#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xw6 n MET 2 N 0.00 2.22 -4.52 0.54 1.56 -1.18 -4.74 117.12 110.99 1xw6 n MET 2 Ca 0.00 0.78 -0.23 0.00 -0.27 0.00 0.00 57.70 57.98 1xw6 n MET 2 Cb 0.00 -2.40 -0.16 0.00 2.15 0.00 0.00 33.22 32.81 1xw6 n MET 2 CO 0.00 0.00 0.00 -1.50 -0.73 0.00 0.00 175.97 173.74 1xw6 s ILE 3 N -0.91 1.00 -0.23 1.12 2.07 -0.35 -0.10 121.20 123.80 1xw6 s ILE 3 Ca 0.57 -0.45 -0.06 0.00 -1.41 0.00 0.00 60.65 59.30 1xw6 s ILE 3 Cb -0.56 -0.90 -0.03 0.00 0.13 0.00 0.00 42.46 41.10 1xw6 s ILE 3 CO 0.60 0.31 0.04 -0.22 -1.91 0.00 0.00 174.94 173.77 1xw6 s LEU 4 N 0.37 3.40 -0.11 8.50 2.96 -0.28 -0.96 118.68 132.56 1xw6 s LEU 4 Ca -0.08 -0.18 -0.01 0.00 -0.22 0.00 0.00 54.13 53.64 1xw6 s LEU 4 Cb -0.12 -1.89 -0.03 0.00 0.50 0.00 0.00 46.19 44.65 1xw6 s LEU 4 CO 0.02 0.02 -0.07 -0.83 -1.32 0.00 0.00 176.35 174.16 1xw6 s GLY 5 N 1.30 1.67 0.13 7.98 0.00 -0.34 -0.65 107.32 117.40 1xw6 s GLY 5 Ca 0.04 -0.86 -0.25 0.00 0.00 0.00 0.00 44.72 43.65 1xw6 s GLY 5 CO 0.03 -0.35 1.05 -0.47 0.00 0.00 0.00 173.10 173.36 1xw6 s TYR 6 N -0.14 -0.03 0.94 1.90 5.04 -0.94 -1.65 117.35 122.46 1xw6 s TYR 6 Ca 0.01 -0.27 -0.12 0.00 -2.44 0.00 0.00 57.07 54.26 1xw6 s TYR 6 Cb -0.13 0.65 0.16 0.00 0.35 0.00 0.00 41.96 42.98 1xw6 s TYR 6 CO 0.03 -0.76 1.09 -1.58 -1.34 0.00 0.00 175.55 172.99 1xw6 s TRP 7 N -2.68 2.07 -0.16 4.97 0.52 -1.26 -1.37 118.94 121.02 1xw6 s TRP 7 Ca 0.17 1.31 -0.06 0.00 0.02 0.00 0.00 56.10 57.53 1xw6 s TRP 7 Cb -0.01 -3.18 -0.25 0.00 -1.15 0.00 0.00 33.47 28.89 1xw6 s TRP 7 CO 0.02 -2.69 3.56 -3.47 0.02 0.00 0.00 176.95 174.39 1xw6 n ASP 8 N -4.10 5.59 -1.90 2.95 4.64 0.46 -4.61 116.55 119.58 1xw6 n ASP 8 Ca 0.07 -2.49 -0.07 0.00 -1.38 0.00 0.00 54.79 50.92 1xw6 n ASP 8 Cb 0.55 -1.43 -0.02 0.00 -1.04 0.00 0.00 41.12 39.17 1xw6 n ASP 8 CO 0.00 0.00 0.00 2.30 -0.82 0.00 0.00 177.20 178.68 1xw6 n ILE 9 N 2.61 0.00 0.00 5.18 -5.35 -1.26 -4.76 119.36 115.78 1xw6 n ILE 9 Ca 0.47 -0.91 0.00 0.00 -0.27 0.00 0.00 62.75 62.03 1xw6 n ILE 9 Cb 0.85 0.50 0.00 0.00 -1.74 0.00 0.00 39.64 39.24 1xw6 n ILE 9 CO 0.00 0.00 0.00 -1.14 -1.76 0.00 0.00 176.55 173.65 1xw6 n ARG 10 N -0.26 0.00 0.00 6.28 0.63 -0.18 -4.87 116.66 118.26 1xw6 n ARG 10 Ca 0.02 0.39 0.00 0.00 -0.92 0.00 0.00 57.85 57.34 1xw6 n ARG 10 Cb 0.25 -0.93 0.00 0.00 0.45 0.00 0.00 32.46 32.23 1xw6 n ARG 10 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1xw6 n GLY 11 N 1.85 1.66 0.00 5.14 0.00 -0.41 -2.29 105.19 111.13 1xw6 n GLY 11 Ca 0.00 -0.25 0.10 0.00 0.00 0.00 0.00 46.02 45.87 1xw6 n GLY 11 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xw6 n LEU 12 N 0.00 0.00 0.00 0.99 4.77 -1.26 -3.07 117.00 118.44 1xw6 n LEU 12 Ca 0.00 0.36 0.12 0.00 -0.03 0.00 0.00 56.01 56.46 1xw6 n LEU 12 Cb 0.00 -0.36 0.27 0.00 -2.33 0.00 0.00 43.42 40.99 1xw6 n LEU 12 CO 0.00 -0.11 0.47 0.00 -1.33 0.00 0.00 177.39 176.42 1xw6 n ALA 13 N -1.36 3.45 0.18 -1.18 0.00 -0.97 -4.51 120.51 116.12 1xw6 n ALA 13 Ca 0.08 -0.33 -0.15 0.00 0.00 0.00 0.00 53.44 53.04 1xw6 n ALA 13 Cb 0.19 -1.14 -0.07 0.00 0.00 0.00 0.00 19.45 18.43 1xw6 n ALA 13 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1xw6 h HIS 14 N 0.00 -0.93 -0.18 0.00 6.17 -1.48 0.52 115.15 119.26 1xw6 h HIS 14 Ca 0.00 0.01 -0.02 0.00 0.71 0.00 0.00 60.37 61.07 1xw6 h HIS 14 Cb 0.51 0.37 -0.01 0.00 2.52 0.00 0.00 27.41 30.80 1xw6 h HIS 14 CO 0.00 -0.47 0.01 0.00 0.71 0.00 0.00 177.93 178.18 1xw6 h ALA 15 N -0.12 1.69 -0.01 5.26 0.00 -1.84 -1.80 119.26 122.44 1xw6 h ALA 15 Ca -0.00 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1xw6 h ALA 15 Cb 0.63 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1xw6 h ALA 15 CO -0.11 0.24 -0.00 0.82 0.00 0.00 0.00 179.25 180.19 1xw6 h ILE 16 N 0.25 1.32 -0.36 0.00 2.04 -1.67 -0.80 117.51 118.28 1xw6 h ILE 16 Ca 0.06 -0.93 0.04 0.00 1.00 0.00 0.00 64.86 65.03 1xw6 h ILE 16 Cb 0.16 1.93 -0.04 0.00 -0.74 0.00 0.00 36.82 38.14 1xw6 h ILE 16 CO 0.00 0.24 0.13 0.03 0.00 0.00 0.00 178.15 178.56 1xw6 h ARG 17 N -0.38 0.28 -0.49 2.37 3.08 -0.70 1.00 114.38 119.53 1xw6 h ARG 17 Ca 0.00 -0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.07 1xw6 h ARG 17 Cb 0.40 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.35 1xw6 h ARG 17 CO 0.00 0.18 0.27 -0.07 -1.07 0.00 0.00 179.97 179.29 1xw6 h LEU 18 N 0.28 0.42 -0.48 3.04 3.38 -1.31 -0.91 115.31 119.73 1xw6 h LEU 18 Ca 0.16 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 1xw6 h LEU 18 Cb 0.13 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1xw6 h LEU 18 CO -0.16 0.29 0.09 0.25 0.09 0.00 0.00 178.44 179.00 1xw6 h LEU 19 N 0.54 0.75 -1.44 1.67 5.85 -0.66 -0.42 115.31 121.61 1xw6 h LEU 19 Ca 0.21 -0.25 0.01 0.00 0.84 0.00 0.00 57.88 58.69 1xw6 h LEU 19 Cb 0.07 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.87 1xw6 h LEU 19 CO -0.12 0.82 0.39 -0.07 -0.34 0.00 0.00 178.44 179.11 1xw6 h LEU 20 N 0.66 0.65 -0.04 2.25 3.38 -0.45 -1.06 115.31 120.71 1xw6 h LEU 20 Ca 0.15 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 58.03 1xw6 h LEU 20 Cb 0.38 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1xw6 h LEU 20 CO 0.01 0.47 -0.27 -0.33 0.09 0.00 0.00 178.44 178.41 1xw6 h GLU 21 N 0.76 0.25 -0.70 1.13 4.39 -0.82 0.64 114.58 120.24 1xw6 h GLU 21 Ca 0.22 -0.22 -0.00 0.00 0.34 0.00 0.00 59.36 59.70 1xw6 h GLU 21 Cb -0.05 0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.61 1xw6 h GLU 21 CO -0.05 0.88 0.43 -0.92 -1.16 0.00 0.00 179.01 178.19 1xw6 h TYR 22 N -0.30 0.90 -0.00 4.33 3.20 -0.88 -2.08 116.97 122.14 1xw6 h TYR 22 Ca -0.02 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1xw6 h TYR 22 Cb 0.94 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 38.91 1xw6 h TYR 22 CO 0.14 0.60 -0.06 0.25 -1.64 0.00 0.00 178.16 177.45 1xw6 n THR 23 N -4.40 0.00 -3.26 1.81 -2.24 -0.42 -4.93 114.28 100.84 1xw6 n THR 23 Ca 0.07 -0.06 -0.16 0.00 -2.27 0.00 0.00 64.05 61.63 1xw6 n THR 23 Cb 0.06 -0.17 0.07 0.00 -2.10 0.00 0.00 70.33 68.19 1xw6 n THR 23 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1xw6 n ASP 24 N -0.90 -3.77 -4.81 3.42 2.03 -0.78 -4.99 116.55 106.75 1xw6 n ASP 24 Ca 0.17 -0.46 -0.36 0.00 0.52 0.00 0.00 54.79 54.66 1xw6 n ASP 24 Cb 0.25 -4.15 -0.06 0.00 -0.72 0.00 0.00 41.12 36.43 1xw6 n ASP 24 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1xw6 s SER 25 N -3.67 7.12 -0.45 1.67 0.01 0.20 -5.02 113.70 113.55 1xw6 s SER 25 Ca 0.24 1.59 -0.23 0.00 1.31 0.00 0.00 55.95 58.86 1xw6 s SER 25 Cb -0.10 -2.49 0.03 0.00 0.21 0.00 0.00 66.02 63.66 1xw6 s SER 25 CO 0.58 -0.08 0.78 -0.55 0.41 0.00 0.00 173.24 174.38 1xw6 s SER 26 N -1.78 6.41 0.13 2.44 0.15 -1.26 -4.86 113.70 114.93 1xw6 s SER 26 Ca 0.49 -0.12 -0.12 0.00 0.70 0.00 0.00 55.95 56.90 1xw6 s SER 26 Cb -0.16 -2.38 0.01 0.00 -1.71 0.00 0.00 66.02 61.78 1xw6 s SER 26 CO 0.21 -0.92 0.33 -0.72 1.20 0.00 0.00 173.24 173.33 1xw6 s TYR 27 N 3.29 0.04 0.37 3.44 1.13 -1.26 -3.12 117.35 121.24 1xw6 s TYR 27 Ca 0.30 -0.41 0.06 0.00 -1.41 0.00 0.00 57.07 55.61 1xw6 s TYR 27 Cb -0.12 0.11 -0.07 0.00 -1.10 0.00 0.00 41.96 40.78 1xw6 s TYR 27 CO 0.23 -0.68 0.03 -1.21 -2.51 0.00 0.00 175.55 171.40 1xw6 s GLU 28 N -3.86 1.81 -0.09 -3.49 2.02 0.85 -4.94 118.70 111.01 1xw6 s GLU 28 Ca 0.07 -2.01 0.00 0.00 0.02 0.00 0.00 54.97 53.05 1xw6 s GLU 28 Cb 0.03 -1.29 0.02 0.00 0.10 0.00 0.00 34.13 32.98 1xw6 s GLU 28 