#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2huq s VAL 2 N 0.00 0.47 -0.08 1.12 0.11 -1.09 -4.42 120.40 116.51 2huq s VAL 2 Ca 0.00 -1.61 0.05 0.00 -2.93 0.00 0.00 61.98 57.49 2huq s VAL 2 Cb 0.00 -1.25 -0.00 0.00 -1.53 0.00 0.00 36.38 33.59 2huq s VAL 2 CO 0.00 -0.76 -0.24 -0.22 -3.33 0.00 0.00 175.10 170.55 2huq s LEU 3 N -2.52 2.08 -0.20 2.54 2.96 -0.53 -0.16 118.68 122.84 2huq s LEU 3 Ca 0.03 -0.54 -0.05 0.00 -0.22 0.00 0.00 54.13 53.35 2huq s LEU 3 Cb 0.01 -1.39 -0.02 0.00 0.50 0.00 0.00 46.19 45.29 2huq s LEU 3 CO -0.05 0.20 -0.01 -0.31 -1.32 0.00 0.00 176.35 174.86 2huq s TYR 4 N 0.12 3.01 -0.58 5.38 2.02 0.33 -1.36 117.35 126.26 2huq s TYR 4 Ca -0.12 -0.56 -0.21 0.00 -0.37 0.00 0.00 57.07 55.80 2huq s TYR 4 Cb -0.16 -2.08 0.07 0.00 -0.40 0.00 0.00 41.96 39.39 2huq s TYR 4 CO 0.07 -0.30 0.81 -0.06 -1.57 0.00 0.00 175.55 174.50 2huq s PHE 5 N 1.07 2.87 -0.22 2.71 0.08 0.84 -0.17 117.98 125.16 2huq s PHE 5 Ca 0.02 -0.55 -0.03 0.00 0.12 0.00 0.00 56.93 56.49 2huq s PHE 5 Cb -0.14 -4.00 0.00 0.00 -0.57 0.00 0.00 43.02 38.31 2huq s PHE 5 CO 0.01 -1.36 -0.06 0.42 -0.10 0.00 0.00 175.22 174.13 2huq s ILE 6 N 3.34 3.12 0.38 0.64 1.01 -0.63 -0.07 121.20 128.99 2huq s ILE 6 Ca 0.19 -0.67 -0.26 0.00 0.00 0.00 0.00 60.65 59.90 2huq s ILE 6 Cb -0.18 -2.45 -0.09 0.00 0.01 0.00 0.00 42.46 39.75 2huq s ILE 6 CO 0.11 0.38 1.22 -0.83 0.00 0.00 0.00 174.94 175.82 2huq s GLY 7 N 1.42 2.93 -0.07 6.18 0.00 -0.25 -2.28 107.32 115.25 2huq s GLY 7 Ca 0.04 1.08 0.20 0.00 0.00 0.00 0.00 44.72 46.05 2huq s GLY 7 CO -0.05 1.65 0.37 1.04 0.00 0.00 0.00 173.10 176.11 2huq n LEU 8 N 0.32 0.00 0.00 0.66 4.77 0.56 -4.58 117.00 118.73 2huq n LEU 8 Ca 0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 2huq n LEU 8 Cb 0.45 0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.65 2huq n LEU 8 CO 0.54 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.32 2huq n GLY 9 N 1.43 0.51 0.10 -0.72 0.00 -1.17 -1.70 105.19 103.64 2huq n GLY 9 Ca -0.10 -2.28 -0.17 0.00 0.00 0.00 0.00 46.02 43.47 2huq n GLY 9 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2huq n LEU 10 N 0.00 1.90 -0.00 0.99 4.77 -1.26 0.31 117.00 123.71 2huq n LEU 10 Ca 0.00 0.42 -0.00 0.00 -0.03 0.00 0.00 56.01 56.40 2huq n LEU 10 Cb 0.00 -0.85 -0.00 0.00 -2.33 0.00 0.00 43.42 40.24 2huq n LEU 10 CO 0.00 0.06 -0.02 0.00 -1.33 0.00 0.00 177.39 176.11 2huq n TYR 11 N -4.43 0.00 -4.63 -1.77 9.36 -1.26 -4.54 117.16 109.90 2huq n TYR 11 Ca -0.29 0.00 -0.27 0.00 3.32 0.00 0.00 57.90 60.66 2huq n TYR 11 Cb 0.61 -0.01 -0.06 0.00 -0.63 0.00 0.00 39.34 39.25 2huq n TYR 11 CO 0.00 0.00 0.00 -0.40 0.22 0.00 0.00 176.86 176.68 2huq n ASP 12 N -2.56 3.06 0.15 2.98 5.68 -1.26 -2.32 116.55 122.28 2huq n ASP 12 Ca -0.00 -2.88 0.12 0.00 -0.50 0.00 0.00 54.79 51.52 2huq n ASP 12 Cb 0.01 0.34 0.54 0.00 -1.14 0.00 0.00 41.12 40.87 2huq n ASP 12 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 2huq n GLU 13 N -1.05 0.18 0.00 0.11 0.00 -1.26 -1.76 120.64 116.85 2huq n GLU 13 Ca -0.17 0.52 0.15 0.00 0.00 0.00 0.00 57.16 57.66 2huq n GLU 13 Cb 0.54 -1.92 0.81 0.00 0.00 0.00 0.00 31.44 30.87 2huq n GLU 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 2huq n ARG 14 N -2.27 1.11 0.00 3.44 1.74 -1.26 -3.36 116.66 116.06 2huq n ARG 14 Ca 0.01 -0.26 0.15 0.00 -0.77 0.00 0.00 57.85 56.98 2huq n ARG 14 Cb 0.15 -1.49 0.79 0.00 -1.02 0.00 0.00 32.46 30.89 2huq n ARG 14 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2huq n ASP 15 N -0.72 0.52 -4.79 0.55 8.00 -0.72 -4.82 116.55 114.57 2huq n ASP 15 Ca 0.21 -1.15 -0.36 0.00 0.71 0.00 0.00 54.79 54.21 2huq n ASP 15 Cb 0.19 -0.01 -0.05 0.00 -0.02 0.00 0.00 41.12 41.24 2huq n ASP 15 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 2huq s ILE 16 N -2.02 3.92 0.63 0.53 2.07 -0.69 -4.09 121.20 121.55 2huq s ILE 16 Ca 0.44 1.38 -0.13 0.00 -1.41 0.00 0.00 60.65 60.93 2huq s ILE 16 Cb 0.22 -3.67 -0.02 0.00 0.13 0.00 0.00 42.46 39.11 2huq s ILE 16 CO 0.36 -0.07 1.05 0.42 -1.91 0.00 0.00 174.94 174.79 2huq s THR 17 N -1.80 4.05 0.25 4.00 -4.23 -1.26 -4.86 115.64 111.79 2huq s THR 17 Ca 0.59 0.81 -0.05 0.00 -1.18 0.00 0.00 61.69 61.86 2huq s THR 17 Cb -0.18 -3.46 0.23 0.00 1.34 0.00 0.00 72.50 70.43 2huq s THR 17 CO 0.23 -0.73 1.87 0.58 -0.54 0.00 0.00 174.62 176.03 2huq h VAL 18 N -0.09 1.08 -0.46 2.29 2.07 -1.96 -0.56 116.25 118.63 2huq h VAL 18 Ca -0.45 -0.37 0.05 0.00 0.82 0.00 0.00 66.70 66.75 2huq h VAL 18 Cb 1.21 -0.08 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 2huq h VAL 18 CO 0.58 0.19 0.21 0.50 0.02 0.00 0.00 177.57 179.07 2huq h LYS 19 N 1.07 0.41 -0.55 1.57 3.64 -1.98 -1.75 116.57 118.97 2huq h LYS 19 Ca 0.39 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.67 2huq h LYS 19 Cb 0.12 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 2huq h LYS 19 CO -0.16 0.27 0.07 0.78 -2.27 0.00 0.00 179.45 178.14 2huq h GLY 20 N 0.42 1.00 0.93 5.01 0.00 -1.61 -2.12 103.07 106.69 2huq h GLY 20 Ca 0.21 -0.68 -0.01 0.00 0.00 0.00 0.00 47.33 46.84 2huq h GLY 20 CO -0.17 0.63 0.14 -2.00 0.00 0.00 0.00 176.54 175.14 2huq h LEU 21 N 0.82 0.38 -0.83 3.11 5.85 -0.84 -0.01 115.31 123.78 2huq h LEU 21 Ca 0.17 -0.13 -0.11 0.00 0.84 0.00 0.00 57.88 58.64 2huq h LEU 21 Cb 0.44 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.36 2huq h LEU 21 CO 0.01 0.41 -0.38 -0.33 -0.34 0.00 0.00 178.44 177.82 2huq h GLU 22 N 0.33 0.41 -0.19 1.25 5.08 -1.30 -1.16 114.58 119.01 2huq h GLU 22 Ca 0.10 -0.19 -0.19 0.00 -1.00 0.00 0.00 59.36 58.07 2huq h GLU 22 Cb 0.13 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.38 2huq h GLU 22 CO -0.01 0.73 -0.63 0.82 -1.00 0.00 0.00 179.01 178.92 2huq h ILE 23 N 0.35 1.29 -0.61 3.13 2.04 -1.27 -3.12 117.51 119.32 2huq h ILE 23 Ca 0.04 -1.84 -0.02 0.00 1.00 0.00 0.00 64.86 64.04 2huq h ILE 23 Cb 0.82 1.91 -0.03 0.00 -0.74 0.00 0.00 36.82 38.78 2huq h ILE 23 CO 0.07 0.58 0.31 0.00 0.00 0.00 0.00 178.15 179.11 2huq h ALA 24 N 0.58 1.41 -0.02 1.87 0.00 -0.81 -2.15 119.26 120.14 2huq h ALA 24 Ca -0.03 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 2huq h ALA 24 Cb 1.25 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2huq h ALA 24 CO 0.13 0.48 -0.14 0.87 0.00 0.00 0.00 179.25 180.60 2huq h LYS 25 N 0.85 0.03 -0.17 0.00 1.57 -1.16 -2.88 116.57 114.82 2huq h LYS 25 Ca 0.21 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 2huq h LYS 25 Cb 0.05 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.36 2huq h LYS 25 CO -0.03 0.17 0.00 1.63 -0.57 0.00 0.00 179.45 180.65 2huq n LYS 26 N -4.36 2.24 -2.21 3.15 4.76 -0.83 -4.96 118.16 115.95 2huq n LYS 26 Ca -0.02 -1.84 -0.32 0.00 -2.87 0.00 0.00 58.31 53.26 2huq n LYS 26 Cb 0.22 -1.47 -0.01 0.00 -1.84 0.00 0.00 35.03 31.92 2huq n LYS 26 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2huq h ASP 28 N 0.58 0.56 -4.15 0.00 3.32 -1.16 -3.46 116.42 112.12 2huq h ASP 28 Ca -0.46 -0.91 -0.53 0.00 0.02 0.00 0.00 57.03 55.14 2huq h ASP 28 Cb 1.19 -0.18 -0.30 0.00 0.22 0.00 0.00 39.33 40.26 2huq h ASP 28 CO 0.60 1.62 -0.83 -0.31 -1.72 0.00 0.00 179.24 178.60 2huq s TYR 29 N -2.51 1.51 -0.15 4.55 2.02 -1.13 -5.04 117.35 116.59 2huq s TYR 29 Ca -0.15 -0.34 0.00 0.00 -0.37 0.00 0.00 57.07 56.22 2huq s TYR 29 Cb 0.04 -0.99 0.02 0.00 -0.40 0.00 0.00 41.96 40.63 2huq s TYR 29 CO 0.84 -0.07 -0.14 0.08 -1.57 0.00 0.00 175.55 174.69 2huq s VAL 30 N -0.22 1.58 0.35 0.71 1.01 -1.26 -1.48 120.40 121.08 2huq s VAL 30 Ca 0.03 -0.67 0.08 0.00 0.00 0.00 0.00 61.98 61.42 2huq s VAL 30 Cb -0.08 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.75 2huq s VAL 30 CO 0.00 0.43 0.14 -0.36 0.00 0.00 0.00 175.10 175.31 2huq s PHE 31 N 1.48 2.69 -0.04 5.22 0.08 0.70 -1.70 117.98 126.40 2huq s PHE 31 Ca 0.04 -0.40 -0.29 0.00 0.12 0.00 0.00 56.93 56.40 2huq s PHE 31 Cb -0.13 -1.66 0.11 0.00 -0.57 0.00 0.00 43.02 40.77 2huq s PHE 31 CO -0.11 0.33 0.91 0.00 -0.10 0.00 0.00 175.22 176.26 2huq s ALA 32 N -2.44 -1.85 0.03 5.36 0.00 -0.92 -0.13 121.76 121.81 2huq s ALA 32 Ca 0.38 1.16 0.03 0.00 0.00 0.00 0.00 51.96 53.53 2huq s ALA 32 Cb -0.02 0.17 -0.02 0.00 0.00 0.00 0.00 23.12 23.25 2huq s ALA 32 CO 0.23 -0.60 -0.10 -1.83 0.00 0.00 0.00 175.76 173.45 2huq s GLU 33 N -2.65 0.71 -0.20 0.00 4.04 -0.86 -0.23 118.70 119.51 2huq s GLU 33 Ca 0.03 -0.61 0.17 0.00 0.04 0.00 0.00 54.97 54.61 2huq s GLU 33 Cb -0.01 -0.65 0.46 0.00 0.02 0.00 0.00 34.13 33.95 2huq s GLU 33 CO -0.06 0.16 1.16 1.19 -1.84 0.00 0.00 175.26 175.87 2huq n PHE 34 N 2.07 1.15 0.30 4.83 3.72 -1.26 -4.25 117.46 124.02 2huq n PHE 34 Ca -0.18 -1.68 0.07 0.00 -0.05 0.00 0.00 57.45 55.61 2huq n PHE 34 Cb 0.56 -0.24 -0.09 0.00 -0.94 0.00 0.00 39.48 38.76 2huq n PHE 34 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 176.76 179.19 2huq n TYR 35 N -0.47 0.00 0.69 1.38 0.18 -1.26 -4.52 117.16 113.16 2huq n TYR 35 Ca 0.18 0.00 0.13 0.00 1.88 0.00 0.00 57.90 60.09 2huq n TYR 35 Cb 0.90 -0.17 0.38 0.00 -0.38 0.00 0.00 39.34 40.08 2huq n TYR 35 CO 0.00 0.00 0.00 0.25 -2.08 0.00 0.00 176.86 175.03 2huq n THR 36 N -1.67 0.42 -3.86 -3.48 -2.24 -1.26 -4.64 114.28 97.55 2huq n THR 36 Ca -0.00 -0.22 -0.03 0.00 -2.27 0.00 0.00 64.05 61.52 2huq n THR 36 Cb 0.29 -0.43 0.01 0.00 -2.10 0.00 0.00 70.33 68.10 2huq n THR 36 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2huq s SER 37 N -4.15 -0.02 -0.12 3.42 0.15 -1.26 -5.03 113.70 106.69 2huq s SER 37 Ca 0.10 -0.63 0.02 0.00 0.70 0.00 0.00 55.95 56.14 2huq s SER 37 Cb 0.14 0.49 0.01 0.00 -1.71 0.00 0.00 66.02 64.95 2huq s SER 37 CO 0.62 -0.97 -0.19 -0.22 1.20 0.00 0.00 173.24 173.68 2huq s LEU 38 N -3.34 1.93 -0.89 3.45 2.96 -1.26 -4.87 118.68 116.66 2huq s LEU 38 Ca 0.21 -0.52 -0.10 0.00 -0.22 0.00 0.00 54.13 53.49 2huq s LEU 38 Cb -0.02 -1.28 0.23 0.00 0.50 0.00 0.00 46.19 45.62 2huq s LEU 38 CO 0.05 0.06 0.82 -0.04 -1.32 0.00 0.00 176.35 175.92 2huq s MET 39 N 0.84 3.61 0.13 1.98 -1.94 -1.26 -4.60 119.30 118.06 2huq s MET 39 Ca -0.08 -2.75 0.12 0.00 -1.71 0.00 0.00 55.69 51.27 2huq s MET 39 Cb -0.15 -4.34 0.58 0.00 2.01 0.00 0.00 34.83 32.93 2huq s MET 39 CO -0.01 -1.26 1.37 0.00 -0.01 0.00 0.00 175.02 175.11 2huq n ALA 40 N 3.42 1.22 -0.43 3.03 0.00 -1.23 -3.15 120.51 123.37 2huq n ALA 40 Ca 0.16 0.06 0.08 0.00 0.00 0.00 0.00 53.44 53.74 2huq n ALA 40 Cb 0.43 -1.18 0.23 0.00 0.00 0.00 0.00 19.45 18.93 2huq n ALA 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2huq n GLY 41 N -0.98 2.95 2.38 0.00 0.00 -0.98 -5.03 105.19 103.53 2huq n GLY 41 Ca 0.00 -0.64 -0.12 0.00 0.00 0.00 0.00 46.02 45.27 2huq n GLY 41 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2huq n THR 42 N 0.61 0.00 -4.07 2.61 5.66 -1.19 -4.65 114.28 113.25 2huq n THR 42 Ca 0.18 -1.48 -0.09 0.00 -3.05 0.00 0.00 64.05 59.60 2huq n THR 42 Cb 0.62 0.83 -0.09 0.00 -1.55 0.00 0.00 70.33 70.14 2huq n THR 42 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2huq s THR 43 N -2.82 0.13 0.23 1.09 -4.23 -1.26 -4.99 115.64 103.78 2huq s THR 43 Ca 0.24 -1.70 -0.07 0.00 -1.18 0.00 0.00 61.69 58.98 2huq s THR 43 Cb 0.00 -1.81 0.19 0.00 1.34 0.00 0.00 72.50 72.22 2huq s THR 43 CO 0.17 -0.57 1.84 0.25 -0.54 0.00 0.00 174.62 175.77 2huq h LEU 44 N 2.85 0.76 -0.56 4.79 5.85 -1.99 -2.25 115.31 124.76 2huq h LEU 44 Ca -0.34 0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.48 2huq h LEU 44 Cb 1.19 -0.14 -0.07 0.00 0.37 0.00 0.00 40.66 42.01 2huq h LEU 44 CO 0.58 0.49 0.18 1.23 -0.34 0.00 0.00 178.44 180.58 2huq h GLY 45 N 0.90 0.75 1.25 3.75 0.00 -1.99 0.10 103.07 107.83 2huq h GLY 45 Ca 0.35 -0.09 -0.09 0.00 0.00 0.00 0.00 47.33 47.50 2huq h GLY 45 CO -0.17 -0.03 -0.04 3.21 0.00 0.00 0.00 176.54 179.51 2huq h ARG 46 N 0.34 0.89 0.04 4.80 3.08 -1.83 -0.90 114.38 120.81 2huq h ARG 46 Ca 0.28 -0.28 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 2huq h ARG 46 Cb 0.35 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.32 2huq h ARG 46 CO -0.31 0.92 -0.02 0.82 -1.07 0.00 0.00 179.97 180.31 2huq h ILE 47 N 0.82 1.10 -0.91 2.04 2.04 -0.80 -1.42 117.51 120.36 2huq h ILE 47 Ca 0.15 -0.46 0.07 0.00 1.00 0.00 0.00 64.86 65.62 2huq h ILE 47 Cb 0.55 1.41 -0.07 0.00 -0.74 0.00 0.00 36.82 37.97 2huq h ILE 47 CO 0.03 0.12 0.57 1.56 0.00 0.00 0.00 178.15 180.43 2huq h GLN 48 N -0.26 1.00 -0.70 2.37 4.20 -0.69 -0.84 115.11 120.20 2huq h GLN 48 Ca -0.01 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.60 2huq h GLN 48 Cb 0.23 -0.23 -0.03 0.00 0.30 0.00 0.00 27.48 27.76 2huq h GLN 48 CO 0.01 0.66 0.26 -0.22 -0.67 0.00 0.00 178.83 178.87 2huq h LYS 49 N 1.03 1.05 -0.52 1.46 3.64 -0.97 0.73 116.57 122.99 2huq h LYS 49 Ca 0.40 -0.20 -0.12 0.00 -1.27 0.00 0.00 60.65 59.46 2huq h LYS 49 Cb 0.20 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 2huq h LYS 49 CO -0.18 0.88 -0.14 1.25 -2.27 0.00 0.00 179.45 178.99 2huq h LEU 50 N 1.00 1.03 0.00 5.20 5.85 -0.48 -3.17 115.31 124.74 2huq h LEU 50 Ca 0.23 -0.35 -0.18 0.00 0.84 0.00 0.00 57.88 58.42 2huq h LEU 50 Cb 0.24 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.96 2huq h LEU 50 CO -0.02 1.15 -1.03 0.40 -0.34 0.00 0.00 178.44 178.60 2huq h ILE 51 N 0.90 1.04 -0.40 4.05 2.04 -0.99 -3.48 117.51 120.66 2huq h ILE 51 Ca 0.13 -2.60 -0.07 0.00 1.00 0.00 0.00 64.86 63.32 2huq h ILE 51 Cb 0.71 2.46 -0.01 0.00 -0.74 0.00 0.00 36.82 39.25 2huq h ILE 51 CO 0.05 0.59 -0.08 0.61 0.00 0.00 0.00 178.15 179.33 2huq n GLY 52 N 1.35 0.32 3.09 5.37 0.00 0.25 -4.42 105.19 111.15 2huq n GLY 52 Ca -0.04 -0.79 -0.10 0.00 0.00 0.00 0.00 46.02 45.10 2huq n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2huq s LYS 53 N -3.76 0.51 0.21 1.61 -0.14 -1.12 -5.05 119.74 111.99 2huq s LYS 53 Ca 0.00 -0.64 -0.25 0.00 -1.36 0.00 0.00 55.97 53.72 2huq s LYS 53 Cb 0.00 0.20 -0.08 0.00 -1.68 0.00 0.00 37.83 36.26 2huq s LYS 53 CO 0.00 -0.12 0.82 -1.21 -0.76 0.00 0.00 175.35 174.08 2huq s GLU 54 N -2.09 4.56 -0.18 1.68 2.02 -1.26 -4.55 118.70 118.87 2huq s GLU 54 Ca -0.09 1.18 -0.03 0.00 0.02 0.00 0.00 54.97 56.05 2huq s GLU 54 Cb -0.04 -3.12 -0.01 0.00 0.10 0.00 0.00 34.13 31.05 2huq s GLU 54 CO -0.02 0.49 -0.06 0.42 0.02 0.00 0.00 175.26 176.10 2huq s ILE 55 N -1.29 3.42 -0.41 -1.63 1.01 -1.26 -4.48 121.20 116.55 2huq s ILE 55 Ca 0.40 -0.50 -0.22 0.00 0.00 0.00 0.00 60.65 60.33 2huq s ILE 55 Cb -0.22 -2.52 0.02 0.00 0.01 0.00 0.00 42.46 39.76 2huq s ILE 55 CO 0.26 0.46 0.73 -0.60 0.00 0.00 0.00 174.94 175.79 2huq s ARG 56 N 0.94 3.51 -0.01 2.79 3.52 -0.69 -4.95 118.95 124.05 2huq s ARG 56 Ca -0.01 -0.04 -0.28 0.00 -0.13 0.00 0.00 55.73 55.27 2huq s ARG 56 Cb -0.15 -3.89 -0.03 0.00 -1.56 0.00 0.00 34.95 29.32 2huq s ARG 56 CO 0.01 -0.97 0.92 0.08 -0.81 0.00 0.00 175.30 174.52 2huq s VAL 57 N 3.05 4.90 0.09 7.11 1.01 -1.26 -2.16 120.40 133.14 2huq s VAL 57 Ca 0.28 1.92 0.04 0.00 0.00 0.00 0.00 61.98 64.22 2huq s VAL 57 Cb -0.13 -4.26 -0.04 0.00 0.00 0.00 0.00 36.38 31.95 2huq s VAL 57 CO 0.19 0.18 0.01 -0.76 0.00 0.00 0.00 175.10 174.73 2huq s LEU 58 N 0.94 3.53 0.73 3.92 1.43 0.68 -4.95 118.68 124.96 2huq s LEU 58 Ca 0.49 -0.14 -0.05 0.00 -1.03 0.00 0.00 54.13 53.40 2huq s LEU 58 Cb -0.20 -2.24 0.10 0.00 0.03 0.00 0.00 46.19 43.88 2huq s LEU 58 CO 0.26 0.18 1.02 -0.94 0.23 0.00 0.00 176.35 177.10 2huq s SER 59 N -2.30 4.44 0.24 2.29 1.04 -1.26 -4.48 113.70 113.67 2huq s SER 59 Ca 0.26 0.07 -0.05 0.00 0.48 0.00 0.00 55.95 56.71 2huq s SER 59 Cb -0.12 -0.56 0.26 0.00 0.10 0.00 0.00 66.02 65.70 2huq s SER 59 CO 0.19 -1.81 1.82 -0.09 0.98 0.00 0.00 173.24 174.32 2huq h ARG 60 N -0.65 1.10 -0.50 4.02 2.43 -2.00 -1.87 114.38 116.91 2huq h ARG 60 Ca -0.41 -0.19 -0.13 0.00 -0.81 0.00 0.00 59.98 58.45 2huq h ARG 60 Cb 1.28 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.63 2huq h ARG 60 CO 0.48 0.88 -0.18 1.49 -1.51 0.00 0.00 179.97 181.14 2huq h GLU 61 N 1.07 1.00 -0.43 0.20 4.81 -1.97 0.84 114.58 120.10 2huq h GLU 61 Ca 0.25 -0.41 0.04 0.00 -0.13 0.00 0.00 59.36 59.12 2huq h GLU 61 Cb 0.19 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.49 2huq h GLU 61 CO -0.02 1.09 0.19 -0.44 -0.73 0.00 0.00 179.01 179.09 2huq h ASP 62 N 0.87 0.25 0.29 1.04 3.32 -1.80 -0.24 116.42 120.16 2huq h ASP 62 Ca 0.12 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.19 2huq h ASP 62 Cb 0.75 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.30 2huq h ASP 62 CO 0.06 0.18 -0.14 0.58 -1.72 0.00 0.00 179.24 178.20 2huq h VAL 63 N 0.39 0.00 -0.21 -1.35 2.07 -1.19 0.98 116.25 116.93 2huq h VAL 63 Ca 0.19 -0.27 0.02 0.00 0.82 0.00 0.00 66.70 67.46 2huq h VAL 63 Cb 0.14 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.89 2huq h VAL 63 CO -0.16 0.00 0.14 -0.33 0.02 0.00 0.00 177.57 177.24 2huq h GLU 64 N -0.66 0.21 0.00 1.57 5.08 -0.87 -1.88 114.58 118.03 2huq h GLU 64 Ca -0.04 -0.01 -0.28 0.00 -1.00 0.00 0.00 59.36 58.02 2huq h GLU 64 Cb 0.30 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.45 2huq h GLU 64 CO 0.07 0.14 -2.06 1.28 -1.00 0.00 0.00 179.01 177.43 2huq n LEU 65 N -4.50 0.13 -0.28 1.33 4.77 -0.11 -4.77 117.00 113.58 2huq n LEU 65 Ca 0.01 -0.00 0.07 0.00 -0.03 0.00 0.00 56.01 56.05 2huq n LEU 65 Cb 0.13 0.33 0.11 0.00 -2.33 0.00 0.00 43.42 41.67 2huq n LEU 65 CO 0.35 0.40 0.46 0.59 -1.33 0.00 0.00 177.39 177.86 2huq n ASN 66 N -2.60 1.72 -0.10 -1.43 5.03 0.25 -4.81 115.26 113.32 2huq n ASN 66 Ca -0.26 -2.91 -0.05 0.00 0.87 0.00 0.00 54.58 52.23 2huq n ASN 66 Cb 1.00 -0.39 0.01 0.00 -1.02 0.00 0.00 39.78 39.38 2huq n ASN 66 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.26 175.58 2huq h PHE 67 N 0.15 -0.12 0.00 3.10 3.57 -0.44 0.10 116.94 123.31 2huq h PHE 67 Ca -0.01 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.52 2huq h PHE 67 Cb 1.12 0.11 0.00 0.00 2.79 0.00 0.00 35.95 39.97 2huq h PHE 67 CO 0.12 -0.12 0.00 -0.85 -2.23 0.00 0.00 178.31 175.23 2huq n GLU 68 N -5.24 0.25 -0.03 1.11 0.00 -1.26 -0.95 120.64 114.52 2huq n GLU 68 Ca 0.01 0.12 0.02 0.00 0.00 0.00 0.00 57.16 57.32 2huq n GLU 68 Cb 0.19 -1.50 -0.12 0.00 0.00 0.00 0.00 31.44 30.01 2huq n GLU 68 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2huq n ASN 69 N -1.27 1.24 -0.10 -1.84 5.03 0.15 -4.22 115.26 114.25 2huq n ASN 69 Ca 0.08 0.00 -0.20 