.42 0.00 0.00 31.31 29.71 2uxs n TRP 109 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 2uxs h ASP 110 N 1.81 0.00 0.61 -0.99 5.19 -1.47 -1.30 116.42 120.27 2uxs h ASP 110 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2uxs h ASP 110 Cb 0.69 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.20 2uxs h ASP 110 CO 0.00 0.07 0.00 0.00 -3.12 0.00 0.00 179.24 176.19 2uxs n HIS 111 N -3.98 0.00 -3.56 4.55 1.44 -1.26 -4.51 115.22 107.89 2uxs n HIS 111 Ca -0.03 0.00 -0.41 0.00 -2.01 0.00 0.00 57.72 55.28 2uxs n HIS 111 Cb 0.16 -0.39 -0.09 0.00 0.12 0.00 0.00 29.99 29.79 2uxs n HIS 111 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 2uxs s VAL 112 N -2.78 4.27 -0.01 0.61 1.01 -0.49 -4.89 120.40 118.12 2uxs s VAL 112 Ca 0.17 -1.63 0.01 0.00 0.00 0.00 0.00 61.98 60.53 2uxs s VAL 112 Cb 0.15 -3.73 -0.01 0.00 0.00 0.00 0.00 36.38 32.79 2uxs s VAL 112 CO 0.39 -0.68 0.01 1.67 0.00 0.00 0.00 175.10 176.49 2uxs n GLN 113 N 4.93 3.42 -4.10 2.72 -0.06 -1.26 -4.99 117.38 118.04 2uxs n GLN 113 Ca -0.09 -0.00 -0.14 0.00 -2.00 0.00 0.00 57.00 54.77 2uxs n GLN 113 Cb 0.42 -1.03 -0.05 0.00 -4.06 0.00 0.00 30.24 25.51 2uxs n GLN 113 CO 0.00 0.00 0.00 0.34 -0.20 0.00 0.00 177.06 177.20 2uxs s ASP 114 N -3.04 0.73 0.55 1.69 -1.08 -1.26 -4.80 116.67 109.47 2uxs s ASP 114 Ca -0.01 -1.41 0.37 0.00 -0.52 0.00 0.00 52.55 50.99 2uxs s ASP 114 Cb 0.00 0.62 1.92 0.00 -1.46 0.00 0.00 42.92 44.00 2uxs s ASP 114 CO 0.05 -1.21 2.12 0.16 0.52 0.00 0.00 175.17 176.81 2uxs h ILE 115 N 2.18 0.00 0.00 4.11 -0.00 -1.52 -0.57 117.51 121.71 2uxs h ILE 115 Ca -0.28 -0.09 -0.01 0.00 -0.00 0.00 0.00 64.86 64.48 2uxs h ILE 115 Cb 1.24 0.97 -0.00 0.00 -0.00 0.00 0.00 36.82 39.03 2uxs h ILE 115 CO 0.39 0.00 -0.03 1.23 -0.00 0.00 0.00 178.15 179.74 2uxs h GLY 116 N 0.45 0.00 -0.62 0.16 0.00 -1.96 -2.95 103.07 98.15 2uxs h GLY 116 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2uxs h GLY 116 CO 0.00 0.00 -0.09 1.22 0.00 0.00 0.00 176.54 177.67 2uxs n ASP 117 N -3.50 1.71 -4.63 0.19 8.00 -0.22 -4.78 116.55 113.31 2uxs n ASP 117 Ca -0.02 -1.46 -0.35 0.00 0.71 0.00 0.00 54.79 53.67 2uxs n ASP 117 Cb 0.14 0.06 -0.10 0.00 -0.02 0.00 0.00 41.12 41.20 2uxs n ASP 117 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2uxs s VAL 118 N -2.14 4.77 0.46 2.53 1.01 -1.12 -4.84 120.40 121.07 2uxs s VAL 118 Ca 0.32 -0.04 -0.24 0.00 0.00 0.00 0.00 61.98 62.02 2uxs s VAL 118 Cb 0.20 -3.15 -0.07 0.00 0.00 0.00 0.00 36.38 33.36 2uxs s VAL 118 CO 0.39 0.46 1.25 -2.84 0.00 0.00 0.00 175.10 174.36 2uxs s PRO 119 N 0.42 3.68 0.26 2.72 0.02 -1.26 -4.82 135.00 136.02 2uxs s PRO 119 Ca 0.03 2.01 -0.03 0.00 0.02 0.00 0.00 61.00 