#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xw6 n MET 2 N 0.00 0.45 -4.42 0.54 0.00 -1.17 -4.55 117.12 107.97 1xw6 n MET 2 Ca 0.00 0.16 -0.22 0.00 -0.00 0.00 0.00 57.70 57.64 1xw6 n MET 2 Cb 0.00 -1.32 -0.16 0.00 0.00 0.00 0.00 33.22 31.74 1xw6 n MET 2 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 175.97 174.47 1xw6 s ILE 3 N -1.24 0.86 -0.24 1.12 2.07 -0.34 -0.10 121.20 123.32 1xw6 s ILE 3 Ca 0.62 -0.35 -0.07 0.00 -1.41 0.00 0.00 60.65 59.44 1xw6 s ILE 3 Cb -0.75 -0.80 -0.03 0.00 0.13 0.00 0.00 42.46 41.02 1xw6 s ILE 3 CO 0.58 0.28 0.06 -0.22 -1.91 0.00 0.00 174.94 173.74 1xw6 s LEU 4 N 0.53 3.44 -0.11 8.50 2.96 -0.29 -1.03 118.68 132.69 1xw6 s LEU 4 Ca -0.09 -0.18 -0.01 0.00 -0.22 0.00 0.00 54.13 53.62 1xw6 s LEU 4 Cb -0.13 -1.91 -0.03 0.00 0.50 0.00 0.00 46.19 44.62 1xw6 s LEU 4 CO 0.02 -0.01 -0.06 -0.83 -1.32 0.00 0.00 176.35 174.15 1xw6 s GLY 5 N 1.44 1.71 0.08 7.98 0.00 -0.33 -0.71 107.32 117.49 1xw6 s GLY 5 Ca 0.05 -0.86 -0.27 0.00 0.00 0.00 0.00 44.72 43.65 1xw6 s GLY 5 CO 0.03 -0.41 1.11 -0.47 0.00 0.00 0.00 173.10 173.37 1xw6 s TYR 6 N -0.31 -0.06 1.01 1.90 5.04 -0.97 -1.67 117.35 122.30 1xw6 s TYR 6 Ca 0.05 -0.17 -0.12 0.00 -2.44 0.00 0.00 57.07 54.39 1xw6 s TYR 6 Cb -0.13 0.61 0.20 0.00 0.35 0.00 0.00 41.96 42.99 1xw6 s TYR 6 CO 0.02 -0.60 1.08 -1.58 -1.34 0.00 0.00 175.55 173.13 1xw6 s TRP 7 N -2.76 1.82 -0.04 4.97 0.52 -1.26 -1.57 118.94 120.62 1xw6 s TRP 7 Ca 0.15 1.29 -0.05 0.00 0.02 0.00 0.00 56.10 57.50 1xw6 s TRP 7 Cb 0.01 -3.18 -0.21 0.00 -1.15 0.00 0.00 33.47 28.94 1xw6 s TRP 7 CO 0.00 -3.07 3.37 -3.47 0.02 0.00 0.00 176.95 173.80 1xw6 n ASP 8 N -4.36 5.35 -2.12 2.95 4.64 0.42 -4.59 116.55 118.85 1xw6 n ASP 8 Ca 0.06 -2.53 -0.09 0.00 -1.38 0.00 0.00 54.79 50.85 1xw6 n ASP 8 Cb 0.55 -1.37 -0.03 0.00 -1.04 0.00 0.00 41.12 39.22 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 2.25 0.00 0.00 5.18 -5.35 -1.26 -4.76 119.36 115.42 1xw6 n ILE 9 Ca 0.39 -1.17 0.00 0.00 -0.27 0.00 0.00 62.75 61.70 1xw6 n ILE 9 Cb 0.84 0.61 0.00 0.00 -1.74 0.00 0.00 39.64 39.36 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 -0.32 0.00 0.00 6.28 0.63 -0.24 -4.87 116.66 118.14 1xw6 n ARG 10 Ca 0.03 0.22 0.00 0.00 -0.92 0.00 0.00 57.85 57.19 1xw6 n ARG 10 Cb 0.31 -0.80 0.00 0.00 0.45 0.00 0.00 32.46 32.42 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 1.81 1.88 0.00 5.14 0.00 -0.43 -2.30 105.19 111.29 1xw6 n GLY 11 Ca 0.00 -0.25 0.10 0.00 0.00 0.00 0.00 46.02 45.87 1xw6 n GLY 11 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xw6 n LEU 12 N 0.00 0.00 0.04 0.99 4.77 -1.26 -3.11 117.00 118.42 1xw6 n LEU 12 Ca 0.00 0.32 0.12 0.00 -0.03 0.00 0.00 56.01 56.42 1xw6 n LEU 12 Cb 0.00 -0.32 0.17 0.00 -2.33 0.00 0.00 43.42 40.94 1xw6 n LEU 12 CO 0.00 -0.10 0.31 0.00 -1.33 0.00 0.00 177.39 176.27 1xw6 n ALA 13 N -1.32 3.17 0.10 -1.18 0.00 -0.97 -4.54 120.51 115.77 1xw6 n ALA 13 Ca 0.09 -0.30 -0.14 0.00 0.00 0.00 0.00 53.44 53.08 1xw6 n ALA 13 Cb 0.17 -1.12 -0.07 0.00 0.00 0.00 0.00 19.45 18.43 1xw6 n ALA 13 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1xw6 h HIS 14 N 0.00 -1.17 0.00 0.00 6.17 -1.50 0.24 115.15 118.89 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 0.68 0.50 -0.00 0.00 2.52 0.00 0.00 27.41 31.10 1xw6 h HIS 14 CO 0.00 -0.51 -0.13 0.00 0.71 0.00 0.00 177.93 178.00 1xw6 h ALA 15 N -0.12 1.76 -0.03 5.26 0.00 -1.84 -1.85 119.26 122.44 1xw6 h ALA 15 Ca 0.03 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1xw6 h ALA 15 Cb 0.67 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 1xw6 h ALA 15 CO -0.26 0.16 -0.04 0.82 0.00 0.00 0.00 179.25 179.93 1xw6 h ILE 16 N 0.00 1.41 -0.31 0.00 2.04 -1.63 -1.24 117.51 117.79 1xw6 h ILE 16 Ca -0.00 -1.26 0.03 0.00 1.00 0.00 0.00 64.86 64.63 1xw6 h ILE 16 Cb 0.23 2.19 -0.03 0.00 -0.74 0.00 0.00 36.82 38.47 1xw6 h ILE 16 CO 0.02 0.34 0.13 0.03 0.00 0.00 0.00 178.15 178.66 1xw6 h ARG 17 N -0.42 0.27 -0.73 2.37 3.08 -0.81 0.57 114.38 118.71 1xw6 h ARG 17 Ca 0.00 -0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.07 1xw6 h ARG 17 Cb 0.56 -0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.51 1xw6 h ARG 17 CO 0.01 0.18 0.45 -0.07 -1.07 0.00 0.00 179.97 179.47 1xw6 h LEU 18 N 0.27 0.74 -0.44 3.04 3.38 -1.36 -0.80 115.31 120.14 1xw6 h LEU 18 Ca 0.13 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.00 1xw6 h LEU 18 Cb 0.08 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1xw6 h LEU 18 CO -0.12 0.51 -0.13 0.25 0.09 0.00 0.00 178.44 179.04 1xw6 h LEU 19 N 0.88 0.88 -1.42 1.67 5.85 -0.77 -0.94 115.31 121.46 1xw6 h LEU 19 Ca 0.30 -0.37 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 1xw6 h LEU 19 Cb 0.04 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.80 1xw6 h LEU 19 CO -0.12 1.05 0.27 -0.07 -0.34 0.00 0.00 178.44 179.23 1xw6 h LEU 20 N 0.70 0.59 -0.02 2.25 3.38 -0.47 -0.88 115.31 120.86 1xw6 h LEU 20 Ca 0.11 -0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.98 1xw6 h LEU 20 Cb 0.68 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1xw6 h LEU 20 CO 0.05 0.48 -0.23 -0.33 0.09 0.00 0.00 178.44 178.49 1xw6 h GLU 21 N 0.67 0.19 -0.65 1.13 4.39 -0.95 0.72 114.58 120.09 1xw6 h GLU 21 Ca 0.17 -0.18 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1xw6 h GLU 21 Cb 0.02 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.68 1xw6 h GLU 21 CO -0.03 0.87 0.42 -0.92 -1.16 0.00 0.00 179.01 178.19 1xw6 h TYR 22 N -0.42 0.83 -0.02 4.33 3.20 -0.96 -1.35 116.97 122.58 1xw6 h TYR 22 Ca -0.02 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.86 1xw6 h TYR 22 Cb 0.94 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.93 1xw6 h TYR 22 CO 0.16 0.53 0.00 0.25 -1.64 0.00 0.00 178.16 177.46 1xw6 n THR 23 N -4.43 0.01 -3.51 1.81 -2.24 -0.35 -4.93 114.28 100.65 1xw6 n THR 23 Ca 0.07 -0.13 -0.20 0.00 -2.27 0.00 0.00 64.05 61.52 1xw6 n THR 23 Cb 0.05 0.01 0.08 0.00 -2.10 0.00 0.00 70.33 68.37 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 -0.38 -3.43 -4.80 3.42 2.03 -0.51 -4.97 116.55 107.90 1xw6 n ASP 24 Ca 0.21 -0.61 -0.36 0.00 0.52 0.00 0.00 54.79 54.55 1xw6 n ASP 24 Cb 0.23 -5.03 -0.06 0.00 -0.72 0.00 0.00 41.12 35.54 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 -4.01 7.16 -0.42 1.67 0.01 0.23 -5.03 113.70 113.30 1xw6 s SER 25 Ca 0.20 1.56 -0.22 0.00 1.31 0.00 0.00 55.95 58.80 1xw6 s SER 25 Cb -0.09 -2.47 0.02 0.00 0.21 0.00 0.00 66.02 63.69 1xw6 s SER 25 CO 0.74 -0.00 0.74 -0.55 0.41 0.00 0.00 173.24 174.58 1xw6 s SER 26 N -1.64 6.43 0.12 2.44 0.15 -1.26 -4.85 113.70 115.09 1xw6 s SER 26 Ca 0.45 -0.02 -0.14 0.00 0.70 0.00 0.00 55.95 56.94 1xw6 s SER 26 Cb -0.17 -2.37 0.03 0.00 -1.71 0.00 0.00 66.02 61.79 1xw6 s SER 26 CO 0.22 -0.82 0.36 -0.72 1.20 0.00 0.00 173.24 173.48 1xw6 s TYR 27 N 3.11 -0.12 0.40 3.44 1.13 -1.26 -3.04 117.35 121.00 1xw6 s TYR 27 Ca 0.28 -0.22 0.06 0.00 -1.41 0.00 0.00 57.07 55.79 1xw6 s TYR 27 Cb -0.13 0.19 -0.07 0.00 -1.10 0.00 0.00 41.96 40.85 1xw6 s TYR 27 CO 0.20 -0.67 0.02 -1.21 -2.51 0.00 0.00 175.55 171.38 1xw6 s GLU 28 N -3.82 1.91 -0.09 -3.49 2.02 0.85 -4.94 118.70 111.14 1xw6 s GLU 28 Ca 0.04 -2.08 -0.00 0.00 0.02 0.00 0.00 54.97 52.94 1xw6 s GLU 28 Cb 0.02 -1.47 0.02 0.00 