#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xw6 s MET 2 N 0.00 3.23 -0.06 0.54 -1.94 -0.49 -4.80 119.30 115.78 1xw6 s MET 2 Ca 0.00 0.40 0.02 0.00 -1.71 0.00 0.00 55.69 54.40 1xw6 s MET 2 Cb 0.00 -2.16 0.01 0.00 2.01 0.00 0.00 34.83 34.69 1xw6 s MET 2 CO 0.00 -0.66 -0.11 -1.50 -0.01 0.00 0.00 175.02 172.74 1xw6 s ILE 3 N -3.11 1.04 -0.23 2.53 2.07 -0.21 -0.04 121.20 123.26 1xw6 s ILE 3 Ca 0.54 -0.44 -0.07 0.00 -1.41 0.00 0.00 60.65 59.27 1xw6 s ILE 3 Cb -0.11 -0.95 -0.03 0.00 0.13 0.00 0.00 42.46 41.50 1xw6 s ILE 3 CO 0.50 0.33 0.07 -0.22 -1.91 0.00 0.00 174.94 173.70 1xw6 s LEU 4 N 0.58 3.51 -0.11 8.50 2.96 -0.33 -0.81 118.68 132.98 1xw6 s LEU 4 Ca -0.12 -0.14 -0.01 0.00 -0.22 0.00 0.00 54.13 53.64 1xw6 s LEU 4 Cb -0.14 -1.93 -0.03 0.00 0.50 0.00 0.00 46.19 44.59 1xw6 s LEU 4 CO 0.03 0.02 -0.07 -0.83 -1.32 0.00 0.00 176.35 174.17 1xw6 s GLY 5 N 1.30 1.67 0.12 7.98 0.00 -0.20 -0.84 107.32 117.35 1xw6 s GLY 5 Ca 0.05 -0.87 -0.25 0.00 0.00 0.00 0.00 44.72 43.65 1xw6 s GLY 5 CO 0.03 -0.39 1.08 -0.47 0.00 0.00 0.00 173.10 173.35 1xw6 s TYR 6 N -0.21 -0.04 0.98 1.90 5.04 -0.98 -1.54 117.35 122.50 1xw6 s TYR 6 Ca 0.03 -0.24 -0.12 0.00 -2.44 0.00 0.00 57.07 54.30 1xw6 s TYR 6 Cb -0.13 0.63 0.18 0.00 0.35 0.00 0.00 41.96 42.99 1xw6 s TYR 6 CO 0.03 -0.71 1.08 -1.58 -1.34 0.00 0.00 175.55 173.03 1xw6 s TRP 7 N -2.68 1.99 0.00 4.97 0.52 -1.26 -1.57 118.94 120.91 1xw6 s TRP 7 Ca 0.17 1.25 -0.05 0.00 0.02 0.00 0.00 56.10 57.48 1xw6 s TRP 7 Cb -0.00 -3.18 -0.22 0.00 -1.15 0.00 0.00 33.47 28.91 1xw6 s TRP 7 CO 0.02 -2.86 3.35 -3.47 0.02 0.00 0.00 176.95 174.00 1xw6 n ASP 8 N -4.21 5.23 -1.64 2.95 4.64 0.57 -4.59 116.55 119.51 1xw6 n ASP 8 Ca 0.06 -2.46 -0.05 0.00 -1.38 0.00 0.00 54.79 50.96 1xw6 n ASP 8 Cb 0.55 -1.37 -0.02 0.00 -1.04 0.00 0.00 41.12 39.25 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 2.34 0.00 0.00 5.18 -5.35 -1.26 -4.76 119.36 115.50 1xw6 n ILE 9 Ca 0.36 -0.67 0.00 0.00 -0.27 0.00 0.00 62.75 62.16 1xw6 n ILE 9 Cb 0.85 0.35 0.00 0.00 -1.74 0.00 0.00 39.64 39.10 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 -0.18 0.00 0.00 6.28 0.63 -0.32 -4.87 116.66 118.19 1xw6 n ARG 10 Ca 0.02 0.31 0.00 0.00 -0.92 0.00 0.00 57.85 57.26 1xw6 n ARG 10 Cb 0.18 -0.83 0.00 0.00 0.45 0.00 0.00 32.46 32.25 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 2.05 1.62 0.00 5.14 0.00 -0.41 -2.22 105.19 111.35 1xw6 n GLY 11 Ca 0.00 -0.24 0.09 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 0.03 0.99 4.77 -1.26 -2.99 117.00 118.55 1xw6 n LEU 12 Ca 0.00 0.35 0.12 0.00 -0.03 0.00 0.00 56.01 56.45 1xw6 n LEU 12 Cb 0.00 -0.35 0.18 0.00 -2.33 0.00 0.00 43.42 40.92 1xw6 n LEU 12 CO 0.00 -0.13 0.34 0.00 -1.33 0.00 0.00 177.39 176.26 1xw6 n ALA 13 N -1.35 3.20 0.13 -1.18 0.00 -0.94 -4.54 120.51 115.83 1xw6 n ALA 13 Ca 0.07 -0.30 -0.16 0.00 0.00 0.00 0.00 53.44 53.05 1xw6 n ALA 13 Cb 0.17 -1.13 -0.09 0.00 0.00 0.00 0.00 19.45 18.40 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 -1.41 0.00 0.00 6.17 -1.45 0.18 115.15 118.64 1xw6 h HIS 14 Ca 0.00 0.03 -0.01 0.00 0.71 0.00 0.00 60.37 61.11 1xw6 h HIS 14 Cb 0.66 0.60 -0.00 0.00 2.52 0.00 0.00 27.41 31.18 1xw6 h HIS 14 CO 0.00 -0.58 -0.04 0.00 0.71 0.00 0.00 177.93 178.02 1xw6 h ALA 15 N -0.44 1.90 -0.06 5.26 0.00 -1.84 -1.71 119.26 122.36 1xw6 h ALA 15 Ca -0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1xw6 h ALA 15 Cb 0.75 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 1xw6 h ALA 15 CO -0.26 0.05 -0.05 0.82 0.00 0.00 0.00 179.25 179.81 1xw6 h ILE 16 N 0.00 1.36 -0.32 0.00 2.04 -1.60 -1.46 117.51 117.53 1xw6 h ILE 16 Ca -0.00 -1.18 0.02 0.00 1.00 0.00 0.00 64.86 64.70 1xw6 h ILE 16 Cb 0.08 2.02 -0.02 0.00 -0.74 0.00 0.00 36.82 38.15 1xw6 h ILE 16 CO 0.01 0.32 0.18 0.03 0.00 0.00 0.00 178.15 178.69 1xw6 h ARG 17 N -0.29 0.37 -0.73 2.37 3.08 -0.70 0.31 114.38 118.79 1xw6 h ARG 17 Ca 0.01 -0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.08 1xw6 h ARG 17 Cb 0.55 -0.08 -0.05 0.00 0.08 0.00 0.00 29.97 30.47 1xw6 h ARG 17 CO 0.01 0.24 0.45 -0.07 -1.07 0.00 0.00 179.97 179.54 1xw6 h LEU 18 N 0.38 0.73 -0.27 3.04 3.38 -1.33 -0.73 115.31 120.51 1xw6 h LEU 18 Ca 0.13 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 1xw6 h LEU 18 Cb 0.01 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1xw6 h LEU 18 CO -0.07 0.50 -0.06 0.25 0.09 0.00 0.00 178.44 179.15 1xw6 h LEU 19 N 0.87 0.52 -1.36 1.67 5.85 -0.86 -0.39 115.31 121.60 1xw6 h LEU 19 Ca 0.30 -0.36 0.04 0.00 0.84 0.00 0.00 57.88 58.70 1xw6 h LEU 19 Cb 0.06 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 1xw6 h LEU 19 CO -0.13 0.76 0.46 -0.07 -0.34 0.00 0.00 178.44 179.13 1xw6 h LEU 20 N 0.27 0.70 -0.05 2.25 3.38 -0.63 -0.31 115.31 120.93 1xw6 h LEU 20 Ca 0.07 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1xw6 h LEU 20 Cb 0.53 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1xw6 h LEU 20 CO 0.03 0.47 -0.15 -0.33 0.09 0.00 0.00 178.44 178.54 1xw6 h GLU 21 N 0.81 0.19 -0.54 1.13 4.39 -0.93 0.13 114.58 119.75 1xw6 h GLU 21 Ca 0.29 -0.14 0.01 0.00 0.34 0.00 0.00 59.36 59.86 1xw6 h GLU 21 Cb 0.13 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.78 1xw6 h GLU 21 CO -0.09 0.76 0.36 -0.92 -1.16 0.00 0.00 179.01 177.97 1xw6 h TYR 22 N -0.34 0.68 -0.03 4.33 3.20 -0.75 -1.52 116.97 122.54 1xw6 h TYR 22 Ca -0.01 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.88 1xw6 h TYR 22 Cb 0.78 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 38.82 1xw6 h TYR 22 CO 0.13 0.43 0.00 0.25 -1.64 0.00 0.00 178.16 177.33 1xw6 n THR 23 N -4.45 0.03 -3.50 1.81 -2.24 -0.15 -4.93 114.28 100.84 1xw6 n THR 23 Ca 0.05 -0.18 -0.20 0.00 -2.27 0.00 0.00 64.05 61.45 1xw6 n THR 23 Cb 0.05 0.15 0.08 0.00 -2.10 0.00 0.00 70.33 68.51 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 -0.20 -4.40 -4.79 3.42 -0.08 -0.57 -4.97 116.55 104.96 1xw6 n ASP 24 Ca 0.20 -0.57 -0.37 0.00 -1.51 0.00 0.00 54.79 52.54 1xw6 n ASP 24 Cb 0.26 -5.00 -0.06 0.00 2.34 0.00 0.00 41.12 38.66 1xw6 n ASP 24 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 1xw6 s SER 25 N -3.78 7.26 -0.46 1.67 0.01 0.42 -5.02 113.70 113.80 1xw6 s SER 25 Ca 0.32 1.73 -0.24 0.00 1.31 0.00 0.00 55.95 59.07 1xw6 s SER 25 Cb -0.14 -2.54 0.03 0.00 0.21 0.00 0.00 66.02 63.58 1xw6 s SER 25 CO 0.72 -0.05 0.82 -0.55 0.41 0.00 0.00 173.24 174.59 1xw6 s SER 26 N -1.64 6.42 0.13 2.44 0.15 -1.26 -4.84 113.70 115.10 1xw6 s SER 26 Ca 0.49 -0.08 -0.13 0.00 0.70 0.00 0.00 55.95 56.92 1xw6 s SER 26 Cb -0.18 -2.40 0.02 0.00 -1.71 0.00 0.00 66.02 61.75 1xw6 s SER 26 CO 0.23 -0.96 0.35 -0.72 1.20 0.00 0.00 173.24 173.34 1xw6 s TYR 27 N 3.41 0.00 0.36 3.44 1.13 -1.26 -1.40 117.35 123.03 1xw6 s TYR 27 Ca 0.31 -0.36 0.06 0.00 -1.41 0.00 0.00 57.07 55.67 1xw6 s TYR 27 Cb -0.12 0.14 -0.07 0.00 -1.10 0.00 0.00 41.96 40.82 1xw6 s TYR 27 CO 0.23 -0.70 0.01 -1.21 -2.51 0.00 0.00 175.55 171.38 1xw6 s GLU 28 N -3.86 1.79 -0.10 -3.49 2.02 0.94 -4.86 118.70 111.14 1xw6 s GLU 28 Ca 0.07 -1.99 -0.00 0.00 0.02 0.00 0.00 54.97 53.06 1xw6 s GLU 28 Cb 0.02 -1.30 0.02 0.00 0.10 0.00 0.00 34.13 32.98 1xw6 s GLU 28 CO -0.08 -0.08 -0.07 -1.21 0.02 0.00 0.00 175.26 173.83 1xw6 