#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xw5 s MET 2 N 0.00 4.48 -0.19 0.54 1.75 -1.11 -4.85 119.30 119.92 1xw5 s MET 2 Ca 0.00 2.00 -0.01 0.00 -1.25 0.00 0.00 55.69 56.43 1xw5 s MET 2 Cb 0.00 -3.16 0.01 0.00 2.84 0.00 0.00 34.83 34.52 1xw5 s MET 2 CO 0.00 -0.05 -0.13 0.99 -0.65 0.00 0.00 175.02 175.18 1xw5 s THR 3 N -0.78 2.64 -0.37 10.11 2.01 0.01 -0.60 115.64 128.66 1xw5 s THR 3 Ca 0.49 -0.75 -0.09 0.00 0.31 0.00 0.00 61.69 61.65 1xw5 s THR 3 Cb -0.36 -2.15 0.04 0.00 0.01 0.00 0.00 72.50 70.04 1xw5 s THR 3 CO 0.44 0.49 0.18 -0.22 -0.69 0.00 0.00 174.62 174.82 1xw5 s LEU 4 N 1.27 4.65 -0.11 4.42 2.96 -0.25 -0.68 118.68 130.94 1xw5 s LEU 4 Ca 0.03 -1.13 -0.09 0.00 -0.22 0.00 0.00 54.13 52.72 1xw5 s LEU 4 Cb -0.14 -1.96 -0.04 0.00 0.50 0.00 0.00 46.19 44.55 1xw5 s LEU 4 CO -0.07 -0.39 0.20 -0.83 -1.32 0.00 0.00 176.35 173.94 1xw5 s GLY 5 N 1.58 2.21 0.04 7.98 0.00 -0.25 -1.54 107.32 117.35 1xw5 s GLY 5 Ca 0.01 -0.55 -0.28 0.00 0.00 0.00 0.00 44.72 43.90 1xw5 s GLY 5 CO 0.05 -0.19 1.20 -0.47 0.00 0.00 0.00 173.10 173.68 1xw5 s TYR 6 N -0.84 -0.02 0.80 1.90 5.04 -1.01 -1.69 117.35 121.53 1xw5 s TYR 6 Ca 0.16 -0.16 -0.11 0.00 -2.44 0.00 0.00 57.07 54.52 1xw5 s TYR 6 Cb -0.13 0.59 0.07 0.00 0.35 0.00 0.00 41.96 42.84 1xw5 s TYR 6 CO 0.05 -0.46 1.09 -1.58 -1.34 0.00 0.00 175.55 173.32 1xw5 s TRP 7 N -2.43 2.53 -1.37 4.97 0.52 -1.26 -1.33 118.94 120.57 1xw5 s TRP 7 Ca 0.18 1.47 -0.09 0.00 0.02 0.00 0.00 56.10 57.68 1xw5 s TRP 7 Cb 0.02 -3.07 -0.10 0.00 -1.15 0.00 0.00 33.47 29.16 1xw5 s TRP 7 CO -0.01 -1.93 3.03 -1.71 0.02 0.00 0.00 176.95 176.35 1xw5 n ASN 8 N -3.60 8.23 -4.11 2.95 5.15 -0.02 -4.68 115.26 119.17 1xw5 n ASN 8 Ca 0.08 -2.60 -0.11 0.00 -0.60 0.00 0.00 54.58 51.36 1xw5 n ASN 8 Cb 0.54 -1.53 -0.09 0.00 -0.53 0.00 0.00 39.78 38.17 1xw5 n ASN 8 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 1xw5 s ILE 9 N 1.77 0.03 -0.00 -1.44 -4.36 -1.26 -4.58 121.20 111.37 1xw5 s ILE 9 Ca 0.69 -1.78 -0.01 0.00 -0.26 0.00 0.00 60.65 59.29 1xw5 s ILE 9 Cb 0.20 -2.23 -0.00 0.00 1.25 0.00 0.00 42.46 41.67 1xw5 s ILE 9 CO -0.06 -0.16 0.60 -0.09 0.24 0.00 0.00 174.94 175.48 1xw5 h ARG 10 N 2.60 -0.03 0.00 0.37 2.43 -1.29 -3.45 114.38 115.02 1xw5 h ARG 10 Ca -0.33 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.84 1xw5 h ARG 10 Cb 1.23 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1xw5 h ARG 10 CO 0.51 -0.02 0.00 0.41 -1.51 0.00 0.00 179.97 179.36 1xw5 n GLY 11 N 0.21 1.63 0.00 2.80 0.00 -0.21 -2.06 105.19 107.56 1xw5 n GLY 11 Ca -0.00 -0.16 0.11 0.00 0.00 0.00 0.00 46.02 45.97 1xw5 n GLY 11 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xw5 n LEU 12 N 0.00 0.00 0.02 0.99 4.77 -1.26 -3.36 117.00 118.17 1xw5 n LEU 12 Ca 0.00 0.38 0.12 0.00 -0.03 0.00 0.00 56.01 56.48 1xw5 n LEU 12 Cb 0.00 -0.38 0.14 0.00 -2.33 0.00 0.00 43.42 40.84 1xw5 n LEU 12 CO 0.00 -0.08 0.25 0.00 -1.33 0.00 0.00 177.39 176.23 1xw5 n ALA 13 N -1.38 3.41 -0.05 -1.18 0.00 -0.87 -4.44 120.51 115.99 1xw5 n ALA 13 Ca 0.09 -0.36 -0.08 0.00 0.00 0.00 0.00 53.44 53.09 1xw5 n ALA 13 Cb 0.22 -1.07 -0.01 0.00 0.00 0.00 0.00 19.45 18.59 1xw5 n ALA 13 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1xw5 h HIS 14 N 0.00 -0.31 -0.42 0.00 6.17 -1.43 0.39 115.15 119.54 1xw5 h HIS 14 Ca 0.00 0.03 -0.07 0.00 0.71 0.00 0.00 60.37 61.04 1xw5 h HIS 14 Cb 0.64 0.17 -0.02 0.00 2.52 0.00 0.00 27.41 30.72 1xw5 h HIS 14 CO 0.00 -0.19 -0.02 0.77 0.71 0.00 0.00 177.93 179.20 1xw5 h SER 15 N -0.10 0.67 -0.10 3.26 0.02 -1.83 -1.98 113.55 113.49 1xw5 h SER 15 Ca 0.13 -0.16 -0.02 0.00 -0.84 0.00 0.00 61.79 60.90 1xw5 h SER 15 Cb 0.30 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.66 1xw5 h SER 15 CO -0.30 0.75 -0.01 0.40 -1.14 0.00 0.00 176.83 176.53 1xw5 h ILE 16 N 0.65 1.27 -0.70 3.27 2.04 -1.67 -1.22 117.51 121.16 1xw5 h ILE 16 Ca 0.13 -0.86 0.02 0.00 1.00 0.00 0.00 64.86 65.15 1xw5 h ILE 16 Cb 0.44 1.63 -0.04 0.00 -0.74 0.00 0.00 36.82 38.11 1xw5 h ILE 16 CO 0.02 0.24 0.45 0.03 0.00 0.00 0.00 178.15 178.90 1xw5 h ARG 17 N -0.10 0.88 -0.64 2.37 3.08 -0.83 0.40 114.38 119.54 1xw5 h ARG 17 Ca 0.03 -0.05 -0.09 0.00 0.07 0.00 0.00 59.98 59.94 1xw5 h ARG 17 Cb 0.38 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 1xw5 h ARG 17 CO 0.01 0.58 0.05 -0.07 -1.07 0.00 0.00 179.97 179.47 1xw5 h LEU 18 N 0.91 1.06 -0.47 3.04 3.38 -1.34 -2.12 115.31 119.77 1xw5 h LEU 18 Ca 0.27 -0.28 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 1xw5 h LEU 18 Cb -0.05 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.40 1xw5 h LEU 18 CO -0.08 1.08 -0.17 0.25 0.09 0.00 0.00 178.44 179.60 1xw5 h LEU 19 N 1.01 0.96 -1.45 1.67 5.85 -0.61 -0.63 115.31 122.11 1xw5 h LEU 19 Ca 0.19 -0.38 -0.03 0.00 0.84 0.00 0.00 57.88 58.49 1xw5 h LEU 19 Cb 0.51 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1xw5 h LEU 19 CO 0.02 1.13 0.03 -0.07 -0.34 0.00 0.00 178.44 179.21 1xw5 h LEU 20 N 0.79 0.36 -0.02 2.25 3.38 -0.82 -1.41 115.31 119.82 1xw5 h LEU 20 Ca 0.11 -0.05 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 1xw5 h LEU 20 Cb 0.74 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 41.41 1xw5 h LEU 20 CO 0.06 0.39 -0.38 -0.33 0.09 0.00 0.00 178.44 178.27 1xw5 h GLU 21 N 0.38 0.30 -0.83 1.13 4.39 -1.12 0.11 114.58 118.93 1xw5 h GLU 21 Ca 0.09 -0.29 0.02 0.00 0.34 0.00 0.00 59.36 59.52 1xw5 h GLU 21 Cb 0.21 0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 28.89 1xw5 h GLU 21 CO 0.00 0.98 0.55 -0.92 -1.16 0.00 0.00 179.01 178.46 1xw5 h TYR 22 N -0.27 1.02 -0.11 4.33 3.20 -0.93 -1.90 116.97 122.31 1xw5 h TYR 22 Ca -0.04 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1xw5 h TYR 22 Cb 1.09 -0.34 0.00 0.00 1.54 0.00 0.00 36.73 39.02 1xw5 