#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 3.64 -0.04 0.54 1.75 -1.17 -4.72 119.30 119.30 1xw6 s MET 2 Ca 0.00 2.38 0.02 0.00 -1.25 0.00 0.00 55.69 56.84 1xw6 s MET 2 Cb 0.00 -2.61 0.01 0.00 2.84 0.00 0.00 34.83 35.07 1xw6 s MET 2 CO 0.00 -0.84 -0.10 -1.50 -0.65 0.00 0.00 175.02 171.92 1xw6 s ILE 3 N -1.22 0.93 -0.22 10.11 2.07 -0.27 0.19 121.20 132.79 1xw6 s ILE 3 Ca 0.62 -0.40 -0.06 0.00 -1.41 0.00 0.00 60.65 59.39 1xw6 s ILE 3 Cb -0.43 -0.84 -0.03 0.00 0.13 0.00 0.00 42.46 41.29 1xw6 s ILE 3 CO 0.55 0.29 0.03 -0.22 -1.91 0.00 0.00 174.94 173.68 1xw6 s LEU 4 N 0.41 3.36 -0.11 8.50 2.96 -0.32 -0.87 118.68 132.61 1xw6 s LEU 4 Ca -0.08 -0.19 -0.01 0.00 -0.22 0.00 0.00 54.13 53.64 1xw6 s LEU 4 Cb -0.12 -1.87 -0.03 0.00 0.50 0.00 0.00 46.19 44.67 1xw6 s LEU 4 CO 0.02 0.03 -0.08 -0.83 -1.32 0.00 0.00 176.35 174.16 1xw6 s GLY 5 N 1.24 1.65 0.10 7.98 0.00 -0.35 -0.69 107.32 117.25 1xw6 s GLY 5 Ca 0.04 -0.88 -0.27 0.00 0.00 0.00 0.00 44.72 43.62 1xw6 s GLY 5 CO 0.02 -0.38 1.09 -0.47 0.00 0.00 0.00 173.10 173.36 1xw6 s TYR 6 N -0.17 -0.07 0.96 1.90 5.04 -0.94 -1.72 117.35 122.34 1xw6 s TYR 6 Ca 0.02 -0.17 -0.11 0.00 -2.44 0.00 0.00 57.07 54.36 1xw6 s TYR 6 Cb -0.13 0.61 0.17 0.00 0.35 0.00 0.00 41.96 42.96 1xw6 s TYR 6 CO 0.03 -0.64 1.09 -1.58 -1.34 0.00 0.00 175.55 173.11 1xw6 s TRP 7 N -2.83 1.90 0.00 4.97 0.52 -1.26 -1.59 118.94 120.65 1xw6 s TRP 7 Ca 0.15 1.42 -0.05 0.00 0.02 0.00 0.00 56.10 57.63 1xw6 s TRP 7 Cb 0.01 -3.19 -0.23 0.00 -1.15 0.00 0.00 33.47 28.91 1xw6 s TRP 7 CO 0.01 -2.84 3.27 -3.47 0.02 0.00 0.00 176.95 173.94 1xw6 n ASP 8 N -4.22 4.92 -1.91 2.95 4.64 0.66 -4.60 116.55 118.99 1xw6 n ASP 8 Ca 0.08 -2.41 -0.08 0.00 -1.38 0.00 0.00 54.79 51.00 1xw6 n ASP 8 Cb 0.54 -1.30 -0.03 0.00 -1.04 0.00 0.00 41.12 39.29 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 2.43 0.00 0.00 5.18 -5.35 -1.26 -4.75 119.36 115.61 1xw6 n ILE 9 Ca 0.36 -0.96 0.00 0.00 -0.27 0.00 0.00 62.75 61.88 1xw6 n ILE 9 Cb 0.82 0.50 0.00 0.00 -1.74 0.00 0.00 39.64 39.22 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 -0.26 -4.87 116.66 118.19 1xw6 n ARG 10 Ca 0.03 0.38 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 1.79 1.75 0.00 5.14 0.00 -0.42 -2.21 105.19 111.24 1xw6 n GLY 11 Ca 0.00 -0.22 0.13 0.00 0.00 0.00 0.00 46.02 45.93 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 0.01 0.99 4.77 -1.26 -3.10 117.00 118.41 1xw6 n LEU 12 Ca 0.00 0.11 0.11 0.00 -0.03 0.00 0.00 56.01 56.20 1xw6 n LEU 12 Cb 0.00 -0.11 0.10 0.00 -2.33 0.00 0.00 43.42 41.08 1xw6 n LEU 12 CO 0.00 -0.02 0.20 0.00 -1.33 0.00 0.00 177.39 176.25 1xw6 n ALA 13 N -1.11 3.69 0.11 -1.18 0.00 -0.94 -4.59 120.51 116.49 1xw6 n ALA 13 Ca 0.17 -0.41 -0.14 0.00 0.00 0.00 0.00 53.44 53.06 1xw6 n ALA 13 Cb 0.13 -1.01 -0.08 0.00 0.00 0.00 0.00 19.45 18.50 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 -1.21 0.00 0.00 6.17 -1.46 0.07 115.15 118.72 1xw6 h HIS 14 Ca 0.00 0.03 -0.03 0.00 0.71 0.00 0.00 60.37 61.08 1xw6 h HIS 14 Cb 0.59 0.51 -0.00 0.00 2.52 0.00 0.00 27.41 31.03 1xw6 h HIS 14 CO 0.00 -0.52 -0.16 0.00 0.71 0.00 0.00 177.93 177.96 1xw6 h ALA 15 N -0.20 1.66 0.01 5.26 0.00 -1.83 -1.65 119.26 122.50 1xw6 h ALA 15 Ca 0.02 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1xw6 h ALA 15 Cb 0.69 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1xw6 h ALA 15 CO -0.25 0.20 -0.00 0.82 0.00 0.00 0.00 179.25 180.01 1xw6 h ILE 16 N 0.00 1.35 -0.28 0.00 2.04 -1.66 -0.79 117.51 118.17 1xw6 h ILE 16 Ca -0.00 -1.10 0.03 0.00 1.00 0.00 0.00 64.86 64.79 1xw6 h ILE 16 Cb 0.29 2.10 -0.03 0.00 -0.74 0.00 0.00 36.82 38.44 1xw6 h ILE 16 CO 0.02 0.28 0.08 0.03 0.00 0.00 0.00 178.15 178.57 1xw6 h ARG 17 N -0.48 0.20 -0.68 2.37 3.08 -0.83 0.12 114.38 118.15 1xw6 h ARG 17 Ca -0.00 -0.01 0.04 0.00 0.07 0.00 0.00 59.98 60.08 1xw6 h ARG 17 Cb 0.47 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.43 1xw6 h ARG 17 CO 0.00 0.13 0.41 -0.07 -1.07 0.00 0.00 179.97 179.37 1xw6 h LEU 18 N 0.20 0.65 -0.49 3.04 3.38 -1.30 -0.85 115.31 119.95 1xw6 h LEU 18 Ca 0.13 0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.98 1xw6 h LEU 18 Cb 0.11 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1xw6 h LEU 18 CO -0.14 0.44 -0.18 0.25 0.09 0.00 0.00 178.44 178.90 1xw6 h LEU 19 N 0.78 1.01 -1.29 1.67 5.85 -0.72 -0.75 115.31 121.87 1xw6 h LEU 19 Ca 0.29 -0.38 -0.02 0.00 0.84 0.00 0.00 57.88 58.60 1xw6 h LEU 19 Cb 0.08 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.81 1xw6 h LEU 19 CO -0.13 1.17 0.22 -0.07 -0.34 0.00 0.00 178.44 179.28 1xw6 h LEU 20 N 0.85 0.64 -0.03 2.25 3.38 -0.31 -1.20 115.31 120.89 1xw6 h LEU 20 Ca 0.12 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 1xw6 h LEU 20 Cb 0.76 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1xw6 h LEU 20 CO 0.06 0.56 -0.09 -0.33 0.09 0.00 0.00 178.44 178.74 1xw6 h GLU 21 N 0.70 0.11 -0.53 1.13 4.39 -0.90 0.79 114.58 120.27 1xw6 h GLU 21 Ca 0.17 -0.08 0.00 0.00 0.34 0.00 0.00 59.36 59.80 1xw6 h GLU 21 Cb 0.11 0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.75 1xw6 h GLU 21 CO -0.02 0.71 0.35 -0.92 -1.16 0.00 0.00 179.01 177.96 1xw6 h TYR 22 N -0.47 0.66 -0.01 4.33 3.20 -1.01 -1.48 116.97 122.19 1xw6 h TYR 22 Ca -0.00 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.88 1xw6 h TYR 22 Cb 0.72 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 38.76 1xw6 h TYR 22 CO 0.14 0.42 -0.02 0.25 -1.64 0.00 0.00 178.16 177.31 1xw6 n THR 23 N -4.45 0.00 -3.48 1.81 -2.24 -0.47 -4.93 114.28 100.52 1xw6 n THR 23 Ca 0.05 -0.13 -0.20 0.00 -2.27 0.00 0.00 64.05 61.49 1xw6 n THR 23 Cb 0.05 0.07 0.08 0.00 -2.10 0.00 0.00 70.33 68.43 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 -0.40 -4.62 -4.79 3.42 2.03 -0.56 -4.98 116.55 106.64 1xw6 n ASP 24 Ca 0.20 -0.55 -0.36 0.00 0.52 0.00 0.00 54.79 54.60 1xw6 n ASP 24 Cb 0.26 -4.88 -0.06 0.00 -0.72 0.00 0.00 41.12 35.71 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 -3.69 7.21 -0.42 1.67 0.01 0.25 -5.02 113.70 113.71 1xw6 s SER 25 Ca 0.35 1.74 -0.23 0.00 1.31 0.00 0.00 55.95 59.12 1xw6 s SER 25 Cb -0.15 -2.55 0.02 0.00 0.21 0.00 0.00 66.02 63.55 1xw6 s SER 25 CO 0.70 -0.12 0.76 -0.55 0.41 0.00 0.00 173.24 174.44 1xw6 s SER 26 N -1.75 6.43 0.11 2.44 0.15 -1.26 -4.85 113.70 114.97 1xw6 s SER 26 Ca 0.52 -0.02 -0.14 0.00 0.70 0.00 0.00 55.95 57.01 1xw6 s SER 26 Cb -0.16 -2.38 0.02 0.00 -1.71 0.00 0.00 66.02 61.80 1xw6 s SER 26 CO 0.21 -0.84 0.34 -0.72 1.20 0.00 0.00 173.24 173.43 1xw6 s TYR 27 N 3.16 -0.11 0.38 3.44 1.13 -1.26 -3.02 117.35 121.07 1xw6 s TYR 27 Ca 0.29 -0.23 0.07 0.00 -1.41 0.00 0.00 57.07 55.80 1xw6 s TYR 27 Cb -0.13 0.17 -0.07 0.00 -1.10 0.00 0.00 41.96 40.83 1xw6 s TYR 27 CO 0.21 -0.65 -0.02 -1.21 -2.51 0.00 0.00 175.55 171.37 1xw6 s GLU 28 N -3.74 1.87 -0.10 -3.49 2.02 0.13 -4.93 118.70 110.46 1xw6 s GLU 28 Ca 0.03 -2.03 -0.00 0.00 0.02 0.00 0.00 54.97 52.99 1xw6 s GLU 28 Cb 0.03 -1.56 0.02 0.00 0.10 0.00 0.00 34.13 32.72 1xw6 s GLU 28 CO -0.11 -0.00 -0.06 -1.21 0.02 0.00 0.00 175.26 173.89 1xw6 s GLU 29 N -3.70 1.35 -0.52 1.61 2.02 -1.26 -1.17 118.70 117.03 1xw6 s GLU 29 Ca 