s GLU 29 N -3.77 1.46 -0.55 1.61 2.02 -1.26 -1.19 118.70 117.01 1xw6 s GLU 29 Ca 0.35 -0.24 -0.20 0.00 0.02 0.00 0.00 54.97 54.90 1xw6 s GLU 29 Cb 0.08 -1.51 0.07 0.00 0.10 0.00 0.00 34.13 32.88 1xw6 s GLU 29 CO 0.16 -0.23 0.72 0.21 0.02 0.00 0.00 175.26 176.14 1xw6 s LYS 30 N 1.60 3.12 -0.08 1.61 2.36 -0.02 -4.95 119.74 123.37 1xw6 s LYS 30 Ca 0.03 -0.94 -0.16 0.00 -2.55 0.00 0.00 55.97 52.34 1xw6 s LYS 30 Cb -0.13 -4.16 -0.05 0.00 -1.05 0.00 0.00 37.83 32.45 1xw6 s LYS 30 CO -0.07 -1.41 0.43 0.15 1.55 0.00 0.00 175.35 176.00 1xw6 s LYS 31 N 2.95 4.19 -0.10 4.03 1.02 -1.26 -2.31 119.74 128.26 1xw6 s LYS 31 Ca 0.16 0.39 0.00 0.00 0.02 0.00 0.00 55.97 56.54 1xw6 s LYS 31 Cb -0.20 -3.36 -0.03 0.00 -0.52 0.00 0.00 37.83 33.73 1xw6 s LYS 31 CO 0.11 0.36 -0.09 0.71 -0.92 0.00 0.00 175.35 175.52 1xw6 s TYR 32 N -0.00 2.89 -0.13 3.18 1.51 -0.61 -4.90 117.35 119.28 1xw6 s TYR 32 Ca 0.24 -0.22 -0.04 0.00 -1.01 0.00 0.00 57.07 56.03 1xw6 s TYR 32 Cb -0.15 -1.78 -0.03 0.00 -0.11 0.00 0.00 41.96 39.88 1xw6 s TYR 32 CO 0.10 0.11 0.02 0.99 -1.11 0.00 0.00 175.55 175.66 1xw6 s THR 33 N -0.30 4.41 -0.03 -0.71 2.01 -1.26 -0.31 115.64 119.45 1xw6 s THR 33 Ca 0.04 -0.19 -0.14 0.00 0.31 0.00 0.00 61.69 61.70 1xw6 s THR 33 Cb -0.13 -2.91 -0.05 0.00 0.01 0.00 0.00 72.50 69.42 1xw6 s THR 33 CO 0.03 0.54 0.39 -0.32 -0.69 0.00 0.00 174.62 174.56 1xw6 s MET 34 N -0.24 3.95 0.74 4.92 1.75 -1.26 -4.64 119.30 124.51 1xw6 s MET 34 Ca 0.06 0.36 -0.12 0.00 -1.25 0.00 0.00 55.69 54.74 1xw6 s MET 34 Cb -0.12 -3.25 0.04 0.00 2.84 0.00 0.00 34.83 34.34 1xw6 s MET 34 CO 0.02 0.62 1.10 0.20 -0.65 0.00 0.00 175.02 176.31 1xw6 s GLY 35 N -0.82 1.85 1.01 2.11 0.00 0.68 -4.86 107.32 107.28 1xw6 s GLY 35 Ca 0.23 0.39 -0.15 0.00 0.00 0.00 0.00 44.72 45.19 1xw6 s GLY 35 CO 0.12 0.75 1.16 0.99 0.00 0.00 0.00 173.10 176.11 1xw6 s ASP 36 N -3.05 2.66 0.94 1.64 1.11 -1.26 -3.75 116.67 114.95 1xw6 s ASP 36 Ca 0.64 0.78 -0.11 0.00 0.18 0.00 0.00 52.55 54.04 1xw6 s ASP 36 Cb -0.19 -1.19 0.16 0.00 1.07 0.00 0.00 42.92 42.76 1xw6 s ASP 36 CO 0.51 -3.06 1.11 0.00 1.18 0.00 0.00 175.17 174.90 1xw6 s ALA 37 N -3.27 1.21 -0.83 5.23 0.00 -1.26 -1.63 121.76 121.21 1xw6 s ALA 37 Ca 0.68 0.30 0.26 0.00 0.00 0.00 0.00 51.96 53.19 1xw6 s ALA 37 Cb -0.12 -3.34 0.66 0.00 0.00 0.00 0.00 23.12 20.31 1xw6 s ALA 37 CO 0.54 -2.77 1.55 -0.35 0.00 0.00 0.00 175.76 174.74 1xw6 n PRO 38 N -4.21 0.15 -0.04 0.00 -0.04 -1.26 -4.77 135.00 124.83 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 -0.07 0.00 -0.04 0.00 0.00 33.50 32.31 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 0.92 -5.81 3.54 5.19 -1.92 -3.48 116.42 114.86 1xw6 h ASP 39 Ca 0.00 -0.61 -0.36 0.00 -0.62 0.00 0.00 57.03 55.44 1xw6 h ASP 39 Cb 0.62 -0.27 0.13 0.00 0.18 0.00 0.00 39.33 39.99 1xw6 h ASP 39 CO 0.00 1.37 -0.80 -1.22 -3.12 0.00 0.00 179.24 175.47 1xw6 n TYR 40 N -3.99 -2.10 -1.68 4.55 4.01 -0.64 -4.82 117.16 112.48 1xw6 n TYR 40 Ca -0.07 0.89 -0.54 0.00 -0.16 0.00 0.00 57.90 58.02 1xw6 n TYR 40 Cb 0.70 -4.74 -0.06 0.00 -0.31 0.00 0.00 39.34 34.93 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 -3.10 2.51 -0.61 7.72 2.03 -1.25 -4.47 116.55 119.38 1xw6 n ASP 41 Ca -0.28 1.06 0.06 0.00 0.52 0.00 0.00 54.79 56.16 1xw6 n ASP 41 Cb 0.67 -1.21 0.16 0.00 -0.72 0.00 0.00 41.12 40.03 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 5.07 2.83 0.31 -0.67 1.74 -1.26 -0.23 116.66 124.45 1xw6 n ARG 42 Ca 0.24 -2.24 0.18 0.00 -0.77 0.00 0.00 57.85 55.27 1xw6 n ARG 42 Cb 0.18 -1.41 1.03 0.00 -1.02 0.00 0.00 32.46 31.24 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 1.62 0.00 -0.17 0.55 4.64 -1.90 -1.12 113.55 117.17 1xw6 h SER 43 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 1xw6 h SER 43 Cb 0.92 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.99 1xw6 h SER 43 CO 0.06 0.00 0.02 -0.61 -0.87 0.00 0.00 176.83 175.44 1xw6 h GLN 44 N 0.00 0.40 0.00 4.77 4.15 -1.84 -1.24 115.11 121.35 1xw6 h GLN 44 Ca -0.00 -0.07 -0.17 0.00 0.77 0.00 0.00 58.65 59.18 1xw6 h GLN 44 Cb 0.02 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.62 1xw6 h GLN 44 CO 0.00 0.42 -1.01 2.35 -1.93 0.00 0.00 178.83 178.65 1xw6 h TRP 45 N 0.39 0.00 -0.86 3.99 -0.00 -1.60 -3.40 115.95 114.47 1xw6 h TRP 45 Ca 0.09 0.00 0.14 0.00 -0.00 0.00 0.00 58.89 59.12 1xw6 h TRP 45 Cb 0.23 0.00 -0.07 0.00 -0.00 0.00 0.00 29.16 29.33 1xw6 h TRP 45 CO 0.01 1.18 0.56 -0.07 -0.00 0.00 0.00 178.44 180.12 1xw6 h LEU 46 N -1.00 0.63 0.00 0.65 3.38 -1.23 0.47 115.31 118.21 1xw6 h LEU 46 Ca -0.26 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1xw6 h LEU 46 Cb 1.13 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1xw6 h LEU 46 CO -0.16 0.33 0.00 0.59 0.09 0.00 0.00 178.44 179.29 1xw6 n ASN 47 N -4.54 0.00 0.00 -0.43 5.03 -0.47 -2.97 115.26 111.87 1xw6 n ASN 47 Ca 0.16 -0.84 0.00 0.00 0.87 0.00 0.00 54.58 54.77 1xw6 n ASN 47 Cb 0.45 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.21 1xw6 n ASN 47 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.26 176.64 1xw6 n GLU 48 N -0.91 2.95 -0.27 3.52 2.13 -0.11 -4.89 120.64 123.06 1xw6 n GLU 48 Ca 0.14 0.00 0.08 0.00 0.66 0.00 0.00 57.16 58.04 1xw6 n GLU 48 Cb 0.07 -0.34 0.20 0.00 0.27 0.00 0.00 31.44 31.63 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 0.15 -0.67 5.31 3.64 -0.04 -0.99 116.57 123.98 1xw6 h LYS 49 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1xw6 h LYS 49 Cb 0.00 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 1xw6 h LYS 49 CO 0.00 0.10 0.00 1.19 -2.27 0.00 0.00 179.45 178.47 1xw6 n PHE 50 N -5.28 1.18 -0.26 1.91 3.01 -1.26 -4.25 117.46 112.51 1xw6 n PHE 50 Ca 0.16 -0.51 0.05 0.00 1.01 0.00 0.00 57.45 58.16 1xw6 n PHE 50 Cb 0.54 -0.13 0.14 0.00 -0.01 0.00 0.00 39.48 40.01 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 1.25 2.86 0.00 -1.08 5.02 -0.38 -4.63 118.16 121.21 1xw6 n LYS 51 Ca 0.24 -2.06 0.09 0.00 -2.02 0.00 0.00 58.31 54.56 1xw6 n LYS 51 Cb 0.72 -1.29 0.02 0.00 -0.02 0.00 0.00 35.03 34.46 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 0.17 2.04 -0.18 -0.35 4.77 -1.23 -4.99 117.00 117.23 1xw6 n LEU 52 Ca 0.11 -0.83 -0.02 0.00 -0.03 0.00 0.00 56.01 55.24 1xw6 n LEU 52 Cb 0.45 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.53 1xw6 n LEU 52 CO 0.07 0.37 -0.02 0.61 -1.33 0.00 0.00 177.39 177.09 1xw6 n GLY 53 N 1.23 0.56 3.73 -0.72 0.00 -1.26 -5.03 105.19 103.72 1xw6 n GLY 53 Ca 0.09 -0.95 -0.40 0.00 0.00 0.00 0.00 46.02 44.75 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 -0.54 4.44 0.05 0.99 1.43 -1.26 -4.90 118.68 118.89 1xw6 s LEU 54 Ca 0.00 1.52 -0.25 0.00 -1.03 0.00 0.00 54.13 54.37 1xw6 s LEU 54 Cb 0.00 -3.32 -0.17 0.00 0.03 0.00 0.00 46.19 42.73 1xw6 s LEU 54 CO 0.00 -0.04 1.55 0.44 0.23 0.00 0.00 176.35 178.52 1xw6 h ASP 55 N 5.87 -0.10 -3.51 2.29 3.32 -1.96 -3.34 116.42 119.00 1xw6 h ASP 55 Ca -0.43 -0.15 -0.63 0.00 0.02 0.00 0.00 57.03 55.84 1xw6 h ASP 55 Cb 1.21 0.03 -0.42 0.00 0.22 0.00 0.00 39.33 40.37 1xw6 h ASP 55 CO 0.72 0.09 -0.58 -0.36 -1.72 0.00 0.00 179.24 177.39 1xw6 s PHE 56 N -5.48 3.46 -0.43 4.55 0.08 -1.26 -5.07 117.98 113.83 1xw6 s PHE 56 Ca -0.14 -3.28 -0.44 0.00 0.12 0.00 0.00 56.93 