CO -0.08 -0.10 -0.07 -1.21 0.02 0.00 0.00 175.26 173.81 1xw6 s GLU 29 N -3.79 1.36 -0.50 1.61 2.02 -1.26 -1.12 118.70 117.02 1xw6 s GLU 29 Ca 0.35 -0.23 -0.19 0.00 0.02 0.00 0.00 54.97 54.93 1xw6 s GLU 29 Cb 0.09 -1.36 0.06 0.00 0.10 0.00 0.00 34.13 33.02 1xw6 s GLU 29 CO 0.17 -0.17 0.59 0.21 0.02 0.00 0.00 175.26 176.07 1xw6 s LYS 30 N 1.37 3.10 -0.11 1.61 2.36 0.17 -4.94 119.74 123.30 1xw6 s LYS 30 Ca -0.02 -0.95 -0.15 0.00 -2.55 0.00 0.00 55.97 52.30 1xw6 s LYS 30 Cb -0.14 -4.10 -0.05 0.00 -1.05 0.00 0.00 37.83 32.50 1xw6 s LYS 30 CO -0.04 -1.18 0.36 0.15 1.55 0.00 0.00 175.35 176.19 1xw6 s LYS 31 N 2.47 4.17 -0.12 4.03 1.02 -1.26 -2.21 119.74 127.83 1xw6 s LYS 31 Ca 0.13 0.24 -0.02 0.00 0.02 0.00 0.00 55.97 56.35 1xw6 s LYS 31 Cb -0.20 -3.37 -0.03 0.00 -0.52 0.00 0.00 37.83 33.71 1xw6 s LYS 31 CO 0.11 0.34 -0.05 0.71 -0.92 0.00 0.00 175.35 175.54 1xw6 s TYR 32 N 0.12 3.00 -0.14 3.18 1.51 -0.47 -4.90 117.35 119.65 1xw6 s TYR 32 Ca 0.20 -0.16 -0.05 0.00 -1.01 0.00 0.00 57.07 56.06 1xw6 s TYR 32 Cb -0.14 -1.86 -0.04 0.00 -0.11 0.00 0.00 41.96 39.82 1xw6 s TYR 32 CO 0.08 0.13 0.03 0.99 -1.11 0.00 0.00 175.55 175.66 1xw6 s THR 33 N -0.15 4.51 0.01 -0.71 2.01 -1.26 -0.40 115.64 119.65 1xw6 s THR 33 Ca 0.03 -0.15 -0.14 0.00 0.31 0.00 0.00 61.69 61.73 1xw6 s THR 33 Cb -0.13 -2.98 -0.06 0.00 0.01 0.00 0.00 72.50 69.35 1xw6 s THR 33 CO 0.03 0.53 0.41 -0.32 -0.69 0.00 0.00 174.62 174.57 1xw6 s MET 34 N -0.14 3.91 0.72 4.92 1.75 -1.26 -4.66 119.30 124.54 1xw6 s MET 34 Ca 0.06 0.40 -0.12 0.00 -1.25 0.00 0.00 55.69 54.78 1xw6 s MET 34 Cb -0.12 -3.20 0.03 0.00 2.84 0.00 0.00 34.83 34.38 1xw6 s MET 34 CO 0.02 0.68 1.10 0.20 -0.65 0.00 0.00 175.02 176.36 1xw6 s GLY 35 N -1.13 1.86 1.00 2.11 0.00 0.70 -4.87 107.32 106.99 1xw6 s GLY 35 Ca 0.25 0.36 -0.15 0.00 0.00 0.00 0.00 44.72 45.18 1xw6 s GLY 35 CO 0.14 0.71 1.16 0.99 0.00 0.00 0.00 173.10 176.09 1xw6 s ASP 36 N -3.10 2.72 0.94 1.64 -0.00 -1.26 -3.76 116.67 113.84 1xw6 s ASP 36 Ca 0.63 0.79 -0.11 0.00 -0.00 0.00 0.00 52.55 53.86 1xw6 s ASP 36 Cb -0.18 -1.21 0.16 0.00 -0.00 0.00 0.00 42.92 41.68 1xw6 s ASP 36 CO 0.50 -3.02 1.11 0.00 -0.00 0.00 0.00 175.17 173.76 1xw6 s ALA 37 N -3.28 1.24 -0.83 5.23 0.00 -1.26 -1.63 121.76 121.23 1xw6 s ALA 37 Ca 0.67 0.31 0.26 0.00 0.00 0.00 0.00 51.96 53.20 1xw6 s ALA 37 Cb -0.12 -3.35 0.67 0.00 0.00 0.00 0.00 23.12 20.32 1xw6 s ALA 37 CO 0.54 -2.75 1.56 -0.35 0.00 0.00 0.00 175.76 174.76 1xw6 n PRO 38 N -4.20 0.15 -0.02 0.00 -0.04 -1.26 -4.77 135.00 124.85 1xw6 n PRO 38 Ca 0.09 0.07 -0.17 0.00 -0.04 0.00 0.00 63.50 63.45 1xw6 n PRO 38 Cb 0.53 -1.62 -0.08 0.00 -0.04 0.00 0.00 33.50 32.29 1xw6 n PRO 38 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1xw6 h ASP 39 N 0.00 0.88 -5.75 3.54 3.45 -1.92 -3.48 116.42 113.14 1xw6 h ASP 39 Ca 0.00 -0.64 -0.34 0.00 0.43 0.00 0.00 57.03 56.48 1xw6 h ASP 39 Cb 0.63 -0.26 0.14 0.00 -0.56 0.00 0.00 39.33 39.28 1xw6 h ASP 39 CO 0.00 1.37 -0.80 -1.22 -1.57 0.00 0.00 179.24 177.02 1xw6 n TYR 40 N -4.00 -2.15 -1.69 4.55 4.01 -0.64 -4.83 117.16 112.41 1xw6 n TYR 40 Ca -0.08 0.89 -0.53 0.00 -0.16 0.00 0.00 57.90 58.02 1xw6 n TYR 40 Cb 0.72 -4.71 -0.06 0.00 -0.31 0.00 0.00 39.34 34.98 1xw6 n TYR 40 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1xw6 n ASP 41 N -3.11 2.69 -0.57 7.72 2.03 -1.25 -4.49 116.55 119.57 1xw6 n ASP 41 Ca -0.25 1.05 0.06 0.00 0.52 0.00 0.00 54.79 56.16 1xw6 n ASP 41 Cb 0.66 -1.24 0.15 0.00 -0.72 0.00 0.00 41.12 39.98 1xw6 n ASP 41 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1xw6 n ARG 42 N 5.32 2.81 0.32 -0.67 1.74 -1.26 -0.22 116.66 124.71 1xw6 n ARG 42 Ca 0.24 -2.19 0.20 0.00 -0.77 0.00 0.00 57.85 55.34 1xw6 n ARG 42 Cb 0.20 -1.38 1.11 0.00 -1.02 0.00 0.00 32.46 31.37 1xw6 n ARG 42 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1xw6 h SER 43 N 1.54 0.00 -0.11 0.55 4.64 -1.90 -0.89 113.55 117.37 1xw6 h SER 43 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 1xw6 h SER 43 Cb 0.88 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.96 1xw6 h SER 43 CO 0.05 0.01 -0.07 -0.61 -0.87 0.00 0.00 176.83 175.34 1xw6 h GLN 44 N 0.00 0.40 0.00 4.77 4.15 -1.84 -1.62 115.11 120.97 1xw6 h GLN 44 Ca -0.00 -0.09 -0.18 0.00 0.77 0.00 0.00 58.65 59.15 1xw6 h GLN 44 Cb 0.05 -0.06 -0.03 0.00 0.21 0.00 0.00 27.48 27.65 1xw6 h GLN 44 CO 0.00 0.49 -1.02 2.35 -1.93 0.00 0.00 178.83 178.72 1xw6 h TRP 45 N 0.38 0.00 -0.88 3.99 -0.00 -1.65 -3.40 115.95 114.40 1xw6 h TRP 45 Ca 0.08 0.00 0.13 0.00 -0.00 0.00 0.00 58.89 59.10 1xw6 h TRP 45 Cb 0.37 0.00 -0.07 0.00 -0.00 0.00 0.00 29.16 29.46 1xw6 h TRP 45 CO 0.01 1.23 0.57 -0.07 -0.00 0.00 0.00 178.44 180.18 1xw6 h LEU 46 N -1.00 0.68 0.00 0.65 3.38 -1.20 0.36 115.31 118.17 1xw6 h LEU 46 Ca -0.26 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.74 1xw6 h LEU 46 Cb 1.15 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1xw6 h LEU 46 CO -0.16 0.36 0.00 0.59 0.09 0.00 0.00 178.44 179.32 1xw6 n ASN 47 N -4.55 0.00 0.00 -0.43 4.13 -0.61 -3.11 115.26 110.68 1xw6 n ASN 47 Ca 0.17 -0.61 0.00 0.00 1.68 0.00 0.00 54.58 55.81 1xw6 n ASN 47 Cb 0.43 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.67 1xw6 n ASN 47 CO 0.00 0.00 0.00 1.21 0.28 0.00 0.00 177.26 178.75 1xw6 n GLU 48 N -0.97 3.00 -0.29 3.52 2.13 -0.31 -4.89 120.64 122.83 1xw6 n GLU 48 Ca 0.13 0.00 0.08 0.00 0.66 0.00 0.00 57.16 58.03 1xw6 n GLU 48 Cb 0.06 -0.31 0.20 0.00 0.27 0.00 0.00 31.44 31.65 1xw6 n GLU 48 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 1xw6 h LYS 49 N 0.00 0.07 -0.64 5.31 3.64 -0.30 -0.80 116.57 123.85 1xw6 h LYS 49 Ca 0.00 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1xw6 h LYS 49 Cb 0.00 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 1xw6 h LYS 49 CO 0.00 0.05 0.00 1.19 -2.27 0.00 0.00 179.45 178.42 1xw6 n PHE 50 N -5.41 0.95 -0.36 1.91 3.01 -1.26 -4.20 117.46 112.09 1xw6 n PHE 50 Ca 0.17 -0.44 0.06 0.00 1.01 0.00 0.00 57.45 58.24 1xw6 n PHE 50 Cb 0.56 -0.05 0.16 0.00 -0.01 0.00 0.00 39.48 40.14 1xw6 n PHE 50 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1xw6 n LYS 51 N 1.27 2.86 0.00 -1.08 5.02 -0.31 -4.61 118.16 121.31 1xw6 n LYS 51 Ca 0.21 -2.18 0.09 0.00 -2.02 0.00 0.00 58.31 54.41 1xw6 n LYS 51 Cb 0.59 -1.37 0.01 0.00 -0.02 0.00 0.00 35.03 34.24 1xw6 n LYS 51 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1xw6 n LEU 52 N 0.13 1.87 -0.00 -0.35 4.77 -1.22 -4.99 117.00 117.21 1xw6 n LEU 52 Ca 0.13 -0.80 -0.00 0.00 -0.03 0.00 0.00 56.01 55.30 1xw6 n LEU 52 Cb 0.51 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.60 1xw6 n LEU 52 CO 0.08 0.35 -0.00 0.61 -1.33 0.00 0.00 177.39 177.10 1xw6 n GLY 53 N 1.20 0.39 3.74 -0.72 0.00 -1.26 -5.03 105.19 103.51 1xw6 n GLY 53 Ca 0.08 -1.01 -0.40 0.00 0.00 0.00 0.00 46.02 44.69 1xw6 n GLY 53 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xw6 s LEU 54 N -0.01 4.44 0.05 0.99 1.43 -1.26 -4.88 118.68 119.44 1xw6 s LEU 54 Ca 0.00 1.48 -0.24 0.00 -1.03 0.00 0.00 54.13 54.35 1xw6 s LEU 54 Cb 0.00 -3.28 -0.16 0.00 0.03 0.00 0.00 46.19 42.78 1xw6 s LEU 54 CO 0.00 -0.01 1.57 0.44 0.23 0.00 0.00 176.35 178.58 1xw6 h ASP 55 N 5.76 0.03 -3.68 2.29 3.32 -1.96 -3.33 116.42 118.85 1xw6 h ASP 55 Ca -0.43 -0.18 -0.63 0.00 0.02 0.00 0.00 57.03 55.81 1xw6 h ASP 55 Cb 1.21 -0.01 -0.41 0.00 0.22 0.00 0.00 39.33 40.33 1xw6 h ASP 55 CO 0.71 0.20 -0.60 -0.36 -1.72 0.00 0.00 179.24 177.47 1xw6 s PHE 56 N -5.47 3.36 -0.39 4.55 0.08 -1.26 -5.07 117.98 113.77 1xw6 s PHE 56 Ca -0.14 -3.25 -0.43 0.00 0.12 0.00 0.00 56.93 53.23 1xw6 s PHE 56 Cb 0.05 -2.73 -0.18 0.00 -0.57 0.00 0.00 43.02 39.59 1xw6 s PHE 56 CO 0.67 -0.64 1.72 -2.30 -0.10 0.00 0.00 175.22 174.57 1xw6 n PRO 57 N 2.51 0.59 -3.80 0.24 -0.02 -1.25 -4.86 135.00 128.41 1xw6 n PRO 57 Ca 0.13 0.21 -0.07 0.00 -2.02 0.00 0.00 63.50 61.75 1xw6 n PRO 57 Cb 0.34 -1.82 -0.02 0.00 -0.02 0.00 0.00 33.50 31.97 1xw6 n PRO 57 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1xw6 s ASN 58 N 3.59 -0.28 -0.07 2.55 3.84 -1.26 -5.10 114.94 118.21 1xw6 s ASN 58 Ca 1.03 -0.52 0.03 0.00 0.21 0.00 0.00 52.86 53.61 1xw6 s ASN 58 Cb -1.27 0.68 0.01 0.00 -0.55 0.00 0.00 41.25 40.11 1xw6 s ASN 58 CO 0.72 -1.24 -0.17 -0.76 -2.79 0.00 0.00 177.10 172.87 1xw6 s LEU 59 N -2.90 1.82 0.67 3.21 1.43 -1.26 -4.06 118.68 117.59 1xw6 s LEU 59 Ca 0.10 -0.38 -0.11 0.00 -1.03 0.00 0.00 54.13 52.71 1xw6 s LEU 59 Cb -0.05 -1.02 -0.01 0.00 0.03 0.00 0.00 46.19 45.14 1xw6 s LEU 59 CO 0.04 0.09 1.06 -2.16 0.23 0.00 0.00 176.35 175.62 1xw6 s PRO 60 N 0.45 3.16 0.08 1.29 0.04 -1.26 -4.94 135.00 133.82 1xw6 s PRO 60 Ca -0.14 0.70 0.02 0.00 0.04 0.00 0.00 61.00 61.63 1xw6 s PRO 60 Cb -0.16 -2.04 -0.03 0.00 0.04 0.00 0.00 34.50 32.31 1xw6 s PRO 60 CO 0.05 -0.87 -0.08 1.52 0.04 0.00 0.00 177.00 177.66 1xw6 s TYR 61 N -3.20 0.87 -0.08 0.56 -0.85 -0.66 -3.82 117.35 110.17 1xw6 s TYR 61 Ca 0.57 -0.72 -0.00 0.00 -0.52 0.00 0.00 57.07 56.40 1xw6 s TYR 61 Cb -0.12 -0.50 0.02 0.00 0.38 0.00 0.00 41.96 41.75 1xw6 s TYR 61 CO 0.54 -0.09 -0.04 -1.17 -1.52 0.00 0.00 175.55 173.27 1xw6 s LEU 62 N -2.43 0.99 -0.26 -3.49 2.96 0.26 -1.20 118.68 115.51 1xw6 s LEU 62 Ca 0.03 -0.17 -0.06 0.00 -0.22 0.00 0.00 54.13 53.71 1xw6 s LEU 62 Cb -0.02 -0.58 -0.01 0.00 0.50 0.00 0.00 46.19 46.08 1xw6 s LEU 62 CO -0.02 -0.13 0.05 -0.63 -1.32 0.00 0.00 176.35 174.30 1xw6 s ILE 63 N 1.58 3.92 -0.58 6.68 1.01 -0.13 -0.76 121.20 132.91 1xw6 s ILE 63 Ca 0.00 -0.48 0.05 0.00 0.00 0.00 0.00 60.65 60.22 1xw6 s ILE 63 Cb -0.13 -2.90 0.17 0.00 0.01 0.00 0.00 42.46 39.60 1xw6 s ILE 63 CO -0.04 0.25 0.43 -0.62 0.00 0.00 0.00 174.94 174.95 1xw6 s ASP 64 N 1.53 3.37 1.55 3.58 2.15 0.92 -1.21 116.67 128.55 1xw6 s ASP 64 Ca 0.05 -3.51 0.00 0.00 0.43 0.00 0.00 52.55 49.51 1xw6 s ASP 64 Cb -0.16 -1.12 0.00 0.00 -0.30 0.00 0.00 42.92 41.34 1xw6 s ASP 64 CO 0.01 -0.12 0.00 0.61 -0.17 0.00 0.00 175.17 175.50 1xw6 n GLY 65 N 2.36 3.32 0.25 2.66 0.00 -1.26 -2.10 105.19 110.41 1xw6 n GLY 65 Ca 0.24 -0.15 0.13 0.00 0.00 0.00 0.00 46.02 46.25 1xw6 n GLY 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xw6 h ALA 66 N -0.55 1.01 -2.09 4.61 0.00 -2.01 -3.43 119.26 116.81 1xw6 h ALA 66 Ca 0.00 -0.11 -0.60 0.00 0.00 0.00 0.00 54.91 54.21 1xw6 h ALA 66 Cb 0.00 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 17.68 1xw6 h ALA 66 CO 0.00 0.15 0.55 -1.01 0.00 0.00 0.00 179.25 178.94 1xw6 s HIS 67 N -3.64 3.12 -0.29 0.00 3.76 -0.89 -5.02 115.29 112.32 1xw6 s HIS 67 Ca 0.01 0.79 -0.02 0.00 -0.15 0.00 0.00 55.06 55.69 1xw6 s HIS 67 Cb 0.09 -3.53 0.04 0.00 1.11 0.00 0.00 32.58 30.29 1xw6 s HIS 67 CO 0.60 -0.76 -0.00 0.15 -0.85 0.00 0.00 174.74 173.88 1xw6 s LYS 68 N 3.34 2.59 -0.02 1.40 3.01 -1.26 -0.05 119.74 128.74 1xw6 s LYS 68 Ca 0.37 -1.16 0.08 0.00 -1.01 0.00 0.00 55.97 54.25 1xw6 s LYS 68 Cb -0.13 -3.16 -0.02 0.00 -1.01 0.00 0.00 37.83 33.51 1xw6 s LYS 68 CO 0.17 -0.55 -0.26 0.42 0.51 0.00 0.00 175.35 175.64 1xw6 s ILE 69 N 1.30 2.08 0.52 2.17 1.01 0.06 -4.78 121.20 123.55 1xw6 s ILE 69 Ca -0.03 -1.11 0.01 0.00 0.00 0.00 0.00 60.65 59.52 1xw6 s ILE 69 Cb -0.19 -1.72 -0.00 0.00 0.01 0.00 0.00 42.46 40.56 1xw6 s ILE 69 CO -0.01 0.57 0.02 0.42 0.00 0.00 0.00 174.94 175.94 1xw6 s THR 70 N -0.62 0.95 -0.01 2.92 -4.23 -1.26 -0.57 115.64 112.82 1xw6 s THR 70 Ca 0.10 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.60 1xw6 s THR 70 Cb -0.10 -2.05 0.00 0.00 1.34 0.00 0.00 72.50 71.70 1xw6 s THR 70 CO -0.01 0.00 0.03 0.00 -0.54 0.00 0.00 174.62 174.10 1xw6 n GLN 71 N -1.27 -1.82 -0.31 3.99 1.13 -1.25 -4.33 117.38 113.52 1xw6 n GLN 71 Ca -0.20 1.65 0.08 0.00 -1.94 0.00 0.00 57.00 56.60 1xw6 n GLN 71 Cb 0.67 -2.15 0.20 0.00 0.11 0.00 0.00 30.24 29.06 1xw6 n GLN 71 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1xw6 h SER 72 N 1.52 -0.52 -0.00 1.08 4.64 -1.91 0.70 113.55 119.06 1xw6 h SER 72 Ca -0.06 0.25 -0.06 0.00 -0.47 0.00 0.00 61.79 61.45 1xw6 h SER 72 Cb 0.13 0.45 -0.01 0.00 -0.31 0.00 0.00 62.40 62.66 1xw6 h SER 72 CO 0.00 -0.27 -0.15 0.78 -0.87 0.00 0.00 176.83 176.32 1xw6 h ASN 73 N 0.05 0.29 -0.41 4.97 2.35 -1.95 -1.85 115.58 119.03 1xw6 h ASN 73 Ca 0.49 -0.07 -0.14 0.00 -0.55 0.00 0.00 56.30 56.03 1xw6 h ASN 73 Cb 0.89 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 39.18 1xw6 h ASN 73 CO -0.83 0.47 -0.30 0.00 -1.65 0.00 0.00 177.43 175.13 1xw6 h ALA 74 N 1.56 0.59 -0.47 -0.83 0.00 -1.12 -1.83 119.26 117.16 1xw6 h ALA 74 Ca 0.06 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 1xw6 h ALA 74 Cb 0.44 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1xw6 h ALA 74 CO 0.03 0.64 0.23 0.82 0.00 0.00 0.00 179.25 180.96 1xw6 h ILE 75 N 0.76 1.19 -0.55 0.00 2.04 -0.90 -0.78 117.51 119.26 1xw6 h ILE 75 Ca 0.08 -0.52 -0.00 0.00 1.00 0.00 0.00 64.86 65.41 1xw6 h ILE 75 Cb 0.88 0.67 -0.03 0.00 -0.74 0.00 0.00 36.82 37.60 1xw6 h ILE 75 CO 0.08 0.20 0.34 -0.07 0.00 0.00 0.00 178.15 178.71 1xw6 h LEU 76 N 0.62 0.65 -0.71 1.44 3.38 -1.29 -2.09 115.31 117.31 1xw6 h LEU 76 Ca 0.16 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 1xw6 h LEU 76 Cb 0.12 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 1xw6 h LEU 76 CO -0.02 0.51 0.32 0.00 0.09 0.00 0.00 178.44 179.34 1xw6 h TYR 78 N 1.00 0.02 -0.17 0.00 3.20 -0.82 0.27 116.97 120.47 1xw6 h TYR 78 Ca 0.24 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.09 1xw6 h TYR 78 Cb 0.15 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.41 1xw6 h TYR 78 CO 0.01 0.01 -0.01 0.82 -1.64 0.00 0.00 178.16 177.35 1xw6 h ILE 79 N 0.04 1.26 -0.96 1.81 2.04 -1.32 -3.15 117.51 117.23 1xw6 h ILE 79 Ca 0.03 -0.88 0.09 0.00 1.00 0.00 0.00 64.86 65.11 1xw6 h ILE 79 Cb 0.03 1.50 -0.07 0.00 -0.74 0.00 0.00 36.82 37.54 1xw6 h ILE 79 CO -0.05 0.26 0.62 0.00 0.00 0.00 0.00 178.15 178.98 1xw6 h ALA 80 N 0.76 1.53 -0.51 1.87 0.00 -0.79 -1.93 119.26 120.19 1xw6 h ALA 80 Ca 0.05 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1xw6 h ALA 80 Cb 0.40 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1xw6 h ALA 80 CO 0.01 0.28 0.33 0.00 0.00 0.00 0.00 179.25 179.87 1xw6 h ARG 81 N 1.01 0.68 0.00 0.00 3.08 -0.90 -0.92 114.38 117.34 1xw6 h ARG 81 Ca 0.44 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.43 1xw6 h ARG 81 Cb 0.35 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.25 1xw6 h ARG 81 CO -0.20 0.46 -0.09 0.87 -1.07 0.00 0.00 179.97 179.93 1xw6 h LYS 82 N 0.70 0.00 0.00 0.04 1.57 -1.36 -3.23 116.57 114.28 1xw6 h LYS 82 Ca 0.19 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.96 1xw6 h LYS 82 Cb -0.07 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.22 1xw6 h LYS 82 CO -0.04 0.09 -0.35 0.72 -0.57 0.00 0.00 179.45 179.31 1xw6 n HIS 83 N -3.22 0.00 -4.04 -1.35 8.25 -0.76 -5.00 115.22 109.10 1xw6 n HIS 83 Ca 0.01 -1.22 -0.28 0.00 -0.26 0.00 0.00 57.72 55.97 1xw6 n HIS 83 Cb 0.37 -0.20 -0.04 0.00 1.12 0.00 0.00 29.99 31.24 1xw6 n HIS 83 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1xw6 n ASN 84 N -1.12 -0.27 -0.81 0.41 4.13 -0.84 -4.89 115.26 111.86 1xw6 n ASN 84 Ca 0.17 -1.09 0.02 0.00 1.68 0.00 0.00 54.58 55.36 1xw6 n ASN 84 Cb 0.69 -2.64 0.20 0.00 -1.54 0.00 0.00 39.78 36.50 1xw6 n ASN 84 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1xw6 n LEU 85 N -4.46 3.35 -0.00 3.41 4.77 -0.42 -4.63 117.00 119.01 1xw6 n LEU 85 Ca -0.30 -3.75 0.10 0.00 -0.03 0.00 0.00 56.01 52.03 1xw6 n LEU 85 Cb 0.68 -0.57 -0.14 0.00 -2.33 0.00 0.00 43.42 41.07 1xw6 n LEU 85 CO 0.77 1.25 -0.32 0.00 -1.33 0.00 0.00 177.39 177.77 1xw6 n GLY 87 N 1.41 2.70 0.62 0.00 0.00 -1.26 -4.66 105.19 104.00 1xw6 n GLY 87 Ca 0.01 -1.58 -0.10 0.00 0.00 0.00 0.00 46.02 44.35 1xw6 n GLY 87 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1xw6 n GLU 88 N 1.13 0.25 -1.43 1.61 1.02 -1.26 -4.80 120.64 117.15 1xw6 n GLU 88 Ca 0.00 0.11 -0.29 0.00 -0.02 0.00 0.00 57.16 56.95 1xw6 n GLU 88 Cb 0.00 -0.93 0.12 0.00 -0.02 0.00 0.00 31.44 30.61 1xw6 n GLU 88 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1xw6 s THR 89 N -2.30 2.55 0.15 2.62 -4.23 -1.26 -4.89 115.64 108.28 1xw6 s THR 89 Ca -0.16 0.18 -0.13 0.00 -1.18 0.00 0.00 61.69 60.40 1xw6 s THR 89 Cb 0.05 -2.84 0.03 0.00 1.34 0.00 0.00 72.50 71.07 1xw6 s THR 89 CO 0.21 -0.23 1.64 -0.08 -0.54 0.00 0.00 174.62 175.62 1xw6 h GLU 90 N -1.40 0.83 -0.83 3.99 4.57 -1.99 -2.46 114.58 117.28 1xw6 h GLU 90 Ca -0.49 -0.21 0.00 0.00 -1.18 0.00 0.00 59.36 57.48 1xw6 h GLU 90 Cb 1.30 -0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 29.75 1xw6 h GLU 90 CO 0.59 0.81 0.54 0.93 -1.18 0.00 0.00 179.01 180.70 1xw6 h GLU 91 N 0.71 1.11 -0.32 1.92 4.39 -1.96 -1.73 114.58 118.69 1xw6 h GLU 91 Ca 0.16 -0.08 -0.04 0.00 0.34 0.00 0.00 59.36 59.74 1xw6 h GLU 91 Cb 0.37 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 1xw6 h GLU 91 CO 0.01 0.75 0.05 0.93 -1.16 0.00 0.00 179.01 179.58 1xw6 h GLU 92 N 1.13 0.53 -0.88 2.33 5.08 -1.73 -2.49 114.58 118.55 1xw6 h GLU 92 Ca 0.30 -0.14 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1xw6 h GLU 92 Cb -0.10 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.04 1xw6 h GLU 92 CO -0.06 0.62 0.53 0.87 -1.00 0.00 0.00 179.01 179.97 1xw6 h LYS 93 N 0.36 1.19 -0.34 2.33 1.57 -1.16 0.49 116.57 121.01 1xw6 h LYS 93 Ca 0.10 -0.10 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 1xw6 h LYS 93 Cb 0.35 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 1xw6 h LYS 93 CO 0.01 0.83 0.07 0.82 -0.57 0.00 0.00 179.45 180.60 1xw6 h ILE 94 N 1.21 1.23 -0.73 1.86 2.04 -1.29 -0.91 117.51 120.91 1xw6 h ILE 94 Ca 0.32 -0.79 -0.03 0.00 1.00 0.00 0.00 64.86 65.36 1xw6 h ILE 94 Cb -0.06 1.10 -0.03 0.00 -0.74 0.00 0.00 36.82 37.09 1xw6 h ILE 94 CO -0.06 0.26 0.34 0.03 0.00 0.00 0.00 178.15 178.72 1xw6 h ARG 95 N 0.39 1.06 -0.19 2.37 3.08 -1.02 -1.83 114.38 118.24 1xw6 h ARG 95 Ca 0.10 -0.16 -0.00 0.00 0.07 0.00 0.00 59.98 59.99 1xw6 h ARG 95 Cb 0.33 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 1xw6 h ARG 95 CO 0.00 0.84 0.10 0.28 -1.07 0.00 0.00 179.97 180.12 1xw6 h VAL 96 N 1.03 1.10 -0.05 2.04 2.07 -0.72 -1.39 116.25 120.32 1xw6 h VAL 96 Ca 0.25 -0.25 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 1xw6 h VAL 96 Cb 0.13 0.93 -0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1xw6 h VAL 96 CO -0.03 0.09 0.03 0.44 0.02 0.00 0.00 177.57 178.12 1xw6 h ASP 97 N 0.20 0.06 -0.17 0.57 3.32 -1.03 0.35 116.42 119.73 1xw6 h ASP 97 Ca 0.07 -0.06 0.03 0.00 0.02 0.00 0.00 57.03 57.08 1xw6 h ASP 97 Cb 0.05 -0.02 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 1xw6 h ASP 97 CO -0.01 0.11 0.00 0.40 -1.72 0.00 0.00 179.24 178.02 1xw6 h ILE 98 N 0.01 0.89 -0.65 0.35 2.04 -1.29 -2.85 117.51 116.01 1xw6 h ILE 98 Ca 0.02 -0.02 -0.07 0.00 1.00 0.00 0.00 64.86 65.78 1xw6 h ILE 98 Cb 0.06 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 36.93 1xw6 h ILE 98 CO -0.00 0.01 0.12 -0.07 0.00 0.00 0.00 178.15 178.20 1xw6 h LEU 99 N 0.06 1.00 -0.95 1.44 3.38 -1.13 0.28 115.31 119.40 1xw6 h LEU 99 Ca 0.08 -0.23 0.10 0.00 0.09 0.00 0.00 57.88 57.92 1xw6 h LEU 99 Cb 0.09 -0.27 -0.08 0.00 0.09 0.00 0.00 40.66 40.50 1xw6 h LEU 99 CO -0.13 0.99 0.59 -0.08 0.09 0.00 0.00 178.44 179.90 1xw6 h GLU 100 N 0.99 0.96 0.14 1.13 4.81 -0.75 0.58 114.58 122.43 1xw6 h GLU 100 Ca 0.20 -0.06 -0.33 0.00 -0.13 0.00 0.00 59.36 59.04 1xw6 h GLU 100 Cb 0.41 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 1xw6 h GLU 100 CO 0.01 0.63 -1.69 -0.91 -0.73 0.00 0.00 179.01 176.33 1xw6 h ASN 101 N 0.99 0.45 0.01 1.04 2.35 -1.29 -3.27 115.58 115.85 1xw6 h ASN 101 Ca 0.45 -0.70 -0.00 0.00 -0.55 0.00 0.00 56.30 55.50 1xw6 h ASN 101 Cb 0.35 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.58 1xw6 h ASN 101 CO -0.23 1.59 -0.01 -0.61 -1.65 0.00 0.00 177.43 176.53 1xw6 h GLN 102 N 0.08 -0.01 -0.67 0.81 5.75 -0.08 -1.87 115.11 119.12 1xw6 h GLN 102 Ca -0.31 0.00 0.04 0.00 -0.15 0.00 0.00 58.65 58.23 1xw6 h GLN 102 Cb 2.05 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 30.56 1xw6 h GLN 102 CO 0.15 -0.00 0.40 1.79 -2.65 0.00 0.00 178.83 178.52 1xw6 h THR 103 N -0.02 1.05 -0.81 2.39 1.35 -1.05 -1.07 112.91 114.74 1xw6 h THR 103 Ca -0.00 -0.26 0.00 0.00 -0.55 0.00 0.00 66.41 65.60 1xw6 h THR 103 Cb 0.02 0.21 -0.04 0.00 -1.73 0.00 0.00 68.15 66.61 1xw6 h THR 103 CO 0.00 0.14 0.51 -0.03 -0.25 0.00 0.00 175.52 175.90 1xw6 h MET 104 N 0.77 1.09 0.21 4.72 1.85 -1.58 0.55 114.93 122.54 1xw6 h MET 104 Ca 0.28 -0.08 -0.01 0.00 -0.61 0.00 0.00 59.70 59.28 1xw6 h MET 104 Cb 0.07 -0.24 -0.00 0.00 0.43 0.00 0.00 31.60 31.86 1xw6 h MET 104 CO -0.13 0.74 -0.13 -0.44 -0.40 0.00 0.00 176.91 176.55 1xw6 h ASP 105 N 1.11 -0.33 -0.35 1.39 5.19 -0.58 0.19 116.42 123.04 1xw6 h ASP 105 Ca 0.29 0.02 -0.06 0.00 -0.62 0.00 0.00 57.03 56.67 1xw6 h ASP 105 Cb -0.08 0.10 -0.02 0.00 0.18 0.00 0.00 39.33 39.50 1xw6 h ASP 105 CO -0.06 -0.21 0.03 0.78 -3.12 0.00 0.00 179.24 176.65 1xw6 h ASN 106 N -0.33 0.65 -0.16 6.45 -0.26 -0.84 -1.79 115.58 119.29 1xw6 h ASN 106 Ca -0.02 -0.14 -0.01 0.00 -0.56 0.00 0.00 56.30 55.58 1xw6 h ASN 106 Cb 0.28 -0.17 -0.01 0.00 -1.06 0.00 0.00 38.32 37.36 1xw6 h ASN 106 CO 0.02 0.71 0.07 -0.74 -1.06 0.00 0.00 177.43 176.42 1xw6 h HIS 107 N 0.66 0.24 -0.82 1.19 2.76 0.46 -2.88 115.15 116.75 1xw6 h HIS 107 Ca 0.14 -0.02 0.08 0.00 -2.20 0.00 0.00 60.37 58.37 1xw6 h HIS 107 Cb 0.37 -0.07 -0.07 0.00 1.55 0.00 0.00 27.41 29.19 1xw6 h HIS 107 CO 0.02 0.30 0.49 0.52 -1.30 0.00 0.00 177.93 177.95 1xw6 h MET 108 N 0.11 0.82 -0.76 5.26 2.86 -0.20 -2.07 114.93 120.94 1xw6 h MET 108 Ca 0.05 -0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.66 1xw6 h MET 108 Cb 0.16 -0.19 -0.04 0.00 0.06 0.00 0.00 31.60 31.60 1xw6 h MET 108 CO -0.00 0.54 0.51 1.96 1.06 0.00 0.00 176.91 180.98 1xw6 h GLN 109 N 0.85 0.98 -0.12 1.72 4.20 -1.19 0.34 115.11 121.89 1xw6 h GLN 109 Ca 0.38 -0.06 -0.07 0.00 0.06 0.00 0.00 58.65 58.96 1xw6 h GLN 109 Cb 0.28 -0.22 -0.00 0.00 0.30 0.00 0.00 27.48 27.84 1xw6 h GLN 109 CO -0.21 0.65 -0.21 1.25 -0.67 0.00 0.00 178.83 179.63 1xw6 h LEU 110 N 1.00 0.40 -1.20 1.46 5.85 -1.24 -3.16 115.31 118.43 1xw6 h LEU 110 Ca 0.29 -0.54 -0.04 0.00 0.84 0.00 0.00 57.88 58.42 1xw6 h LEU 110 Cb -0.07 