h TYR 22 CO 0.15 0.61 0.00 0.25 -1.64 0.00 0.00 178.16 177.54 1xw5 n THR 23 N -4.43 0.14 -3.94 1.81 -2.24 -0.55 -4.92 114.28 100.15 1xw5 n THR 23 Ca 0.10 -0.24 -0.27 0.00 -2.27 0.00 0.00 64.05 61.37 1xw5 n THR 23 Cb 0.07 0.17 -0.00 0.00 -2.10 0.00 0.00 70.33 68.47 1xw5 n THR 23 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1xw5 n ASP 24 N -0.02 -1.94 -4.79 3.42 2.03 -0.71 -4.93 116.55 109.60 1xw5 n ASP 24 Ca 0.15 -0.92 -0.36 0.00 0.52 0.00 0.00 54.79 54.19 1xw5 n ASP 24 Cb 0.25 -3.38 -0.06 0.00 -0.72 0.00 0.00 41.12 37.21 1xw5 n ASP 24 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1xw5 s SER 25 N -3.96 7.04 -0.37 1.67 0.01 0.34 -5.02 113.70 113.42 1xw5 s SER 25 Ca 0.27 1.85 -0.23 0.00 1.31 0.00 0.00 55.95 59.16 1xw5 s SER 25 Cb -0.14 -2.57 0.01 0.00 0.21 0.00 0.00 66.02 63.53 1xw5 s SER 25 CO 0.87 -0.28 0.76 -0.55 0.41 0.00 0.00 173.24 174.45 1xw5 s SER 26 N -1.77 6.52 0.22 2.44 0.15 -1.26 -4.85 113.70 115.15 1xw5 s SER 26 Ca 0.56 0.29 -0.18 0.00 0.70 0.00 0.00 55.95 57.32 1xw5 s SER 26 Cb -0.17 -2.39 0.02 0.00 -1.71 0.00 0.00 66.02 61.78 1xw5 s SER 26 CO 0.22 -0.73 0.56 -0.72 1.20 0.00 0.00 173.24 173.76 1xw5 s TYR 27 N 3.06 -0.08 0.07 3.44 1.13 -1.26 -2.76 117.35 120.95 1xw5 s TYR 27 Ca 0.30 -0.28 0.01 0.00 -1.41 0.00 0.00 57.07 55.69 1xw5 s TYR 27 Cb -0.13 0.43 -0.03 0.00 -1.10 0.00 0.00 41.96 41.12 1xw5 s TYR 27 CO 0.17 -0.99 -0.06 -1.83 -2.51 0.00 0.00 175.55 170.33 1xw5 s GLU 28 N -3.90 0.68 -0.09 -3.49 -1.05 0.23 -4.76 118.70 106.32 1xw5 s GLU 28 Ca 0.11 -1.09 0.01 0.00 -0.15 0.00 0.00 54.97 53.85 1xw5 s GLU 28 Cb -0.02 -0.17 -0.02 0.00 -0.44 0.00 0.00 34.13 33.48 1xw5 s GLU 28 CO 0.00 -0.01 -0.12 -1.21 0.95 0.00 0.00 175.26 174.88 1xw5 s GLU 29 N -2.97 2.99 -0.48 -4.83 2.02 -1.26 -1.10 118.70 113.07 1xw5 s GLU 29 Ca 0.03 -0.66 -0.12 0.00 0.02 0.00 0.00 54.97 54.24 1xw5 s GLU 29 Cb -0.00 -2.55 0.10 0.00 0.10 0.00 0.00 34.13 31.78 1xw5 s GLU 29 CO -0.03 0.43 0.38 0.21 0.02 0.00 0.00 175.26 176.27 1xw5 s LYS 30 N -0.22 2.75 -0.13 1.61 2.36 -0.59 -4.94 119.74 120.59 1xw5 s LYS 30 Ca 0.01 -1.60 -0.15 0.00 -2.55 0.00 0.00 55.97 51.67 1xw5 s LYS 30 Cb -0.13 -4.04 -0.05 0.00 -1.05 0.00 0.00 37.83 32.56 1xw5 s LYS 30 CO 0.03 -1.15 0.37 0.15 1.55 0.00 0.00 175.35 176.30 1xw5 s LYS 31 N 1.50 4.25 -0.09 4.03 -0.14 -1.26 -2.40 119.74 125.63 1xw5 s LYS 31 Ca 0.04 0.25 -0.01 0.00 -1.36 0.00 0.00 55.97 54.89 1xw5 s LYS 31 Cb -0.26 -3.41 -0.03 0.00 -1.68 0.00 0.00 37.83 32.45 1xw5 s LYS 31 CO 0.02 0.25 -0.04 0.71 -0.76 0.00 0.00 175.35 175.53 1xw5 s TYR 32 N 0.40 3.02 -0.17 3.18 2.02 -0.44 -4.92 117.35 120.44 1xw5 s TYR 32 Ca 0.21 0.00 -0.02 0.00 -0.37 0.00 0.00 57.07 56.89 1xw5 s TYR 32 Cb -0.14 -1.78 -0.02 0.00 -0.40 0.00 0.00 41.96 39.62 1xw5 s TYR 32 CO 0.07 0.30 -0.07 0.99 -1.57 0.00 0.00 175.55 175.26 1xw5 s THR 33 N -0.59 3.40 0.21 -0.71 2.01 -1.26 -0.84 115.64 117.86 1xw5 s THR 33 Ca 0.09 -0.52 -0.20 0.00 0.31 0.00 0.00 61.69 61.37 1xw5 s THR 33 Cb -0.12 -2.49 -0.08 0.00 0.01 0.00 0.00 72.50 69.82 1xw5 s THR 33 CO 0.02 0.48 0.73 -0.32 -0.69 0.00 0.00 174.62 174.84 1xw5 s MET 34 N 0.74 4.29 0.67 4.92 1.75 -1.26 -4.76 119.30 125.64 1xw5 s MET 34 Ca -0.03 0.90 -0.11 0.00 -1.25 0.00 0.00 55.69 55.20 1xw5 s MET 34 Cb -0.15 -2.93 -0.01 0.00 2.84 0.00 0.00 34.83 34.58 1xw5 s MET 34 CO 0.02 0.42 1.06 0.20 -0.65 0.00 0.00 175.02 176.06 1xw5 s GLY 35 N -1.58 1.65 0.84 2.11 0.00 -0.45 -4.90 107.32 104.99 1xw5 s GLY 35 Ca 0.42 -0.14 -0.13 0.00 0.00 0.00 0.00 44.72 44.87 1xw5 s GLY 35 CO 0.21 0.17 1.14 2.09 0.00 0.00 0.00 173.10 176.72 1xw5 n ASP 36 N -2.92 0.19 -4.62 1.64 3.85 -1.26 -3.91 116.55 109.52 1xw5 n ASP 36 Ca 0.07 -1.47 -0.37 0.00 -0.71 0.00 0.00 54.79 52.30 1xw5 n ASP 36 Cb 0.55 -0.86 0.06 0.00 -1.35 0.00 0.00 41.12 39.51 1xw5 n ASP 36 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1xw5 n ALA 37 N -3.68 0.17 0.98 2.12 0.00 -1.26 -1.60 120.51 117.24 1xw5 n ALA 37 Ca -0.18 -0.01 0.11 0.00 0.00 0.00 0.00 53.44 53.35 1xw5 n ALA 37 Cb 0.51 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.85 1xw5 n ALA 37 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1xw5 n PRO 38 N -1.10 0.01 -0.03 0.00 -0.04 -1.26 -4.80 135.00 127.78 1xw5 n PRO 38 Ca 0.14 -0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.45 1xw5 n PRO 38 Cb 0.48 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.35 1xw5 n PRO 38 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1xw5 h ASP 39 N 0.00 0.56 -5.72 3.54 3.32 -1.92 -3.48 116.42 112.73 1xw5 h ASP 39 Ca 0.00 -0.63 -0.33 0.00 0.02 0.00 0.00 57.03 56.09 1xw5 h ASP 39 Cb 0.51 -0.16 0.15 0.00 0.22 0.00 0.00 39.33 40.05 1xw5 h ASP 39 CO 0.00 1.09 -0.81 -1.22 -1.72 0.00 0.00 179.24 176.58 1xw5 n TYR 40 N -4.30 -2.18 -1.68 4.55 0.53 -0.62 -4.85 117.16 108.61 1xw5 n TYR 40 Ca -0.08 0.89 -0.49 0.00 -1.02 0.00 0.00 57.90 57.20 1xw5 n TYR 40 Cb 0.56 -4.70 -0.05 0.00 -1.03 0.00 0.00 39.34 34.12 1xw5 n TYR 40 CO 0.00 0.00 0.00 -3.47 -1.02 0.00 0.00 176.86 172.37 1xw5 n ASP 41 N -3.12 3.37 -0.54 7.72 2.03 -1.26 -4.54 116.55 120.21 1xw5 n ASP 41 Ca -0.24 0.95 0.05 0.00 0.52 0.00 0.00 54.79 56.07 1xw5 n ASP 41 Cb 0.66 -1.36 0.12 0.00 -0.72 0.00 0.00 41.12 39.82 1xw5 n ASP 41 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1xw5 n ARG 42 N 6.67 2.51 -0.33 -0.67 1.74 -1.26 -1.34 116.66 123.98 1xw5 n ARG 42 Ca 0.23 -1.86 0.16 0.00 -0.77 0.00 0.00 57.85 55.62 1xw5 n ARG 42 Cb 0.29 -1.23 0.36 0.00 -1.02 0.00 0.00 32.46 30.85 1xw5 n ARG 42 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1xw5 h SER 43 N 1.82 0.56 -0.92 0.55 4.64 -1.91 -1.02 113.55 117.26 1xw5 h SER 43 Ca 0.00 0.14 0.21 0.00 -0.47 0.00 0.00 61.79 61.67 1xw5 h SER 43 Cb 0.66 0.07 -0.12 0.00 -0.31 0.00 0.00 62.40 62.70 1xw5 h SER 43 CO 0.00 0.07 0.47 -0.61 -0.87 0.00 0.00 176.83 175.89 1xw5 h GLN 44 N 0.52 0.50 0.00 4.77 4.15 -1.86 0.28 115.11 123.47 1xw5 h GLN 44 Ca 0.61 -0.03 -0.06 0.00 0.77 0.00 0.00 58.65 59.95 1xw5 h GLN 44 Cb 1.16 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.73 1xw5 h GLN 44 CO -0.49 0.33 -0.32 2.35 -1.93 0.00 0.00 178.83 178.77 1xw5 h TRP 45 N 0.51 0.00 -0.25 3.99 -0.00 -1.57 -3.37 115.95 115.26 1xw5 h TRP 45 Ca 0.57 0.00 0.07 0.00 -0.00 0.00 0.00 58.89 59.53 1xw5 h TRP 45 Cb 1.03 0.00 -0.01 0.00 -0.00 0.00 0.00 29.16 30.18 1xw5 h TRP 45 CO -0.08 1.10 0.21 -0.07 -0.00 0.00 0.00 178.44 179.60 1xw5 h LEU 46 N -1.00 0.00 -1.44 0.65 3.38 -0.69 0.16 115.31 116.36 1xw5 h LEU 46 Ca -0.09 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.83 1xw5 h LEU 46 Cb 1.