0.00 0.87 0.00 0.00 54.58 55.33 2huq n ASN 69 Cb 0.13 1.41 -0.08 0.00 -1.02 0.00 0.00 39.78 40.22 2huq n ASN 69 CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05 2huq n ILE 70 N -2.26 1.12 -0.07 2.41 5.41 0.01 -4.76 119.36 121.22 2huq n ILE 70 Ca -0.12 -0.32 -0.06 0.00 1.00 0.00 0.00 62.75 63.26 2huq n ILE 70 Cb 0.65 -1.63 -0.02 0.00 -0.71 0.00 0.00 39.64 37.93 2huq n ILE 70 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 2huq h VAL 71 N -0.56 0.08 -1.01 1.39 2.07 -1.25 -3.42 116.25 113.56 2huq h VAL 71 Ca -0.50 -1.10 0.25 0.00 0.82 0.00 0.00 66.70 66.17 2huq h VAL 71 Cb 1.51 0.18 -0.12 0.00 -1.52 0.00 0.00 31.29 31.34 2huq h VAL 71 CO -0.26 0.03 0.60 -0.07 0.02 0.00 0.00 177.57 177.89 2huq h LEU 72 N -1.00 0.65 -0.43 2.57 3.38 -1.73 -2.37 115.31 116.38 2huq h LEU 72 Ca -0.03 0.13 0.04 0.00 0.09 0.00 0.00 57.88 58.12 2huq h LEU 72 Cb 0.56 0.04 -0.04 0.00 0.09 0.00 0.00 40.66 41.31 2huq h LEU 72 CO -0.02 0.09 0.19 -0.65 0.09 0.00 0.00 178.44 178.14 2huq h PRO 73 N 0.55 0.37 0.00 1.13 0.11 -1.80 -2.09 132.00 130.27 2huq h PRO 73 Ca 0.65 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.72 2huq h PRO 73 Cb 1.28 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 2huq h PRO 73 CO -0.47 0.24 -0.08 -0.07 -0.21 0.00 0.00 178.00 177.41 2huq h LEU 74 N 0.38 0.00 -1.16 2.35 3.38 -1.66 -2.45 115.31 116.15 2huq h LEU 74 Ca 0.19 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.11 2huq h LEU 74 Cb 0.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2huq h LEU 74 CO -0.16 0.08 -0.25 0.00 0.09 0.00 0.00 178.44 178.20 2huq h ALA 75 N 1.92 1.05 0.00 1.53 0.00 -1.33 0.18 119.26 122.61 2huq h ALA 75 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2huq h ALA 75 Cb 0.25 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2huq h ALA 75 CO 0.01 0.32 0.00 -0.22 0.00 0.00 0.00 179.25 179.36 2huq h LYS 76 N 0.00 0.00 0.00 0.00 1.63 -1.40 -2.62 116.57 114.18 2huq h LYS 76 Ca -0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 2huq h LYS 76 Cb 0.74 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.37 2huq h LYS 76 CO 0.03 0.00 -0.53 0.39 -3.45 0.00 0.00 179.45 175.89 2huq n GLU 77 N -2.71 2.70 -4.33 1.90 -0.58 -1.08 -4.62 120.64 111.93 2huq n GLU 77 Ca 0.02 0.00 -0.19 0.00 -0.42 0.00 0.00 57.16 56.57 2huq n GLU 77 Cb 0.29 -0.73 -0.09 0.00 -0.57 0.00 0.00 31.44 30.34 2huq n GLU 77 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 2huq s ASN 78 N -1.34 1.57 -0.27 1.62 0.01 0.60 -4.26 114.94 112.87 2huq s ASN 78 Ca 0.00 -1.60 -0.13 0.00 -0.71 0.00 0.00 52.86 50.41 2huq s ASN 78 Cb 0.00 0.44 -0.04 0.00 0.41 0.00 0.00 41.25 42.06 2huq s ASN 78 CO 0.00 -0.93 0.29 -1.81 -1.51 0.00 0.00 177.10 173.14 2huq s ASP 79 N -3.38 6.17 0.00 -1.22 1.11 -1.26 0.25 116.67 118.34 2huq s ASP 79 Ca 0.36 0.18 0.08 0.00 0.18 0.00 0.00 52.55 53.35 2huq s ASP 79 Cb 0.04 -2.17 -0.02 0.00 1.07 0.00 0.00 42.92 41.84 2huq s ASP 79 CO 0.19 -0.11 -0.26 -0.69 1.18 0.00 0.00 175.17 175.49 2huq s VAL 80 N 1.82 2.05 0.06 -1.27 1.01 0.78 -0.55 120.40 124.30 2huq s VAL 80 Ca 0.12 -1.20 0.08 0.00 0.00 0.00 0.00 61.98 60.98 2huq s VAL 80 Cb -0.16 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.47 2huq s VAL 80 CO 0.10 0.49 -0.21 0.00 0.00 0.00 0.00 175.10 175.48 2huq s ALA 81 N -0.67 2.51 -0.26 5.51 0.00 -0.55 0.12 121.76 128.42 2huq s ALA 81 Ca 0.10 -1.26 -0.01 0.00 0.00 0.00 0.00 51.96 50.80 2huq s ALA 81 Cb -0.10 -0.64 0.08 0.00 0.00 0.00 0.00 23.12 22.46 2huq s ALA 81 CO 0.00 0.56 0.04 0.12 0.00 0.00 0.00 175.76 176.49 2huq s PHE 82 N -0.94 1.80 0.23 0.00 5.36 0.76 -0.21 117.98 124.98 2huq s PHE 82 Ca 0.14 -1.56 -0.10 0.00 -0.96 0.00 0.00 56.93 54.45 2huq s PHE 82 Cb -0.10 -1.56 -0.07 0.00 -0.34 0.00 0.00 43.02 40.95 2huq s PHE 82 CO 0.05 -0.78 0.56 -0.51 -1.46 0.00 0.00 175.22 173.08 2huq s LEU 83 N 1.59 4.17 0.06 6.12 1.43 0.82 -1.61 118.68 131.27 2huq s LEU 83 Ca 0.03 0.96 -0.09 0.00 -1.03 0.00 0.00 54.13 54.00 2huq s LEU 83 Cb -0.18 -3.68 0.00 0.00 0.03 0.00 0.00 46.19 42.36 2huq s LEU 83 CO -0.15 -0.07 0.19 0.42 0.23 0.00 0.00 176.35 176.97 2huq s THR 84 N -1.80 0.13 0.79 5.49 -4.23 -0.97 -2.04 115.64 113.01 2huq s THR 84 Ca 0.47 -1.04 -0.11 0.00 -1.18 0.00 0.00 61.69 59.83 2huq s THR 84 Cb -0.11 -1.13 0.07 0.00 1.34 0.00 0.00 72.50 72.67 2huq s THR 84 CO 0.21 -0.57 1.11 -2.84 -0.54 0.00 0.00 174.62 171.98 2huq s PRO 85 N -3.22 2.05 3.40 3.99 0.02 -1.26 -0.33 135.00 139.65 2huq s PRO 85 Ca -0.00 1.29 0.00 0.00 0.02 0.00 0.00 61.00 62.31 2huq s PRO 85 Cb 0.02 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 32.68 2huq s PRO 85 CO -0.07 -1.82 0.00 0.41 -0.33 0.00 0.00 177.00 175.19 2huq n GLY 86 N -0.78 2.29 3.70 0.52 0.00 0.92 -4.27 105.19 107.57 2huq n GLY 86 Ca 0.10 -0.30 -0.36 0.00 0.00 0.00 0.00 46.02 45.46 2huq n GLY 86 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2huq s ASP 87 N -4.00 6.26 0.54 1.61 -1.08 -1.25 -2.49 116.67 116.27 2huq s ASP 87 Ca 0.00 0.29 0.32 0.00 -0.52 0.00 0.00 52.55 52.65 2huq s ASP 87 Cb 0.00 -2.13 1.49 0.00 -1.46 0.00 0.00 42.92 40.82 2huq s ASP 87 CO 0.00 0.09 1.86 1.55 0.52 0.00 0.00 175.17 179.20 2huq h PRO 88 N 7.03 0.00 -0.07 4.34 0.14 -1.86 -2.55 132.00 139.04 2huq h PRO 88 Ca -0.39 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.75 2huq h PRO 88 Cb 1.16 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.30 2huq h PRO 88 CO 0.72 0.00 0.00 1.28 0.14 0.00 0.00 178.00 180.14 2huq n LEU 89 N -4.19 2.56 -4.63 1.56 4.77 -1.26 -4.44 117.00 111.37 2huq n LEU 89 Ca 0.19 -1.09 -0.39 0.00 -0.03 0.00 0.00 56.01 54.70 2huq n LEU 89 Cb 1.01 -0.03 -0.09 0.00 -2.33 0.00 0.00 43.42 41.98 2huq n LEU 89 CO 0.38 0.47 0.05 -0.69 -1.33 0.00 0.00 177.39 176.27 2huq s VAL 90 N -1.43 5.20 -1.59 4.08 1.01 -0.96 -4.14 120.40 122.57 2huq s VAL 90 Ca 0.22 0.57 0.00 0.00 0.00 0.00 0.00 61.98 62.77 2huq s VAL 90 Cb 0.15 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.85 2huq s VAL 90 CO 0.22 0.20 0.00 0.00 0.00 0.00 0.00 175.10 175.53 2huq n ALA 91 N 4.98 -0.23 -2.52 5.51 0.00 -1.26 -4.87 120.51 122.12 2huq n ALA 91 Ca -0.09 0.24 -0.25 0.00 0.00 0.00 0.00 53.44 53.33 2huq n ALA 91 Cb 0.51 -1.63 -0.08 0.00 0.00 0.00 0.00 19.45 18.25 2huq n ALA 91 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2huq s THR 92 N -2.56 0.66 -0.24 0.00 -4.23 -1.26 -5.04 115.64 102.96 2huq s THR 92 Ca 0.00 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 58.64 2huq s THR 92 Cb 0.00 -2.38 0.66 0.00 1.34 0.00 0.00 72.50 72.12 2huq s THR 92 CO 0.00 0.00 1.61 0.35 -0.54 0.00 0.00 174.62 176.04 2huq n THR 93 N -0.90 2.62 0.22 3.99 -2.24 -1.26 -4.60 114.28 112.10 2huq n THR 93 Ca -0.06 -1.79 0.10 0.00 -2.27 0.00 0.00 64.05 60.03 2huq n THR 93 Cb 0.65 -0.30 0.43 0.00 -2.10 0.00 0.00 70.33 69.01 2huq n THR 93 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 2huq h HIS 94 N 2.49 0.00 -1.00 4.78 -0.00 -1.90 -3.06 115.15 116.47 2huq h HIS 94 Ca 0.10 0.00 0.17 0.00 -0.00 0.00 0.00 60.37 60.63 2huq h HIS 94 Cb 1.85 0.00 -0.10 0.00 -0.00 0.00 0.00 27.41 29.16 2huq h HIS 94 CO 0.91 0.22 0.61 0.00 -0.00 0.00 0.00 177.93 179.68 2huq h ALA 95 N 1.78 1.61 0.00 2.45 0.00 -1.83 0.87 119.26 124.14 2huq h ALA 95 Ca -0.00 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2huq h ALA 95 Cb 0.79 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 2huq h ALA 95 CO 0.03 0.04 -0.07 1.49 0.00 0.00 0.00 179.25 180.74 2huq h GLU 96 N 0.83 0.00 0.00 0.00 4.22 -1.91 -1.57 114.58 116.15 2huq h GLU 96 Ca 0.55 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.97 2huq h GLU 96 Cb 0.76 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.01 2huq h GLU 96 CO -0.35 0.07 -0.11 -0.07 -2.18 0.00 0.00 179.01 176.37 2huq h LEU 97 N 0.00 0.00 -0.67 1.64 3.38 -0.98 -1.57 115.31 117.11 2huq h LEU 97 Ca -0.00 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 2huq h LEU 97 Cb 0.