53.18 1xw6 s PHE 56 Cb 0.04 -2.76 -0.18 0.00 -0.57 0.00 0.00 43.02 39.55 1xw6 s PHE 56 CO 0.65 -0.61 1.73 -2.30 -0.10 0.00 0.00 175.22 174.59 1xw6 n PRO 57 N 2.33 0.38 -3.84 0.24 -0.02 -1.25 -4.86 135.00 127.97 1xw6 n PRO 57 Ca 0.15 0.14 -0.07 0.00 -2.02 0.00 0.00 63.50 61.70 1xw6 n PRO 57 Cb 0.34 -1.72 -0.01 0.00 -0.02 0.00 0.00 33.50 32.10 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 3.70 -0.19 -0.06 2.55 3.84 -1.26 -5.10 114.94 118.42 1xw6 s ASN 58 Ca 1.05 -0.72 0.03 0.00 0.21 0.00 0.00 52.86 53.43 1xw6 s ASN 58 Cb -1.35 0.73 0.01 0.00 -0.55 0.00 0.00 41.25 40.09 1xw6 s ASN 58 CO 0.74 -1.38 -0.13 -0.76 -2.79 0.00 0.00 177.10 172.78 1xw6 s LEU 59 N -2.97 1.71 0.65 3.21 1.43 -1.26 -4.02 118.68 117.43 1xw6 s LEU 59 Ca 0.12 -0.31 -0.11 0.00 -1.03 0.00 0.00 54.13 52.80 1xw6 s LEU 59 Cb -0.05 -0.86 -0.02 0.00 0.03 0.00 0.00 46.19 45.29 1xw6 s LEU 59 CO 0.08 0.06 1.04 -2.16 0.23 0.00 0.00 176.35 175.59 1xw6 s PRO 60 N 0.54 3.33 0.10 1.29 0.04 -1.26 -4.94 135.00 134.10 1xw6 s PRO 60 Ca -0.13 0.83 0.04 0.00 0.04 0.00 0.00 61.00 61.78 1xw6 s PRO 60 Cb -0.15 -2.04 -0.04 0.00 0.04 0.00 0.00 34.50 32.31 1xw6 s PRO 60 CO 0.04 -0.79 -0.10 1.52 0.04 0.00 0.00 177.00 177.71 1xw6 s TYR 61 N -3.13 1.06 -0.07 0.56 -0.85 -0.59 -3.84 117.35 110.50 1xw6 s TYR 61 Ca 0.56 -0.69 0.00 0.00 -0.52 0.00 0.00 57.07 56.42 1xw6 s TYR 61 Cb -0.12 -0.58 0.02 0.00 0.38 0.00 0.00 41.96 41.66 1xw6 s TYR 61 CO 0.54 -0.01 -0.04 -1.17 -1.52 0.00 0.00 175.55 173.35 1xw6 s LEU 62 N -2.59 1.10 -0.25 -3.49 2.96 0.34 -1.03 118.68 115.73 1xw6 s LEU 62 Ca 0.07 -0.17 -0.05 0.00 -0.22 0.00 0.00 54.13 53.77 1xw6 s LEU 62 Cb -0.01 -0.56 -0.00 0.00 0.50 0.00 0.00 46.19 46.11 1xw6 s LEU 62 CO -0.00 -0.10 0.00 -0.63 -1.32 0.00 0.00 176.35 174.30 1xw6 s ILE 63 N 1.37 3.63 -0.57 6.68 1.01 0.01 -0.80 121.20 132.54 1xw6 s ILE 63 Ca -0.03 -0.53 0.04 0.00 0.00 0.00 0.00 60.65 60.13 1xw6 s ILE 63 Cb -0.13 -2.73 0.17 0.00 0.01 0.00 0.00 42.46 39.77 1xw6 s ILE 63 CO -0.03 0.31 0.42 -0.62 0.00 0.00 0.00 174.94 175.02 1xw6 s ASP 64 N 1.49 3.28 1.53 3.58 2.15 0.58 -1.04 116.67 128.24 1xw6 s ASP 64 Ca 0.05 -3.48 0.00 0.00 0.43 0.00 0.00 52.55 49.55 1xw6 s ASP 64 Cb -0.15 -1.09 0.00 0.00 -0.30 0.00 0.00 42.92 41.38 1xw6 s ASP 64 CO -0.01 -0.13 0.00 0.61 -0.17 0.00 0.00 175.17 175.48 1xw6 n GLY 65 N 2.39 3.19 0.22 2.66 0.00 -1.26 -2.08 105.19 110.31 1xw6 n GLY 65 Ca 0.24 -0.12 0.10 0.00 0.00 0.00 0.00 46.02 46.24 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 -0.53 0.98 -1.95 4.61 0.00 -2.01 -3.43 119.26 116.94 1xw6 h ALA 66 Ca 0.00 -0.21 -0.59 0.00 0.00 0.00 0.00 54.91 54.11 1xw6 h ALA 66 Cb 0.00 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 17.66 1xw6 h ALA 66 CO 0.00 0.29 0.67 -1.01 0.00 0.00 0.00 179.25 179.20 1xw6 s HIS 67 N -3.56 3.00 -0.27 0.00 3.76 -0.88 -5.02 115.29 112.31 1xw6 s HIS 67 Ca 0.01 0.69 -0.04 0.00 -0.15 0.00 0.00 55.06 55.57 1xw6 s HIS 67 Cb 0.10 -3.87 0.02 0.00 1.11 0.00 0.00 32.58 29.94 1xw6 s HIS 67 CO 0.64 -0.97 0.00 0.15 -0.85 0.00 0.00 174.74 173.71 1xw6 s LYS 68 N 3.73 2.91 -0.01 1.40 3.01 -1.26 -0.30 119.74 129.21 1xw6 s LYS 68 Ca 0.40 -0.95 0.07 0.00 -1.01 0.00 0.00 55.97 54.48 1xw6 s LYS 68 Cb -0.11 -3.16 -0.02 0.00 -1.01 0.00 0.00 37.83 33.54 1xw6 s LYS 68 CO 0.23 -0.43 -0.22 0.42 0.51 0.00 0.00 175.35 175.85 1xw6 s ILE 69 N 1.39 1.74 0.49 2.17 1.01 0.02 -4.80 121.20 123.22 1xw6 s ILE 69 Ca 0.01 -0.97 0.02 0.00 0.00 0.00 0.00 60.65 59.71 1xw6 s ILE 69 Cb -0.17 -1.45 -0.01 0.00 0.01 0.00 0.00 42.46 40.84 1xw6 s ILE 69 CO -0.01 0.47 0.04 0.42 0.00 0.00 0.00 174.94 175.85 1xw6 s THR 70 N -0.54 1.00 -0.00 2.92 -4.23 -1.26 -0.50 115.64 113.02 1xw6 s THR 70 Ca 0.08 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.59 1xw6 s THR 70 Cb -0.09 -2.20 0.00 0.00 1.34 0.00 0.00 72.50 71.56 1xw6 s THR 70 CO -0.01 0.00 0.01 0.00 -0.54 0.00 0.00 174.62 174.09 1xw6 n GLN 71 N -1.18 -1.62 -0.29 3.99 1.13 -1.25 -4.36 117.38 113.80 1xw6 n GLN 71 Ca -0.16 1.52 0.03 0.00 -1.94 0.00 0.00 57.00 56.46 1xw6 n GLN 71 Cb 0.66 -1.91 0.11 0.00 0.11 0.00 0.00 30.24 29.22 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 1.34 -0.75 0.08 1.08 4.64 -1.92 0.09 113.55 118.12 1xw6 h SER 72 Ca -0.03 0.25 -0.04 0.00 -0.47 0.00 0.00 61.79 61.50 1xw6 h SER 72 Cb 0.07 0.51 -0.01 0.00 -0.31 0.00 0.00 62.40 62.66 1xw6 h SER 72 CO 0.00 -0.27 -0.14 0.78 -0.87 0.00 0.00 176.83 176.32 1xw6 h ASN 73 N 0.00 0.12 -0.36 4.97 2.35 -1.95 -1.68 115.58 119.05 1xw6 h ASN 73 Ca 0.41 -0.02 -0.17 0.00 -0.55 0.00 0.00 56.30 55.97 1xw6 h ASN 73 Cb 0.63 -0.03 -0.00 0.00 0.05 0.00 0.00 38.32 38.97 1xw6 h ASN 73 CO -0.86 0.28 -0.43 0.00 -1.65 0.00 0.00 177.43 174.78 1xw6 h ALA 74 N 1.73 0.55 -0.51 -0.83 0.00 -1.23 -1.94 119.26 117.03 1xw6 h ALA 74 Ca 0.03 -0.47 -0.03 0.00 0.00 0.00 0.00 54.91 54.43 1xw6 h ALA 74 Cb 0.34 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1xw6 h ALA 74 CO 0.02 0.68 0.20 0.82 0.00 0.00 0.00 179.25 180.97 1xw6 h ILE 75 N 0.74 1.22 -0.63 0.00 2.04 -0.74 -1.07 117.51 119.07 1xw6 h ILE 75 Ca 0.05 -0.68 -0.02 0.00 1.00 0.00 0.00 64.86 65.21 1xw6 h ILE 75 Cb 1.03 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 37.79 1xw6 h ILE 75 CO 0.10 0.25 0.32 -0.07 0.00 0.00 0.00 178.15 178.75 1xw6 h LEU 76 N 0.68 0.81 -0.87 1.44 3.38 -1.26 -2.34 115.31 117.15 1xw6 h LEU 76 Ca 0.17 -0.12 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 1xw6 h LEU 76 Cb 0.21 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1xw6 h LEU 76 CO -0.01 0.70 0.13 0.00 0.09 0.00 0.00 178.44 179.34 1xw6 h TYR 78 N 0.92 -0.03 -0.09 0.00 3.20 -0.95 -0.94 116.97 119.08 1xw6 h TYR 78 Ca 0.19 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.05 1xw6 h TYR 78 Cb 0.36 0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.63 1xw6 h TYR 78 CO 0.02 0.04 0.01 0.82 -1.64 0.00 0.00 178.16 177.41 1xw6 h ILE 79 N -0.09 1.23 -0.80 1.81 2.04 -1.34 -3.16 117.51 117.20 1xw6 h ILE 79 Ca -0.00 -0.72 0.11 0.00 1.00 0.00 0.00 64.86 65.24 1xw6 h ILE 79 Cb 0.08 1.55 -0.06 0.00 -0.74 0.00 0.00 36.82 37.65 1xw6 h ILE 79 CO 0.01 0.20 0.52 0.00 0.00 0.00 0.00 178.15 178.88 1xw6 h ALA 80 N 0.76 1.83 -0.35 1.87 0.00 -0.88 -1.66 119.26 120.83 1xw6 h ALA 80 Ca 0.03 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1xw6 h ALA 80 Cb 0.31 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1xw6 h ALA 80 CO 0.00 -0.01 0.06 0.00 0.00 0.00 0.00 179.25 179.30 1xw6 h ARG 81 N 0.67 0.51 0.00 0.00 3.08 -1.14 -0.26 114.38 117.25 1xw6 h ARG 81 Ca 0.38 -0.09 -0.02 0.00 0.07 0.00 0.00 59.98 60.31 1xw6 h ARG 81 Cb 0.55 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.51 1xw6 h ARG 81 CO -0.15 0.50 -0.12 0.87 -1.07 0.00 0.00 179.97 180.00 1xw6 h LYS 82 N 0.50 0.00 0.00 0.04 1.57 -1.33 -3.27 116.57 114.09 1xw6 h LYS 82 Ca 0.12 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.88 1xw6 h LYS 82 Cb 0.24 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 1xw6 h LYS 82 CO 0.00 0.12 -0.34 0.72 -0.57 0.00 0.00 179.45 179.37 1xw6 n HIS 83 N -3.24 0.00 -4.01 -1.35 8.25 -0.85 -5.01 115.22 109.01 1xw6 n HIS 83 Ca 0.01 -1.18 -0.28 0.00 -0.26 0.00 0.00 57.72 56.00 1xw6 n HIS 83 Cb 0.39 -0.20 -0.03 0.00 1.12 