0.10 0.00 0.00 34.13 32.81 1xw6 s GLU 28 CO -0.12 -0.09 -0.06 -1.21 0.02 0.00 0.00 175.26 173.80 1xw6 s GLU 29 N -3.75 1.25 -0.52 1.61 2.02 -1.26 -1.14 118.70 116.91 1xw6 s GLU 29 Ca 0.34 -0.17 -0.19 0.00 0.02 0.00 0.00 54.97 54.97 1xw6 s GLU 29 Cb 0.09 -1.32 0.07 0.00 0.10 0.00 0.00 34.13 33.06 1xw6 s GLU 29 CO 0.17 -0.21 0.64 0.21 0.02 0.00 0.00 175.26 176.09 1xw6 s LYS 30 N 1.52 3.11 -0.07 1.61 2.36 0.11 -4.95 119.74 123.42 1xw6 s LYS 30 Ca 0.00 -0.97 -0.15 0.00 -2.55 0.00 0.00 55.97 52.30 1xw6 s LYS 30 Cb -0.13 -4.13 -0.05 0.00 -1.05 0.00 0.00 37.83 32.47 1xw6 s LYS 30 CO -0.05 -1.28 0.39 0.15 1.55 0.00 0.00 175.35 176.11 1xw6 s LYS 31 N 2.64 4.10 -0.10 4.03 1.02 -1.26 -2.28 119.74 127.88 1xw6 s LYS 31 Ca 0.14 0.33 0.00 0.00 0.02 0.00 0.00 55.97 56.47 1xw6 s LYS 31 Cb -0.20 -3.33 -0.02 0.00 -0.52 0.00 0.00 37.83 33.76 1xw6 s LYS 31 CO 0.11 0.44 -0.10 0.71 -0.92 0.00 0.00 175.35 175.59 1xw6 s TYR 32 N -0.24 2.86 -0.14 3.18 1.51 -0.61 -4.90 117.35 119.00 1xw6 s TYR 32 Ca 0.22 -0.30 -0.05 0.00 -1.01 0.00 0.00 57.07 55.93 1xw6 s TYR 32 Cb -0.15 -1.78 -0.04 0.00 -0.11 0.00 0.00 41.96 39.88 1xw6 s TYR 32 CO 0.10 0.05 0.04 0.99 -1.11 0.00 0.00 175.55 175.61 1xw6 s THR 33 N -0.18 4.58 0.00 -0.71 2.01 -1.26 -0.43 115.64 119.64 1xw6 s THR 33 Ca 0.01 -0.13 -0.15 0.00 0.31 0.00 0.00 61.69 61.74 1xw6 s THR 33 Cb -0.13 -3.00 -0.06 0.00 0.01 0.00 0.00 72.50 69.32 1xw6 s THR 33 CO 0.03 0.54 0.41 -0.32 -0.69 0.00 0.00 174.62 174.59 1xw6 s MET 34 N -0.25 3.92 0.75 4.92 1.75 -1.26 -4.67 119.30 124.47 1xw6 s MET 34 Ca 0.07 0.42 -0.11 0.00 -1.25 0.00 0.00 55.69 54.82 1xw6 s MET 34 Cb -0.12 -3.22 0.05 0.00 2.84 0.00 0.00 34.83 34.37 1xw6 s MET 34 CO 0.02 0.69 1.09 0.20 -0.65 0.00 0.00 175.02 176.37 1xw6 s GLY 35 N -1.07 1.76 0.98 2.11 0.00 0.93 -4.86 107.32 107.16 1xw6 s GLY 35 Ca 0.24 0.31 -0.14 0.00 0.00 0.00 0.00 44.72 45.12 1xw6 s GLY 35 CO 0.13 0.66 1.17 0.99 0.00 0.00 0.00 173.10 176.05 1xw6 s ASP 36 N -3.27 2.91 0.95 1.64 1.11 -1.26 -3.77 116.67 114.98 1xw6 s ASP 36 Ca 0.62 0.75 -0.11 0.00 0.18 0.00 0.00 52.55 53.99 1xw6 s ASP 36 Cb -0.18 -1.15 0.16 0.00 1.07 0.00 0.00 42.92 42.83 1xw6 s ASP 36 CO 0.53 -2.90 1.11 0.00 1.18 0.00 0.00 175.17 175.09 1xw6 s ALA 37 N -3.35 1.17 -0.85 5.23 0.00 -1.26 -1.72 121.76 120.98 1xw6 s ALA 37 Ca 0.67 0.35 0.26 0.00 0.00 0.00 0.00 51.96 53.24 1xw6 s ALA 37 Cb -0.11 -3.37 0.67 0.00 0.00 0.00 0.00 23.12 20.31 1xw6 s ALA 37 CO 0.54 -2.83 1.56 -0.35 0.00 0.00 0.00 175.76 174.67 1xw6 n PRO 38 N -4.26 0.13 -0.02 0.00 -0.04 -1.26 -4.77 135.00 124.78 1xw6 n PRO 38 Ca 0.09 0.06 -0.18 0.00 -0.04 0.00 0.00 63.50 63.43 1xw6 n PRO 38 Cb 0.53 -1.60 -0.08 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 0.90 -5.77 3.54 5.19 -1.92 -3.48 116.42 114.88 1xw6 h ASP 39 Ca 0.00 -0.64 -0.35 0.00 -0.62 0.00 0.00 57.03 55.42 1xw6 h ASP 39 Cb 0.61 -0.27 0.14 0.00 0.18 0.00 0.00 39.33 39.99 1xw6 h ASP 39 CO 0.00 1.40 -0.81 -1.22 -3.12 0.00 0.00 179.24 175.50 1xw6 n TYR 40 N -3.97 -2.14 -1.68 4.55 4.01 -0.70 -4.83 117.16 112.40 1xw6 n TYR 40 Ca -0.08 0.88 -0.53 0.00 -0.16 0.00 0.00 57.90 58.01 1xw6 n TYR 40 Cb 0.74 -4.69 -0.06 0.00 -0.31 0.00 0.00 39.34 35.02 1xw6 n TYR 40 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1xw6 n ASP 41 N -3.11 2.65 -0.55 7.72 2.03 -1.25 -4.50 116.55 119.54 1xw6 n ASP 41 Ca -0.25 1.05 0.06 0.00 0.52 0.00 0.00 54.79 56.17 1xw6 n ASP 41 Cb 0.66 -1.24 0.16 0.00 -0.72 0.00 0.00 41.12 39.98 1xw6 n ASP 41 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1xw6 n ARG 42 N 5.13 2.77 0.31 -0.67 1.74 -1.26 -0.05 116.66 124.63 1xw6 n ARG 42 Ca 0.23 -2.23 0.19 0.00 -0.77 0.00 0.00 57.85 55.27 1xw6 n ARG 42 Cb 0.20 -1.41 1.04 0.00 -1.02 0.00 0.00 32.46 31.27 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 1.44 0.00 -0.07 0.55 4.64 -1.90 -0.80 113.55 117.41 1xw6 h SER 43 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 1xw6 h SER 43 Cb 0.92 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.00 1xw6 h SER 43 CO 0.06 0.01 -0.08 -0.61 -0.87 0.00 0.00 176.83 175.35 1xw6 h GLN 44 N 0.00 0.34 0.00 4.77 4.15 -1.85 -1.12 115.11 121.40 1xw6 h GLN 44 Ca -0.00 -0.07 -0.17 0.00 0.77 0.00 0.00 58.65 59.17 1xw6 h GLN 44 Cb 0.07 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 27.68 1xw6 h GLN 44 CO 0.00 0.44 -1.03 2.35 -1.93 0.00 0.00 178.83 178.66 1xw6 h TRP 45 N 0.33 0.00 -0.72 3.99 -0.00 -1.67 -3.40 115.95 114.48 1xw6 h TRP 45 Ca 0.07 0.00 0.13 0.00 -0.00 0.00 0.00 58.89 59.09 1xw6 h TRP 45 Cb 0.35 0.00 -0.05 0.00 -0.00 0.00 0.00 29.16 29.46 1xw6 h TRP 45 CO 0.01 1.18 0.48 -0.07 -0.00 0.00 0.00 178.44 180.04 1xw6 h LEU 46 N -1.00 0.40 0.00 0.65 3.38 -1.16 0.41 115.31 117.99 1xw6 h LEU 46 Ca -0.26 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1xw6 h LEU 46 Cb 1.13 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.81 1xw6 h LEU 46 CO -0.16 0.22 0.00 0.59 0.09 0.00 0.00 178.44 179.18 1xw6 n ASN 47 N -4.48 0.00 0.00 -0.43 4.13 -0.43 -3.36 115.26 110.70 1xw6 n ASN 47 Ca 0.13 -0.74 0.00 0.00 1.68 0.00 0.00 54.58 55.65 1xw6 n ASN 47 Cb 0.47 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.71 1xw6 n ASN 47 CO 0.00 0.00 0.00 1.21 0.28 0.00 0.00 177.26 178.75 1xw6 n GLU 48 N -1.00 3.66 -0.30 3.52 2.13 -0.06 -4.90 120.64 123.69 1xw6 n GLU 48 Ca 0.18 0.00 0.11 0.00 0.66 0.00 0.00 57.16 58.11 1xw6 n GLU 48 Cb 0.08 -0.45 0.25 0.00 0.27 0.00 0.00 31.44 31.59 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 0.08 -0.68 5.31 3.64 -0.29 -0.64 116.57 124.00 1xw6 h LYS 49 Ca 0.00 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1xw6 h LYS 49 Cb 0.00 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 1xw6 h LYS 49 CO 0.00 0.05 0.00 1.19 -2.27 0.00 0.00 179.45 178.42 1xw6 n PHE 50 N -5.39 1.09 -0.15 1.91 3.01 -1.26 -4.22 117.46 112.46 1xw6 n PHE 50 Ca 0.20 -0.50 0.06 0.00 1.01 0.00 0.00 57.45 58.22 1xw6 n PHE 50 Cb 0.65 -0.08 0.15 0.00 -0.01 0.00 0.00 39.48 40.19 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 1.38 2.76 0.00 -1.08 5.02 -0.25 -4.58 118.16 121.40 1xw6 n LYS 51 Ca 0.24 -2.01 0.10 0.00 -2.02 0.00 0.00 58.31 54.61 1xw6 n LYS 51 Cb 0.67 -1.27 0.00 0.00 -0.02 0.00 0.00 35.03 34.41 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 0.53 1.94 -0.01 -0.35 4.77 -1.22 -4.98 117.00 117.69 1xw6 n LEU 52 Ca 0.11 -0.78 -0.00 0.00 -0.03 0.00 0.00 56.01 55.32 1xw6 n LEU 52 Cb 0.42 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1xw6 n LEU 52 CO 0.08 0.36 -0.00 0.61 -1.33 0.00 0.00 177.39 177.11 1xw6 n GLY 53 N 1.31 0.41 3.73 -0.72 0.00 -1.26 -5.03 105.19 103.63 1xw6 n GLY 53 Ca 0.08 -0.86 -0.41 0.00 0.00 0.00 0.00 46.02 44.84 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 -0.02 4.45 0.05 0.99 1.43 -1.26 -4.92 118.68 119.40 1xw6 s LEU 54 Ca 0.00 1.65 -0.25 0.00 -1.03 0.00 0.00 54.13 54.50 1xw6 s LEU 54 Cb 0.00 -3.46 -0.17 0.00 0.03 0.00 0.00 46.19 42.59 1xw6 s LEU 54 CO 0.00 -0.08 1.55 0.44 0.23 0.00 0.00 176.35 178.49 1xw6 h ASP 55 N 5.87 -0.12 -3.40 2.29 3.32 -1.96 -3.33 116.42 119.09 1xw6 h ASP 55 Ca -0.43 -0.14 -0.63 0.00 0.02 0.00 0.00 57.03 55.86 1xw6 h ASP 55 Cb 1.21 0.03 -0.41 0.00 0.22 0.00 0.00 39.33 40.38 1xw6 h ASP 55 CO 0.72 0.07 -0.57 -0.36 -1.72 0.00 