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 2huq h LEU 97 CO 0.01 0.11 -0.58 0.03 0.09 0.00 0.00 178.44 178.10 2huq h ARG 98 N 0.00 0.26 -0.55 1.13 3.08 -1.34 -1.35 114.38 115.60 2huq h ARG 98 Ca -0.00 -0.17 -0.09 0.00 0.07 0.00 0.00 59.98 59.79 2huq h ARG 98 Cb 0.39 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.44 2huq h ARG 98 CO 0.01 0.77 -0.01 0.82 -1.07 0.00 0.00 179.97 180.49 2huq h ILE 99 N 0.20 1.26 -0.52 2.04 2.04 -1.39 -1.23 117.51 119.90 2huq h ILE 99 Ca -0.00 -1.10 -0.08 0.00 1.00 0.00 0.00 64.86 64.67 2huq h ILE 99 Cb 1.08 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 37.98 2huq h ILE 99 CO 0.09 0.40 -0.00 0.03 0.00 0.00 0.00 178.15 178.66 2huq h ARG 100 N 0.87 0.92 -0.43 2.37 3.08 -1.21 -1.45 114.38 118.53 2huq h ARG 100 Ca 0.16 -0.29 -0.00 0.00 0.07 0.00 0.00 59.98 59.91 2huq h ARG 100 Cb 0.52 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.47 2huq h ARG 100 CO 0.03 0.94 0.26 0.00 -1.07 0.00 0.00 179.97 180.13 2huq h ALA 101 N 0.94 0.55 0.33 0.04 0.00 -0.94 -2.38 119.26 117.80 2huq h ALA 101 Ca 0.15 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2huq h ALA 101 Cb 0.53 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2huq h ALA 101 CO 0.03 0.04 -0.16 -0.22 0.00 0.00 0.00 179.25 178.94 2huq h LYS 102 N 0.57 -0.42 0.00 0.00 3.64 -1.07 0.14 116.57 119.43 2huq h LYS 102 Ca 0.16 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 2huq h LYS 102 Cb -0.01 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 2huq h LYS 102 CO -0.03 -0.23 0.06 0.54 -2.27 0.00 0.00 179.45 177.52 2huq n ARG 103 N -5.24 0.01 -0.32 1.90 1.74 -0.56 0.16 116.66 114.34 2huq n ARG 103 Ca -0.10 0.46 0.07 0.00 -0.77 0.00 0.00 57.85 57.51 2huq n ARG 103 Cb 0.22 -1.59 0.21 0.00 -1.02 0.00 0.00 32.46 30.27 2huq n ARG 103 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2huq n ALA 104 N -1.47 2.59 -1.69 7.54 0.00 -0.80 -4.96 120.51 121.72 2huq n ALA 104 Ca -0.00 -1.67 -0.12 0.00 0.00 0.00 0.00 53.44 51.65 2huq n ALA 104 Cb 0.06 -0.60 -0.03 0.00 0.00 0.00 0.00 19.45 18.88 2huq n ALA 104 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2huq n GLY 105 N 0.13 0.74 3.41 0.00 0.00 0.12 -5.01 105.19 104.60 2huq n GLY 105 Ca 0.17 -0.44 -0.34 0.00 0.00 0.00 0.00 46.02 45.40 2huq n GLY 105 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2huq s VAL 106 N -2.50 3.60 0.16 1.61 1.01 0.41 -5.01 120.40 119.68 2huq s VAL 106 Ca 0.00 -0.44 -0.28 0.00 0.00 0.00 0.00 61.98 61.25 2huq s VAL 106 Cb 0.00 -2.59 -0.07 0.00 0.00 0.00 0.00 36.38 33.71 2huq s VAL 106 CO 0.00 0.47 0.89 -1.61 0.00 0.00 0.00 175.10 174.85 2huq s GLU 107 N 0.79 4.71 0.14 2.72 0.41 -1.26 -3.45 118.70 122.77 2huq s GLU 107 Ca -0.02 1.36 0.10 0.00 -0.41 0.00 0.00 54.97 56.00 2huq s GLU 107 Cb -0.15 -3.32 -0.04 0.00 -1.78 0.00 0.00 34.13 28.85 2huq s GLU 107 CO 0.02 0.40 -0.22 -1.54 -0.49 0.00 0.00 175.26 173.43 2huq s SER 108 N -0.65 2.92 0.04 -0.19 1.04 -1.26 -1.46 113.70 114.15 2huq s SER 108 Ca 0.42 -0.78 0.04 0.00 0.48 0.00 0.00 55.95 56.10 2huq s SER 108 Cb -0.24 -0.18 -0.02 0.00 0.10 0.00 0.00 66.02 65.67 2huq s SER 108 CO 0.29 0.07 -0.12 -0.31 0.98 0.00 0.00 173.24 174.16 2huq s TYR 109 N -1.48 1.01 -0.18 5.02 1.51 -0.47 -4.97 117.35 117.79 2huq s TYR 109 Ca 0.13 -0.39 0.00 0.00 -1.01 0.00 0.00 57.07 55.81 2huq s TYR 109 Cb -0.08 -0.59 0.01 0.00 -0.11 0.00 0.00 41.96 41.18 2huq s TYR 109 CO 0.06 0.01 -0.17 0.08 -1.11 0.00 0.00 175.55 174.42 2huq s VAL 110 N -1.02 2.37 -0.32 0.71 1.01 -1.26 -0.11 120.40 121.78 2huq s VAL 110 Ca -0.02 -0.84 -0.07 0.00 0.00 0.00 0.00 61.98 61.05 2huq s VAL 110 Cb -0.08 -2.01 0.03 0.00 0.00 0.00 0.00 36.38 34.31 2huq s VAL 110 CO 0.01 0.52 0.10 -0.63 0.00 0.00 0.00 175.10 175.10 2huq s ILE 111 N 1.22 3.92 0.94 2.22 -1.09 0.90 -4.98 121.20 124.33 2huq s ILE 111 Ca 0.03 -0.92 -0.12 0.00 -2.23 0.00 0.00 60.65 57.41 2huq s ILE 111 Cb -0.14 -3.13 0.16 0.00 -1.58 0.00 0.00 42.46 37.77 2huq s ILE 111 CO -0.09 -0.07 1.10 -1.00 -1.23 0.00 0.00 174.94 173.66 2huq s HIS 112 N 1.46 2.28 0.21 3.97 3.76 -1.26 -1.09 115.29 124.62 2huq s HIS 112 Ca 0.00 1.04 -0.17 0.00 -0.15 0.00 0.00 55.06 55.79 2huq s HIS 112 Cb -0.18 -3.25 0.02 0.00 1.11 0.00 0.00 32.58 30.28 2huq s HIS 112 CO 0.03 -2.60 0.53 0.00 -0.85 0.00 0.00 174.74 171.84 2huq s ALA 113 N -3.02 -0.81 0.21 -1.40 0.00 -1.26 -4.55 121.76 110.92 2huq s ALA 113 Ca 0.64 -0.38 -0.32 0.00 0.00 0.00 0.00 51.96 51.90 2huq s ALA 113 Cb -0.17 0.89 -0.14 0.00 0.00 0.00 0.00 23.12 23.70 2huq s ALA 113 CO 0.56 -0.84 1.39 -2.30 0.00 0.00 0.00 175.76 174.58 2huq n PRO 114 N -0.36 1.85 -4.35 0.00 -0.02 -1.26 -4.20 135.00 126.66 2huq n PRO 114 Ca -0.08 0.66 -0.29 0.00 -2.02 0.00 0.00 63.50 61.78 2huq n PRO 114 Cb 0.62 -2.31 -0.12 0.00 -0.02 0.00 0.00 33.50 31.67 2huq n PRO 114 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2huq s SER 115 N 0.35 3.62 0.49 2.55 0.15 -1.26 -3.82 113.70 115.78 2huq s SER 115 Ca 0.72 -0.67 0.19 0.00 0.70 0.00 0.00 55.95 56.88 2huq s SER 115 Cb -0.71 -0.39 1.23 0.00 -1.71 0.00 0.00 66.02 64.45 2huq s SER 115 CO 0.48 0.17 2.07 -0.29 1.20 0.00 0.00 173.24 176.87 2huq h ILE 116 N 3.61 0.94 -0.60 6.45 6.09 -1.94 -1.14 117.51 130.92 2huq h ILE 116 Ca -0.50 -0.42 0.05 0.00 -1.37 0.00 0.00 64.86 62.63 2huq h ILE 116 Cb 1.17 1.23 -0.04 0.00 0.47 0.00 0.00 36.82 39.66 2huq h ILE 116 CO 0.44 0.11 0.40 0.22 -3.07 0.00 0.00 178.15 176.25 2huq h TYR 117 N 0.00 0.61 0.00 2.19 3.20 -1.98 -2.78 116.97 118.21 2huq h TYR 117 Ca -0.00 0.02 -0.29 0.00 3.14 0.00 0.00 58.73 61.59 2huq h TYR 117 Cb 0.23 -0.20 -0.06 0.00 1.54 0.00 0.00 36.73 38.24 2huq h TYR 117 CO 0.00 0.33 -2.27 -1.13 -1.64 0.00 0.00 178.16 173.46 2huq n SER 118 N -4.47 0.21 0.18 -2.11 3.41 -0.98 -4.24 113.62 105.61 2huq n SER 118 Ca 0.08 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.80 2huq n SER 118 Cb 0.21 1.15 0.59 0.00 -0.26 0.00 0.00 64.21 65.90 2huq n SER 118 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2huq h ALA 119 N 1.12 1.05 0.00 7.33 0.00 -0.98 -0.47 119.26 127.31 2huq h ALA 119 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2huq h ALA 119 Cb 1.99 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.78 2huq h ALA 119 CO 0.02 -0.05 0.00 -0.39 0.00 0.00 0.00 179.25 178.83 2huq h VAL 120 N 0.00 0.00 -0.08 0.00 -1.51 -1.67 -1.72 116.25 111.26 2huq h VAL 120 Ca 0.00 -0.04 0.02 0.00 -1.23 0.00 0.00 66.70 65.45 2huq h VAL 120 Cb 0.14 0.65 -0.00 0.00 -2.13 0.00 0.00 31.29 29.95 2huq h VAL 120 CO 0.00 0.00 0.07 1.23 -1.23 0.00 0.00 177.57 177.64 2huq h GLY 121 N 0.30 0.00 2.00 5.19 0.00 -1.34 -0.60 103.07 108.62 2huq h GLY 121 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2huq h GLY 121 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 176.54 181.05 2huq n ILE 122 N -4.14 1.21 0.90 2.60 3.06 -0.65 -1.59 119.36 120.74 2huq n ILE 122 Ca -0.01 0.31 0.13 0.00 -2.50 0.00 0.00 62.75 60.68 2huq n ILE 122 Cb 0.18 -1.12 0.48 0.00 0.54 0.00 0.00 39.64 39.72 2huq n ILE 122 CO 0.00 0.00 0.00 0.35 -2.50 0.00 0.00 176.55 174.40 2huq n THR 123 N -1.53 0.14 -0.17 9.51 -2.24 -0.23 -4.91 114.28 114.84 2huq n THR 123 Ca 0.03 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 2huq n THR 123 Cb 0.13 -0.36 0.00 0.00 -2.10 0.00 0.00 70.33 68.01 2huq n THR 123 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2huq n GLY 124 N 1.45 1.14 3.69 3.38 0.00 -0.62 -4.59 105.19 109.64 2huq n GLY 124 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 2huq n GLY 124 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2huq s MET 125 N -0.54 4.42 -0.02 1.61 -1.94 -1.26 -4.56 119.30 117.01 2huq s MET 125 Ca 0.00 1.30 -0.33 0.00 -1.71 0.00 0.00 55.69 54.96 2huq s MET 125 Cb 0.00 -3.53 -0.11 0.00 2.01 0.00 0.00 34.83 33.20 2huq s MET 125 CO 0.00 -0.26 1.90 0.72 -0.01 0.00 0.00 175.02 177.37 2huq n HIS 126 N 4.85 2.41 0.25 -0.03 -0.00 -1.26 -4.66 115.22 116.79 2huq n HIS 126 Ca 0.07 -0.14 0.10 0.00 -0.00 0.00 0.00 57.72 57.75 2huq n HIS 126 Cb 0.49 -2.71 0.66 0.00 -0.00 0.00 0.00 29.99 28.43 2huq n HIS 126 CO 0.00 0.00 0.00 0.97 -0.00 0.00 0.00 176.34 177.31 2huq h ILE 127 N 5.39 0.81 0.00 1.59 2.10 -1.94 -1.25 117.51 124.21 2huq h ILE 127 Ca -0.49 -0.48 0.00 0.00 1.08 0.00 0.00 64.86 64.97 2huq h ILE 127 Cb 1.26 1.28 0.00 0.00 -1.09 0.00 0.00 36.82 38.27 2huq h ILE 127 CO 0.94 0.12 0.00 0.10 -1.08 0.00 0.00 178.15 178.24 2huq h TYR 128 N 0.00 0.00 -0.04 2.19 -0.00 -2.02 -2.92 116.97 114.18 2huq h TYR 128 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 2huq h TYR 128 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.00 2huq h TYR 128 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 178.16 179.79 2huq n LYS 129 N -2.30 1.67 -2.63 0.10 5.02 -0.47 -4.88 118.16 114.67 2huq n LYS 129 Ca 0.03 -0.98 -0.41 0.00 -2.02 0.00 0.00 58.31 54.93 2huq n LYS 129 Cb 0.29 -1.47 -0.05 0.00 -0.02 0.00 0.00 35.03 33.79 2huq n LYS 129 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2huq s PHE 130 N -1.97 3.76 0.00 2.13 0.40 -1.10 -1.21 117.98 119.98 2huq s PHE 130 Ca 0.37 1.75 0.00 0.00 -0.60 0.00 0.00 56.93 58.45 2huq s PHE 130 Cb 0.20 -3.14 0.00 0.00 0.51 0.00 0.00 43.02 40.60 2huq s PHE 130 CO 0.32 -0.09 0.00 0.41 0.70 0.00 0.00 175.22 176.57 2huq n GLY 131 N 1.89 1.84 3.76 4.36 0.00 0.02 -4.84 105.19 112.22 2huq n GLY 131 Ca 0.01 -1.79 -0.40 0.00 0.00 0.00 0.00 46.02 43.84 2huq n GLY 131 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2huq n LYS 132 N 0.00 2.27 -3.81 1.61 4.81 -1.26 -4.81 118.16 116.97 2huq n LYS 132 Ca 0.00 0.81 -0.21 0.00 -0.87 0.00 0.00 58.31 58.04 2huq n LYS 132 Cb 0.00 -2.62 -0.03 0.00 0.02 0.00 0.00 35.03 32.41 2huq n LYS 132 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 2huq s SER 133 N -0.45 5.73 0.26 3.14 0.01 -1.26 -4.38 113.70 116.75 2huq s SER 133 Ca 0.61 -0.25 -0.10 0.00 1.31 0.00 0.00 55.95 57.52 2huq s SER 133 Cb -0.46 -1.31 -0.01 0.00 0.21 0.00 0.00 66.02 64.46 2huq s SER 133 CO 0.58 -0.26 0.45 0.00 0.41 0.00 0.00 173.24 174.43 2huq s ALA 134 N -2.17 0.04 -0.10 1.44 0.00 -0.77 -5.01 121.76 115.19 2huq s ALA 134 Ca 0.39 -1.05 0.02 0.00 0.00 0.00 0.00 51.96 51.32 2huq s ALA 134 Cb -0.08 1.10 0.01 0.00 0.00 0.00 0.00 23.12 24.16 2huq s ALA 134 CO 0.28 -0.82 -0.17 0.99 0.00 0.00 0.00 175.76 176.04 2huq