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 40.82 1xw6 h LEU 110 CO -0.07 0.87 0.08 1.23 -0.34 0.00 0.00 178.44 180.21 1xw6 h GLY 111 N -0.05 0.69 0.75 3.75 0.00 -0.95 -1.91 103.07 105.35 1xw6 h GLY 111 Ca 0.01 -0.38 0.04 0.00 0.00 0.00 0.00 47.33 46.99 1xw6 h GLY 111 CO 0.05 0.36 0.20 -0.33 0.00 0.00 0.00 176.54 176.82 1xw6 h MET 112 N 0.62 0.39 0.09 4.80 2.86 -0.29 -1.57 114.93 121.84 1xw6 h MET 112 Ca 0.14 -0.02 -0.26 0.00 -2.06 0.00 0.00 59.70 57.50 1xw6 h MET 112 Cb 0.27 -0.09 -0.00 0.00 0.06 0.00 0.00 31.60 31.84 1xw6 h MET 112 CO 0.00 0.26 -1.16 -0.84 1.06 0.00 0.00 176.91 176.23 1xw6 h ILE 113 N 0.41 1.51 -0.02 -1.22 3.07 -1.51 -2.94 117.51 116.81 1xw6 h ILE 113 Ca 0.19 -3.01 -0.06 0.00 1.55 0.00 0.00 64.86 63.52 1xw6 h ILE 113 Cb 0.11 2.85 -0.01 0.00 -0.27 0.00 0.00 36.82 39.50 1xw6 h ILE 113 CO -0.14 0.88 -0.30 0.00 -1.05 0.00 0.00 178.15 177.54 1xw6 n TYR 115 N -4.18 0.35 -2.25 0.00 4.01 -0.60 0.67 117.16 115.17 1xw6 n TYR 115 Ca -0.02 0.10 -0.42 0.00 -0.16 0.00 0.00 57.90 57.40 1xw6 n TYR 115 Cb 0.35 -0.50 -0.03 0.00 -0.31 0.00 0.00 39.34 38.85 1xw6 n TYR 115 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1xw6 s ASN 116 N -3.91 6.88 0.60 7.72 3.84 -0.95 -4.60 114.94 124.53 1xw6 s ASN 116 Ca 0.06 2.15 0.29 0.00 0.21 0.00 0.00 52.86 55.58 1xw6 s ASN 116 Cb 0.14 -2.57 1.63 0.00 -0.55 0.00 0.00 41.25 39.90 1xw6 s ASN 116 CO 0.75 -0.66 2.03 -0.65 -2.79 0.00 0.00 177.10 175.78 1xw6 h PRO 117 N 7.35 0.00 -1.04 0.43 0.11 -1.90 -0.94 132.00 136.01 1xw6 h PRO 117 Ca -0.40 0.00 -0.56 0.00 0.11 0.00 0.00 66.00 65.16 1xw6 h PRO 117 Cb 1.19 0.00 -0.28 0.00 0.11 0.00 0.00 31.00 32.03 1xw6 h PRO 117 CO 0.88 0.00 0.71 0.39 -0.21 0.00 0.00 178.00 179.77 1xw6 n GLU 118 N -3.64 2.36 -0.18 1.05 1.02 -1.26 -4.72 120.64 115.28 1xw6 n GLU 118 Ca 0.03 -2.91 -0.01 0.00 -0.02 0.00 0.00 57.16 54.25 1xw6 n GLU 118 Cb 0.43 -2.14 0.08 0.00 -0.02 0.00 0.00 31.44 29.79 1xw6 n GLU 118 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 1xw6 h PHE 119 N 1.43 0.08 -0.24 -0.32 3.57 -1.34 -2.25 116.94 117.87 1xw6 h PHE 119 Ca 0.58 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 62.10 1xw6 h PHE 119 Cb 1.76 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 40.54 1xw6 h PHE 119 CO 1.41 -0.07 0.10 1.49 -2.23 0.00 0.00 178.31 179.01 1xw6 h GLU 120 N 0.18 0.32 0.09 1.11 4.57 -1.87 -0.94 114.58 118.05 1xw6 h GLU 120 Ca 0.28 -0.03 -0.26 0.00 -1.18 0.00 0.00 59.36 58.17 1xw6 h GLU 120 Cb 0.42 -0.07 0.01 0.00 -0.16 0.00 0.00 28.75 28.95 1xw6 h GLU 120 CO -0.41 0.27 -1.15 -0.22 -1.18 0.00 0.00 179.01 176.32 1xw6 h LYS 121 N 0.33 0.37 0.00 1.92 3.64 -1.81 -3.32 116.57 117.71 1xw6 h LYS 121 Ca 0.08 -0.52 -0.06 0.00 -1.27 0.00 0.00 60.65 58.88 1xw6 h LYS 121 Cb 0.06 0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 1xw6 h LYS 121 CO -0.01 1.21 -0.31 -0.07 -2.27 0.00 0.00 179.45 178.00 1xw6 h LEU 122 N 0.15 0.00 -0.83 5.20 4.07 -1.20 -3.37 115.31 119.33 1xw6 h LEU 122 Ca -0.13 0.00 0.14 0.00 0.08 0.00 0.00 57.88 57.97 1xw6 h LEU 122 Cb 1.84 0.00 -0.09 0.00 1.08 0.00 0.00 40.66 43.49 1xw6 h LEU 122 CO 0.20 0.30 0.43 0.50 -1.08 0.00 0.00 178.44 178.79 1xw6 h LYS 123 N 0.00 0.61 -0.66 1.13 3.64 -1.27 -2.90 116.57 117.12 1xw6 h LYS 123 Ca -0.00 -0.04 0.08 0.00 -1.27 0.00 0.00 60.65 59.42 1xw6 h LYS 123 Cb 1.23 -0.14 -0.06 0.00 -0.41 0.00 0.00 32.23 32.85 1xw6 h LYS 123 CO 0.04 0.40 0.33 -1.35 -2.27 0.00 0.00 179.45 176.60 1xw6 h PRO 124 N 0.63 0.58 -0.12 1.90 0.11 -1.78 -1.73 132.00 131.58 1xw6 h PRO 124 Ca 0.44 -0.03 -0.16 0.00 0.11 0.00 0.00 66.00 66.36 1xw6 h PRO 124 Cb 0.60 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.57 1xw6 h PRO 124 CO -0.35 0.38 -0.61 -0.22 -0.21 0.00 0.00 178.00 176.99 1xw6 h LYS 125 N 0.59 0.43 -0.45 1.05 3.64 -1.80 -2.49 116.57 117.55 1xw6 h LYS 125 Ca 0.31 -0.30 -0.05 0.00 -1.27 0.00 0.00 60.65 59.35 1xw6 h LYS 125 Cb 0.28 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.13 1xw6 h LYS 125 CO -0.23 0.91 0.10 -0.92 -2.27 0.00 0.00 179.45 177.04 1xw6 h TYR 126 N 0.32 0.77 0.00 1.91 3.20 -1.32 -1.91 116.97 119.95 1xw6 h TYR 126 Ca -0.01 -0.10 -0.07 0.00 3.14 0.00 0.00 58.73 61.70 1xw6 h TYR 126 Cb 1.16 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 39.20 1xw6 h TYR 126 CO 0.04 0.71 -0.32 -0.07 -1.64 0.00 0.00 178.16 176.88 1xw6 h LEU 127 N 0.61 0.00 -0.46 2.82 3.38 -1.32 -0.88 115.31 119.46 1xw6 h LEU 127 Ca 0.14 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.95 1xw6 h LEU 127 Cb 0.34 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1xw6 h LEU 127 CO 0.00 0.32 -0.44 -0.08 0.09 0.00 0.00 178.44 178.34 1xw6 h GLU 128 N 0.00 0.79 -0.00 1.13 4.81 -1.11 -3.18 114.58 117.02 1xw6 h GLU 128 Ca -0.00 -0.44 0.00 0.00 -0.13 0.00 0.00 59.36 58.79 1xw6 h GLU 128 Cb 0.65 0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.05 1xw6 h GLU 128 CO 0.04 1.07 -0.46 0.39 -0.73 0.00 0.00 179.01 179.32 1xw6 n GLU 129 N -4.03 0.02 -0.16 1.92 1.02 -0.75 -4.40 120.64 114.27 1xw6 n GLU 129 Ca -0.03 -0.01 -0.07 0.00 -0.02 0.00 0.00 57.16 57.03 1xw6 n GLU 129 Cb 0.56 -1.50 0.02 0.00 -0.02 0.00 0.00 31.44 30.50 1xw6 n GLU 129 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1xw6 h LEU 130 N 0.03 0.57 -1.04 -4.62 5.85 -1.14 -2.99 115.31 111.96 1xw6 h LEU 130 Ca 0.00 -0.03 0.11 0.00 0.84 0.00 0.00 57.88 58.80 1xw6 h LEU 130 Cb 0.50 -0.14 -0.08 0.00 0.37 0.00 0.00 40.66 41.31 1xw6 h LEU 130 CO 0.00 0.43 0.63 -0.65 -0.34 0.00 0.00 178.44 178.51 1xw6 h PRO 131 N 0.65 0.98 -0.29 5.25 0.11 -1.77 -1.81 132.00 135.12 1xw6 h PRO 131 Ca 0.18 -0.06 0.04 0.00 0.11 0.00 0.00 66.00 66.27 1xw6 h PRO 131 Cb -0.05 -0.22 -0.04 0.00 0.11 0.00 0.00 31.00 30.80 1xw6 h PRO 131 CO -0.04 0.65 0.07 1.49 -0.21 0.00 0.00 178.00 179.96 1xw6 h GLU 132 N 1.01 0.17 0.40 1.05 4.81 -1.81 -0.01 114.58 120.19 1xw6 h GLU 132 Ca 0.48 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.68 1xw6 h GLU 132 Cb 0.44 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.78 1xw6 h GLU 132 CO -0.24 0.11 -0.19 0.87 -0.73 0.00 0.00 179.01 178.83 1xw6 h LYS 133 N 0.18 -0.52 -0.96 1.92 1.57 -1.32 -2.85 116.57 114.59 1xw6 h LYS 133 Ca 0.13 0.04 0.04 0.00 -1.87 0.00 0.00 60.65 58.99 1xw6 h LYS 133 Cb 0.13 0.12 -0.06 0.00 0.08 0.00 0.00 32.23 32.50 1xw6 h LYS 133 CO -0.17 -0.33 0.63 -0.07 -0.57 0.00 0.00 179.45 178.94 1xw6 h LEU 134 N -0.57 1.04 -1.76 2.94 4.07 -1.24 -1.72 115.31 118.06 1xw6 h LEU 134 Ca -0.06 -0.01 0.01 0.00 0.08 0.00 0.00 57.88 57.91 1xw6 h LEU 134 Cb 0.43 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 41.93 1xw6 h LEU 134 CO 0.09 0.70 0.18 0.50 -1.08 0.00 0.00 178.44 178.83 1xw6 h LYS 135 N 1.20 0.32 -0.45 1.13 3.64 -0.88 -1.26 116.57 120.26 1xw6 h LYS 135 Ca 0.39 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.70 1xw6 h LYS 135 Cb 0.04 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.77 1xw6 h LYS 135 CO -0.13 0.21 0.09 -0.07 -2.27 0.00 0.00 179.45 177.27 1xw6 h LEU 136 N 0.33 0.70 -0.76 5.20 3.38 -1.08 -0.23 115.31 122.85 1xw6 h LEU 136 Ca 0.10 -0.25 -0.09 0.00 0.09 0.00 0.00 57.88 57.73 1xw6 h LEU 136 Cb 0.01 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1xw6 h LEU 136 CO -0.02 0.77 -0.07 1.88 0.09 0.00 0.00 178.44 181.09 1xw6 h TYR 137 N 0.60 0.96 0.49 1.13 0.05 -1.31 -1.05 116.97 117.83 1xw6 h TYR 137 Ca 0.14 -0.17 -0.02 0.00 0.05 0.00 0.00 58.73 58.73 1xw6 