63.03 2uxs s PRO 119 Cb -0.12 -2.48 0.53 0.00 0.02 0.00 0.00 34.50 32.44 2uxs s PRO 119 CO 0.00 -0.69 1.67 0.00 -0.33 0.00 0.00 177.00 177.66 2uxs h ALA 120 N 2.11 1.05 -0.12 -1.55 0.00 -1.93 -1.53 119.26 117.28 2uxs h ALA 120 Ca -0.50 0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.63 2uxs h ALA 120 Cb 1.26 0.25 -0.00 0.00 0.00 0.00 0.00 17.79 19.30 2uxs h ALA 120 CO 0.60 -0.37 0.10 0.27 0.00 0.00 0.00 179.25 179.86 2uxs h PHE 121 N 0.26 0.00 0.02 0.00 -5.15 -1.99 0.76 116.94 110.84 2uxs h PHE 121 Ca 0.46 0.00 -0.06 0.00 -0.20 0.00 0.00 57.97 58.16 2uxs h PHE 121 Cb 0.82 0.00 0.01 0.00 0.22 0.00 0.00 35.95 37.00 2uxs h PHE 121 CO -0.26 0.00 -0.26 1.49 -2.00 0.00 0.00 178.31 177.28 2uxs h GLU 122 N 0.00 0.14 -0.86 6.09 4.57 -1.64 -2.39 114.58 120.50 2uxs h GLU 122 Ca 0.06 -0.18 -0.02 0.00 -1.18 0.00 0.00 59.36 58.04 2uxs h GLU 122 Cb 0.27 0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 28.87 2uxs h GLU 122 CO -0.00 0.98 0.45 -0.07 -1.18 0.00 0.00 179.01 179.19 2uxs h LEU 123 N -0.61 1.09 -0.74 1.64 3.38 -1.15 -1.55 115.31 117.36 2uxs h LEU 123 Ca -0.04 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.73 2uxs h LEU 123 Cb 1.08 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.54 2uxs h LEU 123 CO 0.05 0.89 -0.09 0.44 0.09 0.00 0.00 178.44 179.82 2uxs h ASP 124 N 1.21 0.86 -0.08 -0.43 5.19 -0.96 -0.62 116.42 121.59 2uxs h ASP 124 Ca 0.30 -0.26 -0.00 0.00 -0.62 0.00 0.00 57.03 56.45 2uxs h ASP 124 Cb 0.06 -0.23 -0.00 0.00 0.18 0.00 0.00 39.33 39.33 2uxs h ASP 124 CO -0.04 0.97 0.03 0.00 -3.12 0.00 0.00 179.24 177.08 2uxs h ALA 125 N 1.11 0.10 -0.56 3.45 0.00 -1.14 0.92 119.26 123.14 2uxs h ALA 125 Ca 0.13 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.99 2uxs h ALA 125 Cb 0.60 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 2uxs h ALA 125 CO 0.04 -0.33 0.33 0.82 0.00 0.00 0.00 179.25 180.11 2uxs h ILE 126 N -0.02 1.05 -0.62 0.00 2.04 -1.15 -1.81 117.51 117.01 2uxs h ILE 126 Ca 0.03 -0.23 -0.09 0.00 1.00 0.00 0.00 64.86 65.57 2uxs h ILE 126 Cb 0.15 0.34 -0.02 0.00 -0.74 0.00 0.00 36.82 36.54 2uxs h ILE 126 CO -0.00 0.12 0.05 0.50 0.00 0.00 0.00 178.15 178.82 2uxs h LYS 127 N 0.66 1.06 -0.91 2.37 3.64 -0.97 -2.71 116.57 119.71 2uxs h LYS 127 Ca 0.23 -0.31 0.01 0.00 -1.27 0.00 0.00 60.65 59.31 2uxs h LYS 127 Cb 0.03 -0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 31.70 2uxs h LYS 127 CO -0.10 1.01 0.60 1.25 -2.27 0.00 0.00 179.45 179.94 2uxs h HIS 128 N 0.96 1.13 -0.07 1.91 2.76 -0.44 -1.63 115.15 119.78 2uxs h HIS 128 Ca 0.18 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.38 2uxs h HIS 128 Cb 0.50 -0.38 -0.00 0.00 1.55 0.00 