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 1xw5 h LEU 46 CO -0.05 0.00 -0.24 0.78 0.09 0.00 0.00 178.44 179.02 1xw5 h ASN 47 N 0.00 0.00 0.00 -0.43 2.35 -0.62 -3.28 115.58 113.60 1xw5 h ASN 47 Ca 0.12 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 1xw5 h ASN 47 Cb 0.54 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.91 1xw5 h ASN 47 CO -0.00 0.24 0.00 -1.84 -1.65 0.00 0.00 177.43 174.18 1xw5 n GLU 48 N -3.67 0.28 -0.23 0.81 0.28 -0.62 -4.85 120.64 112.64 1xw5 n GLU 48 Ca -0.01 -0.63 0.02 0.00 -0.16 0.00 0.00 57.16 56.38 1xw5 n GLU 48 Cb 0.36 -0.84 0.12 0.00 1.43 0.00 0.00 31.44 32.51 1xw5 n GLU 48 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 177.13 176.75 1xw5 h LYS 49 N 0.00 0.09 -0.56 3.44 3.64 -0.80 -1.65 116.57 120.74 1xw5 h LYS 49 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1xw5 h LYS 49 Cb 0.34 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.14 1xw5 h LYS 49 CO 0.00 0.06 0.00 1.19 -2.27 0.00 0.00 179.45 178.43 1xw5 n PHE 50 N -5.33 0.82 -0.58 1.91 3.72 -1.26 -4.18 117.46 112.55 1xw5 n PHE 50 Ca 0.11 -0.38 0.06 0.00 -0.05 0.00 0.00 57.45 57.19 1xw5 n PHE 50 Cb 0.40 -0.06 0.17 0.00 -0.94 0.00 0.00 39.48 39.04 1xw5 n PHE 50 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1xw5 n LYS 51 N 0.97 2.66 0.00 -1.08 5.02 -0.62 -4.59 118.16 120.52 1xw5 n LYS 51 Ca 0.18 -2.33 0.09 0.00 -2.02 0.00 0.00 58.31 54.23 1xw5 n LYS 51 Cb 0.52 -1.47 0.06 0.00 -0.02 0.00 0.00 35.03 34.11 1xw5 n LYS 51 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1xw5 n LEU 52 N -0.33 2.33 -0.07 -0.35 4.77 -1.24 -4.97 117.00 117.15 1xw5 n LEU 52 Ca 0.14 -0.94 -0.01 0.00 -0.03 0.00 0.00 56.01 55.17 1xw5 n LEU 52 Cb 0.60 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.69 1xw5 n LEU 52 CO 0.08 0.41 -0.01 0.61 -1.33 0.00 0.00 177.39 177.16 1xw5 n GLY 53 N 1.10 0.49 3.75 -0.72 0.00 -1.26 -5.02 105.19 103.52 1xw5 n GLY 53 Ca 0.10 -0.51 -0.40 0.00 0.00 0.00 0.00 46.02 45.20 1xw5 n GLY 53 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xw5 s LEU 54 N -0.20 4.59 0.11 0.99 1.43 -1.26 -4.92 118.68 119.43 1xw5 s LEU 54 Ca 0.00 2.11 -0.12 0.00 -1.03 0.00 0.00 54.13 55.08 1xw5 s LEU 54 Cb 0.00 -3.62 -0.12 0.00 0.03 0.00 0.00 46.19 42.48 1xw5 s LEU 54 CO 0.00 -0.01 1.35 0.44 0.23 0.00 0.00 176.35 178.36 1xw5 h ASP 55 N 4.08 0.95 -2.24 2.29 3.32 -1.96 -3.36 116.42 119.51 1xw5 h ASP 55 Ca -0.46 -0.58 -0.59 0.00 0.02 0.00 0.00 57.03 55.43 1xw5 h ASP 55 Cb 1.21 -0.28 -0.41 0.00 0.22 0.00 0.00 39.33 40.07 1xw5 h ASP 55 CO 0.68 1.36 -0.81 0.49 -1.72 0.00 0.00 179.24 179.24 1xw5 n PHE 56 N -3.99 1.72 -1.42 4.55 3.72 -1.26 -5.10 117.46 115.68 1xw5 n PHE 56 Ca -0.06 -3.88 -0.55 0.00 -0.05 0.00 0.00 57.45 52.91 1xw5 n PHE 56 Cb 0.68 -0.41 -0.08 0.00 -0.94 0.00 0.00 39.48 38.72 1xw5 n PHE 56 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 1xw5 n PRO 57 N 1.36 0.00 -3.80 -1.08 -0.02 -1.26 -4.90 135.00 125.30 1xw5 n PRO 57 Ca 0.26 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.69 1xw5 n PRO 57 Cb 0.45 -1.26 -0.01 0.00 -0.02 0.00 0.00 33.50 32.66 1xw5 n PRO 57 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1xw5 s ASN 58 N 1.94 -0.19 -0.07 2.55 3.84 -1.26 -5.10 114.94 116.65 1xw5 s ASN 58 Ca 0.85 -0.53 0.03 0.00 0.21 0.00 0.00 52.86 53.43 1xw5 s ASN 58 Cb -1.21 0.59 0.00 0.00 -0.55 0.00 0.00 41.25 40.09 1xw5 s ASN 58 CO 0.64 -1.11 -0.16 -0.76 -2.79 0.00 0.00 177.10 172.92 1xw5 s LEU 59 N -2.96 1.83 0.72 3.21 1.43 -1.26 -3.94 118.68 117.71 1xw5 s LEU 59 Ca 0.12 -0.37 -0.11 0.00 -1.03 0.00 0.00 54.13 52.74 1xw5 s LEU 59 Cb -0.03 -1.00 0.02 0.00 0.03 0.00 0.00 46.19 45.20 1xw5 s LEU 59 CO 0.05 0.10 1.08 -2.16 0.23 0.00 0.00 176.35 175.65 1xw5 s PRO 60 N 0.38 2.77 0.03 1.29 0.04 -1.26 -4.94 135.00 133.32 1xw5 s PRO 60 Ca -0.12 0.63 0.01 0.00 0.04 0.00 0.00 61.00 61.56 1xw5 s PRO 60 Cb -0.15 -2.00 -0.02 0.00 0.04 0.00 0.00 34.50 32.37 1xw5 s PRO 60 CO 0.04 -1.13 -0.05 1.52 0.04 0.00 0.00 177.00 177.42 1xw5 s TYR 61 N -3.23 0.46 -0.07 0.56 -0.85 -0.68 -3.85 117.35 109.69 1xw5 s TYR 61 Ca 0.58 -0.54 0.02 0.00 -0.52 0.00 0.00 57.07 56.61 1xw5 s TYR 61 Cb -0.12 -0.30 0.02 0.00 0.38 0.00 0.00 41.96 41.93 1xw5 s TYR 61 CO 0.53 -0.15 -0.11 -1.17 -1.52 0.00 0.00 175.55 173.13 1xw5 s LEU 62 N -1.59 1.56 -0.20 -3.49 2.96 -0.11 -1.09 118.68 116.73 1xw5 s LEU 62 Ca -0.12 -0.29 -0.03 0.00 -0.22 0.00 0.00 54.13 53.47 1xw5 s LEU 62 Cb -0.09 -0.81 -0.01 0.00 0.50 0.00 0.00 46.19 45.78 1xw5 s LEU 62 CO -0.01 0.00 -0.06 -0.63 -1.32 0.00 0.00 176.35 174.33 1xw5 s ILE 63 N 0.85 3.30 -0.45 6.68 1.01 0.14 -0.97 121.20 131.75 1xw5 s ILE 63 Ca -0.11 -0.53 0.04 0.00 0.00 0.00 0.00 60.65 60.05 1xw5 s ILE 63 Cb -0.15 -2.48 0.16 0.00 0.01 0.00 0.00 42.46 40.01 1xw5 s ILE 63 CO 0.02 0.45 0.35 -0.62 0.00 0.00 0.00 174.94 175.13 1xw5 s ASP 64 N 1.24 2.29 1.51 3.58 2.15 0.66 -0.81 116.67 127.29 1xw5 s ASP 64 Ca 0.03 -3.08 