0.00 0.00 29.99 31.28 1xw6 n HIS 83 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1xw6 n ASN 84 N -1.09 -0.66 -0.75 0.41 5.15 -0.78 -4.89 115.26 112.65 1xw6 n ASN 84 Ca 0.16 -1.08 0.03 0.00 -0.60 0.00 0.00 54.58 53.10 1xw6 n ASN 84 Cb 0.70 -2.73 0.20 0.00 -0.53 0.00 0.00 39.78 37.42 1xw6 n ASN 84 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1xw6 n LEU 85 N -4.45 3.15 -0.00 1.20 4.77 -0.18 -4.63 117.00 116.86 1xw6 n LEU 85 Ca -0.29 -3.82 0.10 0.00 -0.03 0.00 0.00 56.01 51.97 1xw6 n LEU 85 Cb 0.68 -0.56 -0.13 0.00 -2.33 0.00 0.00 43.42 41.08 1xw6 n LEU 85 CO 0.76 1.32 -0.24 0.00 -1.33 0.00 0.00 177.39 177.90 1xw6 n GLY 87 N 1.43 2.65 0.51 0.00 0.00 -1.26 -4.66 105.19 103.87 1xw6 n GLY 87 Ca 0.02 -1.56 -0.11 0.00 0.00 0.00 0.00 46.02 44.37 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 1.24 0.32 -1.53 1.61 1.02 -1.26 -4.80 120.64 117.24 1xw6 n GLU 88 Ca 0.00 0.13 -0.30 0.00 -0.02 0.00 0.00 57.16 56.97 1xw6 n GLU 88 Cb 0.00 -1.04 0.09 0.00 -0.02 0.00 0.00 31.44 30.47 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 -2.39 3.09 0.17 2.62 -4.23 -1.26 -4.90 115.64 108.75 1xw6 s THR 89 Ca -0.19 0.36 -0.12 0.00 -1.18 0.00 0.00 61.69 60.55 1xw6 s THR 89 Cb 0.06 -3.09 0.08 0.00 1.34 0.00 0.00 72.50 70.89 1xw6 s THR 89 CO 0.26 -0.46 1.75 -0.08 -0.54 0.00 0.00 174.62 175.55 1xw6 h GLU 90 N -1.09 0.85 -0.88 3.99 4.57 -1.99 -2.24 114.58 117.78 1xw6 h GLU 90 Ca -0.47 -0.13 0.01 0.00 -1.18 0.00 0.00 59.36 57.59 1xw6 h GLU 90 Cb 1.27 -0.15 -0.04 0.00 -0.16 0.00 0.00 28.75 29.66 1xw6 h GLU 90 CO 0.59 0.70 0.57 1.49 -1.18 0.00 0.00 179.01 181.18 1xw6 h GLU 91 N 0.80 1.17 -0.30 1.92 4.22 -1.96 -1.29 114.58 119.14 1xw6 h GLU 91 Ca 0.20 -0.08 -0.04 0.00 0.08 0.00 0.00 59.36 59.52 1xw6 h GLU 91 Cb 0.13 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 1xw6 h GLU 91 CO -0.02 0.78 0.03 0.93 -2.18 0.00 0.00 179.01 178.55 1xw6 h GLU 92 N 1.20 0.51 -0.83 1.92 5.08 -1.71 -2.43 114.58 118.32 1xw6 h GLU 92 Ca 0.32 -0.15 -0.01 0.00 -1.00 0.00 0.00 59.36 58.52 1xw6 h GLU 92 Cb -0.12 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.04 1xw6 h GLU 92 CO -0.07 0.63 0.48 0.87 -1.00 0.00 0.00 179.01 179.92 1xw6 h LYS 93 N 0.31 1.13 -0.41 2.33 1.57 -0.97 0.05 116.57 120.59 1xw6 h LYS 93 Ca 0.09 -0.11 -0.04 0.00 -1.87 0.00 0.00 60.65 58.71 1xw6 h LYS 93 Cb 0.39 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 1xw6 h LYS 93 CO 0.01 0.81 0.10 0.82 -0.57 0.00 0.00 179.45 180.62 1xw6 h ILE 94 N 1.15 1.23 -0.61 1.86 2.04 -1.21 -1.05 117.51 120.92 1xw6 h ILE 94 Ca 0.29 -0.79 -0.03 0.00 1.00 0.00 0.00 64.86 65.33 1xw6 h ILE 94 Cb -0.01 0.96 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 1xw6 h ILE 94 CO -0.05 0.28 0.25 0.03 0.00 0.00 0.00 178.15 178.66 1xw6 h ARG 95 N 0.52 0.91 -0.16 2.37 3.08 -0.98 -1.61 114.38 118.51 1xw6 h ARG 95 Ca 0.13 -0.16 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 1xw6 h ARG 95 Cb 0.31 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 1xw6 h ARG 95 CO 0.00 0.77 0.09 0.28 -1.07 0.00 0.00 179.97 180.04 1xw6 h VAL 96 N 0.85 1.09 0.15 2.04 2.07 -0.86 -1.42 116.25 120.17 1xw6 h VAL 96 Ca 0.20 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.49 1xw6 h VAL 96 Cb 0.19 0.95 -0.00 0.00 -1.52 0.00 0.00 31.29 30.91 1xw6 h VAL 96 CO -0.02 0.08 -0.09 0.44 0.02 0.00 0.00 177.57 178.01 1xw6 h ASP 97 N 0.18 -0.21 -0.37 0.57 3.32 -1.07 0.14 116.42 118.98 1xw6 h ASP 97 Ca 0.06 0.01 0.04 0.00 0.02 0.00 0.00 57.03 57.16 1xw6 h ASP 97 Cb 0.05 0.06 -0.04 0.00 0.22 0.00 0.00 39.33 39.63 1xw6 h ASP 97 CO -0.01 -0.14 0.15 0.40 -1.72 0.00 0.00 179.24 177.92 1xw6 h ILE 98 N -0.22 0.92 -0.44 0.35 2.04 -1.26 -2.80 117.51 116.10 1xw6 h ILE 98 Ca -0.02 -0.11 -0.08 0.00 1.00 0.00 0.00 64.86 65.66 1xw6 h ILE 98 Cb 0.18 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 1xw6 h ILE 98 CO 0.02 0.06 -0.03 -0.07 0.00 0.00 0.00 178.15 178.12 1xw6 h LEU 99 N 0.31 0.79 -0.88 1.44 3.38 -1.10 0.15 115.31 119.39 1xw6 h LEU 99 Ca 0.16 -0.33 0.15 0.00 0.09 0.00 0.00 57.88 57.96 1xw6 h LEU 99 Cb 0.12 -0.21 -0.10 0.00 0.09 0.00 0.00 40.66 40.56 1xw6 h LEU 99 CO -0.15 0.93 0.48 -0.08 0.09 0.00 0.00 178.44 179.70 1xw6 h GLU 100 N 0.63 0.64 0.18 1.13 4.81 -0.58 0.11 114.58 121.50 1xw6 h GLU 100 Ca 0.12 -0.04 -0.33 0.00 -0.13 0.00 0.00 59.36 58.98 1xw6 h GLU 100 Cb 0.54 -0.14 0.01 0.00 0.63 0.00 0.00 28.75 29.79 1xw6 h GLU 100 CO 0.03 0.42 -1.59 -0.91 -0.73 0.00 0.00 179.01 176.24 1xw6 h ASN 101 N 0.66 0.61 -0.30 1.04 2.35 -1.39 -3.28 115.58 115.26 1xw6 h ASN 101 Ca 0.49 -0.79 -0.01 0.00 -0.55 0.00 0.00 56.30 55.44 1xw6 h ASN 101 Cb 0.70 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.85 1xw6 h ASN 101 CO -0.36 1.65 0.15 -0.61 -1.65 0.00 0.00 177.43 176.60 1xw6 h GLN 102 N 0.11 0.44 -0.86 0.81 5.75 -0.14 -2.21 115.11 119.01 1xw6 h GLN 102 Ca -0.28 -0.06 0.00 0.00 -0.15 0.00 0.00 58.65 58.16 1xw6 h GLN 102 Cb 2.09 -0.08 -0.04 0.00 1.07 0.00 0.00 27.48 30.52 1xw6 h GLN 102 CO 0.20 0.41 0.54 1.79 -2.65 0.00 0.00 178.83 179.13 1xw6 h THR 103 N 0.36 1.23 -0.76 2.39 1.35 -0.95 -1.19 112.91 115.34 1xw6 h THR 103 Ca 0.10 -0.46 -0.04 0.00 -0.55 0.00 0.00 66.41 65.46 1xw6 h THR 103 Cb 0.12 -0.01 -0.03 0.00 -1.73 0.00 0.00 68.15 66.50 1xw6 h THR 103 CO -0.01 0.23 0.31 -0.03 -0.25 0.00 0.00 175.52 175.77 1xw6 h MET 104 N 1.17 1.12 0.11 4.72 1.85 -1.59 0.57 114.93 122.89 1xw6 h MET 104 Ca 0.31 -0.19 -0.01 0.00 -0.61 0.00 0.00 59.70 59.21 1xw6 h MET 104 Cb -0.09 -0.19 0.00 0.00 0.43 0.00 0.00 31.60 31.75 1xw6 h MET 104 CO -0.06 0.90 -0.05 -0.44 -0.40 0.00 0.00 176.91 176.85 1xw6 h ASP 105 N 1.10 -0.13 -0.40 1.39 3.32 -0.74 0.78 116.42 121.74 1xw6 h ASP 105 Ca 0.26 -0.03 -0.08 0.00 0.02 0.00 0.00 57.03 57.20 1xw6 h ASP 105 Cb 0.19 0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.75 1xw6 h ASP 105 CO -0.02 -0.05 -0.01 0.78 -1.72 0.00 0.00 179.24 178.21 1xw6 h ASN 106 N -0.19 0.77 -0.07 6.45 -0.26 -0.88 -2.02 115.58 119.38 1xw6 h ASN 106 Ca -0.02 -0.19 -0.00 0.00 -0.56 0.00 0.00 56.30 55.53 1xw6 h ASN 106 Cb 0.15 -0.20 -0.00 0.00 -1.06 0.00 0.00 38.32 37.20 1xw6 h ASN 106 CO 0.02 0.84 0.04 -0.74 -1.06 0.00 0.00 177.43 176.54 1xw6 h HIS 107 N 0.74 0.09 -0.81 1.19 2.76 0.45 -2.85 115.15 116.72 1xw6 h HIS 107 Ca 0.14 -0.00 0.08 0.00 -2.20 0.00 0.00 60.37 58.39 1xw6 h HIS 107 Cb 0.47 -0.03 -0.07 0.00 1.55 0.00 0.00 27.41 29.33 1xw6 h HIS 107 CO 0.02 0.10 0.47 0.52 -1.30 0.00 0.00 177.93 177.74 1xw6 h MET 108 N 0.06 0.80 -0.87 5.26 2.86 -0.55 -1.98 114.93 120.51 1xw6 h MET 108 Ca 0.02 -0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.64 1xw6 h MET 108 Cb 0.03 -0.18 -0.05 0.00 0.06 0.00 0.00 31.60 31.47 1xw6 h MET 108 CO -0.00 0.53 0.57 1.96 1.06 0.00 0.00 176.91 181.02 1xw6 h GLN 109 N 0.82 1.10 -0.07 1.72 4.20 -1.16 0.25 115.11 121.98 1xw6 h GLN 109 Ca 0.38 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.99 1xw6 h GLN 109 Cb 0.29 -0.25 -0.00 0.00 0.30 0.00 0.00 27.48 27.82 1xw6 h GLN 109 CO -0.22 0.73 -0.08 1.25 -0.67 0.00 0.00 178.83 179.84 1xw6 h LEU 110 N 1.14 0.18 -1.54 1.46 5.85 -1.25 -3.12 115.31 118.02 1xw6 h LEU 110 Ca 0.33 -0.50 -0.01 0.00 0.84 0.00 0.00 57.88 58.54 1xw6 h LEU 110 Cb -0.07 