s THR 135 N -3.84 1.61 -0.65 0.00 2.01 -1.26 -0.69 115.64 112.83 2huq s THR 135 Ca 0.25 -0.73 -0.24 0.00 0.31 0.00 0.00 61.69 61.28 2huq s THR 135 Cb 0.00 -1.45 0.05 0.00 0.01 0.00 0.00 72.50 71.11 2huq s THR 135 CO 0.11 0.46 1.05 -0.69 -0.69 0.00 0.00 174.62 174.87 2huq s VAL 136 N 0.81 4.17 0.10 3.82 1.01 -0.74 -4.64 120.40 124.93 2huq s VAL 136 Ca -0.10 0.07 -0.09 0.00 0.00 0.00 0.00 61.98 61.85 2huq s VAL 136 Cb -0.16 -4.71 -0.06 0.00 0.00 0.00 0.00 36.38 31.45 2huq s VAL 136 CO 0.01 -1.47 0.42 0.00 0.00 0.00 0.00 175.10 174.06 2huq s ALA 137 N 4.52 3.71 0.38 5.51 0.00 -1.26 -2.39 121.76 132.23 2huq s ALA 137 Ca 0.29 -0.37 -0.27 0.00 0.00 0.00 0.00 51.96 51.60 2huq s ALA 137 Cb -0.13 -2.28 -0.09 0.00 0.00 0.00 0.00 23.12 20.61 2huq s ALA 137 CO 0.14 0.57 1.29 0.71 0.00 0.00 0.00 175.76 178.47 2huq s TYR 138 N -1.47 2.91 0.58 0.00 2.02 -1.26 -4.69 117.35 115.43 2huq s TYR 138 Ca 0.36 1.43 -0.16 0.00 -0.37 0.00 0.00 57.07 58.32 2huq s TYR 138 Cb -0.14 -3.64 -0.04 0.00 -0.40 0.00 0.00 41.96 37.74 2huq s TYR 138 CO 0.19 -1.95 1.06 -2.14 -1.57 0.00 0.00 175.55 171.14 2huq s PRO 139 N -2.12 3.38 -0.08 -1.71 0.02 -1.26 -4.75 135.00 128.47 2huq s PRO 139 Ca 0.55 1.23 -0.03 0.00 0.02 0.00 0.00 61.00 62.76 2huq s PRO 139 Cb -0.38 -2.04 0.04 0.00 0.02 0.00 0.00 34.50 32.14 2huq s PRO 139 CO 0.49 -0.76 0.07 -2.00 -0.33 0.00 0.00 177.00 174.46 2huq s GLU 140 N -3.97 -0.04 7.00 5.54 2.56 -0.32 -5.02 118.70 124.46 2huq s GLU 140 Ca 0.64 0.25 0.00 0.00 0.00 0.00 0.00 54.97 55.86 2huq s GLU 140 Cb -0.16 -0.88 0.00 0.00 2.00 0.00 0.00 34.13 35.09 2huq s GLU 140 CO 0.35 -0.43 0.00 0.41 -0.56 0.00 0.00 175.26 175.03 2huq n GLY 141 N 5.29 2.54 0.01 -1.50 0.00 -1.26 -1.90 105.19 108.37 2huq n GLY 141 Ca -0.04 -0.33 0.13 0.00 0.00 0.00 0.00 46.02 45.77 2huq n GLY 141 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2huq n ASN 142 N 4.87 0.38 -4.64 1.61 5.03 -1.26 -4.83 115.26 116.42 2huq n ASN 142 Ca 0.00 -0.08 -0.43 0.00 0.87 0.00 0.00 54.58 54.94 2huq n ASN 142 Cb 0.00 0.05 -0.02 0.00 -1.02 0.00 0.00 39.78 38.79 2huq n ASN 142 CO 0.00 0.00 0.00 0.86 -1.83 0.00 0.00 177.26 176.29 2huq s TRP 143 N -2.98 3.14 -0.40 3.10 -0.11 -0.80 -5.00 118.94 115.89 2huq s TRP 143 Ca 0.12 1.19 0.04 0.00 1.22 0.00 0.00 56.10 58.67 2huq s TRP 143 Cb 0.18 -3.70 0.11 0.00 -1.50 0.00 0.00 33.47 28.56 2huq s TRP 143 CO 0.65 -0.78 0.12 0.12 -4.62 0.00 0.00 176.95 172.44 2huq s PHE 144 N 3.67 3.46 0.36 5.86 2.19 -1.26 -1.17 117.98 131.08 2huq s PHE 144 Ca 0.46 -3.00 -0.28 0.00 0.33 0.00 0.00 56.93 54.43 2huq s PHE 144 Cb -0.12 -2.82 -0.11 0.00 -1.31 0.00 0.00 43.02 38.65 2huq s PHE 144 CO 0.15 -0.88 1.46 -2.30 1.83 0.00 0.00 175.22 175.49 2huq n PRO 145 N 3.89 2.58 0.00 10.12 -0.02 -1.26 -4.92 135.00 145.38 2huq n PRO 145 Ca 0.04 0.90 0.00 0.00 -2.02 0.00 0.00 63.50 62.43 2huq n PRO 145 Cb 0.39 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.25 2huq n PRO 145 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2huq n THR 146 N 0.61 0.00 -0.20 3.45 -2.24 -1.26 -4.90 114.28 109.74 2huq n THR 146 Ca 0.03 0.00 0.22 0.00 -2.27 0.00 0.00 64.05 62.03 2huq n THR 146 Cb 0.38 1.47 0.60 0.00 -2.10 0.00 0.00 70.33 70.67 2huq n THR 146 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2huq h SER 147 N 0.00 0.24 0.17 3.42 4.64 -1.94 -0.22 113.55 119.86 2huq h SER 147 Ca 0.00 0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 61.34 2huq h SER 147 Cb 0.25 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.32 2huq h SER 147 CO 0.00 0.09 -0.04 0.10 -0.87 0.00 0.00 176.83 176.11 2huq h TYR 148 N 0.24 0.00 -0.38 4.77 -0.00 -1.91 -1.92 116.97 117.77 2huq h TYR 148 Ca 0.43 0.00 -0.15 0.00 0.00 0.00 0.00 58.73 59.02 2huq h TYR 148 Cb 1.32 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 38.05 2huq h TYR 148 CO -0.00 0.04 -0.34 -0.92 -0.00 0.00 0.00 178.16 176.94 2huq h TYR 149 N 0.00 1.08 -0.02 0.10 5.03 -1.42 -2.76 116.97 118.98 2huq h TYR 149 Ca -0.00 -0.31 -0.09 0.00 2.58 0.00 0.00 58.73 60.90 2huq h TYR 149 Cb 0.14 -0.23 -0.01 0.00 1.55 0.00 0.00 36.73 38.17 2huq h TYR 149 CO 0.00 1.13 -0.43 -0.44 -1.32 0.00 0.00 178.16 177.10 2huq h ASP 150 N 0.72 0.04 -0.26 -2.11 3.32 -1.45 -2.54 116.42 114.14 2huq h ASP 150 Ca 0.07 -0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.08 2huq h ASP 150 Cb 0.93 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.46 2huq h ASP 150 CO 0.09 0.46 0.08 0.58 -1.72 0.00 0.00 179.24 178.73 2huq h VAL 151 N 0.03 1.20 -0.32 -1.35 2.07 -1.30 -1.05 116.25 115.53 2huq h VAL 151 Ca -0.00 -0.64 0.03 0.00 0.82 0.00 0.00 66.70 66.91 2huq h VAL 151 Cb 0.77 1.13 -0.03 0.00 -1.52 0.00 0.00 31.29 31.64 2huq h VAL 151 CO 0.06 0.21 0.12 0.40 0.02 0.00 0.00 177.57 178.38 2huq h ILE 152 N 0.25 0.93 0.02 4.57 2.04 -1.25 -1.04 117.51 123.04 2huq h ILE 152 Ca 0.08 -0.09 0.02 0.00 1.00 0.00 0.00 64.86 65.87 2huq h ILE 152 Cb 0.25 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 36.93 2huq h ILE 152 CO -0.00 0.05 -0.17 0.50 0.00 0.00 0.00 178.15 178.52 2huq h LYS 153 N 0.27 -0.28 -0.40 2.37 3.64 -1.27 0.22 116.57 121.13 2huq h LYS 153 Ca 0.14 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.60 2huq h LYS 153 Cb 0.09 0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 31.93 2huq h LYS 153 CO -0.13 -0.19 0.10 1.49 -2.27 0.00 0.00 179.45 178.45 2huq h GLU 154 N -0.30 0.23 -0.17 1.90 4.81 -0.90 -0.15 114.58 120.02 2huq h GLU 154 Ca 0.05 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.24 2huq h GLU 154 Cb 0.35 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.68 2huq h GLU 154 CO -0.15 0.16 -0.00 -0.91 -0.73 0.00 0.00 179.01 177.37 2huq h ASN 155 N 0.24 0.30 -0.79 1.04 2.35 -0.87 -2.93 115.58 114.92 2huq h ASN 155 Ca 0.19 -0.31 0.07 0.00 -0.55 0.00 0.00 56.30 55.70 2huq h ASN 155 Cb 0.21 -0.08 -0.05 0.00 0.05 0.00 0.00 38.32 38.45 2huq h ASN 155 CO -0.23 0.54 0.52 0.00 -1.65 0.00 0.00 177.43 176.60 2huq h ALA 156 N 0.77 1.67 -0.58 -0.83 0.00 -0.32 0.19 119.26 120.15 2huq h ALA 156 Ca 0.05 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2huq h ALA 156 Cb 0.39 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2huq h ALA 156 CO 0.01 0.20 0.27 0.93 0.00 0.00 0.00 179.25 180.66 2huq h GLU 157 N 0.82 0.82 -0.21 0.00 5.08 -0.89 -1.71 114.58 118.50 2huq h GLU 157 Ca 0.35 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.60 2huq h GLU 157 Cb 0.29 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.39 2huq h GLU 157 CO -0.13 0.64 0.00 0.54 -1.00 0.00 0.00 179.01 179.06 2huq n ARG 158 N -4.36 1.76 -1.21 2.33 1.74 -0.12 -4.91 116.66 111.89 2huq n ARG 158 Ca 0.05 -1.15 -0.07 0.00 -0.77 0.00 0.00 57.85 55.91 2huq n ARG 158 Cb 0.13 -1.37 -0.03 0.00 -1.02 0.00 0.00 32.46 30.17 2huq n ARG 158 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2huq n GLY 159 N 1.12 0.93 3.93 -0.13 0.00 -0.61 -4.98 105.19 105.46 2huq n GLY 159 Ca 0.15 -0.64 -0.28 0.00 0.00 0.00 0.00 46.02 45.26 2huq n GLY 159 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2huq s LEU 160 N -1.64 4.33 0.57 0.99 1.43 0.47 -2.74 118.68 122.10 2huq s LEU 160 Ca 0.00 0.19 -0.14 0.00 -1.03 0.00 0.00 54.13 53.15 2huq s LEU 160 Cb 0.00 -2.91 -0.06 0.00 0.03 0.00 0.00 46.19 43.25 2huq s LEU 160 CO 0.00 0.09 1.01 -1.00 0.23 0.00 0.00 176.35 176.68 2huq s HIS 161 N -1.67 3.45 -0.12 0.29 3.76 -0.35 -3.47 115.29 117.18 2huq s HIS 161 Ca 0.35 1.40 0.01 0.00 -0.15 0.00 0.00 55.06 56.68 2huq s HIS 161 Cb -0.12 -2.79 0.02 0.00 1.11 0.00 0.00 32.58 30.80 2huq s HIS 161 CO 0.28 -0.61 -0.16 0.99 -0.85 0.00 0.00 174.74 174.40 2huq s THR 162 N -2.84 1.59 -0.16 1.30 2.01 -0.05 -0.80 115.64 116.70 2huq s THR 162 Ca 0.58 -0.69 -0.16 0.00 0.31 0.00 0.00 61.69 61.73 2huq s THR 162 Cb -0.11 -1.46 -0.04 0.00 0.01 0.00 0.00 72.50 70.90 2huq s THR 162 CO 0.41 0.46 0.41 -0.22 -0.69 0.00 0.00 174.62 175.00 2huq s LEU 163 N 1.08 4.22 -0.30 4.42 2.96 -1.26 -1.66 118.68 128.15 2huq s LEU 163 Ca -0.04 0.64 0.03 0.00 -0.22 0.00 0.00 54.13 54.55 2huq s LEU 163 Cb -0.14 -2.57 0.08 0.00 0.50 0.00 0.00 46.19 44.06 2huq s LEU 163 CO -0.04 -0.01 -0.03 -0.76 -1.32 0.00 0.00 176.35 174.18 2huq s LEU 164 N 0.87 4.06 0.52 -0.68 1.43 0.82 -1.84 118.68 123.87 2huq s LEU 164 Ca 0.22 -1.75 -0.21 0.00 -1.03 0.00 0.00 54.13 51.36 2huq s LEU 164 Cb -0.14 -1.59 -0.06 0.00 0.03 0.00 0.00 46.19 44.43 2huq s LEU 164 CO 0.08 -0.28 1.19 -0.36 0.23 0.00 0.00 176.35 177.21 2huq s PHE 165 N 1.01 2.65 0.02 0.29 0.08 0.13 -2.12 117.98 120.04 2huq s PHE 165 Ca 0.00 1.52 0.03 0.00 0.12 0.00 0.00 56.93 58.60 2huq s PHE 165 Cb -0.20 -3.42 -0.04 0.00 -0.57 0.00 0.00 43.02 38.79 2huq s PHE 165 CO -0.06 -1.84 -0.04 -0.51 -0.10 0.00 0.00 175.22 172.67 2huq s LEU 166 N -3.52 3.30 0.92 -0.37 1.43 -1.26 -1.78 118.68 117.40 2huq s LEU 166 Ca 0.70 -0.12 -0.11 0.00 -1.03 0.00 0.00 54.13 53.57 2huq s LEU 166 Cb -0.29 -1.93 0.11 0.00 0.03 0.00 0.00 46.19 44.11 2huq s LEU 166 CO 0.34 0.26 0.92 -0.67 0.23 0.00 0.00 176.35 177.42 2huq n ASP 167 N 1.32 -0.40 -3.69 2.29 -0.08 -1.01 -4.82 116.55 110.17 2huq n ASP 167 Ca -0.14 0.40 -0.10 0.00 -1.51 0.00 0.00 54.79 53.44 2huq n ASP 167 Cb 0.52 -1.39 -0.10 0.00 2.34 0.00 0.00 41.12 42.49 2huq n ASP 167 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 2huq s ILE 168 N -2.54 -0.02 -0.63 5.18 2.07 -1.26 -2.09 121.20 121.90 2huq s ILE 168 Ca 0.64 0.07 0.05 0.00 -1.41 0.00 0.00 60.65 60.01 2huq s ILE 168 Cb -0.23 -0.67 0.20 0.00 0.13 0.00 0.00 42.46 41.90 2huq s ILE 168 CO 0.61 0.03 0.58 0.29 -1.91 0.00 0.00 174.94 174.53 2huq n LYS 169 N 4.19 1.85 -0.31 3.50 4.76 0.45 -4.96 118.16 127.64 2huq n LYS 169 Ca -0.22 -4.34 0.16 0.00 -2.87 0.00 0.00 58.31 51.04 2huq n LYS 169 Cb 0.56 -2.14 0.41 0.00 -1.84 0.00 0.00 35.03 32.02 2huq n LYS 169 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2huq h ALA 170 N 4.87 1.94 0.00 7.82 0.00 -1.83 0.14 119.26 132.20 2huq h ALA 170 Ca 0.17 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 2huq h ALA 170 Cb 0.74 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 2huq h ALA 170 CO 0.71 -0.28 -0.28 0.93 0.00 0.00 0.00 179.25 180.34 2huq h GLU 171 N 0.59 0.00 -0.01 0.00 5.08 -1.94 -1.73 114.58 116.58 2huq h GLU 171 Ca 0.53 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.89 2huq h GLU 171 Cb 1.