0.34 -0.19 -0.20 0.00 0.02 0.00 0.00 54.97 54.94 1xw6 s GLU 29 Cb 0.07 -1.44 0.06 0.00 0.10 0.00 0.00 34.13 32.92 1xw6 s GLU 29 CO 0.17 -0.25 0.69 0.21 0.02 0.00 0.00 175.26 176.10 1xw6 s LYS 30 N 1.66 3.16 -0.09 1.61 2.36 0.14 -4.95 119.74 123.62 1xw6 s LYS 30 Ca 0.03 -0.78 -0.14 0.00 -2.55 0.00 0.00 55.97 52.53 1xw6 s LYS 30 Cb -0.13 -4.09 -0.05 0.00 -1.05 0.00 0.00 37.83 32.51 1xw6 s LYS 30 CO -0.07 -1.28 0.34 0.15 1.55 0.00 0.00 175.35 176.05 1xw6 s LYS 31 N 2.88 4.04 -0.11 4.03 1.02 -1.26 -2.22 119.74 128.12 1xw6 s LYS 31 Ca 0.18 0.23 -0.00 0.00 0.02 0.00 0.00 55.97 56.39 1xw6 s LYS 31 Cb -0.18 -3.32 -0.02 0.00 -0.52 0.00 0.00 37.83 33.78 1xw6 s LYS 31 CO 0.13 0.46 -0.09 0.71 -0.92 0.00 0.00 175.35 175.64 1xw6 s TYR 32 N -0.26 2.88 -0.14 3.18 1.51 -0.62 -4.90 117.35 119.01 1xw6 s TYR 32 Ca 0.20 -0.29 -0.04 0.00 -1.01 0.00 0.00 57.07 55.93 1xw6 s TYR 32 Cb -0.14 -1.80 -0.03 0.00 -0.11 0.00 0.00 41.96 39.87 1xw6 s TYR 32 CO 0.08 0.05 0.01 0.99 -1.11 0.00 0.00 175.55 175.58 1xw6 s THR 33 N -0.15 4.37 -0.02 -0.71 2.01 -1.26 -0.25 115.64 119.63 1xw6 s THR 33 Ca 0.01 -0.20 -0.16 0.00 0.31 0.00 0.00 61.69 61.65 1xw6 s THR 33 Cb -0.13 -2.90 -0.05 0.00 0.01 0.00 0.00 72.50 69.42 1xw6 s THR 33 CO 0.03 0.53 0.44 -0.32 -0.69 0.00 0.00 174.62 174.61 1xw6 s MET 34 N -0.14 4.06 0.78 4.92 1.75 -1.26 -4.66 119.30 124.75 1xw6 s MET 34 Ca 0.05 0.45 -0.10 0.00 -1.25 0.00 0.00 55.69 54.83 1xw6 s MET 34 Cb -0.12 -3.28 0.06 0.00 2.84 0.00 0.00 34.83 34.33 1xw6 s MET 34 CO 0.02 0.55 1.10 0.20 -0.65 0.00 0.00 175.02 176.24 1xw6 s GLY 35 N -0.66 1.68 0.99 2.11 0.00 0.57 -4.87 107.32 107.14 1xw6 s GLY 35 Ca 0.25 0.29 -0.15 0.00 0.00 0.00 0.00 44.72 45.10 1xw6 s GLY 35 CO 0.13 0.64 1.20 0.99 0.00 0.00 0.00 173.10 176.06 1xw6 s ASP 36 N -3.34 2.82 0.88 1.64 1.11 -1.26 -3.77 116.67 114.75 1xw6 s ASP 36 Ca 0.62 0.63 -0.10 0.00 0.18 0.00 0.00 52.55 53.87 1xw6 s ASP 36 Cb -0.18 -0.93 0.13 0.00 1.07 0.00 0.00 42.92 43.01 1xw6 s ASP 36 CO 0.56 -2.95 1.12 0.00 1.18 0.00 0.00 175.17 175.09 1xw6 s ALA 37 N -3.45 1.61 -0.83 5.23 0.00 -1.26 -1.69 121.76 121.37 1xw6 s ALA 37 Ca 0.69 0.44 0.26 0.00 0.00 0.00 0.00 51.96 53.35 1xw6 s ALA 37 Cb -0.09 -3.38 0.63 0.00 0.00 0.00 0.00 23.12 20.27 1xw6 s ALA 37 CO 0.54 -2.51 1.53 -0.35 0.00 0.00 0.00 175.76 174.96 1xw6 n PRO 38 N -4.05 0.14 -0.01 0.00 -0.04 -1.26 -4.78 135.00 125.00 1xw6 n PRO 38 Ca 0.10 0.06 -0.17 0.00 -0.04 0.00 0.00 63.50 63.45 1xw6 n PRO 38 Cb 0.53 -1.61 -0.07 0.00 -0.04 0.00 0.00 33.50 32.30 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 -5.84 3.54 3.45 -1.92 -3.48 116.42 113.08 1xw6 h ASP 39 Ca 0.00 -0.62 -0.37 0.00 0.43 0.00 0.00 57.03 56.47 1xw6 h ASP 39 Cb 0.62 -0.27 0.12 0.00 -0.56 0.00 0.00 39.33 39.24 1xw6 h ASP 39 CO 0.00 1.42 -0.80 -1.22 -1.57 0.00 0.00 179.24 177.06 1xw6 n TYR 40 N -3.92 -2.07 -1.69 4.55 4.01 -0.68 -4.82 117.16 112.54 1xw6 n TYR 40 Ca -0.08 0.89 -0.56 0.00 -0.16 0.00 0.00 57.90 57.99 1xw6 n TYR 40 Cb 0.76 -4.73 -0.07 0.00 -0.31 0.00 0.00 39.34 34.99 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 2.35 -0.51 7.72 2.03 -1.25 -4.50 116.55 119.30 1xw6 n ASP 41 Ca -0.29 1.08 0.05 0.00 0.52 0.00 0.00 54.79 56.15 1xw6 n ASP 41 Cb 0.67 -1.16 0.13 0.00 -0.72 0.00 0.00 41.12 40.04 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 5.01 2.84 0.31 -0.67 1.74 -1.26 -0.32 116.66 124.32 1xw6 n ARG 42 Ca 0.25 -2.05 0.19 0.00 -0.77 0.00 0.00 57.85 55.47 1xw6 n ARG 42 Cb 0.15 -1.29 1.06 0.00 -1.02 0.00 0.00 32.46 31.36 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 1.46 0.00 -0.12 0.55 4.64 -1.90 -1.18 113.55 116.99 1xw6 h SER 43 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 1xw6 h SER 43 Cb 0.78 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.86 1xw6 h SER 43 CO 0.03 0.00 -0.02 -0.61 -0.87 0.00 0.00 176.83 175.36 1xw6 h GLN 44 N 0.00 0.36 0.00 4.77 4.15 -1.84 -1.20 115.11 121.35 1xw6 h GLN 44 Ca 0.01 -0.07 -0.23 0.00 0.77 0.00 0.00 58.65 59.13 1xw6 h GLN 44 Cb 0.09 -0.06 -0.03 0.00 0.21 0.00 0.00 27.48 27.69 1xw6 h GLN 44 CO -0.00 0.41 -1.31 1.87 -1.93 0.00 0.00 178.83 177.87 1xw6 n TRP 45 N -4.32 0.93 -0.11 3.99 -0.00 -0.65 -4.41 117.44 112.87 1xw6 n TRP 45 Ca 0.00 0.40 0.12 0.00 -0.00 0.00 0.00 57.50 58.02 1xw6 n TRP 45 Cb 0.22 -1.07 0.48 0.00 -0.00 0.00 0.00 31.31 30.94 1xw6 n TRP 45 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 177.69 177.62 1xw6 h LEU 46 N -1.00 0.41 0.00 5.87 3.38 -1.24 0.42 115.31 123.15 1xw6 h LEU 46 Ca -0.35 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.63 1xw6 h LEU 46 Cb 1.28 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1xw6 h LEU 46 CO -0.21 0.25 0.00 0.59 0.09 0.00 0.00 178.44 179.15 1xw6 n ASN 47 N -4.47 0.00 0.00 -0.43 5.03 -0.46 -3.18 115.26 111.75 1xw6 n ASN 47 Ca 0.11 -0.78 0.00 0.00 0.87 0.00 0.00 54.58 54.78 1xw6 n ASN 47 Cb 0.37 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.13 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 -0.95 2.49 -0.29 3.52 2.13 -0.35 -4.90 120.64 122.30 1xw6 n GLU 48 Ca 0.15 0.00 0.11 0.00 0.66 0.00 0.00 57.16 58.08 1xw6 n GLU 48 Cb 0.07 -0.25 0.26 0.00 0.27 0.00 0.00 31.44 31.79 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 0.31 -0.69 5.31 3.64 -0.20 -1.06 116.57 123.89 1xw6 h LYS 49 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1xw6 h LYS 49 Cb 0.00 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 1xw6 h LYS 49 CO 0.00 0.21 0.00 1.19 -2.27 0.00 0.00 179.45 178.58 1xw6 n PHE 50 N -5.12 1.24 -0.30 1.91 3.01 -1.26 -4.26 117.46 112.69 1xw6 n PHE 50 Ca 0.19 -0.54 0.05 0.00 1.01 0.00 0.00 57.45 58.16 1xw6 n PHE 50 Cb 0.59 -0.13 0.13 0.00 -0.01 0.00 0.00 39.48 40.06 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 1.33 2.83 0.00 -1.08 5.02 -0.40 -4.64 118.16 121.22 1xw6 n LYS 51 Ca 0.25 -2.07 0.09 0.00 -2.02 0.00 0.00 58.31 54.56 1xw6 n LYS 51 Cb 0.76 -1.30 0.00 0.00 -0.02 0.00 0.00 35.03 34.47 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 0.04 1.90 -0.06 -0.35 4.77 -1.22 -4.98 117.00 117.09 1xw6 n LEU 52 Ca 0.11 -0.79 -0.01 0.00 -0.03 0.00 0.00 56.01 55.29 1xw6 n LEU 52 Cb 0.46 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.55 1xw6 n LEU 52 CO 0.07 0.35 -0.01 0.61 -1.33 0.00 0.00 177.39 177.08 1xw6 n GLY 53 N 1.26 0.45 3.72 -0.72 0.00 -1.26 -5.03 105.19 103.61 1xw6 n GLY 53 Ca 0.08 -0.94 -0.41 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 -0.18 4.38 0.08 0.99 1.43 -1.26 -4.90 118.68 119.22 1xw6 s LEU 54 Ca 0.00 1.49 -0.22 0.00 -1.03 0.00 0.00 54.13 54.37 1xw6 s LEU 54 Cb 0.00 -3.36 -0.13 0.00 0.03 0.00 0.00 46.19 42.73 1xw6 s LEU 54 CO 0.00 -0.14 1.64 0.44 0.23 0.00 0.00 176.35 178.52 1xw6 h ASP 55 N 6.44 0.10 -3.20 2.29 3.32 -1.96 -3.32 116.42 120.10 1xw6 h ASP 55 Ca -0.42 -0.12 -0.62 0.00 0.02 0.00 0.00 57.03 55.89 1xw6 h ASP 55 Cb 1.21 -0.03 -0.42 0.00 0.22 0.00 0.00 39.33 40.32 1xw6 h ASP 55 CO 0.74 0.20 -0.60 -0.36 -1.72 0.00 0.00 179.24 177.50 1xw6 s PHE 56 N -5.70 3.39 -0.47 4.55 0.08 -1.26 -5.07 117.98 113.49 1xw6 s PHE 56 Ca -0.14 -3.26 -0.45 0.00 0.12 0.00 0.00 56.93 53.20 1xw6 s PHE 56 Cb 0.06 -2.62 -0.19 0.00 -0.57 0.00 0.00 43.02 