0.00 179.24 177.38 1xw6 s PHE 56 N -5.51 3.50 -0.46 4.55 0.08 -1.26 -5.07 117.98 113.81 1xw6 s PHE 56 Ca -0.14 -3.29 -0.46 0.00 0.12 0.00 0.00 56.93 53.16 1xw6 s PHE 56 Cb 0.04 -2.76 -0.19 0.00 -0.57 0.00 0.00 43.02 39.54 1xw6 s PHE 56 CO 0.64 -0.60 1.68 -2.30 -0.10 0.00 0.00 175.22 174.55 1xw6 n PRO 57 N 2.24 0.19 -3.79 0.24 -0.02 -1.25 -4.88 135.00 127.72 1xw6 n PRO 57 Ca 0.16 0.07 -0.06 0.00 -2.02 0.00 0.00 63.50 61.65 1xw6 n PRO 57 Cb 0.34 -1.61 -0.02 0.00 -0.02 0.00 0.00 33.50 32.20 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 3.43 -0.26 -0.07 2.55 3.84 -1.26 -5.10 114.94 118.07 1xw6 s ASN 58 Ca 1.05 -0.50 0.03 0.00 0.21 0.00 0.00 52.86 53.66 1xw6 s ASN 58 Cb -1.43 0.64 0.01 0.00 -0.55 0.00 0.00 41.25 39.92 1xw6 s ASN 58 CO 0.78 -1.17 -0.17 -0.76 -2.79 0.00 0.00 177.10 172.99 1xw6 s LEU 59 N -2.91 1.83 0.61 3.21 1.43 -1.26 -4.01 118.68 117.58 1xw6 s LEU 59 Ca 0.11 -0.38 -0.12 0.00 -1.03 0.00 0.00 54.13 52.70 1xw6 s LEU 59 Cb -0.04 -1.02 -0.04 0.00 0.03 0.00 0.00 46.19 45.11 1xw6 s LEU 59 CO 0.04 0.10 1.02 -2.16 0.23 0.00 0.00 176.35 175.58 1xw6 s PRO 60 N 0.41 3.62 0.11 1.29 0.04 -1.26 -4.94 135.00 134.27 1xw6 s PRO 60 Ca -0.13 0.80 0.04 0.00 0.04 0.00 0.00 61.00 61.76 1xw6 s PRO 60 Cb -0.15 -2.08 -0.04 0.00 0.04 0.00 0.00 34.50 32.27 1xw6 s PRO 60 CO 0.05 -0.55 -0.10 1.52 0.04 0.00 0.00 177.00 177.95 1xw6 s TYR 61 N -3.06 1.13 -0.07 0.56 -0.85 -0.67 -3.77 117.35 110.61 1xw6 s TYR 61 Ca 0.56 -0.67 -0.00 0.00 -0.52 0.00 0.00 57.07 56.43 1xw6 s TYR 61 Cb -0.11 -0.61 0.03 0.00 0.38 0.00 0.00 41.96 41.65 1xw6 s TYR 61 CO 0.50 0.02 -0.03 -1.17 -1.52 0.00 0.00 175.55 173.35 1xw6 s LEU 62 N -2.60 0.91 -0.25 -3.49 2.96 0.30 -1.18 118.68 115.32 1xw6 s LEU 62 Ca 0.08 -0.15 -0.06 0.00 -0.22 0.00 0.00 54.13 53.79 1xw6 s LEU 62 Cb -0.02 -0.54 -0.01 0.00 0.50 0.00 0.00 46.19 46.13 1xw6 s LEU 62 CO 0.00 -0.14 0.03 -0.63 -1.32 0.00 0.00 176.35 174.29 1xw6 s ILE 63 N 1.64 3.82 -0.58 6.68 1.01 -0.20 -0.60 121.20 132.96 1xw6 s ILE 63 Ca 0.01 -0.49 0.05 0.00 0.00 0.00 0.00 60.65 60.22 1xw6 s ILE 63 Cb -0.13 -2.84 0.18 0.00 0.01 0.00 0.00 42.46 39.68 1xw6 s ILE 63 CO -0.04 0.27 0.47 -0.67 0.00 0.00 0.00 174.94 174.97 1xw6 n ASP 64 N 4.85 1.71 0.00 3.58 2.03 0.11 -1.20 116.55 127.63 1xw6 n ASP 64 Ca -0.16 -2.92 0.00 0.00 0.52 0.00 0.00 54.79 52.23 1xw6 n ASP 64 Cb 0.50 -0.67 0.00 0.00 -0.72 0.00 0.00 41.12 40.23 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 2.11 3.11 0.21 0.27 0.00 -1.26 -2.35 105.19 107.27 1xw6 n GLY 65 Ca 0.24 -0.18 0.08 0.00 0.00 0.00 0.00 46.02 46.16 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 -0.45 1.06 -1.95 4.61 0.00 -2.01 -3.43 119.26 117.09 1xw6 h ALA 66 Ca 0.00 -0.27 -0.58 0.00 0.00 0.00 0.00 54.91 54.06 1xw6 h ALA 66 Cb 0.00 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 17.66 1xw6 h ALA 66 CO 0.00 0.37 0.75 -1.01 0.00 0.00 0.00 179.25 179.36 1xw6 s HIS 67 N -3.72 3.05 -0.29 0.00 3.76 -0.99 -5.01 115.29 112.09 1xw6 s HIS 67 Ca -0.00 0.90 -0.02 0.00 -0.15 0.00 0.00 55.06 55.79 1xw6 s HIS 67 Cb 0.11 -3.81 0.04 0.00 1.11 0.00 0.00 32.58 30.03 1xw6 s HIS 67 CO 0.66 -0.89 -0.00 0.15 -0.85 0.00 0.00 174.74 173.81 1xw6 s LYS 68 N 3.72 2.58 -0.02 1.40 3.01 -1.26 0.09 119.74 129.26 1xw6 s LYS 68 Ca 0.42 -1.17 0.08 0.00 -1.01 0.00 0.00 55.97 54.29 1xw6 s LYS 68 Cb -0.11 -3.17 -0.02 0.00 -1.01 0.00 0.00 37.83 33.52 1xw6 s LYS 68 CO 0.20 -0.56 -0.25 0.42 0.51 0.00 0.00 175.35 175.67 1xw6 s ILE 69 N 1.30 2.13 0.48 2.17 1.01 0.23 -4.79 121.20 123.72 1xw6 s ILE 69 Ca -0.03 -1.08 0.02 0.00 0.00 0.00 0.00 60.65 59.56 1xw6 s ILE 69 Cb -0.19 -1.74 -0.02 0.00 0.01 0.00 0.00 42.46 40.52 1xw6 s ILE 69 CO -0.01 0.58 0.03 0.42 0.00 0.00 0.00 174.94 175.95 1xw6 s THR 70 N -0.62 1.16 0.00 2.92 -4.23 -1.26 -0.54 115.64 113.07 1xw6 s THR 70 Ca 0.10 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.61 1xw6 s THR 70 Cb -0.10 -2.31 0.00 0.00 1.34 0.00 0.00 72.50 71.43 1xw6 s THR 70 CO -0.01 0.00 0.01 0.00 -0.54 0.00 0.00 174.62 174.08 1xw6 n GLN 71 N -1.15 -1.28 -0.28 3.99 1.13 -1.25 -4.35 117.38 114.19 1xw6 n GLN 71 Ca -0.15 1.30 0.04 0.00 -1.94 0.00 0.00 57.00 56.26 1xw6 n GLN 71 Cb 0.67 -1.59 0.13 0.00 0.11 0.00 0.00 30.24 29.56 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 1.05 -0.63 0.05 1.08 4.64 -1.91 -0.18 113.55 117.65 1xw6 h SER 72 Ca -0.01 0.23 -0.05 0.00 -0.47 0.00 0.00 61.79 61.49 1xw6 h SER 72 Cb 0.03 0.46 -0.01 0.00 -0.31 0.00 0.00 62.40 62.57 1xw6 h SER 72 CO 0.00 -0.25 -0.16 0.78 -0.87 0.00 0.00 176.83 176.33 1xw6 h ASN 73 N 0.02 0.21 -0.36 4.97 2.35 -1.95 -1.52 115.58 119.31 1xw6 h ASN 73 Ca 0.41 -0.05 -0.13 0.00 -0.55 0.00 0.00 56.30 55.98 1xw6 h ASN 73 Cb 0.68 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.99 1xw6 h ASN 73 CO -0.80 0.39 -0.30 0.00 -1.65 0.00 0.00 177.43 175.07 1xw6 h ALA 74 N 1.64 0.52 -0.64 -0.83 0.00 -1.29 -1.74 119.26 116.91 1xw6 h ALA 74 Ca 0.04 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.52 1xw6 h ALA 74 Cb 0.41 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1xw6 h ALA 74 CO 0.03 0.55 0.33 0.82 0.00 0.00 0.00 179.25 180.98 1xw6 h ILE 75 N 0.63 1.21 -0.65 0.00 2.04 -0.83 -0.70 117.51 119.21 1xw6 h ILE 75 Ca 0.06 -0.56 -0.03 0.00 1.00 0.00 0.00 64.86 65.33 1xw6 h ILE 75 Cb 0.88 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 37.33 1xw6 h ILE 75 CO 0.08 0.24 0.29 -0.07 0.00 0.00 0.00 178.15 178.68 1xw6 h LEU 76 N 0.88 0.87 -0.80 1.44 3.38 -1.22 -2.32 115.31 117.54 1xw6 h LEU 76 Ca 0.22 -0.15 -0.07 0.00 0.09 0.00 0.00 57.88 57.97 1xw6 h LEU 76 Cb 0.08 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 1xw6 h LEU 76 CO -0.03 0.78 0.09 0.00 0.09 0.00 0.00 178.44 179.36 1xw6 h TYR 78 N 0.93 -0.28 -0.24 0.00 3.20 -0.89 -0.76 116.97 118.93 1xw6 h TYR 78 Ca 0.19 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.03 1xw6 h TYR 78 Cb 0.42 0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.77 1xw6 h TYR 78 CO 0.03 -0.17 0.06 0.82 -1.64 0.00 0.00 178.16 177.26 1xw6 h ILE 79 N -0.30 1.21 -0.80 1.81 2.04 -1.39 -3.04 117.51 117.03 1xw6 h ILE 79 Ca -0.03 -0.66 0.10 0.00 1.00 0.00 0.00 64.86 65.26 1xw6 h ILE 79 Cb 0.23 1.19 -0.05 0.00 -0.74 0.00 0.00 36.82 37.45 1xw6 h ILE 79 CO 0.05 0.21 0.52 0.00 0.00 0.00 0.00 178.15 178.94 1xw6 h ALA 80 N 0.88 1.75 -0.48 1.87 0.00 -0.92 -2.09 119.26 120.27 1xw6 h ALA 80 Ca 0.08 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1xw6 h ALA 80 Cb 0.27 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1xw6 h ALA 80 CO -0.00 0.08 0.14 0.00 0.00 0.00 0.00 179.25 179.47 1xw6 h ARG 81 N 0.74 0.71 0.00 0.00 3.08 -1.02 -0.55 114.38 117.34 1xw6 h ARG 81 Ca 0.37 -0.12 -0.01 0.00 0.07 0.00 0.00 59.98 60.29 1xw6 h ARG 81 Cb 0.44 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.37 1xw6 h ARG 81 CO -0.14 0.63 -0.03 0.87 -1.07 0.00 0.00 179.97 180.22 1xw6 h LYS 82 N 0.69 0.00 0.00 0.04 1.57 -1.38 -3.26 116.57 114.24 1xw6 h LYS 82 Ca 0.16 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 1xw6 h LYS 82 Cb 0.22 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 1xw6 h LYS 82 CO -0.01 0.03 -0.32 0.72 -0.57 0.00 0.00 179.45 179.31 1xw6 n HIS 83 N -3.14 0.00 -3.95 -1.35 8.25 -0.89 -5.01 115.22 109.12 1xw6 