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.31 2huq h GLU 171 CO -0.29 0.28 -0.24 1.63 -1.00 0.00 0.00 179.01 179.39 2huq n LYS 172 N -4.19 1.00 -2.56 2.33 5.02 0.35 -4.94 118.16 115.18 2huq n LYS 172 Ca -0.02 -0.63 -0.17 0.00 -2.02 0.00 0.00 58.31 55.47 2huq n LYS 172 Cb 0.33 -1.49 0.01 0.00 -0.02 0.00 0.00 35.03 33.86 2huq n LYS 172 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2huq n ARG 173 N -0.45 -2.48 -3.77 1.97 1.74 -0.34 -4.98 116.66 108.34 2huq n ARG 173 Ca 0.13 0.78 -0.36 0.00 -0.77 0.00 0.00 57.85 57.62 2huq n ARG 173 Cb 0.37 -5.23 -0.12 0.00 -1.02 0.00 0.00 32.46 26.46 2huq n ARG 173 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 2huq s MET 174 N -5.11 3.77 -0.20 5.56 -1.94 -0.78 -4.99 119.30 115.60 2huq s MET 174 Ca 0.11 -0.42 0.01 0.00 -1.71 0.00 0.00 55.69 53.67 2huq s MET 174 Cb -0.05 -3.38 0.05 0.00 2.01 0.00 0.00 34.83 33.46 2huq s MET 174 CO 0.13 -0.11 -0.08 0.71 -0.01 0.00 0.00 175.02 175.66 2huq s TYR 175 N 1.43 2.30 0.14 -0.03 2.02 -1.26 -0.41 117.35 121.53 2huq s TYR 175 Ca 0.06 -1.55 -0.31 0.00 -0.37 0.00 0.00 57.07 54.90 2huq s TYR 175 Cb -0.15 -1.57 -0.10 0.00 -0.40 0.00 0.00 41.96 39.73 2huq s TYR 175 CO 0.05 -0.73 1.73 1.41 -1.57 0.00 0.00 175.55 176.44 2huq s MET 176 N 1.43 4.16 0.56 -0.62 -2.45 -0.89 -4.96 119.30 116.53 2huq s MET 176 Ca -0.02 2.51 -0.07 0.00 -1.25 0.00 0.00 55.69 56.87 2huq s MET 176 Cb -0.17 -3.40 -0.02 0.00 1.25 0.00 0.00 34.83 32.50 2huq s MET 176 CO -0.08 -0.76 0.89 0.95 1.05 0.00 0.00 175.02 177.07 2huq s THR 177 N 2.08 4.32 0.45 10.11 -4.23 -1.26 -4.42 115.64 122.68 2huq s THR 177 Ca 0.76 0.25 0.11 0.00 -1.18 0.00 0.00 61.69 61.64 2huq s THR 177 Cb -0.45 -3.69 0.25 0.00 1.34 0.00 0.00 72.50 69.95 2huq s THR 177 CO 0.34 -0.74 2.07 0.00 -0.54 0.00 0.00 174.62 175.75 2huq h ALA 178 N -0.07 1.79 0.05 3.99 0.00 -1.91 -1.90 119.26 121.21 2huq h ALA 178 Ca -0.46 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.42 2huq h ALA 178 Cb 1.22 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2huq h ALA 178 CO 0.61 0.18 -0.08 -0.91 0.00 0.00 0.00 179.25 179.05 2huq h ASN 179 N 0.28 -0.23 -0.44 0.00 4.21 -1.90 -0.95 115.58 116.56 2huq h ASN 179 Ca 0.07 0.03 -0.03 0.00 1.21 0.00 0.00 56.30 57.58 2huq h ASN 179 Cb 0.03 0.09 -0.02 0.00 -1.12 0.00 0.00 38.32 37.29 2huq h ASN 179 CO -0.01 -0.13 0.17 -0.33 -1.29 0.00 0.00 177.43 175.84 2huq h GLU 180 N -0.17 0.72 -0.57 0.81 5.08 -1.77 -1.15 114.58 117.52 2huq h GLU 180 Ca 0.02 -0.11 -0.08 0.00 -1.00 0.00 0.00 59.36 58.18 2huq h GLU 180 Cb 0.18 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 2huq h GLU 180 CO -0.05 0.62 0.04 0.00 -1.00 0.00 0.00 179.01 178.61 2huq h ALA 181 N 1.48 0.98 -0.50 3.43 0.00 -1.08 -1.20 119.26 122.37 2huq h ALA 181 Ca 0.17 -0.28 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 2huq h ALA 181 Cb 0.19 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2huq h ALA 181 CO -0.01 0.63 -0.01 0.52 0.00 0.00 0.00 179.25 180.38 2huq h MET 182 N 0.89 0.89 -0.13 0.00 2.86 -0.49 -1.17 114.93 117.78 2huq h MET 182 Ca 0.17 -0.29 0.02 0.00 -2.06 0.00 0.00 59.70 57.54 2huq h MET 182 Cb 0.47 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.04 2huq h MET 182 CO 0.02 0.92 0.02 0.93 1.06 0.00 0.00 176.91 179.86 2huq h GLU 183 N 0.75 0.07 -0.84 1.72 4.39 -0.94 -1.42 114.58 118.30 2huq h GLU 183 Ca 0.14 -0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.84 2huq h GLU 183 Cb 0.53 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.12 2huq h GLU 183 CO 0.03 0.05 0.56 -0.07 -1.16 0.00 0.00 179.01 178.41 2huq h LEU 184 N 0.07 0.97 -0.77 1.33 3.38 -1.07 -2.15 115.31 117.07 2huq h LEU 184 Ca 0.06 -0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 2huq h LEU 184 Cb 0.06 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 2huq h LEU 184 CO -0.08 0.70 0.06 -0.07 0.09 0.00 0.00 178.44 179.14 2huq h LEU 185 N 1.14 0.96 -0.82 1.67 3.38 -0.88 -1.48 115.31 119.28 2huq h LEU 185 Ca 0.31 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.98 2huq h LEU 185 Cb -0.13 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.34 2huq h LEU 185 CO -0.07 0.98 0.19 -0.07 0.09 0.00 0.00 178.44 179.56 2huq h LEU 186 N 0.93 1.01 -0.93 1.67 3.38 -0.94 0.86 115.31 121.28 2huq h LEU 186 Ca 0.18 -0.20 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 2huq h LEU 186 Cb 0.46 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 2huq h LEU 186 CO 0.02 0.96 0.33 0.11 0.09 0.00 0.00 178.44 179.94 2huq h LYS 187 N 1.02 1.10 -0.30 1.13 1.57 -1.00 -0.45 116.57 119.65 2huq h LYS 187 Ca 0.22 -0.18 -0.13 0.00 -1.87 0.00 0.00 60.65 58.70 2huq h LYS 187 Cb 0.33 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 2huq h LYS 187 CO -0.00 0.87 -0.33 0.28 -0.57 0.00 0.00 179.45 179.70 2huq h VAL 188 N 1.09 1.28 -0.57 0.50 2.07 -0.55 -2.77 116.25 117.30 2huq h VAL 188 Ca 0.26 -1.46 -0.01 0.00 0.82 0.00 0.00 66.70 66.30 2huq h VAL 188 Cb 0.16 1.41 -0.03 0.00 -1.52 0.00 0.00 31.29 31.31 2huq h VAL 188 CO -0.03 0.47 0.31 -0.08 0.02 0.00 0.00 177.57 178.26 2huq h GLU 189 N 0.55 0.80 -0.74 1.57 4.57 -0.20 -0.62 114.58 120.51 2huq h GLU 189 Ca 0.06 -0.10 0.06 0.00 -1.18 0.00 0.00 59.36 58.21 2huq h GLU 189 Cb 0.83 -0.15 -0.05 0.00 -0.16 0.00 0.00 28.75 29.22 2huq h GLU 189 CO 0.07 0.61 0.49 0.22 -1.18 0.00 0.00 179.01 179.22 2huq h ASP 190 N 0.77 0.70 0.29 1.04 3.58 -0.89 1.26 116.42 123.16 2huq h ASP 190 Ca 0.20 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.64 2huq h ASP 190 Cb 0.05 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 40.96 2huq h ASP 190 CO -0.03 0.45 -0.14 -0.03 -2.88 0.00 0.00 179.24 176.62 2huq h MET 191 N 0.79 -0.37 0.08 0.28 4.05 -1.14 -3.38 114.93 115.25 2huq h MET 191 Ca 0.32 0.03 -0.25 0.00 -0.28 0.00 0.00 59.70 59.51 2huq h MET 191 Cb 0.23 0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 31.10 2huq h MET 191 CO -0.10 -0.18 -1.15 0.87 0.23 0.00 0.00 176.91 176.58 2huq h LYS 192 N -1.07 0.17 -6.12 0.39 1.57 -1.05 -3.49 116.57 106.98 2huq h LYS 192 Ca -0.04 -0.29 -0.42 0.00 -1.87 0.00 0.00 60.65 58.03 2huq h LYS 192 Cb 0.36 0.11 0.06 0.00 0.08 0.00 0.00 32.23 32.84 2huq h LYS 192 CO 0.06 1.14 -0.87 1.63 -0.57 0.00 0.00 179.45 180.84 2huq n LYS 193 N -3.47 -3.39 -0.26 3.15 5.02 0.43 -4.89 118.16 114.75 2huq n LYS 193 Ca -0.05 0.57 0.12 0.00 -2.02 0.00 0.00 58.31 56.92 2huq n LYS 193 Cb 0.99 -4.86 0.26 0.00 -0.02 0.00 0.00 35.03 31.41 2huq n LYS 193 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2huq n GLY 194 N -1.63 1.97 2.38 0.72 0.00 -1.26 -4.93 105.19 102.44 2huq n GLY 194 Ca -0.22 -0.75 -0.20 0.00 0.00 0.00 0.00 46.02 44.85 2huq n GLY 194 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2huq n GLY 195 N 1.56 -0.42 0.14 -0.02 0.00 -1.26 -4.90 105.19 100.29 2huq n GLY 195 Ca 0.21 -0.06 -0.22 0.00 0.00 0.00 0.00 46.02 45.96 2huq n GLY 195 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2huq h VAL 196 N 0.00 0.68 -2.97 1.61 2.07 -1.96 -3.46 116.25 112.23 2huq h VAL 196 Ca -0.47 -2.36 -0.49 0.00 0.82 0.00 0.00 66.70 64.20 2huq h VAL 196 Cb 1.35 2.54 -0.41 0.00 -1.52 0.00 0.00 31.29 33.25 2huq h VAL 196 CO 0.55 0.88 -0.76 0.12 0.02 0.00 0.00 177.57 178.38 2huq s PHE 197 N -2.55 0.35 0.25 1.57 5.36 -1.26 -4.97 117.98 116.72 2huq s PHE 197 Ca -0.22 -0.61 0.02 0.00 -0.96 0.00 0.00 56.93 55.16 2huq s PHE 197 Cb 0.06 -0.83 -0.01 0.00 -0.34 0.00 0.00 43.02 41.91 2huq s PHE 197 CO 0.78 -0.65 0.09 0.25 -1.46 0.00 0.00 175.22 174.22 2huq n THR 198 N 5.24 0.00 0.30 0.12 -2.24 -1.26 -4.61 114.28 111.82 2huq n THR 198 Ca -0.07 -1.43 0.16 0.00 -2.27 0.00 0.00 64.05 60.44 2huq n THR 198 Cb 0.46 0.52 0.93 0.00 -2.10 0.00 0.00 70.33 70.14 2huq n THR 198 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2huq h ASP 199 N 0.98 0.00 0.05 3.42 3.32 -1.99 -1.91 116.42 120.29 2huq h ASP 199 Ca -0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.86 