39.70 1xw6 s PHE 56 CO 0.68 -0.58 1.72 -2.30 -0.10 0.00 0.00 175.22 174.64 1xw6 n PRO 57 N 2.14 0.18 -3.84 0.24 -0.02 -1.25 -4.88 135.00 127.58 1xw6 n PRO 57 Ca 0.19 0.06 -0.07 0.00 -2.02 0.00 0.00 63.50 61.66 1xw6 n PRO 57 Cb 0.35 -1.60 -0.01 0.00 -0.02 0.00 0.00 33.50 32.22 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 3.68 -0.19 -0.07 2.55 3.84 -1.26 -5.10 114.94 118.39 1xw6 s ASN 58 Ca 1.07 -0.71 0.03 0.00 0.21 0.00 0.00 52.86 53.46 1xw6 s ASN 58 Cb -1.43 0.73 0.01 0.00 -0.55 0.00 0.00 41.25 40.01 1xw6 s ASN 58 CO 0.76 -1.38 -0.14 -0.76 -2.79 0.00 0.00 177.10 172.79 1xw6 s LEU 59 N -2.96 1.75 0.66 3.21 1.43 -1.26 -4.04 118.68 117.47 1xw6 s LEU 59 Ca 0.12 -0.34 -0.11 0.00 -1.03 0.00 0.00 54.13 52.77 1xw6 s LEU 59 Cb -0.05 -0.92 -0.01 0.00 0.03 0.00 0.00 46.19 45.24 1xw6 s LEU 59 CO 0.08 0.07 1.06 -2.16 0.23 0.00 0.00 176.35 175.63 1xw6 s PRO 60 N 0.51 3.23 0.08 1.29 0.04 -1.26 -4.94 135.00 133.96 1xw6 s PRO 60 Ca -0.13 0.62 0.02 0.00 0.04 0.00 0.00 61.00 61.55 1xw6 s PRO 60 Cb -0.15 -2.05 -0.04 0.00 0.04 0.00 0.00 34.50 32.30 1xw6 s PRO 60 CO 0.04 -0.80 -0.08 1.52 0.04 0.00 0.00 177.00 177.72 1xw6 s TYR 61 N -3.26 0.86 -0.07 0.56 -0.85 -0.70 -3.81 117.35 110.07 1xw6 s TYR 61 Ca 0.57 -0.74 -0.00 0.00 -0.52 0.00 0.00 57.07 56.37 1xw6 s TYR 61 Cb -0.11 -0.49 0.02 0.00 0.38 0.00 0.00 41.96 41.76 1xw6 s TYR 61 CO 0.53 -0.10 -0.03 -1.17 -1.52 0.00 0.00 175.55 173.25 1xw6 s LEU 62 N -2.50 0.98 -0.23 -3.49 2.96 0.72 -1.21 118.68 115.91 1xw6 s LEU 62 Ca 0.04 -0.15 -0.05 0.00 -0.22 0.00 0.00 54.13 53.75 1xw6 s LEU 62 Cb -0.01 -0.54 -0.02 0.00 0.50 0.00 0.00 46.19 46.13 1xw6 s LEU 62 CO -0.02 -0.13 0.00 -0.63 -1.32 0.00 0.00 176.35 174.25 1xw6 s ILE 63 N 1.53 3.76 -0.55 6.68 1.01 -0.05 -0.68 121.20 132.90 1xw6 s ILE 63 Ca -0.01 -0.36 0.05 0.00 0.00 0.00 0.00 60.65 60.33 1xw6 s ILE 63 Cb -0.13 -2.73 0.18 0.00 0.01 0.00 0.00 42.46 39.79 1xw6 s ILE 63 CO -0.04 0.39 0.44 -0.67 0.00 0.00 0.00 174.94 175.06 1xw6 n ASP 64 N 4.83 1.30 0.00 3.58 2.03 0.75 -1.11 116.55 127.92 1xw6 n ASP 64 Ca -0.17 -2.81 0.00 0.00 0.52 0.00 0.00 54.79 52.33 1xw6 n ASP 64 Cb 0.51 -0.65 0.00 0.00 -0.72 0.00 0.00 41.12 40.26 1xw6 n ASP 64 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1xw6 n GLY 65 N 2.27 3.14 0.22 0.27 0.00 -1.26 -2.20 105.19 107.63 1xw6 n GLY 65 Ca 0.25 -0.16 0.10 0.00 0.00 0.00 0.00 46.02 46.21 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 -0.47 1.02 -1.96 4.61 0.00 -2.01 -3.43 119.26 117.02 1xw6 h ALA 66 Ca 0.00 -0.20 -0.59 0.00 0.00 0.00 0.00 54.91 54.12 1xw6 h ALA 66 Cb 0.00 -0.03 -0.09 0.00 0.00 0.00 0.00 17.79 17.66 1xw6 h ALA 66 CO 0.00 0.27 0.64 -1.01 0.00 0.00 0.00 179.25 179.15 1xw6 s HIS 67 N -3.65 2.99 -0.30 0.00 3.76 -0.93 -5.02 115.29 112.15 1xw6 s HIS 67 Ca 0.01 0.64 -0.05 0.00 -0.15 0.00 0.00 55.06 55.51 1xw6 s HIS 67 Cb 0.10 -3.85 0.03 0.00 1.11 0.00 0.00 32.58 29.96 1xw6 s HIS 67 CO 0.63 -0.97 0.04 0.15 -0.85 0.00 0.00 174.74 173.74 1xw6 s LYS 68 N 3.69 2.80 -0.02 1.40 3.01 -1.26 -0.18 119.74 129.18 1xw6 s LYS 68 Ca 0.39 -1.03 0.07 0.00 -1.01 0.00 0.00 55.97 54.39 1xw6 s LYS 68 Cb -0.11 -3.27 -0.02 0.00 -1.01 0.00 0.00 37.83 33.43 1xw6 s LYS 68 CO 0.23 -0.52 -0.24 0.42 0.51 0.00 0.00 175.35 175.75 1xw6 s ILE 69 N 1.39 1.91 0.50 2.17 1.01 0.14 -4.79 121.20 123.53 1xw6 s ILE 69 Ca -0.00 -1.03 0.01 0.00 0.00 0.00 0.00 60.65 59.63 1xw6 s ILE 69 Cb -0.18 -1.59 -0.00 0.00 0.01 0.00 0.00 42.46 40.69 1xw6 s ILE 69 CO 0.00 0.54 0.04 0.35 0.00 0.00 0.00 174.94 175.87 1xw6 n THR 70 N 2.55 0.00 -1.57 2.92 -2.24 -1.26 -0.20 114.28 114.47 1xw6 n THR 70 Ca -0.16 -2.46 -0.01 0.00 -2.27 0.00 0.00 64.05 59.16 1xw6 n THR 70 Cb 0.52 0.59 -0.01 0.00 -2.10 0.00 0.00 70.33 69.33 1xw6 n THR 70 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xw6 n GLN 71 N -1.21 -1.61 -0.31 -0.78 1.13 -1.25 -4.35 117.38 109.00 1xw6 n GLN 71 Ca -0.18 1.52 0.08 0.00 -1.94 0.00 0.00 57.00 56.48 1xw6 n GLN 71 Cb 0.65 -2.01 0.19 0.00 0.11 0.00 0.00 30.24 29.18 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 1.35 -0.60 -0.05 1.08 4.64 -1.91 0.95 113.55 119.00 1xw6 h SER 72 Ca -0.06 0.26 -0.06 0.00 -0.47 0.00 0.00 61.79 61.46 1xw6 h SER 72 Cb 0.14 0.48 -0.01 0.00 -0.31 0.00 0.00 62.40 62.70 1xw6 h SER 72 CO 0.00 -0.29 -0.12 0.78 -0.87 0.00 0.00 176.83 176.33 1xw6 h ASN 73 N 0.03 0.34 -0.40 4.97 2.35 -1.94 -1.87 115.58 119.06 1xw6 h ASN 73 Ca 0.49 -0.08 -0.10 0.00 -0.55 0.00 0.00 56.30 56.06 1xw6 h ASN 73 Cb 0.88 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 39.15 1xw6 h ASN 73 CO -0.87 0.49 -0.14 0.00 -1.65 0.00 0.00 177.43 175.27 1xw6 h ALA 74 N 1.55 0.55 -0.52 -0.83 0.00 -1.07 -1.82 119.26 117.13 1xw6 h ALA 74 Ca 0.07 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 1xw6 h ALA 74 Cb 0.42 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1xw6 h ALA 74 CO 0.02 0.46 0.27 0.82 0.00 0.00 0.00 179.25 180.83 1xw6 h ILE 75 N 0.61 1.19 -0.64 0.00 2.04 -0.94 -1.04 117.51 118.73 1xw6 h ILE 75 Ca 0.10 -0.50 -0.00 0.00 1.00 0.00 0.00 64.86 65.46 1xw6 h ILE 75 Cb 0.68 0.56 -0.03 0.00 -0.74 0.00 0.00 36.82 37.29 1xw6 h ILE 75 CO 0.05 0.20 0.39 -0.07 0.00 0.00 0.00 178.15 178.72 1xw6 h LEU 76 N 0.69 0.76 -0.72 1.44 3.38 -1.24 -2.26 115.31 117.37 1xw6 h LEU 76 Ca 0.18 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 58.05 1xw6 h LEU 76 Cb 0.08 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 1xw6 h LEU 76 CO -0.03 0.60 0.26 0.00 0.09 0.00 0.00 178.44 179.36 1xw6 h TYR 78 N 1.04 0.05 -0.17 0.00 3.20 -0.89 -0.32 116.97 119.88 1xw6 h TYR 78 Ca 0.24 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.08 1xw6 h TYR 78 Cb 0.25 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.51 1xw6 h TYR 78 CO 0.02 0.02 -0.02 0.82 -1.64 0.00 0.00 178.16 177.36 1xw6 h ILE 79 N 0.07 1.27 -0.82 1.81 2.04 -1.32 -3.14 117.51 117.42 1xw6 h ILE 79 Ca 0.04 -0.93 0.09 0.00 1.00 0.00 0.00 64.86 65.07 1xw6 h ILE 79 Cb 0.03 1.56 -0.06 0.00 -0.74 0.00 0.00 36.82 37.61 1xw6 h ILE 79 CO -0.05 0.28 0.53 0.00 0.00 0.00 0.00 178.15 178.91 1xw6 h ALA 80 N 0.74 1.73 -0.41 1.87 0.00 -0.76 -1.86 119.26 120.57 1xw6 h ALA 80 Ca 0.04 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1xw6 h ALA 80 Cb 0.43 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1xw6 h ALA 80 CO 0.01 0.11 0.10 0.00 0.00 0.00 0.00 179.25 179.47 1xw6 h ARG 81 N 0.77 0.60 0.00 0.00 3.08 -1.01 -0.63 114.38 117.19 1xw6 h ARG 81 Ca 0.38 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 60.31 1xw6 h ARG 81 Cb 0.43 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.37 1xw6 h ARG 81 CO -0.15 0.56 -0.03 0.87 -1.07 0.00 0.00 179.97 180.14 1xw6 h LYS 82 N 0.59 0.00 0.00 0.04 1.57 -1.34 -3.25 116.57 114.18 1xw6 h LYS 82 Ca 0.14 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.89 1xw6 h LYS 82 Cb 0.23 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.48 1xw6 h LYS 82 CO -0.00 0.03 -0.51 0.72 -0.57 0.00 0.00 179.45 179.13 1xw6 n HIS 83 N -3.14 0.00 -4.08 -1.35 8.25 -0.80 -5.01 115.22 109.09 1xw6 n HIS 83 Ca 0.01 -1.23 -0.29 0.00 -0.26 0.00 0.00 57.72 55.95 1xw6 n HIS 83 Cb 0.35 -0.21 -0.05 0.00 1.12 0.00 0.00 29.99 