0.00 0.00 0.43 0.00 0.00 52.55 49.93 1xw5 s ASP 64 Cb -0.14 -0.67 0.00 0.00 -0.30 0.00 0.00 42.92 41.81 1xw5 s ASP 64 CO -0.02 -0.18 0.00 0.61 -0.17 0.00 0.00 175.17 175.41 1xw5 n GLY 65 N 2.87 2.41 0.03 2.66 0.00 -1.26 -2.07 105.19 109.83 1xw5 n GLY 65 Ca 0.25 -0.32 0.11 0.00 0.00 0.00 0.00 46.02 46.06 1xw5 n GLY 65 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xw5 n THR 66 N 0.00 0.54 -2.94 2.61 -2.24 -1.26 -4.68 114.28 106.31 1xw5 n THR 66 Ca 0.00 0.07 -0.43 0.00 -2.27 0.00 0.00 64.05 61.42 1xw5 n THR 66 Cb 0.00 -0.77 -0.05 0.00 -2.10 0.00 0.00 70.33 67.41 1xw5 n THR 66 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1xw5 s HIS 67 N -3.06 2.97 -0.23 4.78 3.76 -0.88 -5.02 115.29 117.61 1xw5 s HIS 67 Ca 0.10 0.17 -0.01 0.00 -0.15 0.00 0.00 55.06 55.17 1xw5 s HIS 67 Cb 0.13 -3.73 0.02 0.00 1.11 0.00 0.00 32.58 30.12 1xw5 s HIS 67 CO 0.43 -1.02 -0.09 0.15 -0.85 0.00 0.00 174.74 173.36 1xw5 s LYS 68 N 3.38 2.86 0.02 1.40 1.02 -1.26 -0.24 119.74 126.92 1xw5 s LYS 68 Ca 0.31 -0.95 0.07 0.00 0.02 0.00 0.00 55.97 55.42 1xw5 s LYS 68 Cb -0.12 -2.91 -0.02 0.00 -0.52 0.00 0.00 37.83 34.26 1xw5 s LYS 68 CO 0.23 -0.36 -0.22 0.42 -0.92 0.00 0.00 175.35 174.50 1xw5 s ILE 69 N 1.31 1.76 0.34 2.17 1.01 -0.14 -4.79 121.20 122.86 1xw5 s ILE 69 Ca 0.01 -1.11 0.04 0.00 0.00 0.00 0.00 60.65 59.59 1xw5 s ILE 69 Cb -0.16 -1.49 -0.06 0.00 0.01 0.00 0.00 42.46 40.76 1xw5 s ILE 69 CO -0.06 0.35 0.07 0.42 0.00 0.00 0.00 174.94 175.72 1xw5 s THR 70 N -0.67 1.10 -0.00 2.92 -4.23 -1.26 -0.93 115.64 112.56 1xw5 s THR 70 Ca 0.08 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.59 1xw5 s THR 70 Cb -0.09 -2.72 0.00 0.00 1.34 0.00 0.00 72.50 71.03 1xw5 s THR 70 CO 0.01 0.00 0.00 0.00 -0.54 0.00 0.00 174.62 174.09 1xw5 n GLN 71 N -0.73 -0.08 -0.32 3.99 1.13 -1.25 -4.45 117.38 115.67 1xw5 n GLN 71 Ca -0.03 0.55 0.19 0.00 -1.94 0.00 0.00 57.00 55.77 1xw5 n GLN 71 Cb 0.66 -0.89 0.37 0.00 0.11 0.00 0.00 30.24 30.49 1xw5 n GLN 71 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1xw5 h SER 72 N 0.07 -0.06 -0.57 1.08 4.64 -1.91 0.15 113.55 116.95 1xw5 h SER 72 Ca -0.01 0.24 -0.02 0.00 -0.47 0.00 0.00 61.79 61.53 1xw5 h SER 72 Cb 0.01 0.34 -0.03 0.00 -0.31 0.00 0.00 62.40 62.41 1xw5 h SER 72 CO 0.00 -0.29 0.27 0.78 -0.87 0.00 0.00 176.83 176.72 1xw5 h ASN 73 N 0.10 0.76 -0.48 4.97 2.35 -1.95 -1.40 115.58 119.93 1xw5 h ASN 73 Ca 0.65 -0.14 -0.06 0.00 -0.55 0.00 0.00 56.30 56.20 1xw5 h ASN 73 Cb 1.45 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 39.60 1xw5 h ASN 73 CO -0.77 0.68 0.11 0.00 -1.65 0.00 0.00 177.43 175.80 1xw5 h ALA 74 N 1.10 1.18 -0.40 -0.83 0.00 -0.99 -1.53 119.26 117.79 1xw5 h ALA 74 Ca 0.20 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 1xw5 h ALA 74 Cb 0.13 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1xw5 h ALA 74 CO -0.02 0.55 -0.07 0.82 0.00 0.00 0.00 179.25 180.53 1xw5 h ILE 75 N 0.80 1.27 -0.36 0.00 2.04 -1.07 -0.93 117.51 119.26 1xw5 h ILE 75 Ca 0.17 -1.14 -0.03 0.00 1.00 0.00 0.00 64.86 64.86 1xw5 h ILE 75 Cb 0.33 1.19 -0.02 0.00 -0.74 0.00 0.00 36.82 37.58 1xw5 h ILE 75 CO 0.00 0.38 0.10 -0.07 0.00 0.00 0.00 178.15 178.57 1xw5 h LEU 76 N 0.58 0.54 -0.79 1.44 3.38 -1.07 -2.14 115.31 117.23 1xw5 h LEU 76 Ca 0.11 -0.21 -0.07 0.00 0.09 0.00 0.00 57.88 57.79 1xw5 h LEU 76 Cb 0.58 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.17 1xw5 h LEU 76 CO 0.03 0.61 0.09 0.03 0.09 0.00 0.00 178.44 179.29 1xw5 h ARG 77 N 0.44 1.00 0.40 1.13 3.08 -1.23 -1.04 114.38 118.15 1xw5 h ARG 77 Ca 0.12 -0.26 -0.02 0.00 0.07 0.00 0.00 59.98 59.89 1xw5 h ARG 77 Cb 0.27 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.20 1xw5 h ARG 77 CO -0.00 0.93 -0.22 -0.92 -1.07 0.00 0.00 179.97 178.68 1xw5 h TYR 78 N 0.94 -0.58 -0.30 3.04 3.20 -0.99 -1.42 116.97 120.86 1xw5 h TYR 78 Ca 0.19 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.05 1xw5 h TYR 78 Cb 0.43 0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.88 1xw5 h TYR 78 CO 0.03 -0.35 0.19 0.82 -1.64 0.00 0.00 178.16 177.21 1xw5 h ILE 79 N -0.58 1.06 -0.84 1.81 2.04 -1.35 -3.06 117.51 116.59 1xw5 h ILE 79 Ca -0.05 -0.13 0.04 0.00 1.00 0.00 0.00 64.86 65.72 1xw5 h ILE 79 Cb 0.47 0.64 -0.05 0.00 -0.74 0.00 0.00 36.82 37.13 1xw5 h ILE 79 CO 0.06 0.07 0.53 0.00 0.00 0.00 0.00 178.15 178.82 1xw5 h ALA 80 N 1.12 1.12 0.00 1.87 0.00 -1.12 -2.35 119.26 119.89 1xw5 h ALA 80 Ca 0.11 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1xw5 h ALA 80 Cb -0.03 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.48 1xw5 h ALA 80 CO -0.03 0.34 -0.11 0.00 0.00 0.00 0.00 179.25 179.45 1xw5 h ARG 81 N 1.02 0.00 0.00 0.00 3.08 -1.15 0.21 114.38 117.54 1xw5 h ARG 81 Ca 0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.39 1xw5 h ARG 81 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.10 1xw5 h ARG 81 CO -0.13 0.11 0.00 -0.22 -1.07 0.00 0.00 179.97 178.66 1xw5 h LYS 82 N 0.00 0.00 0.00 0.04 3.64 -1.38 -3.27 116.57 115.60 1xw5 h LYS 82 Ca -0.00 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1xw5 h LYS 82 Cb 0.23 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 1xw5 h LYS 82 CO 0.01 0.00 -0.18 0.72 -2.27 0.00 0.00 179.45 177.74 1xw5 n HIS 83 N -2.76 0.00 -3.82 1.91 8.25 -0.60 -5.00 115.22 113.21 1xw5 n HIS 83 Ca 0.02 -0.77 -0.27 0.00 -0.26 0.00 0.00 57.72 56.44 1xw5 n HIS 83 Cb 0.34 -0.13 0.03 0.00 1.12 0.00 0.00 29.99 31.36 1xw5 n HIS 83 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1xw5 n ASN 84 N -1.02 -3.97 -2.25 0.41 4.05 -0.85 -4.92 115.26 106.71 1xw5 n ASN 84 Ca 0.12 -0.76 -0.30 0.00 0.45 0.00 0.00 54.58 54.08 1xw5 n ASN 84 Cb 0.67 -4.07 0.05 0.00 1.23 0.00 0.00 39.78 37.65 1xw5 n ASN 84 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 