0.00 27.41 29.07 2uxs h HIS 128 CO 0.04 0.70 0.04 0.35 -1.30 0.00 0.00 177.93 177.76 2uxs h PHE 129 N 1.21 0.09 0.00 5.26 3.57 -1.04 -2.68 116.94 123.35 2uxs h PHE 129 Ca 0.34 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.78 2uxs h PHE 129 Cb -0.11 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.59 2uxs h PHE 129 CO -0.00 0.12 -0.29 0.74 -2.23 0.00 0.00 178.31 176.65 2uxs h PHE 130 N 0.04 0.00 -0.02 0.41 0.04 -1.18 -0.75 116.94 115.48 2uxs h PHE 130 Ca 0.02 0.00 -0.16 0.00 2.80 0.00 0.00 57.97 60.64 2uxs h PHE 130 Cb 0.06 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.19 2uxs h PHE 130 CO -0.05 0.29 -0.71 0.28 -0.60 0.00 0.00 178.31 177.52 2uxs h VAL 131 N 0.00 1.47 0.00 -0.55 2.07 -1.29 -3.39 116.25 114.56 2uxs h VAL 131 Ca -0.00 -2.33 -0.03 0.00 0.82 0.00 0.00 66.70 65.16 2uxs h VAL 131 Cb 0.83 2.25 -0.01 0.00 -1.52 0.00 0.00 31.29 32.85 2uxs h VAL 131 CO 0.04 0.67 -1.37 1.41 0.02 0.00 0.00 177.57 178.34 2uxs n HIS 132 N -3.74 0.00 0.12 1.57 8.25 -1.02 -4.70 115.22 115.70 2uxs n HIS 132 Ca -0.02 0.00 0.17 0.00 -0.26 0.00 0.00 57.72 57.62 2uxs n HIS 132 Cb 0.69 -0.21 0.74 0.00 1.12 0.00 0.00 29.99 32.33 2uxs n HIS 132 CO 0.00 0.00 0.00 0.10 0.64 0.00 0.00 176.34 177.08 2uxs h TYR 133 N 0.00 0.00 -0.73 4.41 -0.00 -1.33 0.11 116.97 119.42 2uxs h TYR 133 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.68 2uxs h TYR 133 Cb 0.61 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.34 2uxs h TYR 133 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 178.16 179.79 2uxs n LYS 134 N -4.13 2.85 -0.25 0.10 5.02 -1.26 -4.22 118.16 116.28 2uxs n LYS 134 Ca 0.05 -2.70 0.14 0.00 -2.02 0.00 0.00 58.31 53.78 2uxs n LYS 134 Cb 0.44 -1.62 0.43 0.00 -0.02 0.00 0.00 35.03 34.25 2uxs n LYS 134 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 2uxs h ASP 135 N 4.32 0.56 -0.50 4.39 3.32 -1.07 -1.02 116.42 126.42 2uxs h ASP 135 Ca 0.00 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.09 2uxs h ASP 135 Cb 1.05 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.53 2uxs h ASP 135 CO 0.03 0.27 0.00 0.18 -1.72 0.00 0.00 179.24 178.00 2uxs n LEU 136 N -4.54 4.25 -4.26 1.55 4.77 -1.26 -4.82 117.00 112.69 2uxs n LEU 136 Ca 0.17 -2.15 -0.38 0.00 -0.03 0.00 0.00 56.01 53.63 2uxs n LEU 136 Cb 0.53 -0.57 -0.12 0.00 -2.33 0.00 0.00 43.42 40.93 2uxs n LEU 136 CO 0.30 0.63 -0.25 -0.70 -1.33 0.00 0.00 177.39 176.04 2uxs s GLU 137 N -2.02 2.57 0.31 3.23 2.12 -0.39 -4.99 118.70 119.54 2uxs s GLU 137 Ca 0.42 -1.24 -0.29 0.00 0.36 0.00 0.00 54.97 54.22 2uxs s GLU 137 Cb 0.29 -3.47 -0.13 0.00 0.26 0.00 0.00 34.13 31.09 2uxs s GLU 137 CO 0.17 -0.71 1.27 -2.30 -0.54 0.00 0.00 