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 40.89 1xw6 h LEU 110 CO -0.08 0.65 0.20 1.23 -0.34 0.00 0.00 178.44 180.10 1xw6 h GLY 111 N -0.28 0.54 0.97 3.75 0.00 -1.01 -1.80 103.07 105.25 1xw6 h GLY 111 Ca 0.01 -0.22 0.01 0.00 0.00 0.00 0.00 47.33 47.12 1xw6 h GLY 111 CO 0.02 0.22 0.15 -0.33 0.00 0.00 0.00 176.54 176.60 1xw6 h MET 112 N 0.51 0.30 0.06 4.80 2.86 -0.45 -1.91 114.93 121.10 1xw6 h MET 112 Ca 0.13 -0.02 -0.24 0.00 -2.06 0.00 0.00 59.70 57.52 1xw6 h MET 112 Cb 0.02 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.61 1xw6 h MET 112 CO -0.02 0.20 -1.07 -0.84 1.06 0.00 0.00 176.91 176.24 1xw6 h ILE 113 N 0.31 1.54 -0.02 -1.22 3.07 -1.49 -2.82 117.51 116.88 1xw6 h ILE 113 Ca 0.09 -2.98 -0.08 0.00 1.55 0.00 0.00 64.86 63.45 1xw6 h ILE 113 Cb -0.02 2.75 -0.01 0.00 -0.27 0.00 0.00 36.82 39.27 1xw6 h ILE 113 CO -0.03 0.87 -0.35 0.00 -1.05 0.00 0.00 178.15 177.59 1xw6 n TYR 115 N -4.12 0.40 -2.23 0.00 4.01 -0.73 0.72 117.16 115.21 1xw6 n TYR 115 Ca -0.02 0.12 -0.42 0.00 -0.16 0.00 0.00 57.90 57.42 1xw6 n TYR 115 Cb 0.39 -0.54 -0.03 0.00 -0.31 0.00 0.00 39.34 38.86 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 -4.02 6.87 0.58 7.72 3.84 -1.00 -4.62 114.94 124.32 1xw6 s ASN 116 Ca 0.05 2.16 0.28 0.00 0.21 0.00 0.00 52.86 55.56 1xw6 s ASN 116 Cb 0.14 -2.57 1.55 0.00 -0.55 0.00 0.00 41.25 39.82 1xw6 s ASN 116 CO 0.75 -0.67 2.01 -0.65 -2.79 0.00 0.00 177.10 175.75 1xw6 h PRO 117 N 7.41 0.00 -1.07 0.43 0.11 -1.90 -1.02 132.00 135.95 1xw6 h PRO 117 Ca -0.39 0.00 -0.52 0.00 0.11 0.00 0.00 66.00 65.20 1xw6 h PRO 117 Cb 1.19 0.00 -0.26 0.00 0.11 0.00 0.00 31.00 32.04 1xw6 h PRO 117 CO 0.88 0.00 0.67 0.39 -0.21 0.00 0.00 178.00 179.73 1xw6 n GLU 118 N -3.85 2.27 -0.16 1.05 1.02 -1.26 -4.71 120.64 115.00 1xw6 n GLU 118 Ca 0.05 -2.72 -0.02 0.00 -0.02 0.00 0.00 57.16 54.45 1xw6 n GLU 118 Cb 0.49 -2.06 0.06 0.00 -0.02 0.00 0.00 31.44 29.90 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 1.39 -0.08 -0.35 -0.32 3.57 -1.35 -2.28 116.94 117.52 1xw6 h PHE 119 Ca 0.54 0.04 0.02 0.00 3.53 0.00 0.00 57.97 62.09 1xw6 h PHE 119 Cb 1.68 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 40.51 1xw6 h PHE 119 CO 1.32 -0.14 0.23 1.49 -2.23 0.00 0.00 178.31 178.99 1xw6 h GLU 120 N 0.09 0.40 0.08 1.11 4.57 -1.87 -0.72 114.58 118.24 1xw6 h GLU 120 Ca 0.25 -0.02 -0.26 0.00 -1.18 0.00 0.00 59.36 58.15 1xw6 h GLU 120 Cb 0.39 -0.09 0.01 0.00 -0.16 0.00 0.00 28.75 28.90 1xw6 h GLU 120 CO -0.44 0.27 -1.13 -0.22 -1.18 0.00 0.00 179.01 176.30 1xw6 h LYS 121 N 0.42 0.44 0.00 1.92 3.64 -1.81 -3.31 116.57 117.86 1xw6 h LYS 121 Ca 0.14 -0.58 -0.05 0.00 -1.27 0.00 0.00 60.65 58.89 1xw6 h LYS 121 Cb 0.04 0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 1xw6 h LYS 121 CO -0.03 1.23 -0.22 -0.07 -2.27 0.00 0.00 179.45 178.09 1xw6 h LEU 122 N 0.20 0.00 -0.80 5.20 4.07 -1.17 -3.37 115.31 119.44 1xw6 h LEU 122 Ca -0.13 0.00 0.11 0.00 0.08 0.00 0.00 57.88 57.94 1xw6 h LEU 122 Cb 1.80 0.00 -0.08 0.00 1.08 0.00 0.00 40.66 43.46 1xw6 h LEU 122 CO 0.20 0.22 0.43 0.50 -1.08 0.00 0.00 178.44 178.71 1xw6 h LYS 123 N 0.00 0.67 -0.74 1.13 3.64 -1.23 -2.93 116.57 117.12 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 1.15 -0.15 -0.07 0.00 -0.41 0.00 0.00 32.23 32.75 1xw6 h LYS 123 CO 0.03 0.44 0.40 -1.35 -2.27 0.00 0.00 179.45 176.70 1xw6 h PRO 124 N 0.69 0.68 -0.13 1.90 0.11 -1.78 -1.82 132.00 131.64 1xw6 h PRO 124 Ca 0.41 -0.04 -0.18 0.00 0.11 0.00 0.00 66.00 66.29 1xw6 h PRO 124 Cb 0.45 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 31.41 1xw6 h PRO 124 CO -0.29 0.45 -0.67 -0.22 -0.21 0.00 0.00 178.00 177.06 1xw6 h LYS 125 N 0.70 0.53 -0.54 1.05 3.64 -1.80 -2.53 116.57 117.62 1xw6 h LYS 125 Ca 0.35 -0.39 -0.03 0.00 -1.27 0.00 0.00 60.65 59.31 1xw6 h LYS 125 Cb 0.30 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 1xw6 h LYS 125 CO -0.23 1.02 0.22 -0.92 -2.27 0.00 0.00 179.45 177.26 1xw6 h TYR 126 N 0.38 0.82 0.00 1.91 3.20 -1.32 -1.65 116.97 120.32 1xw6 h TYR 126 Ca -0.02 -0.06 -0.07 0.00 3.14 0.00 0.00 58.73 61.72 1xw6 h TYR 126 Cb 1.24 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 39.25 1xw6 h TYR 126 CO 0.05 0.67 -0.33 -0.07 -1.64 0.00 0.00 178.16 176.84 1xw6 h LEU 127 N 0.73 0.00 -0.36 2.82 3.38 -1.35 -0.77 115.31 119.75 1xw6 h LEU 127 Ca 0.18 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.98 1xw6 h LEU 127 Cb 0.20 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 1xw6 h LEU 127 CO -0.01 0.33 -0.48 -0.08 0.09 0.00 0.00 178.44 178.29 1xw6 h GLU 128 N 0.00 0.87 -0.00 1.13 4.81 -1.02 -3.20 114.58 117.17 1xw6 h GLU 128 Ca -0.00 -0.51 0.00 0.00 -0.13 0.00 0.00 59.36 58.71 1xw6 h GLU 128 Cb 0.70 0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.13 1xw6 h GLU 128 CO 0.04 1.15 -0.43 0.39 -0.73 0.00 0.00 179.01 179.44 1xw6 n GLU 129 N -4.02 0.06 -0.16 1.92 1.02 -0.66 -4.40 120.64 114.41 1xw6 n GLU 129 Ca -0.03 -0.03 -0.07 0.00 -0.02 0.00 0.00 57.16 57.00 1xw6 n GLU 129 Cb 0.59 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 30.53 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 0.08 0.54 -1.17 -4.62 5.85 -1.14 -3.01 115.31 111.85 1xw6 h LEU 130 Ca 0.00 -0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.79 1xw6 h LEU 130 Cb 0.50 -0.14 -0.07 0.00 0.37 0.00 0.00 40.66 41.33 1xw6 h LEU 130 CO 0.00 0.40 0.59 -0.65 -0.34 0.00 0.00 178.44 178.43 1xw6 h PRO 131 N 0.64 0.90 -0.35 5.25 0.11 -1.77 -1.55 132.00 135.23 1xw6 h PRO 131 Ca 0.17 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 66.25 1xw6 h PRO 131 Cb -0.07 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 30.82 1xw6 h PRO 131 CO -0.04 0.60 0.19 1.49 -0.21 0.00 0.00 178.00 180.03 1xw6 h GLU 132 N 0.93 0.38 0.33 1.05 4.22 -1.82 -0.24 114.58 119.43 1xw6 h GLU 132 Ca 0.42 -0.02 -0.02 0.00 0.08 0.00 0.00 59.36 59.82 1xw6 h GLU 132 Cb 0.37 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1xw6 h GLU 132 CO -0.18 0.25 -0.16 0.87 -2.18 0.00 0.00 179.01 177.62 1xw6 h LYS 133 N 0.39 -0.43 -0.94 1.92 1.57 -1.27 -2.88 116.57 114.93 1xw6 h LYS 133 Ca 0.14 0.03 0.03 0.00 -1.87 0.00 0.00 60.65 58.98 1xw6 h LYS 133 Cb 0.02 0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.38 1xw6 h LYS 133 CO -0.08 -0.25 0.62 -0.07 -0.57 0.00 0.00 179.45 179.10 1xw6 h LEU 134 N -0.50 1.04 -1.62 2.94 4.07 -1.23 -2.14 115.31 117.87 1xw6 h LEU 134 Ca -0.05 -0.02 0.03 0.00 0.08 0.00 0.00 57.88 57.93 1xw6 h LEU 134 Cb 0.37 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 41.84 1xw6 h LEU 134 CO 0.07 0.73 0.30 0.50 -1.08 0.00 0.00 178.44 178.96 1xw6 h LYS 135 N 1.21 0.48 -0.51 1.13 3.64 -0.92 -1.12 116.57 120.48 1xw6 h LYS 135 Ca 0.36 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.66 1xw6 h LYS 135 Cb -0.05 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.65 1xw6 h LYS 135 CO -0.10 0.32 0.10 -0.07 -2.27 0.00 0.00 179.45 177.43 1xw6 h LEU 136 N 0.49 0.79 -0.74 5.20 3.38 -1.17 0.33 115.31 123.59 1xw6 h LEU 136 Ca 0.18 -0.25 -0.10 0.00 0.09 0.00 0.00 57.88 57.80 1xw6 h LEU 136 Cb 0.11 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1xw6 h LEU 136 CO -0.04 0.83 -0.10 1.88 0.09 0.00 0.00 178.44 181.10 1xw6 h TYR 137 N 0.71 0.94 0.53 1.13 