h TYR 137 Cb 0.36 -0.25 0.00 0.00 1.01 0.00 0.00 36.73 37.86 1xw6 h TYR 137 CO 0.02 0.90 -0.23 1.03 -1.05 0.00 0.00 178.16 178.83 1xw6 h SER 138 N 0.80 -0.56 -0.23 3.88 0.87 -1.01 -1.07 113.55 116.23 1xw6 h SER 138 Ca 0.14 0.01 -0.04 0.00 -1.23 0.00 0.00 61.79 60.67 1xw6 h SER 138 Cb 0.57 0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.66 1xw6 h SER 138 CO 0.03 -0.39 0.02 -0.33 -0.53 0.00 0.00 176.83 175.64 1xw6 h GLU 139 N -0.67 0.51 -0.33 2.24 4.39 -0.99 -1.17 114.58 118.56 1xw6 h GLU 139 Ca -0.07 -0.10 -0.04 0.00 0.34 0.00 0.00 59.36 59.50 1xw6 h GLU 139 Cb 0.51 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.07 1xw6 h GLU 139 CO 0.11 0.52 0.06 0.35 -1.16 0.00 0.00 179.01 178.89 1xw6 h PHE 140 N 0.49 0.57 -0.28 4.33 3.57 -1.03 -3.06 116.94 121.53 1xw6 h PHE 140 Ca 0.11 -0.08 -0.04 0.00 3.53 0.00 0.00 57.97 61.49 1xw6 h PHE 140 Cb 0.29 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 1xw6 h PHE 140 CO 0.01 0.60 0.01 1.25 -2.23 0.00 0.00 178.31 177.95 1xw6 h LEU 141 N 0.37 0.47 0.00 0.59 5.85 -0.91 -3.48 115.31 118.20 1xw6 h LEU 141 Ca 0.10 -0.30 0.00 0.00 0.84 0.00 0.00 57.88 58.52 1xw6 h LEU 141 Cb 0.33 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.24 1xw6 h LEU 141 CO 0.00 0.65 0.00 0.61 -0.34 0.00 0.00 178.44 179.36 1xw6 n GLY 142 N -0.36 3.23 1.67 3.75 0.00 -0.47 -1.97 105.19 111.04 1xw6 n GLY 142 Ca -0.03 -0.18 0.09 0.00 0.00 0.00 0.00 46.02 45.90 1xw6 n GLY 142 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xw6 n LYS 143 N 13.78 3.96 -2.72 1.61 4.76 -1.26 -4.96 118.16 133.33 1xw6 n LYS 143 Ca 0.00 -2.96 -0.37 0.00 -2.87 0.00 0.00 58.31 52.11 1xw6 n LYS 143 Cb 0.00 -1.97 -0.06 0.00 -1.84 0.00 0.00 35.03 31.16 1xw6 n LYS 143 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1xw6 s ARG 144 N -1.99 4.54 0.20 1.97 0.52 -0.83 -4.97 118.95 118.40 1xw6 s ARG 144 Ca 0.53 1.40 -0.04 0.00 -0.52 0.00 0.00 55.73 57.09 1xw6 s ARG 144 Cb 0.35 -2.81 0.15 0.00 0.52 0.00 0.00 34.95 33.16 1xw6 s ARG 144 CO 0.24 0.22 1.58 -1.00 0.02 0.00 0.00 175.30 176.36 1xw6 h PRO 145 N 3.16 0.69 -5.47 3.54 0.13 -1.89 -3.45 132.00 128.71 1xw6 h PRO 145 Ca -0.47 -0.34 -0.44 0.00 -0.87 0.00 0.00 66.00 63.88 1xw6 h PRO 145 Cb 1.20 -0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.18 1xw6 h PRO 145 CO 0.65 0.94 -0.71 -1.58 -0.23 0.00 0.00 178.00 177.07 1xw6 s TRP 146 N -4.36 1.72 0.40 1.56 0.52 -0.95 -4.93 118.94 112.89 1xw6 s TRP 146 Ca -0.09 -0.64 0.10 0.00 0.02 0.00 0.00 56.10 55.49 1xw6 s TRP 146 Cb 0.12 -0.86 0.82 0.00 -1.15 0.00 0.00 33.47 32.40 1xw6 s TRP 146 CO 0.84 0.29 1.94 0.74 0.02 0.00 0.00 176.95 180.78 1xw6 h PHE 147 N 2.51 0.26 0.00 -1.98 -1.00 -1.87 -2.93 116.94 111.93 1xw6 h PHE 147 Ca -0.38 -0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.37 1xw6 h PHE 147 Cb 1.22 -0.08 0.00 0.00 3.61 0.00 0.00 35.95 40.70 1xw6 h PHE 147 CO 0.69 0.34 -0.52 0.00 -1.61 0.00 0.00 178.31 177.22 1xw6 h ALA 148 N 1.67 0.71 0.00 2.45 0.00 -1.90 -3.47 119.26 118.73 1xw6 h ALA 148 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1xw6 h ALA 148 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1xw6 h ALA 148 CO 0.02 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.68 1xw6 n GLY 149 N 1.23 -0.27 0.06 0.00 0.00 -1.11 -4.39 105.19 100.70 1xw6 n GLY 149 Ca 0.03 -0.17 0.11 0.00 0.00 0.00 0.00 46.02 45.99 1xw6 n GLY 149 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xw6 n ASN 150 N 0.00 0.61 -4.63 1.61 5.03 -1.26 -2.24 115.26 114.37 1xw6 n ASN 150 Ca 0.00 -0.00 -0.30 0.00 0.87 0.00 0.00 54.58 55.15 1xw6 n ASN 150 Cb 0.00 0.80 -0.09 0.00 -1.02 0.00 0.00 39.78 39.47 1xw6 n ASN 150 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1xw6 s LYS 151 N -3.28 2.32 0.32 3.52 1.02 -1.26 -4.75 119.74 117.63 1xw6 s LYS 151 Ca 0.01 -0.95 -0.27 0.00 0.02 0.00 0.00 55.97 54.79 1xw6 s LYS 151 Cb 0.13 -2.41 -0.09 0.00 -0.52 0.00 0.00 37.83 34.94 1xw6 s LYS 151 CO 0.80 0.52 1.02 -1.50 -0.92 0.00 0.00 175.35 175.28 1xw6 s ILE 152 N -1.27 3.81 0.37 2.17 2.07 -1.26 -4.60 121.20 122.49 1xw6 s ILE 152 Ca 0.24 1.61 0.04 0.00 -1.41 0.00 0.00 60.65 61.13 1xw6 s ILE 152 Cb -0.11 -3.94 -0.03 0.00 0.13 0.00 0.00 42.46 38.50 1xw6 s ILE 152 CO 0.16 0.23 0.16 0.42 -1.91 0.00 0.00 174.94 174.00 1xw6 s THR 153 N -1.42 0.46 0.30 4.00 -4.23 -1.26 -4.80 115.64 108.69 1xw6 s THR 153 Ca 0.49 -2.00 0.36 0.00 -1.18 0.00 0.00 61.69 59.36 1xw6 s THR 153 Cb -0.25 -2.42 0.39 0.00 1.34 0.00 0.00 72.50 71.56 1xw6 s THR 153 CO 0.32 0.00 2.10 2.19 -0.54 0.00 0.00 174.62 178.69 1xw6 h PHE 154 N 1.94 0.00 0.00 3.99 -5.15 -1.62 -2.82 116.94 113.29 1xw6 h PHE 154 Ca -0.33 0.00 -0.02 0.00 -0.20 0.00 0.00 57.97 57.42 1xw6 h PHE 154 Cb 1.26 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 37.43 1xw6 h PHE 154 CO 1.42 0.03 -0.09 -0.39 -2.00 0.00 0.00 178.31 177.27 1xw6 h VAL 155 N 0.00 0.24 -0.26 0.88 -1.51 -1.92 -2.72 116.25 110.97 1xw6 h VAL 155 Ca -0.00 -0.74 -0.05 0.00 -1.23 0.00 0.00 66.70 64.68 1xw6 h VAL 155 Cb 0.35 1.59 -0.01 0.00 -2.13 0.00 0.00 31.29 31.09 1xw6 h VAL 155 CO 0.00 0.09 -0.08 0.44 -1.23 0.00 0.00 177.57 176.79 1xw6 h ASP 156 N 0.00 0.39 -0.14 4.19 3.32 -1.92 0.12 116.42 122.38 1xw6 h ASP 156 Ca -0.00 -0.08 -0.15 0.00 0.02 0.00 0.00 57.03 56.82 1xw6 h ASP 156 Cb 0.59 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 1xw6 h ASP 156 CO 0.01 0.51 -0.45 -0.26 -1.72 0.00 0.00 179.24 177.34 1xw6 h PHE 157 N 0.39 0.84 -0.16 4.55 -1.00 -1.65 0.60 116.94 120.51 1xw6 h PHE 157 Ca 0.08 -0.27 -0.08 0.00 2.81 0.00 0.00 57.97 60.52 1xw6 h PHE 157 Cb 0.39 -0.17 -0.00 0.00 3.61 0.00 0.00 35.95 39.77 1xw6 h PHE 157 CO 0.01 1.02 -0.20 -0.07 -1.61 0.00 0.00 178.31 177.46 1xw6 h LEU 158 N 0.56 0.46 -0.66 1.54 3.38 -1.36 -2.38 115.31 116.84 1xw6 h LEU 158 Ca 0.04 -0.50 -0.10 0.00 0.09 0.00 0.00 57.88 57.40 1xw6 h LEU 158 Cb 1.00 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.60 1xw6 h LEU 158 CO 0.09 0.87 -0.04 0.58 0.09 0.00 0.00 178.44 180.04 1xw6 h VAL 159 N 0.06 1.26 -0.16 1.22 2.07 -0.76 -2.22 116.25 117.73 1xw6 h VAL 159 Ca 0.02 -1.17 0.04 0.00 0.82 0.00 0.00 66.70 66.41 1xw6 h VAL 159 Cb 0.76 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 31.35 1xw6 h VAL 159 CO 0.05 0.42 -0.09 0.22 0.02 0.00 0.00 177.57 178.19 1xw6 h TYR 160 N 0.91 -0.20 -0.95 1.57 5.03 -0.88 -0.21 116.97 122.25 1xw6 h TYR 160 Ca 0.16 0.02 0.03 0.00 2.58 0.00 0.00 58.73 61.52 1xw6 h TYR 160 Cb 0.58 0.12 -0.05 0.00 1.55 0.00 0.00 36.73 38.92 1xw6 h TYR 160 CO 0.04 -0.13 0.62 0.22 -1.32 0.00 0.00 178.16 177.59 1xw6 h ASP 161 N -0.07 1.03 -0.25 -2.11 3.58 -1.26 0.26 116.42 117.59 1xw6 h ASP 161 Ca 0.09 -0.01 -0.07 0.00 0.42 0.00 0.00 57.03 57.46 1xw6 h ASP 161 Cb 0.21 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 41.01 1xw6 h ASP 161 CO -0.21 0.71 -0.11 0.58 -2.88 0.00 0.00 179.24 177.34 1xw6 h VAL 162 N 1.20 1.30 -0.32 2.25 2.07 -0.92 -0.45 116.25 121.37 1xw6 h VAL 162 Ca 0.37 -1.17 -0.04 0.00 0.82 0.00 0.00 66.70 66.68 1xw6 h VAL 162 Cb -0.01 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 1xw6 h VAL 162 CO -0.11 0.37 0.06 -0.07 0.02 0.00 0.00 177.57 177.83 1xw6 h LEU 163 N 0.25 0.51 -0.58 2.57 3.38 -0.78 -2.88 115.31 117.78 1xw6 h LEU 163 Ca 0.06 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 1xw6 h LEU 163 Cb 0.60 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 1xw6 h LEU 163 CO 0.03 