n HIS 83 Ca 0.01 -1.09 -0.25 0.00 -0.26 0.00 0.00 57.72 56.12 1xw6 n HIS 83 Cb 0.33 -0.18 -0.02 0.00 1.12 0.00 0.00 29.99 31.24 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 -1.06 -0.39 -0.85 0.41 2.85 -0.87 -4.90 115.26 110.45 1xw6 n ASN 84 Ca 0.15 -1.00 0.01 0.00 -0.11 0.00 0.00 54.58 53.64 1xw6 n ASN 84 Cb 0.70 -3.07 0.20 0.00 1.24 0.00 0.00 39.78 38.85 1xw6 n ASN 84 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1xw6 n LEU 85 N -4.40 3.48 -0.00 1.20 4.77 -0.27 -4.64 117.00 117.14 1xw6 n LEU 85 Ca -0.30 -3.69 0.10 0.00 -0.03 0.00 0.00 56.01 52.09 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 0.75 1.21 -0.26 0.00 -1.33 0.00 0.00 177.39 177.76 1xw6 n GLY 87 N 1.42 2.64 0.48 0.00 0.00 -1.26 -4.65 105.19 103.82 1xw6 n GLY 87 Ca 0.02 -1.53 -0.10 0.00 0.00 0.00 0.00 46.02 44.40 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 1.33 0.33 -1.48 1.61 1.02 -1.26 -4.78 120.64 117.40 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 -1.06 0.10 0.00 -0.02 0.00 0.00 31.44 30.45 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 -2.46 3.08 0.20 2.62 -4.23 -1.26 -4.88 115.64 108.71 1xw6 s THR 89 Ca -0.19 0.35 -0.10 0.00 -1.18 0.00 0.00 61.69 60.57 1xw6 s THR 89 Cb 0.05 -3.03 0.13 0.00 1.34 0.00 0.00 72.50 70.98 1xw6 s THR 89 CO 0.27 -0.46 1.80 -0.08 -0.54 0.00 0.00 174.62 175.61 1xw6 h GLU 90 N -1.15 1.01 -0.79 3.99 4.57 -1.99 -1.96 114.58 118.25 1xw6 h GLU 90 Ca -0.47 -0.13 -0.01 0.00 -1.18 0.00 0.00 59.36 57.57 1xw6 h GLU 90 Cb 1.26 -0.19 -0.04 0.00 -0.16 0.00 0.00 28.75 29.63 1xw6 h GLU 90 CO 0.58 0.77 0.47 1.49 -1.18 0.00 0.00 179.01 181.14 1xw6 h GLU 91 N 0.98 1.08 -0.22 1.92 4.22 -1.96 -1.42 114.58 119.18 1xw6 h GLU 91 Ca 0.25 -0.10 -0.03 0.00 0.08 0.00 0.00 59.36 59.56 1xw6 h GLU 91 Cb 0.08 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 1xw6 h GLU 91 CO -0.04 0.76 0.01 0.93 -2.18 0.00 0.00 179.01 178.49 1xw6 h GLU 92 N 1.09 0.38 -0.97 1.92 5.08 -1.68 -2.40 114.58 118.00 1xw6 h GLU 92 Ca 0.28 -0.12 0.01 0.00 -1.00 0.00 0.00 59.36 58.54 1xw6 h GLU 92 Cb -0.04 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.13 1xw6 h GLU 92 CO -0.05 0.55 0.64 0.87 -1.00 0.00 0.00 179.01 180.03 1xw6 h LYS 93 N 0.15 1.28 -0.41 2.33 1.57 -1.02 0.25 116.57 120.72 1xw6 h LYS 93 Ca 0.06 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1xw6 h LYS 93 Cb 0.38 -0.29 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 1xw6 h LYS 93 CO 0.01 0.85 0.16 0.82 -0.57 0.00 0.00 179.45 180.72 1xw6 h ILE 94 N 1.32 1.20 -0.70 1.86 2.04 -1.20 -0.97 117.51 121.06 1xw6 h ILE 94 Ca 0.36 -0.61 -0.06 0.00 1.00 0.00 0.00 64.86 65.55 1xw6 h ILE 94 Cb -0.15 0.84 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 1xw6 h ILE 94 CO -0.08 0.22 0.21 0.03 0.00 0.00 0.00 178.15 178.54 1xw6 h ARG 95 N 0.52 1.10 -0.15 2.37 3.08 -1.00 -1.65 114.38 118.64 1xw6 h ARG 95 Ca 0.14 -0.24 -0.00 0.00 0.07 0.00 0.00 59.98 59.94 1xw6 h ARG 95 Cb 0.19 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1xw6 h ARG 95 CO -0.01 0.95 0.08 0.28 -1.07 0.00 0.00 179.97 180.20 1xw6 h VAL 96 N 1.04 1.09 -0.04 2.04 2.07 -0.75 -1.52 116.25 120.18 1xw6 h VAL 96 Ca 0.23 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.51 1xw6 h VAL 96 Cb 0.31 0.98 -0.00 0.00 -1.52 0.00 0.00 31.29 31.06 1xw6 h VAL 96 CO -0.01 0.08 0.03 0.44 0.02 0.00 0.00 177.57 178.13 1xw6 h ASP 97 N 0.15 0.05 -0.21 0.57 3.32 -1.02 0.49 116.42 119.77 1xw6 h ASP 97 Ca 0.05 -0.01 0.03 0.00 0.02 0.00 0.00 57.03 57.12 1xw6 h ASP 97 Cb 0.06 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.57 1xw6 h ASP 97 CO -0.01 0.04 0.05 0.40 -1.72 0.00 0.00 179.24 178.00 1xw6 h ILE 98 N 0.05 0.91 -0.60 0.35 2.04 -1.26 -2.84 117.51 116.16 1xw6 h ILE 98 Ca 0.01 -0.05 -0.09 0.00 1.00 0.00 0.00 64.86 65.73 1xw6 h ILE 98 Cb 0.00 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 36.82 1xw6 h ILE 98 CO -0.00 0.03 0.01 -0.07 0.00 0.00 0.00 178.15 178.11 1xw6 h LEU 99 N 0.14 1.03 -0.99 1.44 3.38 -1.15 0.23 115.31 119.40 1xw6 h LEU 99 Ca 0.10 -0.30 0.12 0.00 0.09 0.00 0.00 57.88 57.88 1xw6 h LEU 99 Cb 0.09 -0.28 -0.08 0.00 0.09 0.00 0.00 40.66 40.48 1xw6 h LEU 99 CO -0.12 1.08 0.62 -0.08 0.09 0.00 0.00 178.44 180.02 1xw6 h GLU 100 N 0.95 0.94 0.13 1.13 4.81 -0.75 0.26 114.58 122.05 1xw6 h GLU 100 Ca 0.17 -0.06 -0.32 0.00 -0.13 0.00 0.00 59.36 59.02 1xw6 h GLU 100 Cb 0.55 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 1xw6 h GLU 100 CO 0.03 0.62 -1.65 -0.91 -0.73 0.00 0.00 179.01 176.37 1xw6 h ASN 101 N 0.97 0.42 -0.26 1.04 2.35 -1.30 -3.29 115.58 115.51 1xw6 h ASN 101 Ca 0.49 -0.64 -0.01 0.00 -0.55 0.00 0.00 56.30 55.59 1xw6 h ASN 101 Cb 0.48 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.71 1xw6 h ASN 101 CO -0.27 1.54 0.12 -0.61 -1.65 0.00 0.00 177.43 176.57 1xw6 h GLN 102 N 0.07 0.37 -0.80 0.81 5.75 -0.17 -2.12 115.11 119.03 1xw6 h GLN 102 Ca -0.29 -0.06 -0.03 0.00 -0.15 0.00 0.00 58.65 58.12 1xw6 h GLN 102 Cb 2.04 -0.07 -0.04 0.00 1.07 0.00 0.00 27.48 30.49 1xw6 h GLN 102 CO 0.15 0.38 0.39 1.79 -2.65 0.00 0.00 178.83 178.89 1xw6 h THR 103 N 0.28 1.25 -0.74 2.39 1.35 -1.12 -1.22 112.91 115.10 1xw6 h THR 103 Ca 0.09 -0.68 -0.06 0.00 -0.55 0.00 0.00 66.41 65.20 1xw6 h THR 103 Cb 0.13 0.21 -0.03 0.00 -1.73 0.00 0.00 68.15 66.74 1xw6 h THR 103 CO -0.01 0.29 0.21 -0.03 -0.25 0.00 0.00 175.52 175.73 1xw6 h MET 104 N 1.14 1.16 0.12 4.72 1.85 -1.60 0.44 114.93 122.76 1xw6 h MET 104 Ca 0.28 -0.26 -0.01 0.00 -0.61 0.00 0.00 59.70 59.10 1xw6 h MET 104 Cb 0.10 -0.16 0.00 0.00 0.43 0.00 0.00 31.60 31.97 1xw6 h MET 104 CO -0.04 1.00 -0.06 -0.44 -0.40 0.00 0.00 176.91 176.98 1xw6 h ASP 105 N 1.11 -0.14 -0.43 1.39 3.32 -0.81 0.16 116.42 121.02 1xw6 h ASP 105 Ca 0.24 -0.03 -0.07 0.00 0.02 0.00 0.00 57.03 57.19 1xw6 h ASP 105 Cb 0.34 0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.90 1xw6 h ASP 105 CO -0.00 -0.06 0.03 0.78 -1.72 0.00 0.00 179.24 178.26 1xw6 h ASN 106 N -0.20 0.78 -0.02 6.45 -0.26 -0.99 -1.74 115.58 119.60 1xw6 h ASN 106 Ca -0.02 -0.18 -0.00 0.00 -0.56 0.00 0.00 56.30 55.54 1xw6 h ASN 106 Cb 0.15 -0.21 -0.00 0.00 -1.06 0.00 0.00 38.32 37.21 1xw6 h ASN 106 CO 0.03 0.83 0.01 -0.74 -1.06 0.00 0.00 177.43 176.50 1xw6 h HIS 107 N 0.77 0.03 -0.71 1.19 2.76 0.19 -2.78 115.15 116.60 1xw6 h HIS 107 Ca 0.15 -0.00 0.09 0.00 -2.20 0.00 0.00 60.37 58.41 1xw6 h HIS 107 Cb 0.42 -0.01 -0.07 0.00 1.55 0.00 0.00 27.41 29.30 1xw6 h HIS 107 CO 0.02 0.07 0.36 0.52 -1.30 0.00 0.00 177.93 177.60 1xw6 h MET 108 N -0.02 0.60 -0.75 5.26 2.86 -0.30 -1.49 114.93 121.10 1xw6 h MET 108 Ca 0.01 -0.04 0.02 0.00 -2.06 0.00 0.00 59.70 57.63 1xw6 h MET 108 Cb 0.05 -0.14 -0.04 0.00 0.06 0.00 0.00 31.60 31.53 1xw6 h MET 108 CO -0.00 0.40 0.49 1.96 1.06 0.00 0.00 176.91 180.82 1xw6 h GLN 109 N 0.62 0.93 -0.09 1.72 4.20 -1.18 0.19 115.11 121.50 1xw6 h GLN 109 Ca 0.34 -0.06 -0.06 0.00 0.06 0.00 0.00 58.65 58.93 1xw6 h GLN 109 Cb 0.34 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 27.91 1xw6 h GLN 109 CO -0.25 0.62 -0.20 1.25 -0.67 0.00 0.00 178.83 179.58 1xw6 h LEU 110 N 0.96 0.33 -1.39 1.46 5.85 -1.14 -3.18 115.31 118.20 1xw6 h LEU 110 Ca 0.29 -0.57 -0.01 0.00 0.84 0.00 0.00 57.88 58.42 1xw6 h LEU 110 Cb -0.03 