0.05 -1.32 -1.38 116.97 117.64 1xw6 h TYR 137 Ca 0.16 -0.18 -0.03 0.00 0.05 0.00 0.00 58.73 58.73 1xw6 h TYR 137 Cb 0.37 -0.24 0.01 0.00 1.01 0.00 0.00 36.73 37.87 1xw6 h TYR 137 CO 0.03 0.91 -0.26 1.03 -1.05 0.00 0.00 178.16 178.82 1xw6 h SER 138 N 0.77 -0.61 -0.10 3.88 0.87 -0.92 -1.19 113.55 116.26 1xw6 h SER 138 Ca 0.13 0.02 -0.05 0.00 -1.23 0.00 0.00 61.79 60.65 1xw6 h SER 138 Cb 0.61 0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.71 1xw6 h SER 138 CO 0.04 -0.43 -0.09 -0.33 -0.53 0.00 0.00 176.83 175.49 1xw6 h GLU 139 N -0.73 0.39 -0.41 2.24 5.08 -0.92 -1.13 114.58 119.10 1xw6 h GLU 139 Ca -0.07 -0.09 -0.07 0.00 -1.00 0.00 0.00 59.36 58.13 1xw6 h GLU 139 Cb 0.55 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 1xw6 h GLU 139 CO 0.12 0.49 -0.01 0.35 -1.00 0.00 0.00 179.01 178.96 1xw6 h PHE 140 N 0.37 0.80 -0.07 4.33 3.57 -1.10 -3.10 116.94 121.73 1xw6 h PHE 140 Ca 0.08 -0.14 -0.01 0.00 3.53 0.00 0.00 57.97 61.42 1xw6 h PHE 140 Cb 0.39 -0.21 -0.00 0.00 2.79 0.00 0.00 35.95 38.92 1xw6 h PHE 140 CO 0.01 0.81 -0.01 1.25 -2.23 0.00 0.00 178.31 178.13 1xw6 h LEU 141 N 0.56 0.14 0.00 0.59 5.85 -0.93 -3.48 115.31 118.04 1xw6 h LEU 141 Ca 0.12 -0.35 0.00 0.00 0.84 0.00 0.00 57.88 58.48 1xw6 h LEU 141 Cb 0.49 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.49 1xw6 h LEU 141 CO 0.02 0.46 0.00 0.61 -0.34 0.00 0.00 178.44 179.19 1xw6 n GLY 142 N -0.16 2.96 1.48 3.75 0.00 -0.45 -2.26 105.19 110.50 1xw6 n GLY 142 Ca -0.07 -0.21 0.11 0.00 0.00 0.00 0.00 46.02 45.85 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 13.54 3.20 -2.61 1.61 4.76 -1.26 -4.95 118.16 132.45 1xw6 n LYS 143 Ca 0.00 -2.76 -0.38 0.00 -2.87 0.00 0.00 58.31 52.31 1xw6 n LYS 143 Cb 0.00 -1.73 -0.05 0.00 -1.84 0.00 0.00 35.03 31.41 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 -1.41 4.41 0.18 1.97 0.52 -0.96 -4.97 118.95 118.69 1xw6 s ARG 144 Ca 0.50 1.51 -0.07 0.00 -0.52 0.00 0.00 55.73 57.16 1xw6 s ARG 144 Cb 0.29 -2.78 0.07 0.00 0.52 0.00 0.00 34.95 33.05 1xw6 s ARG 144 CO 0.29 0.08 1.52 -1.00 0.02 0.00 0.00 175.30 176.22 1xw6 h PRO 145 N 3.03 0.77 -5.64 3.54 0.13 -1.89 -3.45 132.00 128.48 1xw6 h PRO 145 Ca -0.47 -0.41 -0.49 0.00 -0.87 0.00 0.00 66.00 63.75 1xw6 h PRO 145 Cb 1.21 0.02 -0.14 0.00 0.13 0.00 0.00 31.00 32.21 1xw6 h PRO 145 CO 0.64 1.03 -0.71 -1.58 -0.23 0.00 0.00 178.00 177.15 1xw6 s TRP 146 N -4.30 1.91 0.38 1.56 0.52 -1.00 -4.93 118.94 113.07 1xw6 s TRP 146 Ca -0.09 -0.59 0.09 0.00 0.02 0.00 0.00 56.10 55.53 1xw6 s TRP 146 Cb 0.12 -0.97 0.74 0.00 -1.15 0.00 0.00 33.47 32.21 1xw6 s TRP 146 CO 0.86 0.39 1.89 0.74 0.02 0.00 0.00 176.95 180.84 1xw6 h PHE 147 N 2.39 0.24 0.00 -1.98 -1.00 -1.87 -3.02 116.94 111.70 1xw6 h PHE 147 Ca -0.39 -0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.36 1xw6 h PHE 147 Cb 1.23 -0.07 0.00 0.00 3.61 0.00 0.00 35.95 40.72 1xw6 h PHE 147 CO 0.72 0.40 -0.58 0.00 -1.61 0.00 0.00 178.31 177.24 1xw6 h ALA 148 N 1.61 0.64 0.00 2.45 0.00 -1.90 -3.47 119.26 118.60 1xw6 h ALA 148 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1xw6 h ALA 148 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1xw6 h ALA 148 CO 0.03 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.69 1xw6 n GLY 149 N 1.29 -0.26 0.07 0.00 0.00 -1.14 -4.40 105.19 100.74 1xw6 n GLY 149 Ca 0.03 -0.18 0.11 0.00 0.00 0.00 0.00 46.02 45.98 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 0.60 -4.67 1.61 5.03 -1.26 -2.38 115.26 114.18 1xw6 n ASN 150 Ca 0.00 0.09 -0.29 0.00 0.87 0.00 0.00 54.58 55.25 1xw6 n ASN 150 Cb 0.00 0.83 -0.08 0.00 -1.02 0.00 0.00 39.78 39.51 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 -3.33 2.48 0.27 3.52 1.02 -1.26 -4.74 119.74 117.70 1xw6 s LYS 151 Ca -0.00 -0.91 -0.29 0.00 0.02 0.00 0.00 55.97 54.78 1xw6 s LYS 151 Cb 0.12 -2.48 -0.09 0.00 -0.52 0.00 0.00 37.83 34.86 1xw6 s LYS 151 CO 0.81 0.52 1.00 -1.50 -0.92 0.00 0.00 175.35 175.26 1xw6 s ILE 152 N -1.40 3.88 0.39 2.17 2.07 -1.26 -4.58 121.20 122.47 1xw6 s ILE 152 Ca 0.26 1.85 0.04 0.00 -1.41 0.00 0.00 60.65 61.38 1xw6 s ILE 152 Cb -0.11 -4.16 -0.03 0.00 0.13 0.00 0.00 42.46 38.29 1xw6 s ILE 152 CO 0.18 0.41 0.13 0.42 -1.91 0.00 0.00 174.94 174.17 1xw6 s THR 153 N -1.23 0.60 0.32 4.00 -4.23 -1.26 -4.80 115.64 109.04 1xw6 s THR 153 Ca 0.43 -2.00 0.38 0.00 -1.18 0.00 0.00 61.69 59.32 1xw6 s THR 153 Cb -0.27 -2.40 0.41 0.00 1.34 0.00 0.00 72.50 71.58 1xw6 s THR 153 CO 0.34 0.00 2.13 2.19 -0.54 0.00 0.00 174.62 178.74 1xw6 h PHE 154 N 1.86 0.00 0.00 3.99 -5.15 -1.62 -2.74 116.94 113.28 1xw6 h PHE 154 Ca -0.35 0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 57.40 1xw6 h PHE 154 Cb 1.27 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 37.44 1xw6 h PHE 154 CO 1.40 0.01 -0.07 -0.39 -2.00 0.00 0.00 178.31 177.26 1xw6 h VAL 155 N 0.00 0.18 -0.28 0.88 -1.51 -1.92 -2.59 116.25 111.00 1xw6 h VAL 155 Ca -0.00 -0.66 -0.06 0.00 -1.23 0.00 0.00 66.70 64.75 1xw6 h VAL 155 Cb 0.32 1.55 -0.02 0.00 -2.13 0.00 0.00 31.29 31.02 1xw6 h VAL 155 CO 0.00 0.06 -0.10 0.44 -1.23 0.00 0.00 177.57 176.75 1xw6 h ASP 156 N 0.00 0.45 -0.34 4.19 3.32 -1.90 0.16 116.42 122.28 1xw6 h ASP 156 Ca -0.00 -0.10 -0.13 0.00 0.02 0.00 0.00 57.03 56.81 1xw6 h ASP 156 Cb 0.55 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 1xw6 h ASP 156 CO 0.01 0.59 -0.28 -0.26 -1.72 0.00 0.00 179.24 177.57 1xw6 h PHE 157 N 0.44 1.00 -0.17 4.55 -1.00 -1.63 0.40 116.94 120.53 1xw6 h PHE 157 Ca 0.09 -0.26 -0.06 0.00 2.81 0.00 0.00 57.97 60.55 1xw6 h PHE 157 Cb 0.44 -0.23 -0.00 0.00 3.61 0.00 0.00 35.95 39.77 1xw6 h PHE 157 CO 0.01 1.04 -0.12 -0.07 -1.61 0.00 0.00 178.31 177.56 1xw6 h LEU 158 N 0.73 0.40 -0.63 1.54 3.38 -1.34 -2.32 115.31 117.07 1xw6 h LEU 158 Ca 0.09 -0.44 -0.09 0.00 0.09 0.00 0.00 57.88 57.52 1xw6 h LEU 158 Cb 0.83 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 1xw6 h LEU 158 CO 0.07 0.75 0.03 0.58 0.09 0.00 0.00 178.44 179.97 1xw6 h VAL 159 N 0.04 1.27 -0.31 1.22 2.07 -0.68 -2.27 116.25 117.59 1xw6 h VAL 159 Ca 0.03 -1.13 0.05 0.00 0.82 0.00 0.00 66.70 66.48 1xw6 h VAL 159 Cb 0.62 0.75 -0.05 0.00 -1.52 0.00 0.00 31.29 31.10 1xw6 h VAL 159 CO 0.03 0.41 0.03 0.22 0.02 0.00 0.00 177.57 178.28 1xw6 h TYR 160 N 0.99 0.03 -0.90 1.57 5.03 -0.90 0.29 116.97 123.08 1xw6 h TYR 160 Ca 0.18 0.02 0.01 0.00 2.58 0.00 0.00 58.73 61.53 1xw6 h TYR 160 Cb 0.53 0.03 -0.05 0.00 1.55 0.00 0.00 36.73 38.80 1xw6 h TYR 160 CO 0.04 -0.02 0.59 0.22 -1.32 0.00 0.00 178.16 177.67 1xw6 h ASP 161 N 0.12 1.02 -0.27 -2.11 3.58 -1.24 0.19 116.42 117.71 1xw6 h ASP 161 Ca 0.15 -0.02 -0.03 0.00 0.42 0.00 0.00 57.03 57.54 1xw6 h ASP 161 Cb 0.18 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 40.97 1xw6 h ASP 161 CO -0.23 0.73 0.05 0.58 -2.88 0.00 0.00 179.24 177.49 1xw6 h VAL 162 N 1.20 1.23 -0.42 2.25 2.07 -0.79 -0.06 116.25 121.73 1xw6 h VAL 162 Ca 0.34 -0.77 -0.05 0.00 0.82 0.00 0.00 66.70 67.04 1xw6 h VAL 162 Cb -0.11 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 1xw6 h VAL 162 CO -0.08 0.25 0.08 -0.07 0.02 0.00 0.00 177.57 177.77 1xw6 h LEU 163 N 0.26 0.65 -0.64 2.57 3.38 -0.73 -2.88 115.31 117.92 1xw6 h LEU 163 Ca 0.08 -0.25 -0.07 0.00 0.09 0.00 0.00 