1xw5 n LEU 85 N -4.61 6.44 -4.26 1.20 4.77 -0.04 -4.99 117.00 115.51 1xw5 n LEU 85 Ca -0.06 -4.55 -0.14 0.00 -0.03 0.00 0.00 56.01 51.23 1xw5 n LEU 85 Cb 0.57 -0.70 -0.10 0.00 -2.33 0.00 0.00 43.42 40.86 1xw5 n LEU 85 CO 0.72 1.78 -0.37 0.00 -1.33 0.00 0.00 177.39 178.20 1xw5 s GLY 87 N -3.19 2.90 -0.17 0.00 0.00 -1.26 -4.98 107.32 100.63 1xw5 s GLY 87 Ca 0.21 1.25 -0.12 0.00 0.00 0.00 0.00 44.72 46.06 1xw5 s GLY 87 CO 0.03 1.81 -0.27 1.18 0.00 0.00 0.00 173.10 175.85 1xw5 n GLU 88 N -0.19 0.42 -1.29 2.90 1.02 -1.26 -4.67 120.64 117.57 1xw5 n GLU 88 Ca 0.05 0.18 -0.30 0.00 -0.02 0.00 0.00 57.16 57.08 1xw5 n GLU 88 Cb 0.44 -1.22 0.13 0.00 -0.02 0.00 0.00 31.44 30.77 1xw5 n GLU 88 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1xw5 s SER 89 N -6.46 3.60 0.18 1.62 1.04 -1.26 -4.80 113.70 107.61 1xw5 s SER 89 Ca -0.26 1.39 -0.13 0.00 0.48 0.00 0.00 55.95 57.42 1xw5 s SER 89 Cb 0.08 -2.07 0.09 0.00 0.10 0.00 0.00 66.02 64.22 1xw5 s SER 89 CO 0.35 -2.55 1.83 -0.08 0.98 0.00 0.00 173.24 173.77 1xw5 h GLU 90 N -1.49 0.69 -0.71 4.02 4.57 -1.99 0.08 114.58 119.75 1xw5 h GLU 90 Ca -0.50 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 57.62 1xw5 h GLU 90 Cb 1.29 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 29.69 1xw5 h GLU 90 CO 0.56 0.45 0.34 0.87 -1.18 0.00 0.00 179.01 180.05 1xw5 h LYS 91 N 0.71 1.02 -0.66 1.92 1.57 -2.00 -1.32 116.57 117.81 1xw5 h LYS 91 Ca 0.21 -0.15 -0.07 0.00 -1.87 0.00 0.00 60.65 58.77 1xw5 h LYS 91 Cb -0.04 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.06 1xw5 h LYS 91 CO -0.07 0.81 0.12 0.93 -0.57 0.00 0.00 179.45 180.67 1xw5 h GLU 92 N 0.99 1.07 -0.63 3.15 5.08 -1.79 -1.75 114.58 120.70 1xw5 h GLU 92 Ca 0.24 -0.27 -0.08 0.00 -1.00 0.00 0.00 59.36 58.25 1xw5 h GLU 92 Cb 0.12 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 1xw5 h GLU 92 CO -0.03 0.97 0.08 1.96 -1.00 0.00 0.00 179.01 180.99 1xw5 h GLN 93 N 1.01 1.06 -0.04 2.33 4.20 -0.73 -1.43 115.11 121.50 1xw5 h GLN 93 Ca 0.20 -0.30 -0.00 0.00 0.06 0.00 0.00 58.65 58.62 1xw5 h GLN 93 Cb 0.41 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 28.07 1xw5 h GLN 93 CO 0.01 0.99 0.02 0.82 -0.67 0.00 0.00 178.83 180.00 1xw5 h ILE 94 N 0.97 1.06 -0.75 2.54 2.04 -0.98 0.30 117.51 122.69 1xw5 h ILE 94 Ca 0.19 -0.17 0.04 0.00 1.00 0.00 0.00 64.86 65.91 1xw5 h ILE 94 Cb 0.46 1.11 -0.05 0.00 -0.74 0.00 0.00 36.82 37.60 1xw5 h ILE 94 CO 0.02 0.05 0.47 0.03 0.00 0.00 0.00 178.15 178.71 1xw5 h ARG 95 N -0.01 0.87 -0.04 2.37 3.08 -1.25 -0.86 114.38 118.55 1xw5 h ARG 95 Ca 0.01 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 60.02 1xw5 h ARG 95 Cb 0.06 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 29.90 1xw5 h ARG 95 CO -0.00 0.57 -0.03 1.49 -1.07 0.00 0.00 179.97 180.93 1xw5 h GLU 96 N 0.89 -0.03 -0.45 0.04 4.81 -0.91 -1.42 114.58 117.51 1xw5 h GLU 96 Ca 0.31 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.50 1xw5 h GLU 96 Cb 0.06 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 1xw5 h GLU 96 CO -0.13 -0.02 0.10 -0.44 -0.73 0.00 0.00 179.01 177.79 1xw5 h ASP 97 N -0.04 0.69 0.31 1.04 3.32 -0.66 -1.20 116.42 119.89 1xw5 h ASP 97 Ca 0.03 -0.24 -0.02 0.00 0.02 0.00 0.00 57.03 56.82 1xw5 h ASP 97 Cb 0.07 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.45 1xw5 h ASP 97 CO -0.06 0.75 -0.15 0.40 -1.72 0.00 0.00 179.24 178.46 1xw5 h ILE 98 N 0.60 0.70 -0.81 0.35 2.04 -1.07 -3.03 117.51 116.29 1xw5 h ILE 98 Ca 0.14 -0.10 -0.03 0.00 1.00 0.00 0.00 64.86 65.87 1xw5 h ILE 98 Cb 0.33 0.76 -0.04 0.00 -0.74 0.00 0.00 36.82 37.13 1xw5 h ILE 98 CO 0.00 0.02 0.39 -0.07 0.00 0.00 0.00 178.15 178.49 1xw5 h LEU 99 N -0.47 1.06 -0.44 1.44 3.38 -1.24 0.85 115.31 119.89 1xw5 h LEU 99 Ca -0.04 -0.12 0.06 0.00 0.09 0.00 0.00 57.88 57.86 1xw5 h LEU 99 Cb 0.36 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.78 1xw5 h LEU 99 CO 0.07 0.89 0.12 -0.08 0.09 0.00 0.00 178.44 179.54 1xw5 h GLU 100 N 1.16 0.27 0.03 1.13 4.81 -1.22 0.85 114.58 121.61 1xw5 h GLU 100 Ca 0.28 -0.02 -0.24 0.00 -0.13 0.00 0.00 59.36 59.25 1xw5 h GLU 100 Cb 0.11 -0.06 0.01 0.00 0.63 0.00 0.00 28.75 29.44 1xw5 h GLU 100 CO -0.04 0.18 -1.02 -0.91 -0.73 0.00 0.00 179.01 176.49 1xw5 h ASN 101 N 0.28 0.56 0.05 1.04 2.35 -1.38 -2.87 115.58 115.60 1xw5 h ASN 101 Ca 0.21 -0.48 -0.00 0.00 -0.55 0.00 0.00 56.30 55.48 1xw5 h ASN 101 Cb 0.23 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.43 1xw5 h ASN 101 CO -0.24 1.29 -0.02 -0.61 -1.65 0.00 0.00 177.43 176.20 1xw5 h GLN 102 N 0.21 -0.06 -0.70 0.81 5.75 -0.54 -2.17 115.11 118.41 1xw5 h GLN 102 Ca -0.10 0.00 0.04 0.00 -0.15 0.00 0.00 58.65 58.45 1xw5 h GLN 102 Cb 1.68 0.01 -0.04 0.00 1.07 0.00 0.00 27.48 30.20 1xw5 h GLN 102 CO 0.18 0.16 0.46 0.74 -2.65 0.00 0.00 178.83 177.72 1xw5 h PHE 103 N -0.27 0.79 -0.80 3.99 0.04 -0.93 -1.08 116.94 118.67 1xw5 h PHE 103 Ca -0.01 0.02 -0.04 0.00 2.80 0.00 0.00 57.97 60.74 1xw5 h PHE 103 Cb 0.25 -0.26 -0.04 0.00 2.20 0.00 0.00 35.95 38.10 1xw5 h PHE 103 CO -0.00 0.45 0.33 1.98 -0.60 0.00 0.00 178.31 180.47 1xw5 h MET 104 N 0.81 1.18 -0.30 1.51 4.05 -1.28 0.11 114.93 121.01 1xw5 h MET 104 Ca 0.29 -0.20 -0.04 0.00 -0.28 0.00 0.00 59.70 59.46 1xw5 h MET 104 Cb 0.12 -0.20 -0.01 0.00 -0.80 0.00 0.00 31.60 30.71 1xw5 h MET 104 CO -0.09 0.94 0.04 -0.44 0.23 0.00 0.00 176.91 177.60 1xw5 h ASP 105 N 1.16 0.50 -0.82 1.39 3.32 -0.64 -1.17 116.42 120.16 1xw5 h ASP 105 Ca 0.27 -0.27 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 1xw5 h ASP 105 Cb 0.19 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.57 1xw5 h ASP 105 CO -0.02 0.65 0.50 0.28 -1.72 0.00 0.00 179.24 178.92 1xw5 h SER 106 N 0.33 0.98 -0.63 6.45 0.02 -0.91 -1.03 113.55 118.76 