175.26 173.15 2uxs n PRO 138 N 4.79 1.97 0.00 4.30 -0.02 -1.26 -2.02 135.00 142.76 2uxs n PRO 138 Ca -0.12 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 2uxs n PRO 138 Cb 0.44 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 2uxs n PRO 138 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2uxs n GLY 139 N 1.13 2.92 3.70 -1.23 0.00 -1.26 -4.97 105.19 105.48 2uxs n GLY 139 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 2uxs n GLY 139 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2uxs s LYS 140 N -0.08 4.27 0.29 1.61 1.02 -0.86 -4.89 119.74 121.09 2uxs s LYS 140 Ca 0.00 0.33 -0.08 0.00 0.02 0.00 0.00 55.97 56.24 2uxs s LYS 140 Cb 0.00 -3.47 -0.00 0.00 -0.52 0.00 0.00 37.83 33.84 2uxs s LYS 140 CO 0.00 0.09 0.46 -0.59 -0.92 0.00 0.00 175.35 174.39 2uxs s PHE 141 N 0.88 0.68 -0.01 3.18 -0.12 -1.26 -4.73 117.98 116.60 2uxs s PHE 141 Ca 0.22 -1.00 0.02 0.00 -0.05 0.00 0.00 56.93 56.13 2uxs s PHE 141 Cb -0.15 0.06 0.00 0.00 -0.63 0.00 0.00 43.02 42.30 2uxs s PHE 141 CO 0.08 -1.05 -0.07 0.08 -0.05 0.00 0.00 175.22 174.22 2uxs s VAL 142 N -3.58 0.58 -0.00 -2.49 1.01 -1.26 -3.06 120.40 111.60 2uxs s VAL 142 Ca 0.27 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 61.97 2uxs s VAL 142 Cb -0.00 -0.51 -0.00 0.00 0.00 0.00 0.00 36.38 35.87 2uxs s VAL 142 CO 0.14 0.18 -0.00 1.17 0.00 0.00 0.00 175.10 176.58 2uxs n LYS 143 N 3.15 2.61 0.00 2.72 3.00 0.10 -5.01 118.16 124.72 2uxs n LYS 143 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.15 2uxs n LYS 143 Cb 0.56 -1.00 0.00 0.00 0.00 0.00 0.00 35.03 34.59 2uxs n LYS 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2uxs n ALA 144 N -2.17 1.11 -2.50 3.14 0.00 -1.22 -4.96 120.51 113.91 2uxs n ALA 144 Ca -0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 2uxs n ALA 144 Cb 0.50 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.91 2uxs n ALA 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2uxs n ALA 145 N -1.78 -3.64 -3.86 0.00 0.00 -1.16 -4.91 120.51 105.15 2uxs n ALA 145 Ca 0.00 2.27 -0.07 0.00 0.00 0.00 0.00 53.44 55.63 2uxs n ALA 145 Cb 0.00 -4.44 -0.00 0.00 0.00 0.00 0.00 19.45 15.01 2uxs n ALA 145 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2uxs n ASP 146 N 1.60 -1.69 -4.51 0.00 5.75 0.61 -4.99 116.55 113.32 2uxs n ASP 146 Ca -0.39 -2.64 -0.32 0.00 -0.01 0.00 0.00 54.79 51.43 2uxs n ASP 146 Cb 0.61 2.95 -0.12 0.00 -1.03 0.00 0.00 41.12 43.53 2uxs n ASP 146 CO 0.00 0.00 0.00 0.26 -0.11 0.00 0.00 177.20 177.35 2uxs s TRP 147 N -2.87 2.72 0.23 2.11 0.52 -1.26 -0.60 118.94 119.79 2uxs s TRP 147 Ca 0.21 -0.15 0.02 0.00 0.02 0.00 0.00 56.10 56.21 2uxs s TRP 147 Cb -0.03 -1.58 -0.05 