57.88 57.74 1xw6 h LEU 163 Cb 0.33 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 1xw6 h LEU 163 CO 0.00 0.73 0.13 -0.78 0.09 0.00 0.00 178.44 178.61 1xw6 h ASP 164 N 0.54 0.99 0.10 -0.43 3.58 -0.52 -1.97 116.42 118.70 1xw6 h ASP 164 Ca 0.13 -0.25 -0.01 0.00 0.42 0.00 0.00 57.03 57.32 1xw6 h ASP 164 Cb 0.34 -0.26 -0.00 0.00 1.72 0.00 0.00 39.33 41.13 1xw6 h ASP 164 CO 0.00 0.98 -0.07 -0.07 -2.88 0.00 0.00 179.24 177.20 1xw6 h LEU 165 N 0.95 0.00 0.03 2.28 3.38 -0.98 -2.50 115.31 118.47 1xw6 h LEU 165 Ca 0.20 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.91 1xw6 h LEU 165 Cb 0.39 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 1xw6 h LEU 165 CO 0.01 0.07 -1.33 0.45 0.09 0.00 0.00 178.44 177.73 1xw6 h HIS 166 N 0.00 0.12 0.00 1.13 3.86 -1.21 -2.50 115.15 116.54 1xw6 h HIS 166 Ca -0.00 -0.09 -0.09 0.00 -1.16 0.00 0.00 60.37 59.04 1xw6 h HIS 166 Cb 0.14 -0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.59 1xw6 h HIS 166 CO 0.00 1.09 -0.41 0.07 0.86 0.00 0.00 177.93 179.55 1xw6 h ARG 167 N 0.02 0.00 -0.17 2.45 0.11 -1.18 0.44 114.38 116.05 1xw6 h ARG 167 Ca -0.15 0.00 -0.20 0.00 0.10 0.00 0.00 59.98 59.73 1xw6 h ARG 167 Cb 1.90 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.99 1xw6 h ARG 167 CO 0.12 0.41 -0.68 0.82 0.10 0.00 0.00 179.97 180.74 1xw6 h ILE 168 N 0.00 1.29 -0.12 0.08 2.04 -1.50 -1.62 117.51 117.68 1xw6 h ILE 168 Ca -0.00 -1.89 -0.22 0.00 1.00 0.00 0.00 64.86 63.75 1xw6 h ILE 168 Cb 0.84 1.95 0.01 0.00 -0.74 0.00 0.00 36.82 38.88 1xw6 h ILE 168 CO 0.05 0.60 -0.77 0.15 0.00 0.00 0.00 178.15 178.18 1xw6 h PHE 169 N 0.49 1.00 -2.28 1.37 3.57 -1.07 -3.41 116.94 116.61 1xw6 h PHE 169 Ca -0.04 -0.46 -0.47 0.00 3.53 0.00 0.00 57.97 60.53 1xw6 h PHE 169 Cb 1.31 -0.15 -0.35 0.00 2.79 0.00 0.00 35.95 39.55 1xw6 h PHE 169 CO 0.09 1.29 -0.77 -2.00 -2.23 0.00 0.00 178.31 174.69 1xw6 s GLU 170 N -3.65 0.57 0.35 1.11 2.56 0.15 -5.05 118.70 114.74 1xw6 s GLU 170 Ca -0.11 -1.06 0.16 0.00 0.00 0.00 0.00 54.97 53.96 1xw6 s GLU 170 Cb 0.08 -1.00 1.15 0.00 2.00 0.00 0.00 34.13 36.35 1xw6 s GLU 170 CO 0.89 -1.19 1.63 -1.35 -0.56 0.00 0.00 175.26 174.68 1xw6 h PRO 171 N 7.10 0.20 -0.10 4.30 0.11 -1.47 -0.64 132.00 141.50 1xw6 h PRO 171 Ca 0.04 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.14 1xw6 h PRO 171 Cb 1.01 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.08 1xw6 h PRO 171 CO 0.24 0.13 0.00 1.63 -0.21 0.00 0.00 178.00 179.79 1xw6 n LYS 172 N -5.14 1.63 0.28 1.05 5.02 -1.26 -4.43 118.16 115.32 1xw6 n LYS 172 Ca 0.33 -0.94 0.13 0.00 -2.02 0.00 0.00 58.31 55.80 1xw6 n LYS 172 Cb 1.06 -1.42 0.82 0.00 -0.02 0.00 0.00 35.03 35.47 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 -4.08 1.98 -0.35 0.00 4.32 -1.26 -4.46 117.00 113.15 1xw6 n LEU 174 Ca -0.03 -0.67 0.00 0.00 -0.02 0.00 0.00 56.01 55.29 1xw6 n LEU 174 Cb 0.09 -0.03 0.14 0.00 -1.62 0.00 0.00 43.42 42.00 1xw6 n LEU 174 CO 0.30 0.35 1.25 0.44 -1.22 0.00 0.00 177.39 178.50 1xw6 h ASP 175 N 2.71 1.00 0.50 -1.43 3.32 -1.75 -1.66 116.42 119.10 1xw6 h ASP 175 Ca 0.00 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1xw6 h ASP 175 Cb 0.73 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.06 1xw6 h ASP 175 CO 0.00 0.66 0.00 0.00 -1.72 0.00 0.00 179.24 178.18 1xw6 n ALA 176 N -2.36 1.86 -3.76 3.45 0.00 -1.26 -4.28 120.51 114.16 1xw6 n ALA 176 Ca 0.13 -0.07 -0.29 0.00 0.00 0.00 0.00 53.44 53.22 1xw6 n ALA 176 Cb 0.13 -1.29 -0.12 0.00 0.00 0.00 0.00 19.45 18.17 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 -2.84 2.61 0.33 0.00 0.08 -0.62 -4.98 117.98 112.55 1xw6 s PHE 177 Ca 0.12 -2.87 0.05 0.00 0.12 0.00 0.00 56.93 54.35 1xw6 s PHE 177 Cb 0.12 -2.16 0.69 0.00 -0.57 0.00 0.00 43.02 41.10 1xw6 s PHE 177 CO 0.30 -0.69 1.89 -1.00 -0.10 0.00 0.00 175.22 175.62 1xw6 h PRO 178 N 5.96 0.81 0.00 0.24 0.13 -1.74 -2.16 132.00 135.23 1xw6 h PRO 178 Ca 0.10 -0.05 -0.04 0.00 -0.87 0.00 0.00 66.00 65.14 1xw6 h PRO 178 Cb 0.85 -0.18 -0.01 0.00 0.13 0.00 0.00 31.00 31.79 1xw6 h PRO 178 CO 0.58 0.54 -0.19 -2.95 -0.23 0.00 0.00 178.00 175.75 1xw6 h ASN 179 N 0.83 0.00 0.33 1.44 -0.00 -1.92 -1.42 115.58 114.83 1xw6 h ASN 179 Ca 0.42 0.00 -0.23 0.00 -0.00 0.00 0.00 56.30 56.49 1xw6 h ASN 179 Cb 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.81 1xw6 h ASN 179 CO -0.19 0.19 -0.98 -0.07 -0.00 0.00 0.00 177.43 176.38 1xw6 h LEU 180 N 0.00 0.56 -0.50 6.14 3.38 -1.73 -1.52 115.31 121.64 1xw6 h LEU 180 Ca -0.00 -0.46 -0.13 0.00 0.09 0.00 0.00 57.88 57.37 1xw6 h LEU 180 Cb 0.46 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1xw6 h LEU 180 CO 0.02 1.27 -0.22 0.11 0.09 0.00 0.00 178.44 179.71 1xw6 h LYS 181 N 0.23 1.00 -0.25 1.13 1.57 -1.33 -2.30 116.57 116.63 1xw6 h LYS 181 Ca -0.09 -0.43 -0.09 0.00 -1.87 0.00 0.00 60.65 58.18 1xw6 h LYS 181 Cb 1.62 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.89 1xw6 h LYS 181 CO 0.17 1.11 -0.21 -0.44 -0.57 0.00 0.00 179.45 179.50 1xw6 h ASP 182 N 0.86 0.45 -0.47 0.86 3.32 -1.25 -1.73 116.42 118.46 1xw6 h ASP 182 Ca 0.11 -0.14 -0.03 0.00 0.02 0.00 0.00 57.03 56.99 1xw6 h ASP 182 Cb 0.80 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.21 1xw6 h ASP 182 CO 0.07 0.67 0.17 0.15 -1.72 0.00 0.00 179.24 178.59 1xw6 h PHE 183 N 0.41 0.73 -0.73 4.55 3.57 -1.10 -0.61 116.94 123.76 1xw6 h PHE 183 Ca 0.07 -0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 1xw6 h PHE 183 Cb 0.60 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 39.09 1xw6 h PHE 183 CO 0.02 0.63 0.38 0.82 -2.23 0.00 0.00 178.31 177.93 1xw6 h ILE 184 N 0.62 1.23 -0.43 1.41 2.04 -0.96 0.18 117.51 121.60 1xw6 h ILE 184 Ca 0.16 -0.62 -0.08 0.00 1.00 0.00 0.00 64.86 65.32 1xw6 h ILE 184 Cb 0.22 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 36.58 1xw6 h ILE 184 CO -0.01 0.26 -0.02 0.28 0.00 0.00 0.00 178.15 178.66 1xw6 h SER 185 N 1.02 0.77 -0.72 1.72 0.02 -1.17 -0.68 113.55 114.51 1xw6 h SER 185 Ca 0.25 -0.32 -0.06 0.00 -0.84 0.00 0.00 61.79 60.82 1xw6 h SER 185 Cb 0.08 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.38 1xw6 h SER 185 CO -0.04 0.91 0.21 -0.09 -1.14 0.00 0.00 176.83 176.68 1xw6 h ARG 186 N 0.62 1.13 0.19 3.45 2.43 -0.89 0.42 114.38 121.73 1xw6 h ARG 186 Ca 0.12 -0.25 -0.01 0.00 -0.81 0.00 0.00 59.98 59.03 1xw6 h ARG 186 Cb 0.53 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.92 1xw6 h ARG 186 CO 0.03 0.97 -0.09 0.35 -1.51 0.00 0.00 179.97 179.72 1xw6 h PHE 187 N 1.07 -0.23 0.00 2.20 3.57 -0.86 -2.94 116.94 119.75 1xw6 h PHE 187 Ca 0.23 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.71 1xw6 h PHE 187 Cb 0.32 0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.14 1xw6 h PHE 187 CO 0.03 0.15 -0.09 0.93 -2.23 0.00 0.00 178.31 177.10 1xw6 h GLU 188 N -0.69 0.00 0.00 1.11 5.08 -1.08 -2.26 114.58 116.75 1xw6 h GLU 188 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 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 0.09 0.00 0.41 -1.00 0.00 0.00 179.01 178.55 1xw6 n GLY 189 N -0.82 -1.29 3.72 -3.84 0.00 0.15 -3.40 105.19 99.71 1xw6 n GLY 189 Ca -0.02 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 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 -3.16 4.37 