1xw5 h SER 106 Ca 0.09 -0.06 0.02 0.00 -0.84 0.00 0.00 61.79 61.00 1xw5 h SER 106 Cb 0.37 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.63 1xw5 h SER 106 CO 0.01 0.75 0.40 -0.09 -1.14 0.00 0.00 176.83 176.76 1xw5 h ARG 107 N 1.12 0.79 -0.26 3.45 2.43 -0.57 -2.26 114.38 119.09 1xw5 h ARG 107 Ca 0.29 -0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 59.32 1xw5 h ARG 107 Cb -0.06 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.30 1xw5 h ARG 107 CO -0.06 0.52 -0.24 0.52 -1.51 0.00 0.00 179.97 179.20 1xw5 h MET 108 N 0.81 0.49 -0.22 0.20 2.86 -0.87 -1.18 114.93 117.02 1xw5 h MET 108 Ca 0.24 -0.18 -0.02 0.00 -2.06 0.00 0.00 59.70 57.68 1xw5 h MET 108 Cb -0.05 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.57 1xw5 h MET 108 CO -0.07 0.70 0.07 1.96 1.06 0.00 0.00 176.91 180.63 1xw5 h GLN 109 N 0.43 0.34 -0.37 1.72 4.20 -0.81 0.12 115.11 120.73 1xw5 h GLN 109 Ca 0.06 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.67 1xw5 h GLN 109 Cb 0.66 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.37 1xw5 h GLN 109 CO 0.05 0.42 0.11 1.25 -0.67 0.00 0.00 178.83 179.99 1xw5 h LEU 110 N 0.19 0.55 -0.32 1.46 5.85 -1.30 -2.85 115.31 118.88 1xw5 h LEU 110 Ca 0.07 -0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.58 1xw5 h LEU 110 Cb 0.22 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 1xw5 h LEU 110 CO -0.00 0.62 0.19 0.00 -0.34 0.00 0.00 178.44 178.90 1xw5 h ALA 111 N 0.95 0.41 -0.70 1.25 0.00 -1.13 -0.48 119.26 119.57 1xw5 h ALA 111 Ca 0.12 -0.06 0.09 0.00 0.00 0.00 0.00 54.91 55.06 1xw5 h ALA 111 Cb 0.27 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 17.86 1xw5 h ALA 111 CO -0.00 -0.08 0.34 -0.22 0.00 0.00 0.00 179.25 179.29 1xw5 h LYS 112 N 0.41 0.56 -0.15 0.00 3.64 -0.76 -0.89 116.57 119.38 1xw5 h LYS 112 Ca 0.12 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.43 1xw5 h LYS 112 Cb 0.03 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 31.72 1xw5 h LYS 112 CO -0.02 0.37 -0.04 1.25 -2.27 0.00 0.00 179.45 178.75 1xw5 h LEU 113 N 0.58 0.30 -1.83 5.20 5.85 -1.29 -2.62 115.31 121.50 1xw5 h LEU 113 Ca 0.35 -0.36 0.00 0.00 0.84 0.00 0.00 57.88 58.70 1xw5 h LEU 113 Cb 0.37 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.32 1xw5 h LEU 113 CO -0.27 0.59 0.00 0.00 -0.34 0.00 0.00 178.44 178.42 1xw5 n TYR 115 N -2.88 0.00 -2.72 0.00 4.02 -0.38 -0.35 117.16 114.84 1xw5 n TYR 115 Ca -0.01 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.47 1xw5 n TYR 115 Cb 0.19 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.48 1xw5 n TYR 115 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1xw5 s ASP 116 N -1.93 7.34 0.57 7.72 2.15 -0.91 -4.67 116.67 126.92 1xw5 s ASP 116 Ca 0.19 1.62 0.26 0.00 0.43 0.00 0.00 52.55 55.05 1xw5 s ASP 116 Cb 0.16 -2.56 1.66 0.00 -0.30 0.00 0.00 42.92 41.88 1xw5 s ASP 116 CO 0.38 -0.28 2.21 -0.65 -0.17 0.00 0.00 175.17 176.66 1xw5 h PRO 117 N 6.84 0.00 -0.65 4.34 0.11 -1.92 -0.38 132.00 140.33 1xw5 h PRO 117 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1xw5 h PRO 117 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1xw5 h PRO 117 CO 0.76 0.02 0.00 -0.25 -0.21 0.00 0.00 178.00 178.32 1xw5 n ASP 118 N -3.97 2.69 -0.22 -2.05 8.00 -1.26 -4.66 116.55 115.08 1xw5 n ASP 118 Ca -0.03 -2.28 0.10 0.00 0.71 0.00 0.00 54.79 53.29 1xw5 n ASP 118 Cb 0.10 -0.47 0.19 0.00 -0.02 0.00 0.00 41.12 40.93 1xw5 n ASP 118 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1xw5 n PHE 119 N 0.35 0.42 -0.10 1.24 7.35 -0.16 -0.83 117.46 125.74 1xw5 n PHE 119 Ca 0.12 0.77 -0.09 0.00 -0.76 0.00 0.00 57.45 57.49 1xw5 n PHE 119 Cb 0.55 -0.99 -0.02 0.00 0.35 0.00 0.00 39.48 39.37 1xw5 n PHE 119 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 1xw5 h GLU 120 N 0.00 0.43 -0.38 -4.13 4.39 -1.86 -1.35 114.58 111.67 1xw5 h GLU 120 Ca 0.39 -0.04 -0.08 0.00 0.34 0.00 0.00 59.36 59.97 1xw5 h GLU 120 Cb 0.82 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.37 1xw5 h GLU 120 CO -0.60 0.35 -0.09 0.87 -1.16 0.00 0.00 179.01 178.39 1xw5 h LYS 121 N 0.40 0.73 0.00 2.33 1.79 -1.37 -3.23 116.57 117.22 1xw5 h LYS 121 Ca 0.11 -0.28 0.00 0.00 -2.18 0.00 0.00 60.65 58.30 1xw5 h LYS 121 Cb 0.04 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 30.64 1xw5 h LYS 121 CO -0.02 0.87 0.00 -0.07 -1.08 0.00 0.00 179.45 179.15 1xw5 h LEU 122 N 0.54 0.00 -0.25 2.94 4.07 -1.46 -3.36 115.31 117.79 1xw5 h LEU 122 Ca 0.10 0.00 0.01 0.00 0.08 0.00 0.00 57.88 58.06 1xw5 h LEU 122 Cb 0.60 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.33 1xw5 h LEU 122 CO 0.04 0.00 0.15 0.50 -1.08 0.00 0.00 178.44 178.05 1xw5 h LYS 123 N 0.00 0.30 -0.86 1.13 3.64 -1.26 -2.65 116.57 116.88 1xw5 h LYS 123 Ca 0.00 -0.02 0.13 0.00 -1.27 0.00 0.00 60.65 59.49 1xw5 h LYS 123 Cb 0.80 -0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 32.49 1xw5 h LYS 123 CO 0.00 0.20 0.56 -1.35 -2.27 0.00 0.00 179.45 176.59 1xw5 h PRO 124 N 0.31 0.69 -0.10 1.90 0.11 -1.75 -1.20 132.00 131.96 1xw5 h PRO 124 Ca 0.09 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 66.04 1xw5 h PRO 124 Cb -0.02 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 30.92 1xw5 h PRO 124 CO -0.03 0.46 -0.48 0.93 -0.21 0.00 0.00 178.00 178.66 1xw5 h GLU 125 N 0.71 0.27 -0.06 1.05 5.08 -1.73 -2.00 114.58 117.91 1xw5 h GLU 125 Ca 0.42 -0.15 -0.03 0.00 -1.00 0.00 0.00 59.36 58.61 1xw5 h GLU 125 Cb 0.62 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.87 1xw5 h GLU 125 CO -0.18 0.69 -0.07 -0.92 -1.00 0.00 0.00 179.01 177.54 1xw5 h TYR 126 N 0.21 0.17 0.00 4.33 3.20 -0.92 -2.66 116.97 121.31 1xw5 h TYR 126 Ca 0.01 -0.05 -0.03 0.00 3.14 0.00 0.00 58.73 61.80 1xw5 h TYR 126 Cb 0.93 -0.04 -0.00 0.00 1.54 0.00 0.00 36.73 39.16 