0.63 0.27 -0.78 0.09 0.00 0.00 178.44 178.69 1xw6 h ASP 164 N 0.37 0.77 0.02 -0.43 3.58 -0.46 -1.83 116.42 118.44 1xw6 h ASP 164 Ca 0.10 -0.14 -0.00 0.00 0.42 0.00 0.00 57.03 57.41 1xw6 h ASP 164 Cb 0.33 -0.20 -0.00 0.00 1.72 0.00 0.00 39.33 41.19 1xw6 h ASP 164 CO 0.00 0.69 -0.02 -0.07 -2.88 0.00 0.00 179.24 176.97 1xw6 h LEU 165 N 0.79 0.00 0.01 2.28 3.38 -1.05 -2.45 115.31 118.28 1xw6 h LEU 165 Ca 0.20 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.92 1xw6 h LEU 165 Cb 0.13 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 1xw6 h LEU 165 CO -0.02 0.02 -1.34 0.45 0.09 0.00 0.00 178.44 177.63 1xw6 h HIS 166 N 0.00 0.05 0.00 1.13 3.86 -1.18 -2.45 115.15 116.55 1xw6 h HIS 166 Ca -0.00 -0.03 -0.09 0.00 -1.16 0.00 0.00 60.37 59.08 1xw6 h HIS 166 Cb 0.03 -0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.49 1xw6 h HIS 166 CO 0.00 1.04 -0.44 0.07 0.86 0.00 0.00 177.93 179.46 1xw6 h ARG 167 N 0.01 0.00 -0.14 2.45 0.11 -1.07 0.44 114.38 116.19 1xw6 h ARG 167 Ca -0.14 0.00 -0.22 0.00 0.10 0.00 0.00 59.98 59.72 1xw6 h ARG 167 Cb 1.89 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.98 1xw6 h ARG 167 CO 0.11 0.44 -0.77 0.82 0.10 0.00 0.00 179.97 180.67 1xw6 h ILE 168 N 0.00 1.30 -0.06 0.08 2.04 -1.48 -1.51 117.51 117.87 1xw6 h ILE 168 Ca -0.00 -2.01 -0.22 0.00 1.00 0.00 0.00 64.86 63.62 1xw6 h ILE 168 Cb 0.86 2.01 0.01 0.00 -0.74 0.00 0.00 36.82 38.97 1xw6 h ILE 168 CO 0.06 0.63 -0.82 0.15 0.00 0.00 0.00 178.15 178.17 1xw6 h PHE 169 N 0.48 0.95 -2.27 1.37 3.57 -1.05 -3.41 116.94 116.58 1xw6 h PHE 169 Ca -0.05 -0.47 -0.48 0.00 3.53 0.00 0.00 57.97 60.50 1xw6 h PHE 169 Cb 1.39 -0.13 -0.35 0.00 2.79 0.00 0.00 35.95 39.65 1xw6 h PHE 169 CO 0.08 1.30 -0.78 -2.00 -2.23 0.00 0.00 178.31 174.67 1xw6 s GLU 170 N -3.49 0.62 0.35 1.11 2.56 0.15 -5.05 118.70 114.94 1xw6 s GLU 170 Ca -0.11 -1.17 0.15 0.00 0.00 0.00 0.00 54.97 53.83 1xw6 s GLU 170 Cb 0.07 -1.04 1.14 0.00 2.00 0.00 0.00 34.13 36.30 1xw6 s GLU 170 CO 0.89 -1.22 1.60 -1.35 -0.56 0.00 0.00 175.26 174.62 1xw6 h PRO 171 N 6.92 0.07 -0.08 4.30 0.11 -1.44 -0.19 132.00 141.67 1xw6 h PRO 171 Ca 0.07 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.18 1xw6 h PRO 171 Cb 1.01 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.10 1xw6 h PRO 171 CO 0.23 0.04 0.00 1.63 -0.21 0.00 0.00 178.00 179.70 1xw6 n LYS 172 N -5.27 1.58 0.28 1.05 5.02 -1.26 -4.44 118.16 115.11 1xw6 n LYS 172 Ca 0.33 -0.85 0.13 0.00 -2.02 0.00 0.00 58.31 55.90 1xw6 n LYS 172 Cb 1.09 -1.42 0.82 0.00 -0.02 0.00 0.00 35.03 35.50 1xw6 n LYS 172 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xw6 n LEU 174 N -3.91 1.79 -0.36 0.00 4.32 -1.26 -4.46 117.00 113.12 1xw6 n LEU 174 Ca -0.03 -0.62 0.03 0.00 -0.02 0.00 0.00 56.01 55.38 1xw6 n LEU 174 Cb 0.13 -0.04 0.20 0.00 -1.62 0.00 0.00 43.42 42.09 1xw6 n LEU 174 CO 0.29 0.33 1.26 0.44 -1.22 0.00 0.00 177.39 178.49 1xw6 h ASP 175 N 2.27 1.00 0.57 -1.43 3.32 -1.76 -1.08 116.42 119.31 1xw6 h ASP 175 Ca 0.00 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1xw6 h ASP 175 Cb 0.69 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.04 1xw6 h ASP 175 CO 0.00 0.63 0.00 0.00 -1.72 0.00 0.00 179.24 178.15 1xw6 n ALA 176 N -2.37 1.88 -3.78 3.45 0.00 -1.26 -4.29 120.51 114.14 1xw6 n ALA 176 Ca 0.15 -0.07 -0.28 0.00 0.00 0.00 0.00 53.44 53.24 1xw6 n ALA 176 Cb 0.20 -1.30 -0.12 0.00 0.00 0.00 0.00 19.45 18.23 1xw6 n ALA 176 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1xw6 s PHE 177 N -2.90 2.75 0.31 0.00 0.08 -0.41 -4.98 117.98 112.83 1xw6 s PHE 177 Ca 0.11 -2.96 0.03 0.00 0.12 0.00 0.00 56.93 54.23 1xw6 s PHE 177 Cb 0.12 -2.23 0.61 0.00 -0.57 0.00 0.00 43.02 40.95 1xw6 s PHE 177 CO 0.32 -0.67 1.86 -1.00 -0.10 0.00 0.00 175.22 175.64 1xw6 h PRO 178 N 5.84 0.90 0.00 0.24 0.13 -1.75 -1.87 132.00 135.50 1xw6 h PRO 178 Ca 0.11 -0.05 -0.03 0.00 -0.87 0.00 0.00 66.00 65.15 1xw6 h PRO 178 Cb 0.83 -0.20 -0.00 0.00 0.13 0.00 0.00 31.00 31.76 1xw6 h PRO 178 CO 0.60 0.60 -0.17 -2.95 -0.23 0.00 0.00 178.00 175.86 1xw6 h ASN 179 N 0.93 0.00 0.25 1.44 -0.00 -1.92 -0.87 115.58 115.41 1xw6 h ASN 179 Ca 0.46 0.00 -0.22 0.00 -0.00 0.00 0.00 56.30 56.54 1xw6 h ASN 179 Cb 0.47 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.79 1xw6 h ASN 179 CO -0.22 0.17 -0.89 -0.07 -0.00 0.00 0.00 177.43 176.42 1xw6 h LEU 180 N 0.00 0.59 -0.55 6.14 3.38 -1.69 -1.39 115.31 121.79 1xw6 h LEU 180 Ca -0.00 -0.44 -0.12 0.00 0.09 0.00 0.00 57.88 57.41 1xw6 h LEU 180 Cb 0.35 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1xw6 h LEU 180 CO 0.02 1.23 -0.12 0.11 0.09 0.00 0.00 178.44 179.78 1xw6 h LYS 181 N 0.28 1.04 -0.24 1.13 1.57 -1.23 -2.28 116.57 116.84 1xw6 h LYS 181 Ca -0.07 -0.39 -0.08 0.00 -1.87 0.00 0.00 60.65 58.24 1xw6 h LYS 181 Cb 1.51 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.74 1xw6 h LYS 181 CO 0.16 1.08 -0.19 -0.44 -0.57 0.00 0.00 179.45 179.49 1xw6 h ASP 182 N 0.92 0.41 -0.35 0.86 3.32 -1.10 -1.69 116.42 118.79 1xw6 h ASP 182 Ca 0.14 -0.12 -0.02 0.00 0.02 0.00 0.00 57.03 57.05 1xw6 h ASP 182 Cb 0.69 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.11 1xw6 h ASP 182 CO 0.05 0.62 0.13 0.15 -1.72 0.00 0.00 179.24 178.47 1xw6 h PHE 183 N 0.38 0.55 -0.89 4.55 3.57 -1.00 -0.74 116.94 123.36 1xw6 h PHE 183 Ca 0.07 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 1xw6 h PHE 183 Cb 0.55 -0.16 -0.04 0.00 2.79 0.00 0.00 35.95 39.09 1xw6 h PHE 183 CO 0.02 0.52 0.51 0.82 -2.23 0.00 0.00 178.31 177.94 1xw6 h ILE 184 N 0.42 1.25 -0.36 1.41 2.04 -0.96 0.38 117.51 121.70 1xw6 h ILE 184 Ca 0.12 -0.59 -0.05 0.00 1.00 0.00 0.00 64.86 65.33 1xw6 h ILE 184 Cb 0.21 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.30 1xw6 h ILE 184 CO -0.01 0.28 0.01 0.28 0.00 0.00 0.00 178.15 178.71 1xw6 h SER 185 N 1.24 0.61 -0.73 1.72 0.02 -1.15 -0.77 113.55 114.49 1xw6 h SER 185 Ca 0.32 -0.30 -0.07 0.00 -0.84 0.00 0.00 61.79 60.90 1xw6 h SER 185 Cb -0.01 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.34 1xw6 h SER 185 CO -0.05 0.76 0.20 -0.09 -1.14 0.00 0.00 176.83 176.51 1xw6 h ARG 186 N 0.44 1.16 0.17 3.45 2.43 -0.86 0.32 114.38 121.50 1xw6 h ARG 186 Ca 0.10 -0.27 -0.01 0.00 -0.81 0.00 0.00 59.98 59.00 1xw6 h ARG 186 Cb 0.44 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 1xw6 h ARG 186 CO 0.02 1.00 -0.08 0.35 -1.51 0.00 0.00 179.97 179.74 1xw6 h PHE 187 N 1.10 -0.22 0.00 2.20 3.57 -0.82 -3.01 116.94 119.77 1xw6 h PHE 187 Ca 0.23 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.72 1xw6 h PHE 187 Cb 0.35 0.07 -0.00 0.00 2.79 0.00 0.00 35.95 39.16 1xw6 h PHE 187 CO 0.03 0.18 -0.05 0.93 -2.23 0.00 0.00 178.31 177.17 1xw6 h GLU 188 N -0.69 0.00 0.00 1.11 5.08 -1.12 -2.08 114.58 116.88 1xw6 h GLU 188 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1xw6 h GLU 188 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1xw6 h GLU 188 CO 0.04 0.05 0.00 0.41 -1.00 0.00 0.00 179.01 178.51 1xw6 n GLY 189 N -0.59 -1.34 3.71 -3.84 0.00 0.11 -3.45 105.19 99.80 1xw6 n GLY 189 Ca -0.01 -0.09 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 1xw6 n GLY 189 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xw6 s LEU 190 N -2.97 4.37 0.18 0.99 1.43 -0.78 -4.83 118.68 117.07 1xw6 s LEU 190 Ca 0.13 2.56 -0.25 0.00 -1.03 0.00 0.00 54.13 55.53 1xw6 s LEU 190 Cb 0.16 -3.58 0.05 0.00 0.03 0.00 0.00 46.19 42.85 1xw6 s LEU 190 CO 