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 40.88 1xw6 h LEU 110 CO -0.07 0.84 0.25 1.23 -0.34 0.00 0.00 178.44 180.35 1xw6 h GLY 111 N -0.18 0.71 0.77 3.75 0.00 -0.98 -2.01 103.07 105.14 1xw6 h GLY 111 Ca 0.00 -0.31 0.02 0.00 0.00 0.00 0.00 47.33 47.05 1xw6 h GLY 111 CO 0.04 0.30 0.01 -0.33 0.00 0.00 0.00 176.54 176.56 1xw6 h MET 112 N 0.67 0.06 0.03 4.80 2.86 -0.61 -1.60 114.93 121.14 1xw6 h MET 112 Ca 0.17 -0.00 -0.23 0.00 -2.06 0.00 0.00 59.70 57.58 1xw6 h MET 112 Cb 0.05 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.69 1xw6 h MET 112 CO -0.03 0.04 -1.00 -0.84 1.06 0.00 0.00 176.91 176.14 1xw6 h ILE 113 N 0.06 1.46 -0.02 -1.22 3.07 -1.53 -2.76 117.51 116.56 1xw6 h ILE 113 Ca 0.07 -2.66 -0.06 0.00 1.55 0.00 0.00 64.86 63.76 1xw6 h ILE 113 Cb 0.09 2.57 -0.01 0.00 -0.27 0.00 0.00 36.82 39.20 1xw6 h ILE 113 CO -0.12 0.78 -0.26 0.00 -1.05 0.00 0.00 178.15 177.50 1xw6 n TYR 115 N -4.21 0.43 -2.23 0.00 4.01 -0.62 0.69 117.16 115.24 1xw6 n TYR 115 Ca -0.02 0.13 -0.42 0.00 -0.16 0.00 0.00 57.90 57.42 1xw6 n TYR 115 Cb 0.32 -0.56 -0.03 0.00 -0.31 0.00 0.00 39.34 38.76 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 -4.13 6.87 0.57 7.72 3.84 -0.89 -4.60 114.94 124.32 1xw6 s ASN 116 Ca 0.05 2.17 0.28 0.00 0.21 0.00 0.00 52.86 55.57 1xw6 s ASN 116 Cb 0.14 -2.57 1.52 0.00 -0.55 0.00 0.00 41.25 39.79 1xw6 s ASN 116 CO 0.76 -0.67 2.00 -0.65 -2.79 0.00 0.00 177.10 175.75 1xw6 h PRO 117 N 7.40 0.00 -1.07 0.43 0.11 -1.90 -0.78 132.00 136.18 1xw6 h PRO 117 Ca -0.40 0.00 -0.47 0.00 0.11 0.00 0.00 66.00 65.24 1xw6 h PRO 117 Cb 1.19 0.00 -0.25 0.00 0.11 0.00 0.00 31.00 32.06 1xw6 h PRO 117 CO 0.88 0.00 0.61 0.39 -0.21 0.00 0.00 178.00 179.67 1xw6 n GLU 118 N -3.92 2.16 -0.16 1.05 1.02 -1.26 -4.70 120.64 114.82 1xw6 n GLU 118 Ca 0.06 -2.54 -0.03 0.00 -0.02 0.00 0.00 57.16 54.63 1xw6 n GLU 118 Cb 0.52 -2.00 0.04 0.00 -0.02 0.00 0.00 31.44 29.99 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 1.20 -0.23 -0.39 -0.32 3.57 -1.31 -2.26 116.94 117.20 1xw6 h PHE 119 Ca 0.51 0.04 0.03 0.00 3.53 0.00 0.00 57.97 62.08 1xw6 h PHE 119 Cb 1.89 0.18 -0.02 0.00 2.79 0.00 0.00 35.95 40.79 1xw6 h PHE 119 CO 1.27 -0.20 0.26 1.49 -2.23 0.00 0.00 178.31 178.90 1xw6 h GLU 120 N 0.02 0.42 0.07 1.11 4.57 -1.87 -1.01 114.58 117.89 1xw6 h GLU 120 Ca 0.25 -0.03 -0.25 0.00 -1.18 0.00 0.00 59.36 58.15 1xw6 h GLU 120 Cb 0.38 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.88 1xw6 h GLU 120 CO -0.51 0.28 -1.10 -0.22 -1.18 0.00 0.00 179.01 176.28 1xw6 h LYS 121 N 0.43 0.32 0.00 1.92 3.64 -1.81 -3.32 116.57 117.76 1xw6 h LYS 121 Ca 0.16 -0.44 -0.02 0.00 -1.27 0.00 0.00 60.65 59.07 1xw6 h LYS 121 Cb 0.09 0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.06 1xw6 h LYS 121 CO -0.04 1.16 -0.27 -0.07 -2.27 0.00 0.00 179.45 177.96 1xw6 h LEU 122 N 0.14 0.00 -0.76 5.20 4.07 -1.14 -3.37 115.31 119.45 1xw6 h LEU 122 Ca -0.11 0.00 0.08 0.00 0.08 0.00 0.00 57.88 57.94 1xw6 h LEU 122 Cb 1.78 0.00 -0.07 0.00 1.08 0.00 0.00 40.66 43.46 1xw6 h LEU 122 CO 0.18 0.07 0.42 0.50 -1.08 0.00 0.00 178.44 178.53 1xw6 h LYS 123 N 0.00 0.70 -0.58 1.13 3.64 -1.29 -2.90 116.57 117.28 1xw6 h LYS 123 Ca -0.00 -0.04 0.08 0.00 -1.27 0.00 0.00 60.65 59.41 1xw6 h LYS 123 Cb 1.06 -0.16 -0.06 0.00 -0.41 0.00 0.00 32.23 32.66 1xw6 h LYS 123 CO 0.01 0.46 0.23 -1.35 -2.27 0.00 0.00 179.45 176.54 1xw6 h PRO 124 N 0.72 0.42 -0.22 1.90 0.11 -1.78 -1.35 132.00 131.80 1xw6 h PRO 124 Ca 0.36 -0.03 -0.14 0.00 0.11 0.00 0.00 66.00 66.31 1xw6 h PRO 124 Cb 0.31 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.31 1xw6 h PRO 124 CO -0.23 0.28 -0.43 -0.22 -0.21 0.00 0.00 178.00 177.18 1xw6 h LYS 125 N 0.43 0.54 -0.51 1.05 3.64 -1.81 -2.34 116.57 117.57 1xw6 h LYS 125 Ca 0.28 -0.28 -0.07 0.00 -1.27 0.00 0.00 60.65 59.31 1xw6 h LYS 125 Cb 0.30 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.11 1xw6 h LYS 125 CO -0.26 0.87 0.06 -0.92 -2.27 0.00 0.00 179.45 176.93 1xw6 h TYR 126 N 0.44 0.92 0.00 1.91 3.20 -1.28 -1.99 116.97 120.17 1xw6 h TYR 126 Ca 0.03 -0.14 -0.08 0.00 3.14 0.00 0.00 58.73 61.69 1xw6 h TYR 126 Cb 0.93 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.94 1xw6 h TYR 126 CO 0.04 0.84 -0.36 -0.07 -1.64 0.00 0.00 178.16 176.97 1xw6 h LEU 127 N 0.74 0.00 -0.45 2.82 3.38 -1.20 -0.87 115.31 119.72 1xw6 h LEU 127 Ca 0.15 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.97 1xw6 h LEU 127 Cb 0.43 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 1xw6 h LEU 127 CO 0.01 0.36 -0.34 -0.08 0.09 0.00 0.00 178.44 178.49 1xw6 h GLU 128 N 0.00 0.93 0.00 1.13 4.81 -1.08 -3.18 114.58 117.19 1xw6 h GLU 128 Ca -0.00 -0.46 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 1xw6 h GLU 128 Cb 0.69 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.07 1xw6 h GLU 128 CO 0.05 1.11 -0.47 0.39 -0.73 0.00 0.00 179.01 179.36 1xw6 n GLU 129 N -4.07 0.07 -0.13 1.92 1.02 -0.78 -4.39 120.64 114.28 1xw6 n GLU 129 Ca -0.01 0.02 -0.07 0.00 -0.02 0.00 0.00 57.16 57.07 1xw6 n GLU 129 Cb 0.52 -1.54 0.01 0.00 -0.02 0.00 0.00 31.44 30.41 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 0.40 -1.18 -4.62 5.85 -1.13 -2.85 115.31 111.79 1xw6 h LEU 130 Ca 0.00 0.00 0.11 0.00 0.84 0.00 0.00 57.88 58.83 1xw6 h LEU 130 Cb 0.56 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.43 1xw6 h LEU 130 CO 0.00 0.29 0.59 -0.65 -0.34 0.00 0.00 178.44 178.32 1xw6 h PRO 131 N 0.49 0.85 -0.25 5.25 0.11 -1.77 -1.85 132.00 134.83 1xw6 h PRO 131 Ca 0.16 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 66.24 1xw6 h PRO 131 Cb -0.00 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 30.89 1xw6 h PRO 131 CO -0.07 0.56 0.11 1.49 -0.21 0.00 0.00 178.00 179.89 1xw6 h GLU 132 N 0.88 0.23 0.33 1.05 4.81 -1.79 -0.53 114.58 119.56 1xw6 h GLU 132 Ca 0.44 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.64 1xw6 h GLU 132 Cb 0.47 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.80 1xw6 h GLU 132 CO -0.20 0.15 -0.16 0.87 -0.73 0.00 0.00 179.01 178.95 1xw6 h LYS 133 N 0.24 -0.43 -0.80 1.92 1.57 -1.30 -2.90 116.57 114.87 1xw6 h LYS 133 Ca 0.11 0.03 0.03 0.00 -1.87 0.00 0.00 60.65 58.94 1xw6 h LYS 133 Cb 0.05 0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.41 1xw6 h LYS 133 CO -0.09 -0.28 0.51 -0.07 -0.57 0.00 0.00 179.45 178.95 1xw6 h LEU 134 N -0.45 0.86 -1.94 2.94 4.07 -1.29 -2.07 115.31 117.43 1xw6 h LEU 134 Ca -0.05 -0.01 0.06 0.00 0.08 0.00 0.00 57.88 57.97 1xw6 h LEU 134 Cb 0.34 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 41.88 1xw6 h LEU 134 CO 0.07 0.60 0.18 0.50 -1.08 0.00 0.00 178.44 178.71 1xw6 h LYS 135 N 1.01 0.07 -0.35 1.13 3.64 -1.00 -0.91 116.57 120.16 1xw6 h LYS 135 Ca 0.31 -0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.61 1xw6 h LYS 135 Cb -0.02 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 1xw6 h LYS 135 CO -0.10 0.05 -0.08 -0.07 -2.27 0.00 0.00 179.45 176.98 1xw6 h LEU 136 N 0.08 0.68 -0.78 5.20 3.38 -1.17 -0.59 115.31 122.10 1xw6 h LEU 136 Ca 0.12 -0.36 -0.08 0.00 0.09 0.00 0.00 57.88 57.65 1xw6 h LEU 136 Cb 0.37 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1xw6 h LEU 136 CO -0.01 0.88 0.08 1.88 0.09 0.00 0.00 178.44 181.36 1xw6 h TYR 137 N 