1xw5 h TYR 126 CO 0.02 0.61 -0.12 -0.07 -1.64 0.00 0.00 178.16 176.96 1xw5 h LEU 127 N -0.32 0.00 0.08 2.82 3.38 -1.27 -0.39 115.31 119.61 1xw5 h LEU 127 Ca 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xw5 h LEU 127 Cb 0.59 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1xw5 h LEU 127 CO 0.02 0.12 -0.04 -0.61 0.09 0.00 0.00 178.44 178.02 1xw5 h GLN 128 N 0.00 -0.10 0.00 1.13 -0.00 -1.23 -3.19 115.11 111.72 1xw5 h GLN 128 Ca -0.00 0.01 0.00 0.00 -0.00 0.00 0.00 58.65 58.66 1xw5 h GLN 128 Cb 0.37 0.02 0.00 0.00 0.00 0.00 0.00 27.48 27.87 1xw5 h GLN 128 CO 0.02 0.18 -0.08 0.00 0.00 0.00 0.00 178.83 178.95 1xw5 n ALA 129 N -2.29 2.40 -0.19 3.38 0.00 -1.00 -4.20 120.51 118.62 1xw5 n ALA 129 Ca -0.08 -0.08 -0.04 0.00 0.00 0.00 0.00 53.44 53.24 1xw5 n ALA 129 Cb 0.18 -1.43 0.06 0.00 0.00 0.00 0.00 19.45 18.27 1xw5 n ALA 129 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1xw5 h LEU 130 N 0.00 0.45 -1.75 0.00 5.85 -1.06 -2.58 115.31 116.22 1xw5 h LEU 130 Ca 0.00 0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.75 1xw5 h LEU 130 Cb 0.67 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 1xw5 h LEU 130 CO 0.00 0.30 0.18 -0.65 -0.34 0.00 0.00 178.44 177.94 1xw5 h PRO 131 N 0.58 0.33 -0.26 5.25 0.11 -1.74 -0.93 132.00 135.33 1xw5 h PRO 131 Ca 0.25 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.31 1xw5 h PRO 131 Cb 0.13 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.15 1xw5 h PRO 131 CO -0.15 0.22 0.07 1.49 -0.21 0.00 0.00 178.00 179.41 1xw5 h GLU 132 N 0.34 0.41 -0.30 1.05 4.81 -1.73 -1.14 114.58 118.02 1xw5 h GLU 132 Ca 0.10 -0.09 -0.05 0.00 -0.13 0.00 0.00 59.36 59.19 1xw5 h GLU 132 Cb 0.01 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 1xw5 h GLU 132 CO -0.02 0.49 -0.01 1.98 -0.73 0.00 0.00 179.01 180.72 1xw5 h MET 133 N 0.25 0.53 -0.72 1.92 4.05 -1.30 -3.08 114.93 116.59 1xw5 h MET 133 Ca 0.08 -0.18 -0.02 0.00 -0.28 0.00 0.00 59.70 59.30 1xw5 h MET 133 Cb 0.26 -0.05 -0.03 0.00 -0.80 0.00 0.00 31.60 30.98 1xw5 h MET 133 CO -0.00 0.69 0.35 -0.07 0.23 0.00 0.00 176.91 178.11 1xw5 h LEU 134 N 0.32 0.92 -0.77 3.39 4.07 -1.16 -2.65 115.31 119.44 1xw5 h LEU 134 Ca 0.08 -0.10 0.04 0.00 0.08 0.00 0.00 57.88 57.98 1xw5 h LEU 134 Cb 0.45 -0.24 -0.05 0.00 1.08 0.00 0.00 40.66 41.91 1xw5 h LEU 134 CO 0.02 0.78 0.49 0.50 -1.08 0.00 0.00 178.44 179.14 1xw5 h LYS 135 N 1.02 0.91 -0.75 1.13 3.64 -1.12 -0.12 116.57 121.28 1xw5 h LYS 135 Ca 0.25 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.53 1xw5 h LYS 135 Cb 0.09 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 31.67 1xw5 h LYS 135 CO -0.03 0.60 0.28 -0.07 -2.27 0.00 0.00 179.45 177.96 1xw5 h LEU 136 N 0.94 1.05 -0.52 5.20 3.38 -1.40 0.70 115.31 124.66 1xw5 h LEU 136 Ca 0.31 -0.17 -0.14 0.00 0.09 0.00 0.00 57.88 57.98 1xw5 h LEU 136 Cb 0.04 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1xw5 h LEU 136 CO -0.12 0.94 -0.29 1.88 0.09 0.00 0.00 178.44 180.94 1xw5 h TYR 137 N 1.10 1.04 -0.31 1.13 0.05 -1.26 -1.93 116.97 116.79 1xw5 h TYR 137 Ca 0.25 -0.27 -0.02 0.00 0.05 0.00 0.00 58.73 58.74 1xw5 h TYR 137 Cb 0.24 -0.23 -0.01 0.00 1.01 0.00 0.00 36.73 37.73 1xw5 h TYR 137 CO 0.02 1.07 0.14 1.03 -1.05 0.00 0.00 178.16 179.36 1xw5 h SER 138 N 0.76 0.42 -0.60 3.88 0.87 -0.57 -1.45 113.55 116.86 1xw5 h SER 138 Ca 0.09 -0.15 -0.03 0.00 -1.23 0.00 0.00 61.79 60.47 1xw5 h SER 138 Cb 0.85 -0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 62.67 1xw5 h SER 138 CO 0.07 0.45 0.27 1.56 -0.53 0.00 0.00 176.83 178.66 1xw5 h GLN 139 N 0.36 0.88 -0.25 2.24 4.20 -0.83 -1.84 115.11 119.87 1xw5 h GLN 139 Ca 0.11 -0.14 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 1xw5 h GLN 139 Cb 0.15 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 1xw5 h GLN 139 CO -0.01 0.72 0.09 0.35 -0.67 0.00 0.00 178.83 179.31 1xw5 h PHE 140 N 0.82 0.39 -0.58 2.96 3.57 -1.19 -3.17 116.94 119.75 1xw5 h PHE 140 Ca 0.20 -0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.66 1xw5 h PHE 140 Cb 0.15 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 38.75 1xw5 h PHE 140 CO 0.00 0.42 0.32 1.25 -2.23 0.00 0.00 178.31 178.08 1xw5 h LEU 141 N 0.24 0.72 0.00 0.59 5.85 -1.14 -3.48 115.31 118.09 1xw5 h LEU 141 Ca 0.08 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1xw5 h LEU 141 Cb 0.21 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.06 1xw5 h LEU 141 CO -0.00 0.60 0.00 0.61 -0.34 0.00 0.00 178.44 179.30 1xw5 n GLY 142 N -1.06 3.13 1.14 3.75 0.00 -0.70 -2.46 105.19 108.99 1xw5 n GLY 142 Ca 0.04 -0.27 0.09 0.00 0.00 0.00 0.00 46.02 45.88 1xw5 n GLY 142 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xw5 n LYS 143 N 14.00 2.52 -2.55 1.61 5.02 -1.26 -4.92 118.16 132.58 1xw5 n LYS 143 Ca 0.00 -2.17 -0.36 0.00 -2.02 0.00 0.00 58.31 53.77 1xw5 n LYS 143 Cb 0.00 -1.52 -0.04 0.00 -0.02 0.00 0.00 35.03 33.46 1xw5 n LYS 143 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1xw5 s GLN 144 N -1.31 4.06 0.30 1.97 -0.21 -1.03 -4.95 119.66 118.50 1xw5 s GLN 144 Ca 0.40 1.46 0.15 0.00 0.02 0.00 0.00 55.36 57.39 1xw5 s GLN 144 Cb 0.22 -2.40 0.35 0.00 1.00 0.00 0.00 33.01 32.18 1xw5 s GLN 144 CO 0.26 -0.22 1.58 -1.00 -2.12 0.00 0.00 175.29 173.79 1xw5 h PRO 145 N 2.21 0.00 -5.20 2.91 0.13 -1.89 -3.46 132.00 126.71 1xw5 h PRO 145 Ca -0.49 0.00 -0.39 0.00 -0.87 0.00 0.00 66.00 64.25 1xw5 h PRO 145 Cb 1.22 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.20 1xw5 h PRO 145 CO 0.61 0.52 -0.68 -1.58 -0.23 0.00 0.00 178.00 176.64 1xw5 s TRP 146 N -3.30 1.57 0.35 1.56 0.52 -0.98 -4.90 118.94 113.75 1xw5 s TRP 146 Ca 0.01 -0.81 0.39 0.00 0.02 0.00 0.00 56.10 55.70 1xw5 s TRP 146 Cb 0.10 -0.87 1.85 0.00 -1.15 0.00 0.00 33.47 33.40 1xw5 s TRP 