31.20 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 -0.89 -0.26 -0.79 0.41 4.05 -0.84 -4.88 115.26 112.05 1xw6 n ASN 84 Ca 0.16 -1.12 0.02 0.00 0.45 0.00 0.00 54.58 54.09 1xw6 n ASN 84 Cb 0.75 -2.46 0.20 0.00 1.23 0.00 0.00 39.78 39.51 1xw6 n ASN 84 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 1xw6 n LEU 85 N -4.50 3.27 -0.00 1.20 4.77 -0.31 -4.64 117.00 116.78 1xw6 n LEU 85 Ca -0.30 -3.79 0.10 0.00 -0.03 0.00 0.00 56.01 51.99 1xw6 n LEU 85 Cb 0.68 -0.57 -0.13 0.00 -2.33 0.00 0.00 43.42 41.07 1xw6 n LEU 85 CO 0.78 1.29 -0.32 0.00 -1.33 0.00 0.00 177.39 177.82 1xw6 n GLY 87 N 1.42 2.69 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 44.34 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 -1.58 1.61 1.02 -1.26 -4.80 120.64 117.01 1xw6 n GLU 88 Ca 0.00 0.11 -0.30 0.00 -0.02 0.00 0.00 57.16 56.95 1xw6 n GLU 88 Cb 0.00 -0.93 0.09 0.00 -0.02 0.00 0.00 31.44 30.58 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 -2.28 2.99 0.18 2.62 -4.23 -1.26 -4.89 115.64 108.77 1xw6 s THR 89 Ca -0.16 0.32 -0.11 0.00 -1.18 0.00 0.00 61.69 60.57 1xw6 s THR 89 Cb 0.05 -3.09 0.10 0.00 1.34 0.00 0.00 72.50 70.90 1xw6 s THR 89 CO 0.21 -0.42 1.74 -0.08 -0.54 0.00 0.00 174.62 175.53 1xw6 h GLU 90 N -1.10 0.98 -0.91 3.99 4.57 -1.99 -2.16 114.58 117.95 1xw6 h GLU 90 Ca -0.47 -0.18 0.00 0.00 -1.18 0.00 0.00 59.36 57.53 1xw6 h GLU 90 Cb 1.27 -0.16 -0.04 0.00 -0.16 0.00 0.00 28.75 29.66 1xw6 h GLU 90 CO 0.60 0.83 0.58 1.49 -1.18 0.00 0.00 179.01 181.32 1xw6 h GLU 91 N 0.92 1.22 -0.18 1.92 4.22 -1.96 -1.38 114.58 119.34 1xw6 h GLU 91 Ca 0.22 -0.09 -0.02 0.00 0.08 0.00 0.00 59.36 59.55 1xw6 h GLU 91 Cb 0.22 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 1xw6 h GLU 91 CO -0.02 0.83 0.04 0.93 -2.18 0.00 0.00 179.01 178.62 1xw6 h GLU 92 N 1.25 0.29 -0.96 1.92 5.08 -1.72 -2.38 114.58 118.06 1xw6 h GLU 92 Ca 0.33 -0.07 0.03 0.00 -1.00 0.00 0.00 59.36 58.65 1xw6 h GLU 92 Cb -0.10 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.06 1xw6 h GLU 92 CO -0.07 0.43 0.63 0.87 -1.00 0.00 0.00 179.01 179.87 1xw6 h LYS 93 N 0.09 1.21 -0.39 2.33 1.57 -1.04 0.27 116.57 120.61 1xw6 h LYS 93 Ca 0.06 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.72 1xw6 h LYS 93 Cb 0.27 -0.27 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 1xw6 h LYS 93 CO 0.00 0.80 0.10 0.82 -0.57 0.00 0.00 179.45 180.60 1xw6 h ILE 94 N 1.25 1.23 -0.80 1.86 2.04 -1.19 -0.89 117.51 121.01 1xw6 h ILE 94 Ca 0.37 -0.77 -0.04 0.00 1.00 0.00 0.00 64.86 65.42 1xw6 h ILE 94 Cb -0.06 0.98 -0.04 0.00 -0.74 0.00 0.00 36.82 36.96 1xw6 h ILE 94 CO -0.10 0.27 0.36 0.03 0.00 0.00 0.00 178.15 178.71 1xw6 h ARG 95 N 0.49 1.17 -0.25 2.37 3.08 -0.95 -1.50 114.38 118.79 1xw6 h ARG 95 Ca 0.12 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 59.98 1xw6 h ARG 95 Cb 0.30 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 1xw6 h ARG 95 CO 0.00 0.92 0.12 0.28 -1.07 0.00 0.00 179.97 180.22 1xw6 h VAL 96 N 1.14 1.15 0.20 2.04 2.07 -0.75 -1.82 116.25 120.28 1xw6 h VAL 96 Ca 0.27 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 1xw6 h VAL 96 Cb 0.16 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 1xw6 h VAL 96 CO -0.03 0.15 -0.10 0.44 0.02 0.00 0.00 177.57 178.05 1xw6 h ASP 97 N 0.26 -0.23 -0.17 0.57 3.32 -0.95 -0.31 116.42 118.91 1xw6 h ASP 97 Ca 0.08 -0.04 0.04 0.00 0.02 0.00 0.00 57.03 57.14 1xw6 h ASP 97 Cb 0.13 0.06 -0.05 0.00 0.22 0.00 0.00 39.33 39.69 1xw6 h ASP 97 CO -0.01 -0.11 -0.12 0.40 -1.72 0.00 0.00 179.24 177.68 1xw6 h ILE 98 N -0.34 0.65 -0.49 0.35 2.04 -1.27 -2.71 117.51 115.75 1xw6 h ILE 98 Ca -0.03 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.80 1xw6 h ILE 98 Cb 0.26 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 1xw6 h ILE 98 CO 0.05 0.00 0.19 -0.07 0.00 0.00 0.00 178.15 178.32 1xw6 h LEU 99 N -0.12 0.67 -0.83 1.44 3.38 -1.29 0.34 115.31 118.90 1xw6 h LEU 99 Ca 0.10 -0.17 0.17 0.00 0.09 0.00 0.00 57.88 58.07 1xw6 h LEU 99 Cb 0.27 -0.17 -0.10 0.00 0.09 0.00 0.00 40.66 40.74 1xw6 h LEU 99 CO -0.25 0.66 0.37 -0.08 0.09 0.00 0.00 178.44 179.23 1xw6 h GLU 100 N 0.64 0.47 0.13 1.13 4.81 -0.88 0.23 114.58 121.12 1xw6 h GLU 100 Ca 0.16 -0.03 -0.31 0.00 -0.13 0.00 0.00 59.36 59.05 1xw6 h GLU 100 Cb 0.20 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.47 1xw6 h GLU 100 CO -0.01 0.31 -1.53 -0.91 -0.73 0.00 0.00 179.01 176.14 1xw6 h ASN 101 N 0.48 0.44 -0.38 1.04 2.35 -1.25 -3.29 115.58 114.97 1xw6 h ASN 101 Ca 0.48 -0.59 -0.04 0.00 -0.55 0.00 0.00 56.30 55.60 1xw6 h ASN 101 Cb 0.77 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.98 1xw6 h ASN 101 CO -0.43 1.49 0.10 -0.61 -1.65 0.00 0.00 177.43 176.32 1xw6 h GLN 102 N 0.08 0.60 -0.67 0.81 5.75 0.27 -2.36 115.11 119.59 1xw6 h GLN 102 Ca -0.24 -0.14 -0.02 0.00 -0.15 0.00 0.00 58.65 58.10 1xw6 h GLN 102 Cb 2.03 -0.08 -0.03 0.00 1.07 0.00 0.00 27.48 30.47 1xw6 h GLN 102 CO 0.17 0.63 0.35 1.79 -2.65 0.00 0.00 178.83 179.13 1xw6 h THR 103 N 0.46 1.22 -0.84 2.39 1.35 -0.72 -1.35 112.91 115.41 1xw6 h THR 103 Ca 0.12 -0.56 -0.03 0.00 -0.55 0.00 0.00 66.41 65.39 1xw6 h THR 103 Cb 0.30 0.36 -0.04 0.00 -1.73 0.00 0.00 68.15 67.03 1xw6 h THR 103 CO 0.00 0.24 0.42 -0.03 -0.25 0.00 0.00 175.52 175.90 1xw6 h MET 104 N 0.92 1.20 0.13 4.72 1.85 -1.61 0.35 114.93 122.49 1xw6 h MET 104 Ca 0.23 -0.17 -0.00 0.00 -0.61 0.00 0.00 59.70 59.15 1xw6 h MET 104 Cb 0.06 -0.22 -0.00 0.00 0.43 0.00 0.00 31.60 31.87 1xw6 h MET 104 CO -0.04 0.91 -0.07 -0.44 -0.40 0.00 0.00 176.91 176.87 1xw6 h ASP 105 N 1.19 -0.17 -0.23 1.39 5.19 -0.86 0.90 116.42 123.82 1xw6 h ASP 105 Ca 0.29 0.01 -0.07 0.00 -0.62 0.00 0.00 57.03 56.64 1xw6 h ASP 105 Cb 0.10 0.05 -0.02 0.00 0.18 0.00 0.00 39.33 39.64 1xw6 h ASP 105 CO -0.04 -0.12 -0.09 0.78 -3.12 0.00 0.00 179.24 176.65 1xw6 h ASN 106 N -0.19 0.59 -0.01 6.45 -0.26 -0.88 -2.02 115.58 119.26 1xw6 h ASN 106 Ca -0.01 -0.15 -0.00 0.00 -0.56 0.00 0.00 56.30 55.57 1xw6 h ASN 106 Cb 0.15 -0.16 -0.00 0.00 -1.06 0.00 0.00 38.32 37.26 1xw6 h ASN 106 CO 0.02 0.72 0.00 -0.74 -1.06 0.00 0.00 177.43 176.37 1xw6 h HIS 107 N 0.56 0.02 -0.81 1.19 2.76 -0.03 -2.87 115.15 115.98 1xw6 h HIS 107 Ca 0.10 -0.00 0.09 0.00 -2.20 0.00 0.00 60.37 58.36 1xw6 h HIS 107 Cb 0.49 -0.00 -0.07 0.00 1.55 0.00 0.00 27.41 29.38 1xw6 h HIS 107 CO 0.02 0.15 0.46 0.52 -1.30 0.00 0.00 177.93 177.77 1xw6 h MET 108 N -0.12 0.76 -0.53 5.26 2.86 -0.51 -1.64 114.93 121.01 1xw6 h MET 108 Ca 0.00 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.59 1xw6 h MET 108 Cb 0.14 -0.17 -0.03 0.00 0.06 0.00 0.00 31.60 31.60 1xw6 h MET 108 CO -0.00 0.50 0.29 1.96 1.06 0.00 0.00 176.91 180.72 1xw6 h GLN 109 N 0.78 0.72 -0.05 1.72 4.20 -1.29 0.20 115.11 121.39 1xw6 h GLN 109 Ca 0.38 -0.07 -0.04 0.00 0.06 0.00 0.00 58.65 58.98 1xw6 h GLN 109 Cb 0.34 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 27.97 1xw6 h GLN 109 CO -0.24 0.53 -0.14 1.25 -0.67 0.00 0.00 178.83 179.56 1xw6 h LEU 110 N 0.73 0.21 -1.49 1.46 5.85 -1.19 -3.21 115.31 117.67 1xw6 h LEU 110 Ca 0.19 -0.61 -0.00 0.00 0.84 0.00 0.00 57.88 58.30 1xw6 h LEU 110 Cb 0.02 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 