0.46 1.07 0.54 1.13 0.05 -1.17 -1.41 116.97 117.64 1xw6 h TYR 137 Ca 0.09 -0.15 -0.02 0.00 0.05 0.00 0.00 58.73 58.70 1xw6 h TYR 137 Cb 0.58 -0.29 -0.00 0.00 1.01 0.00 0.00 36.73 38.03 1xw6 h TYR 137 CO 0.05 0.91 -0.31 1.03 -1.05 0.00 0.00 178.16 178.79 1xw6 h SER 138 N 0.94 -0.78 -0.41 3.88 0.87 -1.05 -0.97 113.55 116.03 1xw6 h SER 138 Ca 0.19 0.04 -0.03 0.00 -1.23 0.00 0.00 61.79 60.75 1xw6 h SER 138 Cb 0.44 0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 62.60 1xw6 h SER 138 CO 0.01 -0.50 0.15 -0.33 -0.53 0.00 0.00 176.83 175.64 1xw6 h GLU 139 N -0.80 0.69 -0.29 2.24 5.08 -1.07 -1.02 114.58 119.41 1xw6 h GLU 139 Ca -0.07 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.16 1xw6 h GLU 139 Cb 0.64 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 1xw6 h GLU 139 CO 0.08 0.59 0.06 0.35 -1.00 0.00 0.00 179.01 179.10 1xw6 h PHE 140 N 0.67 0.49 -0.40 4.33 3.57 -1.10 -2.98 116.94 121.52 1xw6 h PHE 140 Ca 0.16 -0.06 -0.05 0.00 3.53 0.00 0.00 57.97 61.55 1xw6 h PHE 140 Cb 0.19 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 38.78 1xw6 h PHE 140 CO 0.01 0.54 0.07 1.25 -2.23 0.00 0.00 178.31 177.95 1xw6 h LEU 141 N 0.30 0.63 0.00 0.59 5.85 -0.86 -3.48 115.31 118.34 1xw6 h LEU 141 Ca 0.09 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.55 1xw6 h LEU 141 Cb 0.30 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.16 1xw6 h LEU 141 CO 0.00 0.73 0.00 0.61 -0.34 0.00 0.00 178.44 179.44 1xw6 n GLY 142 N -0.52 3.41 1.44 3.75 0.00 -0.41 -1.87 105.19 111.00 1xw6 n GLY 142 Ca -0.01 -0.18 0.09 0.00 0.00 0.00 0.00 46.02 45.93 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 13.96 3.36 -2.67 1.61 4.76 -1.26 -4.96 118.16 132.97 1xw6 n LYS 143 Ca 0.00 -2.56 -0.36 0.00 -2.87 0.00 0.00 58.31 52.52 1xw6 n LYS 143 Cb 0.00 -1.80 -0.05 0.00 -1.84 0.00 0.00 35.03 31.34 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 -1.74 4.29 0.19 1.97 0.52 -0.78 -4.97 118.95 118.43 1xw6 s ARG 144 Ca 0.46 1.37 -0.02 0.00 -0.52 0.00 0.00 55.73 57.03 1xw6 s ARG 144 Cb 0.29 -2.53 0.11 0.00 0.52 0.00 0.00 34.95 33.34 1xw6 s ARG 144 CO 0.23 -0.01 1.48 -1.00 0.02 0.00 0.00 175.30 176.03 1xw6 h PRO 145 N 2.55 0.47 -5.34 3.54 0.13 -1.89 -3.45 132.00 128.00 1xw6 h PRO 145 Ca -0.48 -0.33 -0.41 0.00 -0.87 0.00 0.00 66.00 63.91 1xw6 h PRO 145 Cb 1.20 0.05 -0.14 0.00 0.13 0.00 0.00 31.00 32.24 1xw6 h PRO 145 CO 0.63 0.94 -0.71 -1.58 -0.23 0.00 0.00 178.00 177.05 1xw6 s TRP 146 N -3.83 1.59 0.37 1.56 0.52 -0.95 -4.93 118.94 113.27 1xw6 s TRP 146 Ca -0.06 -0.69 0.07 0.00 0.02 0.00 0.00 56.10 55.43 1xw6 s TRP 146 Cb 0.11 -0.81 0.74 0.00 -1.15 0.00 0.00 33.47 32.36 1xw6 s TRP 146 CO 0.84 0.21 1.93 0.74 0.02 0.00 0.00 176.95 180.69 1xw6 h PHE 147 N 2.57 0.41 0.00 -1.98 -1.00 -1.88 -2.97 116.94 112.10 1xw6 h PHE 147 Ca -0.38 -0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.37 1xw6 h PHE 147 Cb 1.21 -0.12 0.00 0.00 3.61 0.00 0.00 35.95 40.65 1xw6 h PHE 147 CO 0.67 0.42 -0.44 0.00 -1.61 0.00 0.00 178.31 177.35 1xw6 h ALA 148 N 1.61 0.74 0.00 2.45 0.00 -1.90 -3.47 119.26 118.69 1xw6 h ALA 148 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1xw6 h ALA 148 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1xw6 h ALA 148 CO 0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.67 1xw6 n GLY 149 N 1.26 -0.12 0.09 0.00 0.00 -1.12 -4.40 105.19 100.90 1xw6 n GLY 149 Ca 0.03 -0.34 0.12 0.00 0.00 0.00 0.00 46.02 45.83 1xw6 n GLY 149 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1xw6 h ASN 150 N 0.00 0.00 -2.93 1.61 -0.26 -1.96 -2.52 115.58 109.52 1xw6 h ASN 150 Ca 0.00 -0.12 -0.61 0.00 -0.56 0.00 0.00 56.30 55.01 1xw6 h ASN 150 Cb 0.00 0.00 -0.11 0.00 -1.06 0.00 0.00 38.32 37.15 1xw6 h ASN 150 CO 0.00 0.06 -0.64 -1.59 -1.06 0.00 0.00 177.43 174.20 1xw6 s LYS 151 N -3.28 2.51 0.27 0.81 -2.85 -1.26 -4.75 119.74 111.18 1xw6 s LYS 151 Ca 0.02 -1.02 -0.28 0.00 -1.00 0.00 0.00 55.97 53.69 1xw6 s LYS 151 Cb 0.11 -2.43 -0.09 0.00 -2.06 0.00 0.00 37.83 33.36 1xw6 s LYS 151 CO 0.77 0.47 0.92 -1.50 0.10 0.00 0.00 175.35 176.11 1xw6 s ILE 152 N -1.66 4.16 0.39 3.79 2.07 -1.26 -4.59 121.20 124.10 1xw6 s ILE 152 Ca 0.28 1.93 0.04 0.00 -1.41 0.00 0.00 60.65 61.49 1xw6 s ILE 152 Cb -0.10 -4.18 -0.03 0.00 0.13 0.00 0.00 42.46 38.29 1xw6 s ILE 152 CO 0.19 0.35 0.15 0.42 -1.91 0.00 0.00 174.94 174.14 1xw6 s THR 153 N -1.36 0.52 0.30 4.00 -4.23 -1.26 -4.80 115.64 108.81 1xw6 s THR 153 Ca 0.44 -2.00 0.37 0.00 -1.18 0.00 0.00 61.69 59.32 1xw6 s THR 153 Cb -0.23 -2.39 0.41 0.00 1.34 0.00 0.00 72.50 71.63 1xw6 s THR 153 CO 0.28 0.00 2.12 2.19 -0.54 0.00 0.00 174.62 178.67 1xw6 h PHE 154 N 1.87 0.00 0.00 3.99 -5.15 -1.53 -2.92 116.94 113.20 1xw6 h PHE 154 Ca -0.34 0.00 -0.02 0.00 -0.20 0.00 0.00 57.97 57.41 1xw6 h PHE 154 Cb 1.27 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 37.43 1xw6 h PHE 154 CO 1.47 0.01 -0.08 -0.39 -2.00 0.00 0.00 178.31 177.32 1xw6 h VAL 155 N 0.00 0.21 -0.26 0.88 -1.51 -1.92 -2.62 116.25 111.03 1xw6 h VAL 155 Ca -0.00 -0.74 -0.05 0.00 -1.23 0.00 0.00 66.70 64.67 1xw6 h VAL 155 Cb 0.34 1.62 -0.02 0.00 -2.13 0.00 0.00 31.29 31.10 1xw6 h VAL 155 CO 0.00 0.08 -0.07 0.44 -1.23 0.00 0.00 177.57 176.80 1xw6 h ASP 156 N 0.00 0.39 -0.14 4.19 3.32 -1.93 0.17 116.42 122.42 1xw6 h ASP 156 Ca -0.00 -0.08 -0.14 0.00 0.02 0.00 0.00 57.03 56.83 1xw6 h ASP 156 Cb 0.61 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.05 1xw6 h ASP 156 CO 0.01 0.51 -0.38 -0.26 -1.72 0.00 0.00 179.24 177.40 1xw6 h PHE 157 N 0.40 0.78 -0.12 4.55 -1.00 -1.64 0.61 116.94 120.52 1xw6 h PHE 157 Ca 0.08 -0.22 -0.06 0.00 2.81 0.00 0.00 57.97 60.58 1xw6 h PHE 157 Cb 0.37 -0.17 -0.00 0.00 3.61 0.00 0.00 35.95 39.76 1xw6 h PHE 157 CO 0.01 0.94 -0.16 -0.07 -1.61 0.00 0.00 178.31 177.42 1xw6 h LEU 158 N 0.55 0.34 -0.65 1.54 3.38 -1.33 -2.32 115.31 116.81 1xw6 h LEU 158 Ca 0.05 -0.51 -0.08 0.00 0.09 0.00 0.00 57.88 57.43 1xw6 h LEU 158 Cb 0.90 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.52 1xw6 h LEU 158 CO 0.08 0.79 0.11 0.58 0.09 0.00 0.00 178.44 180.09 1xw6 h VAL 159 N -0.10 1.26 -0.18 1.22 2.07 -0.65 -2.15 116.25 117.72 1xw6 h VAL 159 Ca 0.01 -1.02 0.04 0.00 0.82 0.00 0.00 66.70 66.56 1xw6 h VAL 159 Cb 0.71 0.66 -0.05 0.00 -1.52 0.00 0.00 31.29 31.09 1xw6 h VAL 159 CO 0.04 0.38 -0.11 0.22 0.02 0.00 0.00 177.57 178.12 1xw6 h TYR 160 N 0.99 -0.27 -0.93 1.57 5.03 -0.89 0.39 116.97 122.87 1xw6 h TYR 160 Ca 0.20 0.02 0.03 0.00 2.58 0.00 0.00 58.73 61.56 1xw6 h TYR 160 Cb 0.43 0.15 -0.05 0.00 1.55 0.00 0.00 36.73 38.80 1xw6 h TYR 160 CO 0.03 -0.17 0.61 0.22 -1.32 0.00 0.00 178.16 177.53 1xw6 h ASP 161 N -0.10 1.01 -0.27 -2.11 3.58 -1.21 0.31 116.42 117.63 1xw6 h ASP 161 Ca 0.10 -0.01 -0.04 0.00 0.42 0.00 0.00 57.03 57.50 1xw6 h ASP 161 Cb 0.26 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.06 1xw6 h ASP 161 CO -0.25 0.70 0.01 0.58 -2.88 0.00 0.00 179.24 177.40 1xw6 h VAL 162 N 1.18 1.25 -0.35 2.25 2.07 -0.92 -0.63 116.25 121.11 1xw6 h VAL 162 Ca 0.37 -0.90 -0.04 0.00 0.82 0.00 0.00 66.70 66.95 1xw6 h VAL 162 Cb -0.01 1.32 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 1xw6 h VAL 162 CO -0.12 0.29 0.08 -0.07 0.02 0.00 0.00 177.57 177.77 1xw6 h LEU 163 N 