2huq h ASP 199 Cb 0.73 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.28 2huq h ASP 199 CO 0.30 0.02 -0.14 0.47 -1.72 0.00 0.00 179.24 178.17 2huq n ASP 200 N -3.70 1.80 -4.76 6.45 8.00 -1.26 -0.45 116.55 122.63 2huq n ASP 200 Ca -0.03 -1.46 -0.41 0.00 0.71 0.00 0.00 54.79 53.60 2huq n ASP 200 Cb 0.11 0.11 -0.03 0.00 -0.02 0.00 0.00 41.12 41.29 2huq n ASP 200 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2huq s THR 201 N -2.20 3.11 0.01 -3.53 2.01 -0.72 -4.75 115.64 109.57 2huq s THR 201 Ca 0.29 1.06 -0.24 0.00 0.31 0.00 0.00 61.69 63.11 2huq s THR 201 Cb 0.20 -3.67 -0.05 0.00 0.01 0.00 0.00 72.50 68.98 2huq s THR 201 CO 0.41 0.23 0.72 -0.22 -0.69 0.00 0.00 174.62 175.06 2huq s LEU 202 N -1.23 4.42 0.11 4.42 2.96 -1.26 -1.16 118.68 126.94 2huq s LEU 202 Ca 0.49 1.34 0.01 0.00 -0.22 0.00 0.00 54.13 55.76 2huq s LEU 202 Cb -0.36 -3.13 -0.04 0.00 0.50 0.00 0.00 46.19 43.15 2huq s LEU 202 CO 0.45 0.01 -0.04 0.68 -1.32 0.00 0.00 176.35 176.13 2huq s VAL 203 N 0.06 0.64 -0.03 1.68 -7.23 -0.01 -4.28 120.40 111.23 2huq s VAL 203 Ca 0.37 -1.94 0.04 0.00 -1.81 0.00 0.00 61.98 58.64 2huq s VAL 203 Cb -0.19 -1.79 -0.00 0.00 0.56 0.00 0.00 36.38 34.95 2huq s VAL 203 CO 0.21 -0.77 -0.15 -0.69 -0.31 0.00 0.00 175.10 173.38 2huq s VAL 204 N -3.67 1.28 -0.09 1.32 1.01 0.46 -1.64 120.40 119.07 2huq s VAL 204 Ca 0.15 -0.65 0.04 0.00 0.00 0.00 0.00 61.98 61.52 2huq s VAL 204 Cb 0.06 -1.10 -0.01 0.00 0.00 0.00 0.00 36.38 35.33 2huq s VAL 204 CO -0.03 0.37 -0.22 -0.69 0.00 0.00 0.00 175.10 174.53 2huq s VAL 205 N -0.03 2.27 -0.16 2.92 1.01 0.17 -1.06 120.40 125.51 2huq s VAL 205 Ca -0.01 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 61.02 2huq s VAL 205 Cb -0.10 -1.88 0.02 0.00 0.00 0.00 0.00 36.38 34.43 2huq s VAL 205 CO 0.01 0.56 -0.16 -0.22 0.00 0.00 0.00 175.10 175.29 2huq s LEU 206 N 0.20 1.80 -0.07 3.92 2.96 -1.08 -1.29 118.68 125.12 2huq s LEU 206 Ca -0.13 -0.53 0.04 0.00 -0.22 0.00 0.00 54.13 53.28 2huq s LEU 206 Cb -0.16 -1.25 0.00 0.00 0.50 0.00 0.00 46.19 45.27 2huq s LEU 206 CO 0.07 -0.04 -0.19 0.00 -1.32 0.00 0.00 176.35 174.87 2huq s ALA 207 N 1.44 1.75 -1.22 5.97 0.00 0.21 -1.60 121.76 128.30 2huq s ALA 207 Ca 0.05 -0.75 -0.00 0.00 0.00 0.00 0.00 51.96 51.26 2huq s ALA 207 Cb -0.13 -0.65 0.00 0.00 0.00 0.00 0.00 23.12 22.34 2huq s ALA 207 CO -0.11 0.25 0.96 0.54 0.00 0.00 0.00 175.76 177.40 2huq n ARG 208 N 3.47 -6.44 -1.59 0.00 1.74 -0.47 -1.51 116.66 111.86 2huq n ARG 208 Ca -0.20 0.81 -0.36 0.00 -0.77 0.00 0.00 57.85 57.34 2huq n ARG 208 Cb 0.52 -5.77 0.08 0.00 -1.02 0.00 0.00 32.46 26.28 2huq n ARG 208 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2huq s ALA 209 N -3.40 2.24 0.00 7.54 0.00 -1.26 -2.22 121.76 124.66 2huq s ALA 209 Ca 0.03 1.09 0.00 0.00 0.00 0.00 0.00 51.96 53.08 2huq s ALA 209 Cb -0.01 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.58 2huq s ALA 209 CO 0.74 -1.76 0.00 0.41 0.00 0.00 0.00 175.76 175.15 2huq n GLY 210 N 0.74 3.09 3.84 0.00 0.00 -1.26 -4.00 105.19 107.61 2huq n GLY 210 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 2huq n GLY 210 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2huq s SER 211 N 0.04 4.24 0.23 1.61 1.04 -0.94 -4.65 113.70 115.28 2huq s SER 211 Ca 0.00 0.99 0.05 0.00 0.48 0.00 0.00 55.95 57.47 2huq s SER 211 Cb 0.00 -1.59 0.23 0.00 0.10 0.00 0.00 66.02 64.76 2huq s SER 211 CO 0.00 -2.09 1.54 -0.07 0.98 0.00 0.00 173.24 173.60 2huq h LEU 212 N -1.18 0.20 -6.07 2.42 -0.00 -1.96 -3.35 115.31 105.38 2huq h LEU 212 Ca -0.48 -0.13 -0.59 0.00 -0.00 0.00 0.00 57.88 56.68 2huq h LEU 212 Cb 1.31 -0.06 -0.42 0.00 -0.00 0.00 0.00 40.66 41.49 2huq h LEU 212 CO 0.63 0.80 -0.66 0.59 -0.00 0.00 0.00 178.44 179.80 2huq n ASN 213 N -3.82 3.45 -4.76 -0.43 4.13 -1.26 -5.09 115.26 107.48 2huq n ASN 213 Ca -0.02 -3.39 -0.31 0.00 1.68 0.00 0.00 54.58 52.54 2huq n ASN 213 Cb 0.65 -0.65 0.10 0.00 -1.54 0.00 0.00 39.78 38.33 2huq n ASN 213 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 2huq s PRO 214 N -2.47 2.09 -0.30 3.52 0.04 -1.26 -4.98 135.00 131.65 2huq s PRO 214 Ca 0.40 1.09 -0.16 0.00 0.04 0.00 0.00 61.00 62.38 2huq s PRO 214 Cb 0.17 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.80 2huq s PRO 214 CO -0.04 -1.74 0.40 0.99 0.04 0.00 0.00 177.00 176.66 2huq s THR 215 N -2.92 5.14 -0.24 1.26 2.01 -0.57 -4.94 115.64 115.39 2huq s THR 215 Ca 0.61 0.41 0.02 0.00 0.31 0.00 0.00 61.69 63.05 2huq s THR 215 Cb -0.17 -3.78 0.05 0.00 0.01 0.00 0.00 72.50 68.61 2huq s THR 215 CO 0.56 0.03 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.78 2huq s ILE 216 N 2.12 2.00 0.04 1.82 1.01 -1.26 -0.62 121.20 126.31 2huq s ILE 216 Ca 0.15 -1.40 0.03 0.00 0.00 0.00 0.00 60.65 59.43 2huq s ILE 216 Cb -0.16 -2.08 -0.02 0.00 0.01 0.00 0.00 42.46 40.21 2huq s ILE 216 CO 0.11 0.07 -0.10 -0.13 0.00 0.00 0.00 174.94 174.89 2huq s ARG 217 N 1.21 0.66 -0.00 2.79 1.81 -0.41 -4.45 118.95 120.55 2huq s ARG 217 Ca -0.06 -0.75 -0.01 0.00 -1.72 0.00 0.00 55.73 53.20 2huq s ARG 217 Cb -0.18 -0.55 -0.00 0.00 -0.45 0.00 0.00 34.95 33.77 2huq s ARG 217 CO -0.07 0.12 0.02 0.00 -0.68 0.00 0.00 175.30 174.69 2huq s ALA 218 N -1.13 -0.04 0.00 2.13 0.00 -1.10 0.41 121.76 122.03 2huq s ALA 218 Ca -0.05 -0.02 0.00 0.00 0.00 0.00 0.00 51.96 51.89 2huq s ALA 218 Cb -0.09 -0.01 0.00 0.00 0.00 0.00 0.00 23.12 23.02 2huq s ALA 218 CO 0.01 -0.03 0.00 0.41 0.00 0.00 0.00 175.76 176.15 2huq n GLY 219 N 2.87 -1.57 3.79 0.00 0.00 -0.65 -3.79 105.19 105.83 2huq n GLY 219 Ca -0.14 -1.07 -0.36 0.00 0.00 0.00 0.00 46.02 44.45 2huq n GLY 219 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2huq s TYR 220 N -2.60 3.61 0.18 1.61 2.02 -1.26 -0.83 117.35 120.09 2huq s TYR 220 Ca 0.00 1.75 -0.16 0.00 -0.37 0.00 0.00 57.07 58.29 2huq s TYR 220 Cb 0.00 -2.94 0.15 0.00 -0.40 0.00 0.00 41.96 38.77 2huq s TYR 220 CO 0.00 0.09 1.65 0.28 -1.57 0.00 0.00 175.55 176.00 2huq h VAL 221 N 2.50 0.48 -1.06 0.71 2.07 -0.92 -0.14 116.25 119.88 2huq h VAL 221 Ca -0.47 0.00 0.29 0.00 0.82 0.00 0.00 66.70 67.34 2huq h VAL 221 Cb 1.19 0.48 -0.07 0.00 -1.52 0.00 0.00 31.29 31.37 2huq h VAL 221 CO 0.64 0.00 0.72 0.07 0.02 0.00 0.00 177.57 179.02 2huq h LYS 222 N -0.02 0.21 0.06 1.57 2.10 -1.04 0.12 116.57 119.57 2huq h LYS 222 Ca 0.24 -0.01 -0.32 0.00 -2.00 0.00 0.00 60.65 58.56 2huq h LYS 222 Cb 0.38 -0.05 -0.03 0.00 -0.90 0.00 0.00 32.23 31.63 2huq h LYS 222 CO -0.52 0.14 -1.77 -0.44 -2.00 0.00 0.00 179.45 174.86 2huq h ASP 223 N 0.22 0.21 0.69 7.07 3.32 -1.33 -3.40 116.42 123.20 2huq h ASP 223 Ca 0.56 -0.43 -0.03 0.00 0.02 0.00 0.00 57.03 57.14 2huq h ASP 223 Cb 1.75 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 41.23 2huq h ASP 223 CO -0.16 1.38 -1.34 0.18 -1.72 0.00 0.00 179.24 177.58 2huq n LEU 224 N -3.27 0.63 -0.02 1.55 4.77 -0.58 -4.37 117.00 115.71 2huq n LEU 224 Ca -0.22 0.25 0.23 0.00 -0.03 0.00 0.00 56.01 56.24 2huq n LEU 224 Cb 1.05 -0.01 0.72 0.00 -2.33 0.00 0.00 43.42 42.85 2huq n LEU 224 CO 0.45 -0.08 1.21 -0.29 -1.33 0.00 0.00 177.39 177.35 2huq h ILE 225 N 0.00 0.43 -0.19 -0.08 2.10 -1.23 0.37 117.51 118.92 2huq h ILE 225 Ca -0.04 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.90 2huq h ILE 225 Cb 1.12 0.59 0.00 0.00 -1.09 0.00 0.00 36.82 37.44 2huq h ILE 225 CO 0.01 0.00 0.00 0.54 -1.08 0.00 0.00 178.15 177.62 2huq n ARG 226 N -3.90 2.71 -2.99 2.19 1.74 -1.26 -4.70 116.66 110.44 2huq n ARG 226 Ca 0.12 -2.14 -0.34 0.00 -0.77 0.00 0.00 57.85 54.71 2huq n ARG 226 Cb 0.77 -1.35 -0.06 0.00 -1.02 0.00 0.00 32.46 30.80 2huq n ARG 226 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2huq s GLU 227 N -1.63 4.21 -0.31 5.56 2.12 0.12 -5.03 118.70 123.74 2huq s GLU 227 Ca 0.22 0.94 -0.20 0.00 0.36 0.00 0.00 54.97 56.29 2huq s GLU 227 Cb 0.16 -2.53 -0.01 0.00 0.26 0.00 0.00 34.13 32.01 2huq s GLU 227 CO 0.08 0.18 0.62 0.34 -0.54 0.00 0.00 175.26 175.94 2huq s ASP 228 N -2.00 6.47 -0.09 -1.70 2.15 -1.26 -4.89 116.67 115.35 2huq s ASP 228 Ca 0.53 0.38 0.18 0.00 0.43 0.00 0.00 52.55 54.07 2huq s ASP 228 Cb -0.13 -2.32 0.67 0.00 -0.30 0.00 0.00 42.92 40.84 2huq s ASP 228 CO 0.18 -0.48 1.58 0.49 -0.17 0.00 0.00 175.17 176.77 2huq n PHE 229 N 5.87 1.32 -2.84 -5.34 3.72 -1.26 -5.08 117.46 113.85 2huq n PHE 229 Ca -0.01 -0.60 0.00 0.00 -0.05 0.00 0.00 57.45 56.78 2huq n PHE 229 Cb 0.49 -0.20 0.00 0.00 -0.94 0.00 0.00 39.48 38.83 2huq n PHE 229 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2huq n GLY 230 N 1.06 -2.16 3.74 1.37 0.00 -1.26 -4.80 105.19 103.15 2huq n GLY 230 Ca 0.24 -1.51 -0.33 0.00 0.00 0.00 0.00 46.02 44.42 2huq n GLY 230 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2huq s ASP 231 N -3.53 4.53 1.07 1.61 1.01 -1.26 -5.03 116.67 115.06 2huq s ASP 231 Ca 0.00 2.16 -0.15 0.00 0.71 0.00 0.00 52.55 55.28 2huq s ASP 231 Cb 0.00 -2.57 0.22 0.00 1.01 0.00 0.00 42.92 41.58 2huq s ASP 231 CO 0.00 -2.03 1.11 -2.16 0.21 0.00 0.00 175.17 172.30 2huq s PRO 232 N -4.08 -0.12 0.50 8.23 0.04 -1.26 -4.55 135.00 133.76 2huq s PRO 232 Ca 0.70 0.26 -0.18 0.00 0.04 