0.00 -1.15 0.00 0.00 33.47 30.66 2uxs s TRP 147 CO 0.16 0.26 0.04 0.14 0.02 0.00 0.00 176.95 177.56 2uxs s VAL 148 N -0.86 0.81 0.76 4.03 -7.23 0.04 -4.95 120.40 113.00 2uxs s VAL 148 Ca 0.14 -2.01 -0.08 0.00 -1.81 0.00 0.00 61.98 58.23 2uxs s VAL 148 Cb -0.11 -2.42 0.10 0.00 0.56 0.00 0.00 36.38 34.51 2uxs s VAL 148 CO 0.04 -0.23 1.07 1.51 -0.31 0.00 0.00 175.10 177.18 2uxs s ASP 149 N -3.29 4.44 0.39 4.85 -4.77 -1.26 -1.69 116.67 115.33 2uxs s ASP 149 Ca 0.31 0.32 0.16 0.00 -3.30 0.00 0.00 52.55 50.04 2uxs s ASP 149 Cb 0.07 -0.82 1.05 0.00 -1.09 0.00 0.00 42.92 42.13 2uxs s ASP 149 CO 0.10 -1.85 1.78 -0.09 0.70 0.00 0.00 175.17 175.81 2uxs h ARG 150 N -0.79 0.44 0.03 2.11 2.43 -1.85 -1.83 114.38 114.91 2uxs h ARG 150 Ca -0.43 -0.03 0.02 0.00 -0.81 0.00 0.00 59.98 58.73 2uxs h ARG 150 Cb 1.30 -0.10 -0.05 0.00 -0.42 0.00 0.00 29.97 30.70 2uxs h ARG 150 CO 0.54 0.29 -0.49 0.00 -1.51 0.00 0.00 179.97 178.80 2uxs h ALA 151 N 1.63 -0.93 -0.48 2.80 0.00 -1.92 0.17 119.26 120.52 2uxs h ALA 151 Ca 0.58 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 55.33 2uxs h ALA 151 Cb 1.37 0.90 -0.02 0.00 0.00 0.00 0.00 17.79 20.04 2uxs h ALA 151 CO -0.30 -1.07 0.03 0.93 0.00 0.00 0.00 179.25 178.85 2uxs h GLU 152 N -0.64 0.77 -0.21 0.00 5.08 -1.72 -2.25 114.58 115.61 2uxs h GLU 152 Ca 0.01 -0.19 0.05 0.00 -1.00 0.00 0.00 59.36 58.23 2uxs h GLU 152 Cb 0.67 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.77 2uxs h GLU 152 CO -0.31 0.76 -0.10 0.00 -1.00 0.00 0.00 179.01 178.35 2uxs h ALA 153 N 1.31 0.07 -0.49 3.43 0.00 -1.13 -1.54 119.26 120.91 2uxs h ALA 153 Ca 0.15 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2uxs h ALA 153 Cb 0.40 0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 2uxs h ALA 153 CO 0.01 -0.53 0.31 0.93 0.00 0.00 0.00 179.25 179.98 2uxs h GLU 154 N -0.08 0.65 -0.09 0.00 5.08 -0.20 -1.27 114.58 118.67 2uxs h GLU 154 Ca 0.11 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.38 2uxs h GLU 154 Cb 0.25 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 2uxs h GLU 154 CO -0.26 0.45 -0.15 0.00 -1.00 0.00 0.00 179.01 178.04 2uxs h ALA 155 N 1.67 0.14 -0.76 3.43 0.00 -0.95 -2.25 119.26 120.55 2uxs h ALA 155 Ca 0.18 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 2uxs h ALA 155 Cb -0.05 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 2uxs h ALA 155 CO -0.04 0.04 0.36 1.49 0.00 0.00 0.00 179.25 181.10 2uxs h GLU 156 N -0.19 1.09 -0.16 0.00 4.57 -0.86 -2.27 114.58 116.75 2uxs h GLU 156 Ca 0.01 -0.16 0.05 0.00 -1.18 0.00 0.00 59.36 58.07 2uxs h GLU 156 Cb 0.72 -0.19 -0.05 0.00 -0.16 0.00 0.00 28.75 29.07 2uxs h GLU 156 CO 0.03 0.85 -0.16 0.28 -1.18 0.00 0.00 179.01 178.84 2uxs h VAL 157 N 1.06 0.57 -0.71 0.32 2.07 -1.22 -1.96 116.25 116.38 2uxs h VAL 157 Ca 0.26 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.88 2uxs h VAL 157 Cb 0.13 0.57 -0.08 0.00 -1.52 0.00 0.00 31.29 30.39 2uxs h VAL 157 CO -0.03 0.00 0.34 -0.61 0.02 0.00 0.00 177.57 177.29 2uxs h GLN 158 N -0.18 0.55 -0.47 1.57 5.75 -0.93 -0.37 115.11 121.02 2uxs h GLN 158 Ca 0.11 -0.03 -0.08 0.00 -0.15 0.00 0.00 58.65 58.49 2uxs h GLN 158 Cb 0.34 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 28.74 2uxs h GLN 158 CO -0.27 0.36 -0.05 0.00 -2.65 0.00 0.00 178.83 176.22 2uxs h ARG 159 N 0.56 0.81 0.00 1.69 3.08 -1.13 -1.95 114.38 117.45 2uxs h ARG 159 Ca 0.36 -0.25 -0.15 0.00 0.07 0.00 0.00 59.98 60.01 2uxs h ARG 159 Cb 0.42 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.37 2uxs h ARG 159 CO -0.30 0.85 -0.73 0.77 -1.07 0.00 0.00 179.97 179.49 2uxs h SER 160 N 0.75 0.00 -0.42 7.04 0.02 -0.38 0.12 113.55 120.68 2uxs h SER 160 Ca 0.14 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 61.02 2uxs h SER 160 Cb 0.52 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.05 2uxs h SER 160 CO 0.03 0.73 -0.01 0.58 -1.14 0.00 0.00 176.83 177.03 2uxs h VAL 161 N 0.00 1.26 -0.09 2.27 2.07 -0.92 0.50 116.25 121.34 2uxs h VAL 161 Ca -0.01 -1.03 -0.14 0.00 0.82 0.00 0.00 66.70 66.34 2uxs h VAL 161 Cb 1.30 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 32.16 2uxs h VAL 161 CO 0.10 0.35 -0.55 -0.33 0.02 0.00 0.00 177.57 177.16 2uxs h GLU 162 N 0.58 0.28 -0.34 1.57 3.07 -1.09 -2.61 114.58 116.04 2uxs h GLU 162 Ca 0.12 -0.18 -0.10 0.00 -0.50 0.00 0.00 59.36 58.70 2uxs h GLU 162 Cb 0.49 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.41 2uxs h GLU 162 CO 0.02 0.76 -0.22 0.00 -1.40 0.00 0.00 179.01 178.17 2uxs h ARG 163 N 0.22 0.66 0.00 2.33 3.08 -0.92 -2.90 114.38 116.85 2uxs h ARG 163 Ca 0.00 -0.25 -0.04 0.00 0.07 0.00 0.00 59.98 59.76 2uxs h ARG 163 Cb 1.04 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.05 2uxs h ARG 163 CO 0.09 0.83 -0.17 0.35 -1.07 0.00 0.00 179.97 180.00 2uxs h PHE 164 N 0.58 0.00 -0.20 3.04 3.57 -0.92 -2.25 116.94 120.77 2uxs h PHE 164 Ca 0.08 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.58 2uxs h PHE 164 Cb 0.69 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.43 2uxs h PHE 164 CO 0.03 0.17 0.00 1.63 -2.23 0.00 0.00 178.31 177.91 2uxs n LYS 165 N -4.26 1.71 0.00 1.11 5.02 -1.01 -5.01 118.16 115.72 2uxs n LYS 165 Ca -0.02 -1.07 0.00 0.00 -2.02 0.00 0.00 58.31 55.19 2uxs n LYS 165 Cb 0.24 -1.36 0.00 0.00 -0.02 0.00 0.00 35.03 33.89 2uxs n LYS 165 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88