1xw6 h LEU 110 CO -0.03 0.78 0.26 1.23 -0.34 0.00 0.00 178.44 180.34 1xw6 h GLY 111 N -0.36 0.65 0.85 3.75 0.00 -1.05 -1.89 103.07 105.02 1xw6 h GLY 111 Ca -0.00 -0.26 0.02 0.00 0.00 0.00 0.00 47.33 47.08 1xw6 h GLY 111 CO 0.03 0.25 0.09 -0.33 0.00 0.00 0.00 176.54 176.59 1xw6 h MET 112 N 0.62 0.20 0.06 4.80 2.86 -0.62 -1.83 114.93 121.03 1xw6 h MET 112 Ca 0.16 -0.01 -0.24 0.00 -2.06 0.00 0.00 59.70 57.55 1xw6 h MET 112 Cb -0.01 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.61 1xw6 h MET 112 CO -0.03 0.13 -1.08 -0.84 1.06 0.00 0.00 176.91 176.16 1xw6 h ILE 113 N 0.21 1.48 -0.11 -1.22 3.07 -1.53 -2.84 117.51 116.56 1xw6 h ILE 113 Ca 0.10 -2.82 -0.07 0.00 1.55 0.00 0.00 64.86 63.62 1xw6 h ILE 113 Cb 0.05 2.70 -0.01 0.00 -0.27 0.00 0.00 36.82 39.29 1xw6 h ILE 113 CO -0.09 0.83 -0.23 0.00 -1.05 0.00 0.00 178.15 177.61 1xw6 n TYR 115 N -4.20 0.37 -2.23 0.00 4.01 -0.70 0.55 117.16 114.96 1xw6 n TYR 115 Ca -0.01 0.11 -0.42 0.00 -0.16 0.00 0.00 57.90 57.42 1xw6 n TYR 115 Cb 0.33 -0.52 -0.03 0.00 -0.31 0.00 0.00 39.34 38.81 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 -3.90 6.87 0.59 7.72 3.84 -0.91 -4.61 114.94 124.54 1xw6 s ASN 116 Ca 0.07 2.16 0.28 0.00 0.21 0.00 0.00 52.86 55.58 1xw6 s ASN 116 Cb 0.14 -2.57 1.59 0.00 -0.55 0.00 0.00 41.25 39.86 1xw6 s ASN 116 CO 0.73 -0.67 2.03 -0.65 -2.79 0.00 0.00 177.10 175.76 1xw6 h PRO 117 N 7.41 0.00 -1.07 0.43 0.11 -1.90 -0.86 132.00 136.12 1xw6 h PRO 117 Ca -0.39 0.00 -0.54 0.00 0.11 0.00 0.00 66.00 65.17 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 0.70 0.39 -0.21 0.00 0.00 178.00 179.76 1xw6 n GLU 118 N -3.80 2.34 -0.15 1.05 1.02 -1.26 -4.72 120.64 115.13 1xw6 n GLU 118 Ca 0.04 -2.80 -0.03 0.00 -0.02 0.00 0.00 57.16 54.35 1xw6 n GLU 118 Cb 0.44 -2.10 0.05 0.00 -0.02 0.00 0.00 31.44 29.81 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 1.50 -0.05 -0.42 -0.32 3.57 -1.32 -2.44 116.94 117.44 1xw6 h PHE 119 Ca 0.55 0.04 0.03 0.00 3.53 0.00 0.00 57.97 62.11 1xw6 h PHE 119 Cb 1.53 0.10 -0.02 0.00 2.79 0.00 0.00 35.95 40.35 1xw6 h PHE 119 CO 1.34 -0.12 0.28 1.49 -2.23 0.00 0.00 178.31 179.07 1xw6 h GLU 120 N 0.10 0.46 0.07 1.11 4.57 -1.87 -1.01 114.58 118.01 1xw6 h GLU 120 Ca 0.24 -0.03 -0.25 0.00 -1.18 0.00 0.00 59.36 58.14 1xw6 h GLU 120 Cb 0.36 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 28.85 1xw6 h GLU 120 CO -0.41 0.30 -1.10 -0.22 -1.18 0.00 0.00 179.01 176.40 1xw6 h LYS 121 N 0.47 0.31 0.00 1.92 3.64 -1.84 -3.32 116.57 117.76 1xw6 h LYS 121 Ca 0.17 -0.44 -0.04 0.00 -1.27 0.00 0.00 60.65 59.07 1xw6 h LYS 121 Cb 0.10 0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 1xw6 h LYS 121 CO -0.04 1.16 -0.29 -0.07 -2.27 0.00 0.00 179.45 177.94 1xw6 h LEU 122 N 0.13 0.00 -0.81 5.20 4.07 -1.15 -3.38 115.31 119.38 1xw6 h LEU 122 Ca -0.11 0.00 0.10 0.00 0.08 0.00 0.00 57.88 57.96 1xw6 h LEU 122 Cb 1.79 0.00 -0.08 0.00 1.08 0.00 0.00 40.66 43.46 1xw6 h LEU 122 CO 0.18 0.19 0.45 0.50 -1.08 0.00 0.00 178.44 178.68 1xw6 h LYS 123 N 0.00 0.71 -0.80 1.13 3.64 -1.29 -2.93 116.57 117.03 1xw6 h LYS 123 Ca -0.01 -0.04 0.07 0.00 -1.27 0.00 0.00 60.65 59.40 1xw6 h LYS 123 Cb 1.15 -0.16 -0.06 0.00 -0.41 0.00 0.00 32.23 32.75 1xw6 h LYS 123 CO 0.02 0.47 0.47 -1.35 -2.27 0.00 0.00 179.45 176.79 1xw6 h PRO 124 N 0.73 0.81 -0.12 1.90 0.11 -1.78 -1.81 132.00 131.84 1xw6 h PRO 124 Ca 0.40 -0.05 -0.18 0.00 0.11 0.00 0.00 66.00 66.28 1xw6 h PRO 124 Cb 0.41 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 31.34 1xw6 h PRO 124 CO -0.27 0.53 -0.69 -0.22 -0.21 0.00 0.00 178.00 177.14 1xw6 h LYS 125 N 0.83 0.51 -0.45 1.05 3.64 -1.81 -2.56 116.57 117.78 1xw6 h LYS 125 Ca 0.36 -0.39 -0.02 0.00 -1.27 0.00 0.00 60.65 59.33 1xw6 h LYS 125 Cb 0.25 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 1xw6 h LYS 125 CO -0.20 1.02 0.20 -0.92 -2.27 0.00 0.00 179.45 177.27 1xw6 h TYR 126 N 0.36 0.67 0.00 1.91 3.20 -1.32 -1.79 116.97 120.00 1xw6 h TYR 126 Ca -0.02 -0.04 -0.07 0.00 3.14 0.00 0.00 58.73 61.73 1xw6 h TYR 126 Cb 1.27 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 39.32 1xw6 h TYR 126 CO 0.05 0.57 -0.35 -0.07 -1.64 0.00 0.00 178.16 176.72 1xw6 h LEU 127 N 0.59 0.00 -0.47 2.82 3.38 -1.36 -0.47 115.31 119.80 1xw6 h LEU 127 Ca 0.15 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.98 1xw6 h LEU 127 Cb 0.16 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1xw6 h LEU 127 CO -0.02 0.35 -0.27 -0.08 0.09 0.00 0.00 178.44 178.52 1xw6 h GLU 128 N 0.00 0.98 0.00 1.13 4.81 -1.06 -3.18 114.58 117.26 1xw6 h GLU 128 Ca -0.00 -0.45 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 1xw6 h GLU 128 Cb 0.66 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.02 1xw6 h GLU 128 CO 0.05 1.12 -0.49 0.39 -0.73 0.00 0.00 179.01 179.34 1xw6 n GLU 129 N -4.09 0.09 -0.20 1.92 1.02 -0.71 -4.40 120.64 114.27 1xw6 n GLU 129 Ca -0.01 0.03 -0.06 0.00 -0.02 0.00 0.00 57.16 57.10 1xw6 n GLU 129 Cb 0.49 -1.56 0.04 0.00 -0.02 0.00 0.00 31.44 30.39 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 0.00 0.62 -1.01 -4.62 5.85 -1.06 -2.91 115.31 112.18 1xw6 h LEU 130 Ca 0.00 -0.01 0.09 0.00 0.84 0.00 0.00 57.88 58.80 1xw6 h LEU 130 Cb 0.57 -0.15 -0.08 0.00 0.37 0.00 0.00 40.66 41.38 1xw6 h LEU 130 CO 0.00 0.44 0.64 -0.65 -0.34 0.00 0.00 178.44 178.54 1xw6 h PRO 131 N 0.74 1.07 -0.37 5.25 0.11 -1.77 -1.64 132.00 135.39 1xw6 h PRO 131 Ca 0.22 -0.06 0.04 0.00 0.11 0.00 0.00 66.00 66.30 1xw6 h PRO 131 Cb -0.05 -0.24 -0.04 0.00 0.11 0.00 0.00 31.00 30.78 1xw6 h PRO 131 CO -0.06 0.70 0.15 0.93 -0.21 0.00 0.00 178.00 179.51 1xw6 h GLU 132 N 1.10 0.30 0.16 1.05 4.39 -1.80 -0.18 114.58 119.60 1xw6 h GLU 132 Ca 0.47 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 60.14 1xw6 h GLU 132 Cb 0.32 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.90 1xw6 h GLU 132 CO -0.22 0.20 -0.07 0.87 -1.16 0.00 0.00 179.01 178.63 1xw6 h LYS 133 N 0.31 -0.20 -0.93 2.33 1.57 -1.30 -2.91 116.57 115.44 1xw6 h LYS 133 Ca 0.16 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.98 1xw6 h LYS 133 Cb 0.12 0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.43 1xw6 h LYS 133 CO -0.15 -0.07 0.61 -0.07 -0.57 0.00 0.00 179.45 179.20 1xw6 h LEU 134 N -0.28 1.05 -1.58 2.94 4.07 -1.21 -2.40 115.31 117.90 1xw6 h LEU 134 Ca -0.02 -0.02 0.06 0.00 0.08 0.00 0.00 57.88 57.97 1xw6 h LEU 134 Cb 0.22 -0.25 -0.03 0.00 1.08 0.00 0.00 40.66 41.68 1xw6 h LEU 134 CO 0.04 0.75 0.36 0.50 -1.08 0.00 0.00 178.44 179.00 1xw6 h LYS 135 N 1.23 0.50 -0.49 1.13 3.64 -0.93 -1.22 116.57 120.43 1xw6 h LYS 135 Ca 0.35 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.65 1xw6 h LYS 135 Cb -0.10 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.59 1xw6 h LYS 135 CO -0.09 0.33 0.11 -0.07 -2.27 0.00 0.00 179.45 177.47 1xw6 h LEU 136 N 0.52 0.75 -0.73 5.20 3.38 -1.23 0.45 115.31 123.65 1xw6 h LEU 136 Ca 0.23 -0.24 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1xw6 h LEU 136 Cb 0.27 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1xw6 h LEU 136 CO -0.06 0.80 -0.02 1.88 0.09 0.00 0.00 178.44 181.12 1xw6 h TYR 137 N 0.68 1.04 0.43 1.13 0.05 -1.33 -1.43 116.97 117.53 1xw6 h TYR 137 Ca 0.15 -0.17 -0.02 0.00 0.05 0.00 0.00 58.73 58.74 1xw6 h TYR 137 Cb 0.34 -0.27 0.00 0.00 1.01 0.00 0.00 36.73 37.81 1xw6 h TYR 137 CO 0.02 0.94 -0.23 1.03 -1.05 0.00 0.00 178.16 178.88 1xw6 h SER 138 N 0.88 -0.55 -0.23 3.88 0.87 -0.92 -1.15 113.55 116.33 1xw6 h SER 138 Ca 0.16 0.02 -0.06 0.00 -1.23 0.00 0.00 61.79 60.69 1xw6 h SER 138 Cb 0.54 0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 62.63 1xw6 h SER 138 CO 0.03 -0.37 -0.03 -0.33 -0.53 0.00 0.00 176.83 175.60 1xw6 h GLU 139 N -0.60 0.54 -0.42 2.24 5.08 -0.89 -1.37 114.58 119.15 1xw6 h GLU 139 Ca -0.05 -0.13 -0.06 0.00 -1.00 0.00 0.00 59.36 58.12 1xw6 h GLU 139 Cb 0.48 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 1xw6 h GLU 139 CO 0.08 0.59 0.03 0.35 -1.00 0.00 0.00 179.01 179.06 1xw6 h PHE 140 N 0.52 0.78 -0.27 4.33 3.57 -1.11 -3.09 116.94 121.68 1xw6 h PHE 140 Ca 0.11 -0.12 -0.06 0.00 3.53 0.00 0.00 57.97 61.42 1xw6 h PHE 140 Cb 0.38 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 1xw6 h PHE 140 CO 0.01 0.77 -0.06 1.25 -2.23 0.00 0.00 178.31 178.05 1xw6 h LEU 141 N 0.57 0.52 0.00 0.59 5.85 -0.98 -3.48 115.31 118.38 1xw6 h LEU 141 Ca 0.12 -0.36 0.00 0.00 0.84 0.00 0.00 57.88 58.48 1xw6 h LEU 141 Cb 0.44 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.33 1xw6 h LEU 141 CO 0.02 0.76 0.00 0.61 -0.34 0.00 0.00 178.44 179.48 1xw6 n GLY 142 N -0.17 3.24 1.44 3.75 0.00 -0.54 -1.83 105.19 111.08 1xw6 n GLY 142 Ca -0.03 -0.20 0.09 0.00 0.00 0.00 0.00 46.02 45.87 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 13.84 3.33 -2.63 1.61 4.76 -1.26 -4.96 118.16 132.85 1xw6 n LYS 143 Ca 0.00 -2.59 -0.37 0.00 -2.87 0.00 0.00 58.31 52.48 1xw6 n LYS 143 Cb 0.00 -1.78 -0.05 0.00 -1.84 0.00 0.00 35.03 31.36 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 -1.68 4.37 0.18 1.97 0.52 -0.76 -4.97 118.95 118.58 1xw6 s ARG 144 Ca 0.47 1.47 -0.06 0.00 -0.52 0.00 0.00 55.73 57.08 1xw6 s ARG 144 Cb 0.29 -2.70 0.07 0.00 0.52 0.00 0.00 34.95 33.13 1xw6 s ARG 144 CO 0.24 0.05 1.53 -1.00 0.02 0.00 0.00 175.30 176.14 1xw6 h PRO 145 N 2.88 0.76 -5.54 3.54 0.13 -1.89 -3.45 132.00 128.43 1xw6 h PRO 145 Ca -0.48 -0.40 -0.48 0.00 -0.87 0.00 0.00 66.00 63.77 1xw6 h PRO 145 Cb 1.21 0.01 -0.14 0.00 0.13 0.00 0.00 31.00 32.21 1xw6 h PRO 145 CO 0.64 1.03 -0.70 -1.58 -0.23 0.00 0.00 178.00 177.16 1xw6 s TRP 146 N -4.31 1.88 0.35 1.56 0.52 -0.96 -4.94 118.94 113.04 1xw6 s TRP 146 Ca -0.09 -0.65 0.07 0.00 0.02 0.00 0.00 56.10 55.45 1xw6 s TRP 146 Cb 0.12 -1.00 0.67 0.00 -1.15 0.00 0.00 33.47 32.10 1xw6 s TRP 146 CO 0.86 0.31 1.86 0.74 0.02 0.00 0.00 176.95 180.74 1xw6 h PHE 147 N 2.37 0.34 0.00 -1.98 -1.00 -1.88 -3.03 116.94 111.77 1xw6 h PHE 147 Ca -0.39 -0.05 0.00 0.00 2.81 0.00 0.00 57.97 60.34 1xw6 h PHE 147 Cb 1.23 -0.09 0.00 0.00 3.61 0.00 0.00 35.95 40.70 1xw6 h PHE 147 CO 0.69 0.47 -0.48 0.00 -1.61 0.00 0.00 178.31 177.37 1xw6 h ALA 148 N 1.55 0.71 0.00 2.45 0.00 -1.90 -3.47 119.26 118.60 1xw6 h ALA 148 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1xw6 h ALA 148 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.24 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 1.27 -0.19 0.07 0.00 0.00 -1.14 -4.40 105.19 100.80 1xw6 n GLY 149 Ca 0.03 -0.25 0.11 0.00 0.00 0.00 0.00 46.02 45.91 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 0.67 -4.66 1.61 5.03 -1.26 -2.26 115.26 114.38 1xw6 n ASN 150 Ca 0.00 0.11 -0.29 0.00 0.87 0.00 0.00 54.58 55.27 1xw6 n ASN 150 Cb 0.00 0.66 -0.08 0.00 -1.02 0.00 0.00 39.78 39.34 1xw6 n ASN 150 CO 0.00 0.00 0.00 -1.59 -1.83 0.00 0.00 177.26 173.84 1xw6 s LYS 151 N -3.30 2.43 0.29 3.52 -2.85 -1.26 -4.75 119.74 113.82 1xw6 s LYS 151 Ca 0.01 -0.95 -0.28 0.00 -1.00 0.00 0.00 55.97 53.75 1xw6 s LYS 151 Cb 0.12 -2.45 -0.09 0.00 -2.06 0.00 0.00 37.83 33.35 1xw6 s LYS 151 CO 0.79 0.51 0.98 -1.50 0.10 0.00 0.00 175.35 176.23 1xw6 s ILE 152 N -1.41 3.98 0.36 3.79 2.07 -1.26 -4.59 121.20 124.14 1xw6 s ILE 152 Ca 0.25 1.84 0.04 0.00 -1.41 0.00 0.00 60.65 61.38 1xw6 s ILE 152 Cb -0.11 -4.11 -0.03 0.00 0.13 0.00 0.00 42.46 38.34 1xw6 s ILE 152 CO 0.18 0.32 0.15 0.42 -1.91 0.00 0.00 174.94 174.10 1xw6 s THR 153 N -1.35 0.48 0.35 4.00 -4.23 -1.26 -4.80 115.64 108.83 1xw6 s THR 153 Ca 0.46 -2.00 0.36 0.00 -1.18 0.00 0.00 61.69 59.33 1xw6 s THR 153 Cb -0.24 -2.45 0.39 0.00 1.34 0.00 0.00 72.50 71.54 1xw6 s THR 153 CO 0.31 0.00 2.14 2.19 -0.54 0.00 0.00 174.62 178.71 1xw6 h PHE 154 N 1.98 0.00 0.00 3.99 -5.15 -1.55 -2.72 116.94 113.50 1xw6 h PHE 154 Ca -0.34 0.00 -0.01 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 1.32 0.02 -0.04 -0.39 -2.00 0.00 0.00 178.31 177.23 1xw6 h VAL 155 N 0.00 0.09 -0.16 0.88 -1.51 -1.92 -2.55 116.25 111.09 1xw6 h VAL 155 Ca -0.00 -0.60 -0.07 0.00 -1.23 0.00 0.00 66.70 64.80 1xw6 h VAL 155 Cb 0.31 1.55 -0.01 0.00 -2.13 0.00 0.00 31.29 31.00 1xw6 h VAL 155 CO 0.00 0.03 -0.21 0.44 -1.23 0.00 0.00 177.57 176.61 1xw6 h ASP 156 N 0.00 0.26 0.03 4.19 3.32 -1.90 0.80 116.42 123.12 1xw6 h ASP 156 Ca -0.00 -0.07 -0.15 0.00 0.02 0.00 0.00 57.03 56.83 1xw6 h ASP 156 Cb 0.55 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.02 1xw6 h ASP 156 CO 0.00 0.49 -0.50 -0.26 -1.72 0.00 0.00 179.24 177.25 1xw6 h PHE 157 N 0.25 0.66 -0.19 4.55 -1.00 -1.62 0.26 116.94 119.84 1xw6 h PHE 157 Ca 0.04 -0.22 -0.13 0.00 2.81 0.00 0.00 57.97 60.48 1xw6 h PHE 157 Cb 0.51 -0.13 0.00 0.00 3.61 0.00 0.00 35.95 39.95 1xw6 h PHE 157 CO 0.01 0.93 -0.37 -0.07 -1.61 0.00 0.00 178.31 177.19 1xw6 h LEU 158 N 0.42 0.66 -0.51 1.54 3.38 -1.36 -2.44 115.31 117.00 1xw6 h LEU 158 Ca 0.02 -0.55 -0.14 0.00 0.09 0.00 0.00 57.88 57.30 1xw6 h LEU 158 Cb 1.03 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 1xw6 h LEU 158 CO 0.09 1.08 -0.30 0.58 0.09 0.00 0.00 178.44 179.99 1xw6 h VAL 159 N 0.26 1.27 -0.27 1.22 2.07 -0.83 -2.29 116.25 117.68 1xw6 h VAL 159 Ca 0.01 -1.46 0.04 0.00 0.82 0.00 0.00 66.70 66.11 1xw6 h VAL 159 Cb 0.97 1.27 -0.04 0.00 -1.52 0.00 0.00 31.29 31.97 1xw6 h VAL 159 CO 0.08 0.49 0.02 0.22 0.02 0.00 0.00 177.57 178.41 1xw6 h TYR 160 N 0.76 0.03 -0.98 1.57 5.03 -0.96 -0.07 116.97 122.35 1xw6 h TYR 160 Ca 0.08 0.02 0.01 0.00 2.58 0.00 0.00 58.73 61.42 1xw6 h TYR 160 Cb 0.86 0.03 -0.05 0.00 1.55 0.00 0.00 36.73 39.12 1xw6 h TYR 160 CO 0.05 -0.02 0.65 0.22 -1.32 0.00 0.00 178.16 177.74 1xw6 h ASP 161 N 0.11 1.12 -0.41 -2.11 3.58 -1.30 0.22 116.42 117.63 1xw6 h ASP 161 Ca 0.13 -0.03 -0.08 0.00 0.42 0.00 0.00 57.03 57.47 1xw6 h ASP 161 Cb 0.15 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 40.91 1xw6 h ASP 161 CO -0.20 0.80 -0.06 0.58 -2.88 0.00 0.00 179.24 177.48 1xw6 h VAL 162 N 1.32 1.27 -0.36 2.25 2.07 -0.92 -0.88 116.25 121.00 1xw6 h VAL 162 Ca 0.36 -1.13 -0.08 0.00 0.82 0.00 0.00 66.70 66.67 1xw6 h VAL 162 Cb -0.14 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 1xw6 h VAL 162 CO -0.08 0.38 -0.09 -0.07 0.02 0.00 0.00 177.57 177.73 1xw6 h LEU 163 N 0.58 0.69 -0.45 2.57 3.38 -0.67 -2.97 115.31 118.45 1xw6 h LEU 163 Ca 0.11 -0.37 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 1xw6 h LEU 163 Cb 0.57 