0.00 0.00 61.00 61.82 2huq s PRO 232 Cb -0.24 -1.70 -0.08 0.00 0.04 0.00 0.00 34.50 32.52 2huq s PRO 232 CO 0.45 -3.04 0.99 -1.25 0.04 0.00 0.00 177.00 174.18 2huq s PRO 233 N -5.16 3.94 0.17 0.56 0.04 -1.26 -4.72 135.00 128.57 2huq s PRO 233 Ca 0.67 1.06 0.09 0.00 0.04 0.00 0.00 61.00 62.87 2huq s PRO 233 Cb -0.15 -2.13 -0.04 0.00 0.04 0.00 0.00 34.50 32.22 2huq s PRO 233 CO 0.57 -0.28 -0.19 -1.01 0.04 0.00 0.00 177.00 176.12 2huq s HIS 234 N -2.43 1.91 0.03 0.56 3.76 -1.26 -1.36 115.29 116.49 2huq s HIS 234 Ca 0.61 -0.45 0.02 0.00 -0.15 0.00 0.00 55.06 55.09 2huq s HIS 234 Cb -0.11 -0.94 -0.02 0.00 1.11 0.00 0.00 32.58 32.62 2huq s HIS 234 CO 0.26 0.37 -0.07 -1.50 -0.85 0.00 0.00 174.74 172.96 2huq s ILE 235 N -2.02 0.46 -0.00 0.60 2.07 -0.63 -4.31 121.20 117.36 2huq s ILE 235 Ca 0.17 -0.82 0.05 0.00 -1.41 0.00 0.00 60.65 58.64 2huq s ILE 235 Cb -0.06 -0.50 -0.03 0.00 0.13 0.00 0.00 42.46 42.00 2huq s ILE 235 CO 0.07 -0.26 -0.15 -0.22 -1.91 0.00 0.00 174.94 172.47 2huq s LEU 236 N -1.16 2.71 -0.05 8.50 2.96 -0.90 -2.63 118.68 128.11 2huq s LEU 236 Ca -0.07 -0.29 0.02 0.00 -0.22 0.00 0.00 54.13 53.56 2huq s LEU 236 Cb -0.08 -1.57 0.02 0.00 0.50 0.00 0.00 46.19 45.06 2huq s LEU 236 CO 0.00 0.30 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.61 2huq s ILE 237 N -0.84 0.88 -0.38 6.68 1.01 -0.23 -0.12 121.20 128.20 2huq s ILE 237 Ca 0.13 -0.33 -0.03 0.00 0.00 0.00 0.00 60.65 60.42 2huq s ILE 237 Cb -0.11 -0.83 0.09 0.00 0.01 0.00 0.00 42.46 41.62 2huq s ILE 237 CO 0.03 0.30 0.15 -0.69 0.00 0.00 0.00 174.94 174.74 2huq s VAL 238 N 0.73 3.33 0.63 2.92 1.01 -0.66 -0.41 120.40 127.96 2huq s VAL 238 Ca -0.13 -1.78 -0.16 0.00 0.00 0.00 0.00 61.98 59.91 2huq s VAL 238 Cb -0.15 -3.15 -0.02 0.00 0.00 0.00 0.00 36.38 33.06 2huq s VAL 238 CO 0.02 -0.51 1.11 -2.84 0.00 0.00 0.00 175.10 172.88 2huq s PRO 239 N 1.21 2.97 0.00 2.72 0.02 -1.26 -0.87 135.00 139.79 2huq s PRO 239 Ca 0.04 1.41 0.00 0.00 0.02 0.00 0.00 61.00 62.47 2huq s PRO 239 Cb -0.22 -1.97 0.00 0.00 0.02 0.00 0.00 34.50 32.33 2huq s PRO 239 CO -0.02 -1.12 0.00 0.41 -0.33 0.00 0.00 177.00 175.93 2huq n GLY 240 N -0.46 0.54 3.64 0.52 0.00 -1.23 -4.85 105.19 103.35 2huq n GLY 240 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 2huq n GLY 240 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2huq s LYS 241 N 3.73 3.84 0.05 1.61 2.20 -1.11 -4.96 119.74 125.09 2huq s LYS 241 Ca 0.00 2.01 -0.28 0.00 -0.36 0.00 0.00 55.97 57.34 2huq s LYS 241 Cb 0.00 -4.10 -0.05 0.00 -1.51 0.00 0.00 37.83 32.17 2huq s LYS 241 CO 0.00 -1.26 0.90 -0.51 -0.36 0.00 0.00 175.35 174.12 2huq s LEU 242 N 5.29 4.43 0.66 5.43 1.43 -1.26 -4.94 118.68 129.73 2huq s LEU 242 Ca 0.79 1.62 -0.13 0.00 -1.03 0.00 0.00 54.13 55.38 2huq s LEU 242 Cb -0.31 -3.46 -0.00 0.00 0.03 0.00 0.00 46.19 42.45 2huq s LEU 242 CO 0.32 -0.11 1.07 -1.00 0.23 0.00 0.00 176.35 176.86 2huq s HIS 243 N 0.36 2.94 0.17 0.29 3.76 -1.26 -4.91 115.29 116.64 2huq s HIS 243 Ca 0.46 1.49 -0.16 0.00 -0.15 0.00 0.00 55.06 56.69 2huq s HIS 243 Cb -0.21 -2.98 0.11 0.00 1.11 0.00 0.00 32.58 30.60 2huq s HIS 243 CO 0.27 -1.31 1.67 0.82 -0.85 0.00 0.00 174.74 175.34 2huq h ILE 244 N -0.23 0.61 0.00 0.60 1.08 -1.97 -1.72 117.51 115.88 2huq h ILE 244 Ca -0.45 -0.01 -0.05 0.00 -0.39 0.00 0.00 64.86 63.95 2huq h ILE 244 Cb 1.22 0.58 -0.01 0.00 -3.07 0.00 0.00 36.82 35.55 2huq h ILE 244 CO 0.56 0.00 -0.26 1.62 -0.69 0.00 0.00 178.15 179.38 2huq h VAL 245 N 0.03 1.08 0.11 1.67 3.04 -1.98 -1.13 116.25 119.07 2huq h VAL 245 Ca 0.20 -0.93 -0.01 0.00 -1.01 0.00 0.00 66.70 64.96 2huq h VAL 245 Cb 0.30 1.51 0.00 0.00 -2.01 0.00 0.00 31.29 31.10 2huq h VAL 245 CO -0.40 0.26 -0.05 -0.33 -1.01 0.00 0.00 177.57 176.03 2huq h GLU 246 N 0.00 -0.14 -0.93 4.17 5.08 -1.57 -1.13 114.58 120.05 2huq h GLU 246 Ca -0.00 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2huq h GLU 246 Cb 0.49 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.73 2huq h GLU 246 CO 0.03 0.10 0.57 0.00 -1.00 0.00 0.00 179.01 178.72 2huq h ALA 247 N 0.48 1.19 -0.61 3.43 0.00 -1.22 -1.87 119.26 120.65 2huq h ALA 247 Ca -0.02 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2huq h ALA 247 Cb 0.31 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 2huq h ALA 247 CO 0.03 0.63 0.38 0.93 0.00 0.00 0.00 179.25 181.22 2huq h GLU 248 N 1.28 0.82 -0.13 0.00 5.08 -1.07 -1.17 114.58 119.39 2huq h GLU 248 Ca 0.34 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.62 2huq h GLU 248 Cb -0.07 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.00 2huq h GLU 248 CO -0.06 0.57 0.06 -0.92 -1.00 0.00 0.00 179.01 177.66 2huq h TYR 249 N 0.83 0.19 -0.83 4.33 5.03 -0.77 0.11 116.97 125.85 2huq h TYR 249 Ca 0.22 -0.01 0.09 0.00 2.58 0.00 0.00 58.73 61.61 2huq h TYR 249 Cb -0.05 -0.06 -0.07 0.00 1.55 0.00 0.00 36.73 38.10 2huq h TYR 249 CO -0.02 0.24 0.48 -0.07 -1.32 0.00 0.00 178.16 177.47 2huq h LEU 250 N 0.08 0.71 -0.03 2.82 3.38 -1.07 0.74 115.31 121.93 2huq h LEU 250 Ca 0.04 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2huq h LEU 250 Cb 0.12 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 2huq h LEU 250 CO -0.01 0.41 -0.04 0.58 0.09 0.00 0.00 178.44 179.48 2huq h VAL 251 N 0.82 1.39 -0.13 1.22 2.07 -0.98 0.06 116.25 120.70 2huq h VAL 251 Ca 0.39 -1.22 -0.17 0.00 0.82 0.00 0.00 66.70 66.52 2huq h VAL 251 Cb 0.33 2.14 -0.00 0.00 -1.52 0.00 0.00 31.29 32.23 2huq h VAL 251 CO -0.23 0.33 -0.64 -0.33 0.02 0.00 0.00 177.57 176.71 2huq h GLU 252 N -0.39 0.49 0.00 1.57 4.39 -0.62 -3.11 114.58 116.91 2huq h GLU 252 Ca 0.00 -0.35 -0.28 0.00 0.34 0.00 0.00 59.36 59.07 2huq h GLU 252 Cb 0.55 0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 29.20 2huq h GLU 252 CO 0.01 0.97 -2.07 -0.89 -1.16 0.00 0.00 179.01 175.87 2huq n ILE 253 N -3.90 1.07 -0.21 3.13 2.08 0.26 -4.62 119.36 117.16 2huq n ILE 253 Ca -0.04 -0.53 0.11 0.00 0.56 0.00 0.00 62.75 62.84 2huq n ILE 253 Cb 0.66 -0.89 0.27 0.00 -0.75 0.00 0.00 39.64 38.93 2huq n ILE 253 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2huq n ALA 254 N -2.81 2.35 -2.58 -1.39 0.00 -0.09 -4.94 120.51 111.05 2huq n ALA 254 Ca -0.29 -1.21 -0.20 0.00 0.00 0.00 0.00 53.44 51.74 2huq n ALA 254 Cb 0.93 -0.81 0.01 0.00 0.00 0.00 0.00 19.45 19.57 2huq n ALA 254 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2huq n GLY 255 N 1.40 -0.44 3.77 0.00 0.00 -0.74 -2.72 105.19 106.46 2huq n GLY 255 Ca 0.21 -0.02 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 2huq n GLY 255 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2huq s ALA 256 N -3.03 2.55 0.13 4.61 0.00 -0.61 -4.79 121.76 120.61 2huq s ALA 256 Ca 0.10 0.65 -0.33 0.00 0.00 0.00 0.00 51.96 52.37 2huq s ALA 256 Cb -0.04 -3.33 -0.13 0.00 0.00 0.00 0.00 23.12 19.61 2huq s ALA 256 CO 0.12 -1.11 1.67 -2.30 0.00 0.00 0.00 175.76 174.15 2huq n PRO 257 N -2.03 2.33 -0.40 0.00 -0.02 -1.26 -4.58 135.00 129.03 2huq n PRO 257 Ca 0.11 0.84 0.38 0.00 -2.02 0.00 0.00 63.50 62.81 2huq n PRO 257 Cb 0.52 -2.65 0.74 0.00 -0.02 0.00 0.00 33.50 32.09 2huq n PRO 257 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2huq h ARG 258 N 6.78 0.03 -0.84 -0.52 3.08 -1.94 -1.68 114.38 119.30 2huq h ARG 258 Ca -0.45 -0.00 0.17 0.00 0.07 0.00 0.00 59.98 59.76 2huq h ARG 258 Cb 1.24 -0.01 -0.10 0.00 0.08 0.00 0.00 29.97 31.18 2huq h ARG 258 CO 0.91 0.02 0.39 1.05 -1.07 0.00 0.00 179.97 181.27 2huq h GLU 259 N 0.03 0.50 0.00 0.04 9.09 -1.99 -1.29 114.58 120.96 2huq h GLU 259 Ca 0.65 -0.03 0.00 0.00 0.05 0.00 0.00 59.36 60.03 2huq h GLU 259 Cb 2.50 -0.11 0.00 0.00 -1.65 0.00 0.00 28.75 29.49 2huq h GLU 259 CO -0.05 0.33 0.05 0.44 0.05 0.00 0.00 179.01 179.83 2huq n ILE 260 N -4.95 1.81 0.29 -1.06 -5.35 -0.63 -0.94 119.36 108.53 2huq n ILE 260 Ca 0.18 0.50 0.16 0.00 -0.27 0.00 0.00 62.75 63.32 2huq n ILE 260 Cb 0.49 -1.50 0.88 0.00 -1.74 0.00 0.00 39.64 37.77 2huq n ILE 260 CO 0.00 0.00 0.00 -0.07 -1.76 0.00 0.00 176.55 174.72 2huq h LEU 261 N 0.00 0.00 -8.10 7.28 3.38 -1.44 -3.36 115.31 113.08 2huq h LEU 261 Ca 0.00 0.00 -0.68 0.00 0.09 0.00 0.00 57.88 57.29 2huq h LEU 261 Cb 0.09 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 40.66 2huq h LEU 261 CO 0.00 0.05 0.48 -0.60 0.09 0.00 0.00 178.44 178.46 2huq s ARG 262 N -4.22 3.30 0.42 1.13 3.52 -0.11 -4.96 118.95 118.02 2huq s ARG 262 Ca -0.03 -1.43 -0.15 0.00 -0.13 0.00 0.00 55.73 53.99 2huq s ARG 262 Cb 0.13 -4.49 -0.08 0.00 -1.56 0.00 0.00 34.95 28.95 2huq s ARG 262 CO 0.53 -1.68 0.85 0.08 -0.81 0.00 0.00 175.30 174.27 2huq s VAL 263 N 2.87 4.62 -0.89 7.11 1.01 -1.26 -5.01 120.40 128.85 2huq s VAL 263 Ca 0.22 1.01 0.00 0.00 0.00 0.00 0.00 61.98 63.21 2huq s VAL 263 Cb -0.14 -3.68 0.29 0.00 0.00 0.00 0.00 36.38 32.85 2huq s VAL 263 CO 0.01 -0.45 1.18 0.59 0.00 0.00 0.00 175.10 176.43 2huq n ASN 264 N -1.02 5.33 0.00 3.32 4.13 -1.26 -5.18 115.26 120.57 2huq n ASN 264 Ca 0.05 -3.44 0.00 0.00 1.68 0.00 0.00 54.58 52.87 2huq n ASN 264 Cb 0.54 -1.01 0.00 0.00 -1.54 0.00 0.00 39.78 37.76 2huq n ASN 264 CO 0.00 0.00 0.00 1.33 0.28 0.00 0.00 177.26 178.87