0.25 0.53 -0.61 2.57 3.38 -0.61 -2.85 115.31 117.97 1xw6 h LEU 163 Ca 0.08 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.78 1xw6 h LEU 163 Cb 0.41 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 1xw6 h LEU 163 CO 0.01 0.63 0.26 -0.78 0.09 0.00 0.00 178.44 178.66 1xw6 h ASP 164 N 0.41 0.83 0.02 -0.43 3.58 -0.35 -1.87 116.42 118.62 1xw6 h ASP 164 Ca 0.11 -0.16 -0.00 0.00 0.42 0.00 0.00 57.03 57.40 1xw6 h ASP 164 Cb 0.31 -0.22 -0.00 0.00 1.72 0.00 0.00 39.33 41.14 1xw6 h ASP 164 CO 0.00 0.76 -0.02 -0.07 -2.88 0.00 0.00 179.24 177.03 1xw6 h LEU 165 N 0.85 0.00 0.00 2.28 3.38 -1.07 -2.45 115.31 118.30 1xw6 h LEU 165 Ca 0.21 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.95 1xw6 h LEU 165 Cb 0.17 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.89 1xw6 h LEU 165 CO -0.02 0.02 -1.22 0.45 0.09 0.00 0.00 178.44 177.76 1xw6 h HIS 166 N 0.00 0.00 0.00 1.13 3.86 -1.18 -2.42 115.15 116.54 1xw6 h HIS 166 Ca -0.00 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.11 1xw6 h HIS 166 Cb 0.03 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.49 1xw6 h HIS 166 CO 0.00 0.94 -0.48 0.07 0.86 0.00 0.00 177.93 179.32 1xw6 h ARG 167 N 0.00 0.00 -0.19 2.45 0.11 -1.01 0.29 114.38 116.02 1xw6 h ARG 167 Ca -0.11 0.00 -0.18 0.00 0.10 0.00 0.00 59.98 59.79 1xw6 h ARG 167 Cb 1.82 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.90 1xw6 h ARG 167 CO 0.10 0.48 -0.59 0.82 0.10 0.00 0.00 179.97 180.89 1xw6 h ILE 168 N 0.00 1.30 -0.20 0.08 2.04 -1.48 -1.23 117.51 118.02 1xw6 h ILE 168 Ca -0.00 -1.81 -0.20 0.00 1.00 0.00 0.00 64.86 63.85 1xw6 h ILE 168 Cb 0.95 1.89 0.01 0.00 -0.74 0.00 0.00 36.82 38.92 1xw6 h ILE 168 CO 0.06 0.57 -0.65 0.15 0.00 0.00 0.00 178.15 178.28 1xw6 h PHE 169 N 0.46 1.03 -2.22 1.37 3.57 -1.16 -3.40 116.94 116.59 1xw6 h PHE 169 Ca -0.02 -0.42 -0.47 0.00 3.53 0.00 0.00 57.97 60.59 1xw6 h PHE 169 Cb 1.21 -0.17 -0.35 0.00 2.79 0.00 0.00 35.95 39.43 1xw6 h PHE 169 CO 0.09 1.25 -0.77 -2.00 -2.23 0.00 0.00 178.31 174.64 1xw6 s GLU 170 N -3.89 0.63 0.34 1.11 2.56 0.98 -5.06 118.70 115.38 1xw6 s GLU 170 Ca -0.11 -1.16 0.13 0.00 0.00 0.00 0.00 54.97 53.83 1xw6 s GLU 170 Cb 0.09 -1.00 1.09 0.00 2.00 0.00 0.00 34.13 36.31 1xw6 s GLU 170 CO 0.89 -1.22 1.59 -1.35 -0.56 0.00 0.00 175.26 174.61 1xw6 h PRO 171 N 6.88 0.06 -0.07 4.30 0.11 -1.39 -0.07 132.00 141.81 1xw6 h PRO 171 Ca 0.07 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.18 1xw6 h PRO 171 Cb 1.01 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1xw6 h PRO 171 CO 0.23 0.04 0.00 1.63 -0.21 0.00 0.00 178.00 179.69 1xw6 n LYS 172 N -5.30 1.54 0.21 1.05 5.02 -1.26 -4.45 118.16 114.97 1xw6 n LYS 172 Ca 0.32 -0.81 0.14 0.00 -2.02 0.00 0.00 58.31 55.94 1xw6 n LYS 172 Cb 1.05 -1.42 0.76 0.00 -0.02 0.00 0.00 35.03 35.40 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 -4.15 1.86 -0.37 0.00 4.32 -1.26 -4.49 117.00 112.91 1xw6 n LEU 174 Ca 0.00 -0.64 0.03 0.00 -0.02 0.00 0.00 56.01 55.38 1xw6 n LEU 174 Cb 0.24 -0.03 0.18 0.00 -1.62 0.00 0.00 43.42 42.19 1xw6 n LEU 174 CO 0.31 0.34 1.27 0.44 -1.22 0.00 0.00 177.39 178.52 1xw6 h ASP 175 N 2.45 1.04 0.64 -1.43 3.32 -1.75 -1.25 116.42 119.44 1xw6 h ASP 175 Ca 0.00 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1xw6 h ASP 175 Cb 0.70 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.04 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 -2.37 1.79 -3.80 3.45 0.00 -1.26 -4.31 120.51 114.01 1xw6 n ALA 176 Ca 0.15 -0.04 -0.28 0.00 0.00 0.00 0.00 53.44 53.27 1xw6 n ALA 176 Cb 0.18 -1.30 -0.12 0.00 0.00 0.00 0.00 19.45 18.21 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 -3.05 2.91 0.34 0.00 0.08 -0.47 -4.98 117.98 112.81 1xw6 s PHE 177 Ca 0.08 -3.04 0.07 0.00 0.12 0.00 0.00 56.93 54.16 1xw6 s PHE 177 Cb 0.11 -2.33 0.76 0.00 -0.57 0.00 0.00 43.02 40.99 1xw6 s PHE 177 CO 0.34 -0.65 1.86 -1.00 -0.10 0.00 0.00 175.22 175.66 1xw6 h PRO 178 N 5.76 0.74 0.00 0.24 0.13 -1.75 -1.63 132.00 135.49 1xw6 h PRO 178 Ca 0.11 -0.04 -0.04 0.00 -0.87 0.00 0.00 66.00 65.16 1xw6 h PRO 178 Cb 0.82 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 31.78 1xw6 h PRO 178 CO 0.63 0.49 -0.19 -2.95 -0.23 0.00 0.00 178.00 175.75 1xw6 h ASN 179 N 0.76 0.00 0.51 1.44 -0.00 -1.93 -1.25 115.58 115.12 1xw6 h ASN 179 Ca 0.47 0.00 -0.21 0.00 -0.00 0.00 0.00 56.30 56.56 1xw6 h ASN 179 Cb 0.68 0.00 -0.01 0.00 -0.00 0.00 0.00 38.32 39.00 1xw6 h ASN 179 CO -0.23 0.19 -0.91 -0.07 -0.00 0.00 0.00 177.43 176.41 1xw6 h LEU 180 N 0.00 0.34 -0.39 6.14 3.38 -1.64 -1.42 115.31 121.72 1xw6 h LEU 180 Ca -0.00 -0.28 -0.15 0.00 0.09 0.00 0.00 57.88 57.54 1xw6 h LEU 180 Cb 0.45 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1xw6 h LEU 180 CO 0.02 1.09 -0.33 0.11 0.09 0.00 0.00 178.44 179.42 1xw6 h LYS 181 N 0.14 0.91 -0.27 1.13 1.57 -1.25 -2.58 116.57 116.23 1xw6 h LYS 181 Ca -0.06 -0.46 -0.06 0.00 -1.87 0.00 0.00 60.65 58.20 1xw6 h LYS 181 Cb 1.55 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.85 1xw6 h LYS 181 CO 0.15 1.11 -0.11 -0.44 -0.57 0.00 0.00 179.45 179.59 1xw6 h ASP 182 N 0.72 0.42 -0.34 0.86 3.32 -1.19 -1.38 116.42 118.84 1xw6 h ASP 182 Ca 0.07 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.00 1xw6 h ASP 182 Cb 0.92 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.35 1xw6 h ASP 182 CO 0.09 0.57 0.13 0.15 -1.72 0.00 0.00 179.24 178.45 1xw6 h PHE 183 N 0.41 0.52 -0.76 4.55 3.57 -1.15 -0.67 116.94 123.40 1xw6 h PHE 183 Ca 0.08 -0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.51 1xw6 h PHE 183 Cb 0.44 -0.15 -0.04 0.00 2.79 0.00 0.00 35.95 38.99 1xw6 h PHE 183 CO 0.01 0.50 0.39 0.82 -2.23 0.00 0.00 178.31 177.80 1xw6 h ILE 184 N 0.40 1.24 -0.40 1.41 2.04 -1.01 0.71 117.51 121.90 1xw6 h ILE 184 Ca 0.11 -0.64 -0.04 0.00 1.00 0.00 0.00 64.86 65.29 1xw6 h ILE 184 Cb 0.20 0.26 -0.02 0.00 -0.74 0.00 0.00 36.82 36.52 1xw6 h ILE 184 CO -0.01 0.27 0.10 -1.28 0.00 0.00 0.00 178.15 177.23 1xw6 h SER 185 N 1.07 0.61 -0.65 1.72 0.87 -1.13 -0.43 113.55 115.61 1xw6 h SER 185 Ca 0.27 -0.23 -0.04 0.00 -1.23 0.00 0.00 61.79 60.55 1xw6 h SER 185 Cb 0.08 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 61.85 1xw6 h SER 185 CO -0.04 0.69 0.24 -0.09 -0.53 0.00 0.00 176.83 177.10 1xw6 h ARG 186 N 0.51 0.99 0.26 2.24 2.43 -0.85 0.27 114.38 120.22 1xw6 h ARG 186 Ca 0.13 -0.19 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 1xw6 h ARG 186 Cb 0.31 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 1xw6 h ARG 186 CO 0.00 0.84 -0.13 0.35 -1.51 0.00 0.00 179.97 179.53 1xw6 h PHE 187 N 0.93 -0.32 0.00 2.20 3.57 -0.69 -2.91 116.94 119.71 1xw6 h PHE 187 Ca 0.21 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.69 1xw6 h PHE 187 Cb 0.24 0.11 -0.00 0.00 2.79 0.00 0.00 35.95 39.09 1xw6 h PHE 187 CO 0.02 0.01 -0.06 0.93 -2.23 0.00 0.00 178.31 176.98 1xw6 h GLU 188 N -0.70 0.00 0.00 1.11 5.08 -1.07 -2.11 114.58 116.90 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 0.