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 1xw6 h LEU 163 CO 0.03 0.90 0.15 -0.78 0.09 0.00 0.00 178.44 178.84 1xw6 h ASP 164 N 0.48 0.64 -0.11 -0.43 3.58 -0.52 -1.91 116.42 118.14 1xw6 h ASP 164 Ca 0.09 -0.19 0.03 0.00 0.42 0.00 0.00 57.03 57.37 1xw6 h ASP 164 Cb 0.60 -0.17 -0.00 0.00 1.72 0.00 0.00 39.33 41.48 1xw6 h ASP 164 CO 0.04 0.66 0.08 -0.07 -2.88 0.00 0.00 179.24 177.07 1xw6 h LEU 165 N 0.58 0.03 0.03 2.28 3.38 -1.17 -2.25 115.31 118.19 1xw6 h LEU 165 Ca 0.15 -0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.87 1xw6 h LEU 165 Cb 0.24 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 1xw6 h LEU 165 CO -0.01 0.02 -1.22 0.45 0.09 0.00 0.00 178.44 177.77 1xw6 h HIS 166 N 0.03 0.11 0.00 1.13 3.86 -1.28 -2.27 115.15 116.73 1xw6 h HIS 166 Ca 0.05 -0.08 -0.10 0.00 -1.16 0.00 0.00 60.37 59.08 1xw6 h HIS 166 Cb 0.17 -0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.62 1xw6 h HIS 166 CO -0.00 1.08 -0.49 0.07 0.86 0.00 0.00 177.93 179.45 1xw6 h ARG 167 N 0.02 0.00 -0.26 2.45 0.11 -0.98 0.56 114.38 116.28 1xw6 h ARG 167 Ca -0.10 0.00 -0.18 0.00 0.10 0.00 0.00 59.98 59.80 1xw6 h ARG 167 Cb 1.87 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.95 1xw6 h ARG 167 CO 0.13 0.49 -0.54 0.82 0.10 0.00 0.00 179.97 180.97 1xw6 h ILE 168 N 0.00 1.28 -0.14 0.08 2.04 -1.44 -1.23 117.51 118.10 1xw6 h ILE 168 Ca -0.00 -1.73 -0.19 0.00 1.00 0.00 0.00 64.86 63.93 1xw6 h ILE 168 Cb 0.89 1.70 0.01 0.00 -0.74 0.00 0.00 36.82 38.67 1xw6 h ILE 168 CO 0.06 0.56 -0.65 0.15 0.00 0.00 0.00 178.15 178.27 1xw6 h PHE 169 N 0.60 0.93 -2.32 1.37 3.57 -1.04 -3.41 116.94 116.64 1xw6 h PHE 169 Ca 0.01 -0.41 -0.50 0.00 3.53 0.00 0.00 57.97 60.60 1xw6 h PHE 169 Cb 1.15 -0.14 -0.36 0.00 2.79 0.00 0.00 35.95 39.39 1xw6 h PHE 169 CO 0.08 1.22 -0.79 -2.00 -2.23 0.00 0.00 178.31 174.58 1xw6 s GLU 170 N -3.74 0.60 0.35 1.11 2.56 0.19 -5.06 118.70 114.72 1xw6 s GLU 170 Ca -0.11 -1.19 0.15 0.00 0.00 0.00 0.00 54.97 53.82 1xw6 s GLU 170 Cb 0.07 -1.07 1.14 0.00 2.00 0.00 0.00 34.13 36.28 1xw6 s GLU 170 CO 0.87 -1.22 1.61 -1.35 -0.56 0.00 0.00 175.26 174.61 1xw6 h PRO 171 N 6.94 0.10 -0.13 4.30 0.11 -1.39 -0.21 132.00 141.73 1xw6 h PRO 171 Ca 0.07 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.17 1xw6 h PRO 171 Cb 1.00 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1xw6 h PRO 171 CO 0.24 0.07 0.00 1.63 -0.21 0.00 0.00 178.00 179.73 1xw6 n LYS 172 N -5.23 1.65 0.28 1.05 5.02 -1.26 -4.44 118.16 115.22 1xw6 n LYS 172 Ca 0.33 -0.97 0.13 0.00 -2.02 0.00 0.00 58.31 55.78 1xw6 n LYS 172 Cb 1.08 -1.40 0.81 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 -3.87 1.92 -0.33 0.00 4.32 -1.26 -4.47 117.00 113.31 1xw6 n LEU 174 Ca -0.03 -0.67 0.01 0.00 -0.02 0.00 0.00 56.01 55.31 1xw6 n LEU 174 Cb 0.14 -0.03 0.18 0.00 -1.62 0.00 0.00 43.42 42.10 1xw6 n LEU 174 CO 0.29 0.35 1.27 0.44 -1.22 0.00 0.00 177.39 178.52 1xw6 h ASP 175 N 2.50 1.01 0.47 -1.43 3.32 -1.78 -1.75 116.42 118.78 1xw6 h ASP 175 Ca 0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1xw6 h ASP 175 Cb 0.72 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.04 1xw6 h ASP 175 CO 0.00 0.69 0.00 0.00 -1.72 0.00 0.00 179.24 178.21 1xw6 n ALA 176 N -2.39 2.01 -3.71 3.45 0.00 -1.26 -4.28 120.51 114.33 1xw6 n ALA 176 Ca 0.13 -0.09 -0.28 0.00 0.00 0.00 0.00 53.44 53.20 1xw6 n ALA 176 Cb 0.11 -1.33 -0.12 0.00 0.00 0.00 0.00 19.45 18.11 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 -2.71 2.43 0.34 0.00 0.08 -0.66 -4.98 117.98 112.49 1xw6 s PHE 177 Ca 0.16 -2.79 0.07 0.00 0.12 0.00 0.00 56.93 54.49 1xw6 s PHE 177 Cb 0.13 -2.00 0.76 0.00 -0.57 0.00 0.00 43.02 41.34 1xw6 s PHE 177 CO 0.32 -0.70 1.87 -1.00 -0.10 0.00 0.00 175.22 175.61 1xw6 h PRO 178 N 5.92 0.74 0.00 0.24 0.13 -1.74 -1.63 132.00 135.66 1xw6 h PRO 178 Ca 0.12 -0.04 -0.04 0.00 -0.87 0.00 0.00 66.00 65.16 1xw6 h PRO 178 Cb 0.85 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 31.81 1xw6 h PRO 178 CO 0.56 0.49 -0.21 -2.95 -0.23 0.00 0.00 178.00 175.66 1xw6 h ASN 179 N 0.76 0.00 0.40 1.44 -0.00 -1.92 -1.41 115.58 114.84 1xw6 h ASN 179 Ca 0.45 0.00 -0.22 0.00 -0.00 0.00 0.00 56.30 56.54 1xw6 h ASN 179 Cb 0.65 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 38.97 1xw6 h ASN 179 CO -0.21 0.21 -0.92 -0.07 -0.00 0.00 0.00 177.43 176.43 1xw6 h LEU 180 N 0.00 0.46 -0.43 6.14 3.38 -1.64 -1.55 115.31 121.67 1xw6 h LEU 180 Ca -0.00 -0.37 -0.12 0.00 0.09 0.00 0.00 57.88 57.48 1xw6 h LEU 180 Cb 0.48 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1xw6 h LEU 180 CO 0.03 1.17 -0.20 0.11 0.09 0.00 0.00 178.44 179.63 1xw6 h LYS 181 N 0.20 0.90 -0.16 1.13 1.57 -1.27 -2.55 116.57 116.40 1xw6 h LYS 181 Ca -0.07 -0.39 -0.06 0.00 -1.87 0.00 0.00 60.65 58.26 1xw6 h LYS 181 Cb 1.55 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.82 1xw6 h LYS 181 CO 0.15 1.04 -0.18 -0.44 -0.57 0.00 0.00 179.45 179.46 1xw6 h ASP 182 N 0.72 0.25 -0.35 0.86 3.32 -1.22 -1.61 116.42 118.39 1xw6 h ASP 182 Ca 0.10 -0.06 -0.04 0.00 0.02 0.00 0.00 57.03 57.05 1xw6 h ASP 182 Cb 0.77 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.24 1xw6 h ASP 182 CO 0.06 0.45 0.07 0.15 -1.72 0.00 0.00 179.24 178.25 1xw6 h PHE 183 N 0.24 0.60 -0.61 4.55 3.57 -1.09 -0.70 116.94 123.50 1xw6 h PHE 183 Ca 0.05 -0.08 -0.01 0.00 3.53 0.00 0.00 57.97 61.46 1xw6 h PHE 183 Cb 0.46 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 39.01 1xw6 h PHE 183 CO 0.01 0.62 0.34 0.82 -2.23 0.00 0.00 178.31 177.86 1xw6 h ILE 184 N 0.41 1.20 -0.26 1.41 2.04 -1.02 0.27 117.51 121.55 1xw6 h ILE 184 Ca 0.11 -0.49 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 1xw6 h ILE 184 Cb 0.33 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 1xw6 h ILE 184 CO 0.00 0.21 0.11 -1.28 0.00 0.00 0.00 178.15 177.19 1xw6 h SER 185 N 0.83 0.36 -0.85 1.72 0.87 -1.18 -0.48 113.55 114.83 1xw6 h SER 185 Ca 0.22 -0.16 -0.02 0.00 -1.23 0.00 0.00 61.79 60.60 1xw6 h SER 185 Cb 0.04 -0.09 -0.04 0.00 -0.44 0.00 0.00 62.40 61.86 1xw6 h SER 185 CO -0.04 0.43 0.47 -0.09 -0.53 0.00 0.00 176.83 177.07 1xw6 h ARG 186 N 0.28 1.18 0.32 2.24 2.43 -0.95 0.36 114.38 120.24 1xw6 h ARG 186 Ca 0.09 -0.14 -0.02 0.00 -0.81 0.00 0.00 59.98 59.11 1xw6 h ARG 186 Cb 0.18 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 29.50 1xw6 h ARG 186 CO -0.01 0.86 -0.15 0.35 -1.51 0.00 0.00 179.97 179.51 1xw6 h PHE 187 N 1.18 -0.40 0.00 2.20 3.57 -0.80 -2.90 116.94 119.79 1xw6 h PHE 187 Ca 0.30 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.78 1xw6 h PHE 187 Cb 0.02 0.13 -0.00 0.00 2.79 0.00 0.00 35.95 38.89 1xw6 h PHE 187 CO 0.01 -0.06 -0.05 0.93 -2.23 0.00 0.00 178.31 176.91 1xw6 h GLU 188 N -0.81 0.00 0.00 1.11 5.08 -1.01 -1.79 114.58 117.16 1xw6 h GLU 188 Ca -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1xw6 h GLU 188 Cb 0.