0.45 -0.85 1.55 -0.33 0.23 0.00 0.00 176.35 177.40 1xw6 h GLU 191 N 7.43 -0.08 0.00 1.70 5.08 -1.90 0.36 114.58 127.17 1xw6 h GLU 191 Ca -0.43 0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 57.90 1xw6 h GLU 191 Cb 1.20 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 1xw6 h GLU 191 CO 0.92 -0.05 -0.20 0.87 -1.00 0.00 0.00 179.01 179.54 1xw6 h LYS 192 N -0.08 0.00 0.14 2.33 1.57 -1.92 -1.62 116.57 117.00 1xw6 h LYS 192 Ca 0.22 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.75 1xw6 h LYS 192 Cb 0.52 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.86 1xw6 h LYS 192 CO -0.87 0.20 -1.05 0.82 -0.57 0.00 0.00 179.45 177.99 1xw6 h ILE 193 N 0.00 1.39 -0.08 1.86 1.08 -1.46 -2.71 117.51 117.60 1xw6 h ILE 193 Ca -0.00 -2.49 0.01 0.00 -0.39 0.00 0.00 64.86 61.99 1xw6 h ILE 193 Cb 0.60 2.96 -0.01 0.00 -3.07 0.00 0.00 36.82 37.29 1xw6 h ILE 193 CO 0.03 0.73 -0.00 -1.28 -0.69 0.00 0.00 178.15 176.94 1xw6 h SER 194 N -0.05 -0.03 -0.64 1.72 0.87 -0.21 -0.50 113.55 114.72 1xw6 h SER 194 Ca -0.17 0.02 0.04 0.00 -1.23 0.00 0.00 61.79 60.44 1xw6 h SER 194 Cb 1.79 0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 63.73 1xw6 h SER 194 CO 0.20 -0.00 0.38 0.00 -0.53 0.00 0.00 176.83 176.87 1xw6 h ALA 195 N 1.06 0.84 -0.54 6.23 0.00 -1.39 -2.61 119.26 122.85 1xw6 h ALA 195 Ca 0.04 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 1xw6 h ALA 195 Cb 0.04 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1xw6 h ALA 195 CO -0.06 0.10 -0.08 -0.92 0.00 0.00 0.00 179.25 178.29 1xw6 h TYR 196 N 0.73 1.12 0.00 0.00 3.20 -1.25 -2.83 116.97 117.94 1xw6 h TYR 196 Ca 0.27 -0.22 -0.01 0.00 3.14 0.00 0.00 58.73 61.90 1xw6 h TYR 196 Cb 0.08 -0.28 -0.00 0.00 1.54 0.00 0.00 36.73 38.06 1xw6 h TYR 196 CO -0.06 1.04 -0.04 0.52 -1.64 0.00 0.00 178.16 177.97 1xw6 h MET 197 N 0.89 0.00 -0.02 1.82 2.86 -0.79 -2.26 114.93 117.42 1xw6 h MET 197 Ca 0.14 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.78 1xw6 h MET 197 Cb 0.64 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.30 1xw6 h MET 197 CO 0.04 0.04 -0.13 1.63 1.06 0.00 0.00 176.91 179.56 1xw6 n LYS 198 N -3.26 1.72 -2.56 1.72 5.02 -1.01 -4.88 118.16 114.91 1xw6 n LYS 198 Ca -0.01 -1.28 -0.24 0.00 -2.02 0.00 0.00 58.31 54.76 1xw6 n LYS 198 Cb 0.21 -1.47 0.11 0.00 -0.02 0.00 0.00 35.03 33.86 1xw6 n LYS 198 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1xw6 s SER 199 N -2.16 4.32 0.38 4.39 1.04 -0.85 -5.00 113.70 115.81 1xw6 s SER 199 Ca 0.28 -0.32 0.25 0.00 0.48 0.00 0.00 55.95 56.64 1xw6 s SER 199 Cb 0.20 -0.05 0.60 0.00 0.10 0.00 0.00 66.02 66.86 1xw6 s SER 199 CO 0.39 -1.88 1.70 0.77 0.98 0.00 0.00 173.24 175.20 1xw6 h SER 200 N -0.56 0.00 0.27 7.02 4.64 -1.93 -3.28 113.55 119.71 1xw6 h SER 200 Ca -0.37 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 60.79 1xw6 h SER 200 Cb 1.27 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.35 1xw6 h SER 200 CO 0.41 0.00 -0.63 0.03 -0.87 0.00 0.00 176.83 175.76 1xw6 h ARG 201 N 0.00 0.34 -6.30 4.77 3.08 -1.95 -3.45 114.38 110.88 1xw6 h ARG 201 Ca 0.00 -0.25 -0.65 0.00 0.07 0.00 0.00 59.98 59.15 1xw6 h ARG 201 Cb 0.85 0.04 0.04 0.00 0.08 0.00 0.00 29.97 30.98 1xw6 h ARG 201 CO 0.00 0.87 0.82 0.34 -1.07 0.00 0.00 179.97 180.92 1xw6 n PHE 202 N -3.87 2.04 -3.34 3.04 7.35 -1.24 -4.95 117.46 116.49 1xw6 n PHE 202 Ca -0.03 0.36 -0.26 0.00 -0.76 0.00 0.00 57.45 56.76 1xw6 n PHE 202 Cb 0.64 -2.50 -0.08 0.00 0.35 0.00 0.00 39.48 37.89 1xw6 n PHE 202 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 1xw6 n LEU 203 N 4.51 1.30 0.08 -2.13 7.94 -1.26 -4.95 117.00 122.49 1xw6 n LEU 203 Ca 0.21 -4.90 0.09 0.00 -1.11 0.00 0.00 56.01 50.31 1xw6 n LEU 203 Cb 0.23 0.15 0.41 0.00 0.53 0.00 0.00 43.42 44.73 1xw6 n LEU 203 CO 0.70 2.01 0.79 -0.81 -1.11 0.00 0.00 177.39 178.97 1xw6 n PRO 204 N 1.50 0.11 -3.45 1.96 -0.04 -1.26 -4.18 135.00 129.64 1xw6 n PRO 204 Ca 0.25 0.37 -0.12 0.00 -0.04 0.00 0.00 63.50 63.96 1xw6 n PRO 204 Cb 0.48 -1.72 -0.02 0.00 -0.04 0.00 0.00 33.50 32.19 1xw6 n PRO 204 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1xw6 s ARG 205 N -3.20 1.28 0.43 0.54 0.52 -1.26 -4.45 118.95 112.80 1xw6 s ARG 205 Ca 0.05 -0.51 -0.26 0.00 -0.52 0.00 0.00 55.73 54.49 1xw6 s ARG 205 Cb 0.09 0.58 -0.09 0.00 0.52 0.00 0.00 34.95 36.04 1xw6 s ARG 205 CO 0.31 -0.56 1.33 -2.30 0.02 0.00 0.00 175.30 174.11 1xw6 n PRO 206 N -0.37 2.07 0.12 3.54 -0.02 -1.26 -4.68 135.00 134.40 1xw6 n PRO 206 Ca -0.16 0.74 -0.13 0.00 -2.02 0.00 0.00 63.50 61.92 1xw6 n PRO 206 Cb 0.65 -2.47 -0.08 0.00 -0.02 0.00 0.00 33.50 31.57 1xw6 n PRO 206 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1xw6 h VAL 207 N 2.20 0.86 -4.89 -1.45 2.07 -1.70 -0.45 116.25 112.89 1xw6 h VAL 207 Ca -0.49 -0.56 -0.35 0.00 0.82 0.00 0.00 66.70 66.12 1xw6 h VAL 207 Cb 1.28 1.18 -0.04 0.00 -1.52 0.00 0.00 31.29 32.19 1xw6 h VAL 207 CO 0.60 0.12 -0.20 0.49 0.02 0.00 0.00 177.57 178.61 1xw6 n PHE 208 N -5.09 -0.36 -1.97 1.57 3.72 -0.01 -1.29 117.46 114.03 1xw6 n PHE 208 Ca -0.09 -1.37 -0.29 0.00 -0.05 0.00 0.00 57.45 55.65 1xw6 n PHE 208 Cb 0.23 -0.23 0.12 0.00 -0.94 0.00 0.00 39.48 38.66 1xw6 n PHE 208 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1xw6 s SER 209 N -2.75 4.03 0.64 4.37 1.04 -1.26 -4.52 113.70 115.26 1xw6 s SER 209 Ca 0.11 0.52 0.43 0.00 0.48 0.00 0.00 55.95 57.49 1xw6 s SER 209 Cb -0.01 -0.86 2.31 0.00 0.10 0.00 0.00 66.02 67.56 1xw6 s SER 209 CO 0.07 -2.17 2.32 0.11 0.98 0.00 0.00 173.24 174.55 1xw6 h LYS 210 N -1.20 0.00 0.00 4.02 1.57 -1.93 -1.21 116.57 117.83 1xw6 h LYS 210 Ca -0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1xw6 h LYS 210 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.60 1xw6 h LYS 210 CO 0.54 0.00 0.00 -1.33 -0.57 0.00 0.00 179.45 178.09 1xw6 n MET 211 N -3.03 0.01 -2.12 3.15 2.81 -1.26 -4.87 117.12 111.80 1xw6 n MET 211 Ca -0.03 0.04 -0.33 0.00 -1.81 0.00 0.00 57.70 55.57 1xw6 n MET 211 Cb 0.08 -1.51 0.01 0.00 -0.71 0.00 0.00 33.22 31.09 1xw6 n MET 211 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1xw6 s ALA 212 N -3.00 2.73 -0.03 3.04 0.00 -0.46 -4.87 121.76 119.17 1xw6 s ALA 212 Ca 0.13 0.49 0.12 0.00 0.00 0.00 0.00 51.96 52.69 1xw6 s ALA 212 Cb 0.18 -3.26 -0.23 0.00 0.00 0.00 0.00 23.12 19.81 1xw6 s ALA 212 CO 0.50 -0.77 0.73 0.28 0.00 0.00 0.00 175.76 176.50 1xw6 h VAL 213 N 0.67 0.94 -4.23 0.00 2.07 -0.01 -3.40 116.25 112.28 1xw6 h VAL 213 Ca -0.48 -2.77 -0.53 0.00 0.82 0.00 0.00 66.70 63.73 1xw6 h VAL 213 Cb 1.23 2.47 -0.28 0.00 -1.52 0.00 0.00 31.29 33.19 1xw6 h VAL 213 CO 0.57 0.54 -0.83 0.86 0.02 0.00 0.00 177.57 178.74 1xw6 s TRP 214 N -2.61 1.56 -0.35 1.57 -0.00 -0.98 -4.75 118.94 113.38 1xw6 s TRP 214 Ca -0.04 -0.32 0.00 0.00 -0.00 0.00 0.00 56.10 55.74 1xw6 s TRP 214 Cb 0.08 -0.97 0.00 0.00 -0.00 0.00 0.00 33.47 32.58 1xw6 s TRP 214 CO 0.82 0.01 0.00 0.41 -0.00 0.00 0.00 176.95 178.20 1xw6 n GLY 215 N 2.33 0.57 0.00 5.86 0.00 -1.26 -4.71 105.19 107.98 1xw6 n GLY 215 Ca -0.16 -0.23 0.08 0.00 0.00 0.00 0.00 46.02 45.71 1xw6 n GLY 215 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1xw6 n ASN 216 N -0.07 0.00 0.00 1.61 2.04 -1.26 -0.83 115.26 116.75 1xw6 n ASN 216 Ca -0.03 0.47 0.00 0.00 -0.44 0.00 0.00 54.58 54.58 1xw6 n ASN 216 Cb 0.24 -0.49 0.00 0.00 -2.53 0.00 0.00 39.78 37.01 1xw6 n ASN 216 CO 0.00 0.00 0.00 1.17 -0.44 0.00 0.00 177.26 177.99