0.18 0.99 1.43 -0.85 -4.84 118.68 116.80 1xw6 s LEU 190 Ca 0.10 2.63 -0.24 0.00 -1.03 0.00 0.00 54.13 55.60 1xw6 s LEU 190 Cb 0.14 -3.60 0.07 0.00 0.03 0.00 0.00 46.19 42.83 1xw6 s LEU 190 CO 0.41 -0.80 1.56 -0.33 0.23 0.00 0.00 176.35 177.43 1xw6 h GLU 191 N 6.36 -0.15 0.00 1.70 5.08 -1.90 0.21 114.58 125.88 1xw6 h GLU 191 Ca -0.43 0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 57.89 1xw6 h GLU 191 Cb 1.21 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 1xw6 h GLU 191 CO 0.88 -0.10 -0.24 0.87 -1.00 0.00 0.00 179.01 179.42 1xw6 h LYS 192 N -0.16 0.00 0.13 2.33 1.57 -1.92 -1.71 116.57 116.81 1xw6 h LYS 192 Ca 0.21 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.73 1xw6 h LYS 192 Cb 0.55 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.89 1xw6 h LYS 192 CO -0.77 0.24 -1.11 0.82 -0.57 0.00 0.00 179.45 178.06 1xw6 h ILE 193 N 0.00 1.35 -0.17 1.86 1.08 -1.52 -2.67 117.51 117.44 1xw6 h ILE 193 Ca -0.00 -2.46 0.00 0.00 -0.39 0.00 0.00 64.86 62.01 1xw6 h ILE 193 Cb 0.67 2.84 -0.01 0.00 -3.07 0.00 0.00 36.82 37.25 1xw6 h ILE 193 CO 0.03 0.73 0.11 -1.28 -0.69 0.00 0.00 178.15 177.05 1xw6 h SER 194 N 0.08 0.19 -0.57 1.72 0.87 -0.52 -0.41 113.55 114.91 1xw6 h SER 194 Ca -0.18 -0.02 0.01 0.00 -1.23 0.00 0.00 61.79 60.37 1xw6 h SER 194 Cb 1.82 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 63.71 1xw6 h SER 194 CO 0.21 0.16 0.38 0.00 -0.53 0.00 0.00 176.83 177.05 1xw6 h ALA 195 N 1.04 0.73 -0.63 6.23 0.00 -1.40 -2.59 119.26 122.64 1xw6 h ALA 195 Ca 0.06 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1xw6 h ALA 195 Cb -0.00 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1xw6 h ALA 195 CO -0.01 0.15 0.10 -0.92 0.00 0.00 0.00 179.25 178.57 1xw6 h TYR 196 N 0.76 1.11 0.00 0.00 3.20 -1.23 -2.83 116.97 117.99 1xw6 h TYR 196 Ca 0.21 -0.16 -0.02 0.00 3.14 0.00 0.00 58.73 61.91 1xw6 h TYR 196 Cb -0.07 -0.30 -0.00 0.00 1.54 0.00 0.00 36.73 37.89 1xw6 h TYR 196 CO -0.04 0.95 -0.09 0.52 -1.64 0.00 0.00 178.16 177.86 1xw6 h MET 197 N 0.96 0.00 -0.02 1.82 2.86 -0.82 -2.10 114.93 117.64 1xw6 h MET 197 Ca 0.19 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.83 1xw6 h MET 197 Cb 0.44 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.10 1xw6 h MET 197 CO 0.01 0.09 -0.09 1.63 1.06 0.00 0.00 176.91 179.61 1xw6 n LYS 198 N -3.45 1.61 -2.59 1.72 5.02 -1.00 -4.87 118.16 114.60 1xw6 n LYS 198 Ca -0.01 -1.09 -0.23 0.00 -2.02 0.00 0.00 58.31 54.96 1xw6 n LYS 198 Cb 0.24 -1.48 0.10 0.00 -0.02 0.00 0.00 35.03 33.87 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 -2.14 4.45 0.37 4.39 1.04 -0.79 -5.00 113.70 116.02 1xw6 s SER 199 Ca 0.31 -0.31 0.25 0.00 0.48 0.00 0.00 55.95 56.68 1xw6 s SER 199 Cb 0.20 -0.12 0.66 0.00 0.10 0.00 0.00 66.02 66.86 1xw6 s SER 199 CO 0.39 -1.78 1.72 0.77 0.98 0.00 0.00 173.24 175.31 1xw6 h SER 200 N -0.47 0.00 0.30 7.02 4.64 -1.93 -3.28 113.55 119.84 1xw6 h SER 200 Ca -0.37 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 60.78 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 0.42 0.00 -0.70 0.03 -0.87 0.00 0.00 176.83 175.71 1xw6 h ARG 201 N 0.00 0.35 -6.28 4.77 3.08 -1.95 -3.45 114.38 110.90 1xw6 h ARG 201 Ca 0.00 -0.28 -0.66 0.00 0.07 0.00 0.00 59.98 59.11 1xw6 h ARG 201 Cb 0.81 0.05 0.03 0.00 0.08 0.00 0.00 29.97 30.95 1xw6 h ARG 201 CO 0.00 0.91 0.81 0.34 -1.07 0.00 0.00 179.97 180.97 1xw6 n PHE 202 N -3.84 2.02 -3.33 3.04 7.35 -1.24 -4.95 117.46 116.52 1xw6 n PHE 202 Ca -0.04 0.38 -0.26 0.00 -0.76 0.00 0.00 57.45 56.78 1xw6 n PHE 202 Cb 0.69 -2.49 -0.08 0.00 0.35 0.00 0.00 39.48 37.94 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 4.56 1.64 0.07 -2.13 7.94 -1.26 -4.95 117.00 122.86 1xw6 n LEU 203 Ca 0.22 -4.98 0.09 0.00 -1.11 0.00 0.00 56.01 50.22 1xw6 n LEU 203 Cb 0.22 0.06 0.39 0.00 0.53 0.00 0.00 43.42 44.61 1xw6 n LEU 203 CO 0.71 2.03 0.78 -0.81 -1.11 0.00 0.00 177.39 178.99 1xw6 n PRO 204 N 1.34 0.09 -3.49 1.96 -0.04 -1.26 -4.20 135.00 129.40 1xw6 n PRO 204 Ca 0.25 0.36 -0.11 0.00 -0.04 0.00 0.00 63.50 63.96 1xw6 n PRO 204 Cb 0.47 -1.69 -0.02 0.00 -0.04 0.00 0.00 33.50 32.22 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 -3.17 1.32 0.42 0.54 0.52 -1.26 -4.45 118.95 112.87 1xw6 s ARG 205 Ca 0.05 -0.55 -0.26 0.00 -0.52 0.00 0.00 55.73 54.46 1xw6 s ARG 205 Cb 0.09 0.58 -0.10 0.00 0.52 0.00 0.00 34.95 36.04 1xw6 s ARG 205 CO 0.30 -0.58 1.32 -2.30 0.02 0.00 0.00 175.30 174.06 1xw6 n PRO 206 N -0.38 2.04 0.12 3.54 -0.02 -1.26 -4.68 135.00 134.37 1xw6 n PRO 206 Ca -0.16 0.73 -0.13 0.00 -2.02 0.00 0.00 63.50 61.92 1xw6 n PRO 206 Cb 0.64 -2.44 -0.08 0.00 -0.02 0.00 0.00 33.50 31.60 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 2.19 0.84 -5.07 -1.45 2.07 -1.72 -0.85 116.25 112.26 1xw6 h VAL 207 Ca -0.48 -0.54 -0.38 0.00 0.82 0.00 0.00 66.70 66.12 1xw6 h VAL 207 Cb 1.29 1.15 -0.04 0.00 -1.52 0.00 0.00 31.29 32.17 1xw6 h VAL 207 CO 0.60 0.12 -0.21 0.49 0.02 0.00 0.00 177.57 178.60 1xw6 n PHE 208 N -5.10 -0.54 -1.99 1.57 3.72 0.16 -1.29 117.46 113.98 1xw6 n PHE 208 Ca -0.09 -1.52 -0.28 0.00 -0.05 0.00 0.00 57.45 55.51 1xw6 n PHE 208 Cb 0.23 -0.27 0.12 0.00 -0.94 0.00 0.00 39.48 38.61 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 -3.00 4.12 0.63 4.37 1.04 -1.26 -4.53 113.70 115.07 1xw6 s SER 209 Ca 0.15 0.52 0.42 0.00 0.48 0.00 0.00 55.95 57.52 1xw6 s SER 209 Cb -0.01 -0.89 2.29 0.00 0.10 0.00 0.00 66.02 67.50 1xw6 s SER 209 CO 0.10 -2.11 2.29 0.11 0.98 0.00 0.00 173.24 174.61 1xw6 h LYS 210 N -1.14 0.00 0.00 4.02 1.57 -1.93 -1.80 116.57 117.30 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 1.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.61 1xw6 h LYS 210 CO 0.55 0.00 0.00 -1.33 -0.57 0.00 0.00 179.45 178.10 1xw6 n MET 211 N -2.99 0.01 -2.08 3.15 2.81 -1.26 -4.88 117.12 111.88 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 0.07 -1.51 0.01 0.00 -0.71 0.00 0.00 33.22 31.08 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 -3.01 2.74 -0.03 3.04 0.00 -0.68 -4.87 121.76 118.96 1xw6 s ALA 212 Ca 0.13 0.42 0.12 0.00 0.00 0.00 0.00 51.96 52.63 1xw6 s ALA 212 Cb 0.18 -3.24 -0.21 0.00 0.00 0.00 0.00 23.12 19.85 1xw6 s ALA 212 CO 0.50 -0.78 0.79 0.28 0.00 0.00 0.00 175.76 176.55 1xw6 h VAL 213 N 0.52 0.93 -4.18 0.00 2.07 0.04 -3.40 116.25 112.23 1xw6 h VAL 213 Ca -0.47 -2.71 -0.49 0.00 0.82 0.00 0.00 66.70 63.85 1xw6 h VAL 213 Cb 1.22 2.43 -0.28 0.00 -1.52 0.00 0.00 31.29 33.15 1xw6 h VAL 213 CO 0.57 0.53 -0.81 0.86 0.02 0.00 0.00 177.57 178.74 1xw6 s TRP 214 N -2.66 1.34 -0.30 1.57 -0.00 -1.04 -4.76 118.94 113.08 1xw6 s TRP 214 Ca -0.03 -0.28 0.00 0.00 -0.00 0.00 0.00 56.10 55.78 1xw6 s TRP 214 Cb 0.08 -0.84 0.00 0.00 -0.00 0.00 0.00 33.47 32.71 1xw6 s TRP 214 CO 0.82 0.00 0.00 0.41 -0.00 0.00 0.00 176.95 178.18 1xw6 n GLY 215 N 2.45 0.55 0.07 5.86 0.00 -1.26 -4.71 105.19 108.15 1xw6 n GLY 215 Ca -0.15 -0.22 0.10 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.05 0.39 0.00 1.61 2.04 -1.26 -0.67 115.26 117.32 1xw6 n ASN 216 Ca -0.03 0.59 0.00 0.00 -0.44 0.00 0.00 54.58 54.70 1xw6 n ASN 216 Cb 0.23 -0.68 0.00 0.00 -2.53 0.00 0.00 39.78 36.80 1xw6 n ASN 216 CO 0.00 0.00 0.00 1.17 -0.44 0.00 0.00 177.26 177.99