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1xw6 h GLU 188 CO 0.07 0.05 0.00 0.41 -1.00 0.00 0.00 179.01 178.54 1xw6 n GLY 189 N -0.79 -1.49 3.72 -3.84 0.00 0.13 -3.44 105.19 99.47 1xw6 n GLY 189 Ca -0.02 -0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 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 -3.88 4.37 0.20 0.99 1.43 -0.67 -4.80 118.68 116.32 1xw6 s LEU 190 Ca 0.10 2.84 -0.21 0.00 -1.03 0.00 0.00 54.13 55.83 1xw6 s LEU 190 Cb 0.14 -3.59 0.14 0.00 0.03 0.00 0.00 46.19 42.90 1xw6 s LEU 190 CO 0.50 -0.97 1.56 -0.08 0.23 0.00 0.00 176.35 177.60 1xw6 h GLU 191 N 7.07 -0.08 0.00 1.70 4.81 -1.89 0.17 114.58 126.35 1xw6 h GLU 191 Ca -0.43 0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 58.74 1xw6 h GLU 191 Cb 1.20 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 1xw6 h GLU 191 CO 0.95 -0.06 -0.29 0.87 -0.73 0.00 0.00 179.01 179.76 1xw6 h LYS 192 N -0.09 0.00 0.09 1.92 1.57 -1.92 -1.92 116.57 116.23 1xw6 h LYS 192 Ca 0.27 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.81 1xw6 h LYS 192 Cb 0.56 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.90 1xw6 h LYS 192 CO -0.85 0.29 -0.97 0.82 -0.57 0.00 0.00 179.45 178.17 1xw6 h ILE 193 N 0.00 1.37 -0.16 1.86 1.08 -1.44 -2.67 117.51 117.56 1xw6 h ILE 193 Ca -0.00 -2.37 0.00 0.00 -0.39 0.00 0.00 64.86 62.10 1xw6 h ILE 193 Cb 0.73 2.78 -0.01 0.00 -3.07 0.00 0.00 36.82 37.25 1xw6 h ILE 193 CO 0.04 0.70 0.10 -1.28 -0.69 0.00 0.00 178.15 177.02 1xw6 h SER 194 N 0.03 0.17 -0.64 1.72 0.87 -0.62 -0.44 113.55 114.64 1xw6 h SER 194 Ca -0.15 -0.00 0.03 0.00 -1.23 0.00 0.00 61.79 60.44 1xw6 h SER 194 Cb 1.69 -0.04 -0.04 0.00 -0.44 0.00 0.00 62.40 63.57 1xw6 h SER 194 CO 0.19 0.12 0.40 0.00 -0.53 0.00 0.00 176.83 177.01 1xw6 h ALA 195 N 1.06 0.83 -0.58 6.23 0.00 -1.43 -2.53 119.26 122.84 1xw6 h ALA 195 Ca 0.06 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 1xw6 h ALA 195 Cb -0.02 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1xw6 h ALA 195 CO -0.02 0.15 0.01 -0.92 0.00 0.00 0.00 179.25 178.48 1xw6 h TYR 196 N 0.78 1.11 0.00 0.00 3.20 -1.20 -2.86 116.97 118.00 1xw6 h TYR 196 Ca 0.26 -0.19 -0.01 0.00 3.14 0.00 0.00 58.73 61.93 1xw6 h TYR 196 Cb 0.01 -0.29 -0.00 0.00 1.54 0.00 0.00 36.73 37.99 1xw6 h TYR 196 CO -0.05 0.98 -0.05 0.52 -1.64 0.00 0.00 178.16 177.92 1xw6 h MET 197 N 0.91 0.00 -0.02 1.82 2.86 -0.73 -2.34 114.93 117.43 1xw6 h MET 197 Ca 0.17 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 1xw6 h MET 197 Cb 0.53 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.19 1xw6 h MET 197 CO 0.03 0.05 -0.09 1.63 1.06 0.00 0.00 176.91 179.59 1xw6 n LYS 198 N -3.27 1.78 -2.60 1.72 5.02 -0.98 -4.88 118.16 114.95 1xw6 n LYS 198 Ca -0.01 -1.30 -0.23 0.00 -2.02 0.00 0.00 58.31 54.74 1xw6 n LYS 198 Cb 0.24 -1.47 0.10 0.00 -0.02 0.00 0.00 35.03 33.88 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 -2.11 4.42 0.36 4.39 1.04 -0.88 -5.00 113.70 115.92 1xw6 s SER 199 Ca 0.30 -0.35 0.25 0.00 0.48 0.00 0.00 55.95 56.63 1xw6 s SER 199 Cb 0.20 -0.06 0.62 0.00 0.10 0.00 0.00 66.02 66.88 1xw6 s SER 199 CO 0.37 -1.81 1.70 0.77 0.98 0.00 0.00 173.24 175.26 1xw6 h SER 200 N -0.47 0.00 0.20 7.02 4.64 -1.93 -3.28 113.55 119.73 1xw6 h SER 200 Ca -0.36 0.00 -0.17 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 -0.64 0.03 -0.87 0.00 0.00 176.83 175.77 1xw6 h ARG 201 N 0.00 0.42 -6.24 4.77 3.08 -1.95 -3.45 114.38 111.01 1xw6 h ARG 201 Ca 0.00 -0.30 -0.68 0.00 0.07 0.00 0.00 59.98 59.07 1xw6 h ARG 201 Cb 0.84 0.05 0.03 0.00 0.08 0.00 0.00 29.97 30.97 1xw6 h ARG 201 CO 0.00 0.92 0.82 0.34 -1.07 0.00 0.00 179.97 180.98 1xw6 n PHE 202 N -3.89 2.00 -3.31 3.04 7.35 -1.24 -4.95 117.46 116.46 1xw6 n PHE 202 Ca -0.03 0.42 -0.25 0.00 -0.76 0.00 0.00 57.45 56.82 1xw6 n PHE 202 Cb 0.65 -2.48 -0.08 0.00 0.35 0.00 0.00 39.48 37.92 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 4.70 1.58 0.06 -2.13 7.94 -1.26 -4.94 117.00 122.95 1xw6 n LEU 203 Ca 0.23 -4.97 0.09 0.00 -1.11 0.00 0.00 56.01 50.24 1xw6 n LEU 203 Cb 0.20 0.09 0.39 0.00 0.53 0.00 0.00 43.42 44.63 1xw6 n LEU 203 CO 0.73 2.04 0.78 -0.81 -1.11 0.00 0.00 177.39 179.02 1xw6 n PRO 204 N 1.30 0.09 -3.47 1.96 -0.04 -1.26 -4.15 135.00 129.43 1xw6 n PRO 204 Ca 0.25 0.35 -0.12 0.00 -0.04 0.00 0.00 63.50 63.94 1xw6 n PRO 204 Cb 0.48 -1.68 -0.03 0.00 -0.04 0.00 0.00 33.50 32.23 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 -3.16 1.24 0.36 0.54 0.52 -1.26 -4.41 118.95 112.78 1xw6 s ARG 205 Ca 0.05 -0.53 -0.28 0.00 -0.52 0.00 0.00 55.73 54.46 1xw6 s ARG 205 Cb 0.09 0.56 -0.11 0.00 0.52 0.00 0.00 34.95 36.01 1xw6 s ARG 205 CO 0.31 -0.53 1.44 -2.30 0.02 0.00 0.00 175.30 174.24 1xw6 n PRO 206 N -0.35 2.53 0.19 3.54 -0.02 -1.26 -4.67 135.00 134.95 1xw6 n PRO 206 Ca -0.17 0.89 -0.14 0.00 -2.02 0.00 0.00 63.50 62.06 1xw6 n PRO 206 Cb 0.65 -2.58 -0.08 0.00 -0.02 0.00 0.00 33.50 31.47 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 2.85 0.70 -5.15 -1.45 2.07 -1.73 -0.67 116.25 112.88 1xw6 h VAL 207 Ca -0.49 -0.29 -0.45 0.00 0.82 0.00 0.00 66.70 66.29 1xw6 h VAL 207 Cb 1.25 0.85 -0.06 0.00 -1.52 0.00 0.00 31.29 31.82 1xw6 h VAL 207 CO 0.64 0.06 -0.26 0.49 0.02 0.00 0.00 177.57 178.52 1xw6 n PHE 208 N -5.22 -0.19 -1.81 1.57 3.72 -0.01 -1.30 117.46 114.22 1xw6 n PHE 208 Ca -0.10 -1.76 -0.29 0.00 -0.05 0.00 0.00 57.45 55.25 1xw6 n PHE 208 Cb 0.24 -0.30 0.11 0.00 -0.94 0.00 0.00 39.48 38.59 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 -3.26 4.11 0.59 4.37 1.04 -1.26 -4.50 113.70 114.79 1xw6 s SER 209 Ca 0.14 0.77 0.39 0.00 0.48 0.00 0.00 55.95 57.74 1xw6 s SER 209 Cb -0.01 -1.23 2.12 0.00 0.10 0.00 0.00 66.02 67.00 1xw6 s SER 209 CO 0.09 -2.15 2.20 0.11 0.98 0.00 0.00 173.24 174.47 1xw6 h LYS 210 N -1.23 0.00 0.00 4.02 1.57 -1.92 -1.78 116.57 117.23 1xw6 h LYS 210 Ca -0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 1xw6 h LYS 210 Cb 1.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.63 1xw6 h LYS 210 CO 0.62 0.00 0.00 -1.33 -0.57 0.00 0.00 179.45 178.17 1xw6 n MET 211 N -2.89 0.06 -2.18 3.15 2.81 -1.26 -4.86 117.12 111.94 1xw6 n MET 211 Ca -0.02 0.04 -0.33 0.00 -1.81 0.00 0.00 57.70 55.57 1xw6 n MET 211 Cb 0.07 -1.50 -0.00 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 -2.93 2.78 -0.03 3.04 0.00 -0.67 -4.87 121.76 119.09 1xw6 s ALA 212 Ca 0.15 0.44 0.12 0.00 0.00 0.00 0.00 51.96 52.67 1xw6 s ALA 212 Cb 0.18 -3.23 -0.22 0.00 0.00 0.00 0.00 23.12 19.85 1xw6 s ALA 212 CO 0.48 -0.67 0.78 0.28 0.00 0.00 0.00 175.76 176.63 1xw6 h VAL 213 N 0.74 0.95 -4.15 0.00 2.07 -0.15 -3.40 116.25 112.30 1xw6 h VAL 213 Ca -0.48 -2.75 -0.49 0.00 0.82 0.00 0.00 66.70 63.80 1xw6 h VAL 213 Cb 1.22 2.45 -0.27 0.00 -1.52 0.00 0.00 31.29 33.17 1xw6 h VAL 213 CO 0.58 0.54 -0.81 0.86 0.02 0.00 0.00 177.57 178.76 1xw6 s TRP 214 N -2.64 1.37 -0.43 1.57 -0.00 -1.04 -4.76 118.94 113.01 1xw6 s TRP 214 Ca -0.04 -0.31 0.00 0.00 -0.00 0.00 0.00 56.10 55.76 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 0.02 0.00 0.41 -0.00 0.00 0.00 176.95 178.20 1xw6 n GLY 215 N 2.26 0.63 0.04 5.86 0.00 -1.26 -4.72 105.19 108.00 1xw6 n GLY 215 Ca -0.16 -0.25 0.09 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.08 0.21 0.00 1.61 2.04 -1.26 -0.83 115.26 116.94 1xw6 n ASN 216 Ca -0.04 0.55 0.00 0.00 -0.44 0.00 0.00 54.58 54.65 1xw6 n ASN 216 Cb 0.27 -0.59 0.00 0.00 -2.53 0.00 0.00 39.78 36.92 1xw6 n ASN 216 CO 0.00 0.00 0.00 1.17 -0.44 0.00 0.00 177.26 177.99