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1xw6 h GLU 188 CO 0.06 0.06 0.00 0.41 -1.00 0.00 0.00 179.01 178.54 1xw6 n GLY 189 N -0.71 -1.50 3.71 -3.84 0.00 0.94 -3.45 105.19 100.34 1xw6 n GLY 189 Ca -0.02 0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 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 -4.30 4.38 0.20 0.99 1.43 -0.79 -4.80 118.68 115.79 1xw6 s LEU 190 Ca 0.08 2.78 -0.22 0.00 -1.03 0.00 0.00 54.13 55.74 1xw6 s LEU 190 Cb 0.12 -3.58 0.12 0.00 0.03 0.00 0.00 46.19 42.87 1xw6 s LEU 190 CO 0.50 -0.97 1.55 -0.08 0.23 0.00 0.00 176.35 177.59 1xw6 h GLU 191 N 7.66 -0.06 0.00 1.70 4.81 -1.90 0.25 114.58 127.04 1xw6 h GLU 191 Ca -0.44 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 58.75 1xw6 h GLU 191 Cb 1.21 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 1xw6 h GLU 191 CO 0.95 -0.04 -0.22 0.87 -0.73 0.00 0.00 179.01 179.84 1xw6 h LYS 192 N -0.06 0.00 0.16 1.92 1.57 -1.92 -1.91 116.57 116.33 1xw6 h LYS 192 Ca 0.26 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.77 1xw6 h LYS 192 Cb 0.55 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.88 1xw6 h LYS 192 CO -0.90 0.22 -1.15 0.82 -0.57 0.00 0.00 179.45 177.87 1xw6 h ILE 193 N 0.00 1.35 -0.14 1.86 1.08 -1.40 -2.83 117.51 117.43 1xw6 h ILE 193 Ca -0.00 -2.51 0.00 0.00 -0.39 0.00 0.00 64.86 61.96 1xw6 h ILE 193 Cb 0.67 2.93 -0.01 0.00 -3.07 0.00 0.00 36.82 37.34 1xw6 h ILE 193 CO 0.03 0.75 0.09 -1.28 -0.69 0.00 0.00 178.15 177.04 1xw6 h SER 194 N 0.03 0.15 -0.66 1.72 0.87 -0.50 -0.97 113.55 114.19 1xw6 h SER 194 Ca -0.19 -0.00 0.04 0.00 -1.23 0.00 0.00 61.79 60.41 1xw6 h SER 194 Cb 1.87 -0.04 -0.05 0.00 -0.44 0.00 0.00 62.40 63.74 1xw6 h SER 194 CO 0.22 0.11 0.39 0.00 -0.53 0.00 0.00 176.83 177.02 1xw6 h ALA 195 N 1.05 0.87 -0.48 6.23 0.00 -1.43 -2.47 119.26 123.03 1xw6 h ALA 195 Ca 0.05 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 1xw6 h ALA 195 Cb -0.02 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1xw6 h ALA 195 CO -0.01 0.11 -0.09 -0.92 0.00 0.00 0.00 179.25 178.34 1xw6 h TYR 196 N 0.75 1.02 0.00 0.00 3.20 -1.32 -2.81 116.97 117.82 1xw6 h TYR 196 Ca 0.28 -0.21 -0.01 0.00 3.14 0.00 0.00 58.73 61.92 1xw6 h TYR 196 Cb 0.09 -0.25 -0.00 0.00 1.54 0.00 0.00 36.73 38.11 1xw6 h TYR 196 CO -0.06 0.99 -0.07 0.52 -1.64 0.00 0.00 178.16 177.90 1xw6 h MET 197 N 0.77 0.00 -0.02 1.82 2.86 -0.81 -2.04 114.93 117.51 1xw6 h MET 197 Ca 0.13 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 1xw6 h MET 197 Cb 0.64 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.30 1xw6 h MET 197 CO 0.04 0.07 -0.05 1.63 1.06 0.00 0.00 176.91 179.66 1xw6 n LYS 198 N -3.43 1.84 -2.57 1.72 5.02 -0.96 -4.88 118.16 114.90 1xw6 n LYS 198 Ca -0.02 -1.31 -0.24 0.00 -2.02 0.00 0.00 58.31 54.73 1xw6 n LYS 198 Cb 0.21 -1.47 0.11 0.00 -0.02 0.00 0.00 35.03 33.86 1xw6 n LYS 198 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1xw6 s SER 199 N -2.07 4.31 0.40 4.39 1.04 -0.76 -5.00 113.70 116.00 1xw6 s SER 199 Ca 0.32 -0.36 0.24 0.00 0.48 0.00 0.00 55.95 56.64 1xw6 s SER 199 Cb 0.20 -0.01 0.53 0.00 0.10 0.00 0.00 66.02 66.84 1xw6 s SER 199 CO 0.35 -1.89 1.67 0.77 0.98 0.00 0.00 173.24 175.12 1xw6 h SER 200 N -0.56 0.00 0.09 7.02 4.64 -1.93 -3.30 113.55 119.52 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 0.40 0.00 -0.60 0.03 -0.87 0.00 0.00 176.83 175.79 1xw6 h ARG 201 N 0.00 0.51 -6.23 4.77 3.08 -1.95 -3.45 114.38 111.11 1xw6 h ARG 201 Ca 0.00 -0.34 -0.69 0.00 0.07 0.00 0.00 59.98 59.01 1xw6 h ARG 201 Cb 0.90 0.05 0.03 0.00 0.08 0.00 0.00 29.97 31.03 1xw6 h ARG 201 CO 0.00 0.96 0.74 0.34 -1.07 0.00 0.00 179.97 180.94 1xw6 n PHE 202 N -3.93 1.89 -3.36 3.04 7.35 -1.24 -4.94 117.46 116.26 1xw6 n PHE 202 Ca -0.04 0.51 -0.26 0.00 -0.76 0.00 0.00 57.45 56.90 1xw6 n PHE 202 Cb 0.63 -2.44 -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 4.27 1.10 0.09 -2.13 7.94 -1.26 -4.95 117.00 122.05 1xw6 n LEU 203 Ca 0.22 -4.83 0.11 0.00 -1.11 0.00 0.00 56.01 50.39 1xw6 n LEU 203 Cb 0.18 0.19 0.44 0.00 0.53 0.00 0.00 43.42 44.75 1xw6 n LEU 203 CO 0.72 1.98 0.82 -0.81 -1.11 0.00 0.00 177.39 179.00 1xw6 n PRO 204 N 1.68 0.14 -3.46 1.96 -0.04 -1.26 -4.17 135.00 129.84 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 0.47 -1.75 -0.03 0.00 -0.04 0.00 0.00 33.50 32.16 1xw6 n PRO 204 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 1xw6 s ARG 205 N -3.20 1.23 0.36 0.54 1.70 -1.26 -4.42 118.95 113.90 1xw6 s ARG 205 Ca 0.06 -0.51 -0.27 0.00 -0.47 0.00 0.00 55.73 54.53 1xw6 s ARG 205 Cb 0.10 0.56 -0.12 0.00 -0.57 0.00 0.00 34.95 34.93 1xw6 s ARG 205 CO 0.37 -0.53 1.31 -2.30 -1.08 0.00 0.00 175.30 173.07 1xw6 n PRO 206 N -0.33 2.14 0.14 3.89 -0.02 -1.26 -4.68 135.00 134.88 1xw6 n PRO 206 Ca -0.17 0.75 -0.14 0.00 -2.02 0.00 0.00 63.50 61.93 1xw6 n PRO 206 Cb 0.65 -2.38 -0.08 0.00 -0.02 0.00 0.00 33.50 31.67 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 2.48 0.81 -5.23 -1.45 2.07 -1.70 -0.63 116.25 112.60 1xw6 h VAL 207 Ca -0.47 -0.48 -0.46 0.00 0.82 0.00 0.00 66.70 66.11 1xw6 h VAL 207 Cb 1.28 1.08 -0.05 0.00 -1.52 0.00 0.00 31.29 32.08 1xw6 h VAL 207 CO 0.62 0.10 -0.25 0.49 0.02 0.00 0.00 177.57 178.55 1xw6 n PHE 208 N -5.13 -0.30 -1.89 1.57 3.72 -0.08 -1.32 117.46 114.03 1xw6 n PHE 208 Ca -0.09 -1.81 -0.29 0.00 -0.05 0.00 0.00 57.45 55.21 1xw6 n PHE 208 Cb 0.23 -0.31 0.13 0.00 -0.94 0.00 0.00 39.48 38.58 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 -3.35 3.88 0.50 4.37 1.04 -1.26 -4.51 113.70 114.37 1xw6 s SER 209 Ca 0.16 0.58 0.34 0.00 0.48 0.00 0.00 55.95 57.51 1xw6 s SER 209 Cb -0.01 -0.89 1.80 0.00 0.10 0.00 0.00 66.02 67.02 1xw6 s SER 209 CO 0.10 -2.28 2.03 0.11 0.98 0.00 0.00 173.24 174.18 1xw6 h LYS 210 N -1.32 0.00 0.00 4.02 1.57 -1.93 -1.79 116.57 117.11 1xw6 h LYS 210 Ca -0.46 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 1xw6 h LYS 210 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.60 1xw6 h LYS 210 CO 0.54 0.00 0.00 -1.33 -0.57 0.00 0.00 179.45 178.09 1xw6 n MET 211 N -2.70 0.08 -2.14 3.15 2.81 -1.26 -4.88 117.12 112.18 1xw6 n MET 211 Ca -0.02 0.06 -0.34 0.00 -1.81 0.00 0.00 57.70 55.60 1xw6 n MET 211 Cb 0.07 -1.59 0.01 0.00 -0.71 0.00 0.00 33.22 31.00 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 -3.03 2.71 -0.02 3.04 0.00 -0.67 -4.87 121.76 118.91 1xw6 s ALA 212 Ca 0.13 0.56 0.12 0.00 0.00 0.00 0.00 51.96 52.77 1xw6 s ALA 212 Cb 0.17 -3.28 -0.21 0.00 0.00 0.00 0.00 23.12 19.80 1xw6 s ALA 212 CO 0.55 -0.78 0.81 0.28 0.00 0.00 0.00 175.76 176.61 1xw6 h VAL 213 N 0.76 0.97 -4.20 0.00 2.07 0.01 -3.40 116.25 112.46 1xw6 h VAL 213 Ca -0.48 -2.75 -0.51 0.00 0.82 0.00 0.00 66.70 63.78 1xw6 h VAL 213 Cb 1.23 2.46 -0.28 0.00 -1.52 0.00 0.00 31.29 33.18 1xw6 h VAL 213 CO 0.57 0.55 -0.82 0.86 0.02 0.00 0.00 177.57 178.75 1xw6 s TRP 214 N -2.66 1.41 -0.24 1.57 -0.00 -1.00 -4.75 118.94 113.27 1xw6 s TRP 214 Ca -0.03 -0.29 0.00 0.00 -0.00 0.00 0.00 56.10 55.77 1xw6 s TRP 214 Cb 0.08 -0.88 0.00 0.00 -0.00 0.00 0.00 33.47 32.67 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 2.43 0.49 0.07 5.86 0.00 -1.26 -4.71 105.19 108.07 1xw6 n GLY 215 Ca -0.15 -0.17 0.09 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.15 0.34 0.00 1.61 2.04 -1.26 -0.91 115.26 116.94 1xw6 n ASN 216 Ca -0.02 0.59 0.00 0.00 -0.44 0.00 0.00 54.58 54.70 1xw6 n ASN 216 Cb 0.23 -0.66 0.00 0.00 -2.53 0.00 0.00 39.78 36.82 1xw6 n ASN 216 CO 0.00 0.00 0.00 1.17 -0.44 0.00 0.00 177.26 177.99