146 CO 0.73 0.08 2.16 0.74 0.02 0.00 0.00 176.95 180.68 1xw5 h PHE 147 N 2.52 0.00 -0.01 -1.98 0.04 -1.89 -2.68 116.94 112.94 1xw5 h PHE 147 Ca -0.38 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.39 1xw5 h PHE 147 Cb 1.22 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.37 1xw5 h PHE 147 CO 0.63 0.00 -0.56 1.28 -0.60 0.00 0.00 178.31 179.05 1xw5 n LEU 148 N -3.06 1.25 0.00 1.54 4.77 -1.26 -4.93 117.00 115.30 1xw5 n LEU 148 Ca -0.01 -0.63 0.00 0.00 -0.03 0.00 0.00 56.01 55.34 1xw5 n LEU 148 Cb 0.19 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1xw5 n LEU 148 CO 0.24 0.26 0.00 0.61 -1.33 0.00 0.00 177.39 177.17 1xw5 n GLY 149 N 1.29 0.53 0.22 -0.72 0.00 -1.01 -4.85 105.19 100.64 1xw5 n GLY 149 Ca 0.05 -1.01 0.13 0.00 0.00 0.00 0.00 46.02 45.19 1xw5 n GLY 149 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1xw5 h ASP 150 N 0.00 0.00 -3.40 1.61 3.45 -1.98 -2.60 116.42 113.50 1xw5 h ASP 150 Ca 0.00 0.00 -0.67 0.00 0.43 0.00 0.00 57.03 56.79 1xw5 h ASP 150 Cb 0.00 0.00 -0.18 0.00 -0.56 0.00 0.00 39.33 38.59 1xw5 h ASP 150 CO 0.00 0.00 -0.65 -1.59 -1.57 0.00 0.00 179.24 175.43 1xw5 s LYS 151 N -3.25 3.15 0.31 3.56 -2.85 -1.26 -4.85 119.74 114.55 1xw5 s LYS 151 Ca 0.07 -0.47 -0.28 0.00 -1.00 0.00 0.00 55.97 54.28 1xw5 s LYS 151 Cb 0.06 -2.79 -0.09 0.00 -2.06 0.00 0.00 37.83 32.94 1xw5 s LYS 151 CO 0.65 0.55 1.09 -1.50 0.10 0.00 0.00 175.35 176.25 1xw5 s ILE 152 N -0.48 3.52 0.33 3.79 2.07 -1.26 -4.53 121.20 124.63 1xw5 s ILE 152 Ca 0.08 1.45 0.06 0.00 -1.41 0.00 0.00 60.65 60.83 1xw5 s ILE 152 Cb -0.12 -3.89 -0.03 0.00 0.13 0.00 0.00 42.46 38.55 1xw5 s ILE 152 CO 0.02 0.29 0.25 0.42 -1.91 0.00 0.00 174.94 174.01 1xw5 s THR 153 N -1.26 0.07 0.39 4.00 -4.23 -1.26 -4.79 115.64 108.57 1xw5 s THR 153 Ca 0.47 -2.00 0.08 0.00 -1.18 0.00 0.00 61.69 59.07 1xw5 s THR 153 Cb -0.30 -2.48 0.30 0.00 1.34 0.00 0.00 72.50 71.36 1xw5 s THR 153 CO 0.38 0.00 1.99 2.19 -0.54 0.00 0.00 174.62 178.64 1xw5 h PHE 154 N 2.13 0.61 0.00 3.99 -0.00 -1.35 -2.24 116.94 120.07 1xw5 h PHE 154 Ca -0.27 0.02 -0.01 0.00 -0.00 0.00 0.00 57.97 57.70 1xw5 h PHE 154 Cb 1.24 -0.20 -0.00 0.00 -0.00 0.00 0.00 35.95 36.99 1xw5 h PHE 154 CO 1.58 0.33 -0.06 -0.39 -0.00 0.00 0.00 178.31 179.76 1xw5 h VAL 155 N 0.61 0.68 0.00 0.88 -1.51 -1.94 -1.26 116.25 113.71 1xw5 h VAL 155 Ca 0.26 -0.25 -0.03 0.00 -1.23 0.00 0.00 66.70 65.45 1xw5 h VAL 155 Cb 0.26 1.15 -0.00 0.00 -2.13 0.00 0.00 31.29 30.56 1xw5 h VAL 155 CO -0.08 0.06 -0.16 0.44 -1.23 0.00 0.00 177.57 176.61 1xw5 h ASP 156 N 0.00 0.00 0.51 4.19 3.32 -1.82 0.47 116.42 123.09 1xw5 h ASP 156 Ca -0.00 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.81 1xw5 h ASP 156 Cb 0.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.70 1xw5 h ASP 156 CO 0.01 0.16 -1.06 -0.26 -1.72 0.00 0.00 179.24 176.37 1xw5 h PHE 157 N 0.00 0.50 -0.14 4.55 -1.00 -1.35 -0.79 116.94 118.70 1xw5 h PHE 157 Ca -0.00 -0.31 -0.11 0.00 2.81 0.00 0.00 57.97 60.36 1xw5 h PHE 157 Cb 0.34 -0.04 0.00 0.00 3.61 0.00 0.00 35.95 39.86 1xw5 h PHE 157 CO 0.00 1.17 -0.34 0.82 -1.61 0.00 0.00 178.31 178.35 1xw5 h ILE 158 N 0.14 1.36 -0.23 -0.55 2.04 -1.27 -2.89 117.51 116.11 1xw5 h ILE 158 Ca -0.09 -1.62 0.04 0.00 1.00 0.00 0.00 64.86 64.19 1xw5 h ILE 158 Cb 1.73 2.04 -0.04 0.00 -0.74 0.00 0.00 36.82 39.81 1xw5 h ILE 158 CO 0.17 0.48 -0.03 0.00 0.00 0.00 0.00 178.15 178.78 1xw5 h ALA 159 N 0.54 0.17 -0.42 1.87 0.00 -0.08 -2.28 119.26 119.05 1xw5 h ALA 159 Ca -0.00 0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.03 1xw5 h ALA 159 Cb 0.95 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.84 1xw5 h ALA 159 CO 0.07 -0.45 0.18 -0.92 0.00 0.00 0.00 179.25 178.13 1xw5 h TYR 160 N 0.03 0.33 0.13 0.00 3.20 -1.17 -2.13 116.97 117.34 1xw5 h TYR 160 Ca 0.11 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.00 1xw5 h TYR 160 Cb 0.15 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.33 1xw5 h TYR 160 CO -0.22 0.15 -0.13 0.22 -1.64 0.00 0.00 178.16 176.54 1xw5 h ASP 161 N 0.37 -0.35 -0.25 -2.11 3.58 -1.23 0.26 116.42 116.70 1xw5 h ASP 161 Ca 0.19 0.04 -0.14 0.00 0.42 0.00 0.00 57.03 57.54 1xw5 h ASP 161 Cb 0.14 0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.30 1xw5 h ASP 161 CO -0.16 -0.20 -0.33 -0.37 -2.88 0.00 0.00 179.24 175.30 1xw5 h VAL 162 N -0.29 1.28 0.14 2.25 -1.51 -1.40 -1.96 116.25 114.77 1xw5 h VAL 162 Ca 0.01 -1.49 -0.01 0.00 -1.23 0.00 0.00 66.70 63.98 1xw5 h VAL 162 Cb 0.28 1.37 0.00 0.00 -2.13 0.00 0.00 31.29 30.81 1xw5 h VAL 162 CO -0.04 0.49 -0.07 -0.07 -1.23 0.00 0.00 177.57 176.65 1xw5 h LEU 163 N 0.64 -0.16 -1.39 4.19 3.38 -1.35 -2.63 115.31 118.00 1xw5 h LEU 163 Ca 0.07 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.68 1xw5 h LEU 163 Cb 0.87 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.64 1xw5 h LEU 163 CO 0.08 0.30 0.26 -0.08 0.09 0.00 0.00 178.44 179.09 1xw5 h GLU 164 N -0.65 0.67 0.00 1.13 4.22 -1.01 -1.84 114.58 117.10 1xw5 h GLU 164 Ca -0.02 -0.07 -0.02 0.00 0.08 0.00 0.00 59.36 59.33 1xw5 h GLU 164 Cb 0.49 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.60 1xw5 h GLU 164 CO 0.03 0.50 -0.10 0.07 -2.18 0.00 0.00 179.01 177.34 1xw5 h ARG 165 N 0.68 0.00 0.00 1.92 0.11 -1.35 -1.62 114.38 114.12 1xw5 h ARG 165 Ca 0.18 0.00 -0.19 0.00 0.10 0.00 0.00 59.98 60.07 1xw5 h ARG 165 Cb 0.03 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.10 1xw5 h ARG 165 CO -0.03 0.10 -0.85 -0.91 0.10 0.00 0.00 179.97 178.38 1xw5 h ASN 166 N 0.00 0.19 -0.04 0.08 4.21 -0.97 -2.19 115.58 116.86 1xw5 h ASN 166 Ca -0.00 -0.15 -0.10 0.00 1.21 0.00 0.00 56.30 57.26 1xw5 h ASN 166 Cb 0.75 -0.06 -0.01 0.00 -1.12 0.00 0.00 38.32 37.88 1xw5 h ASN 166 CO 0.01 0.95 -0.28 -0.61 -1.29 0.00 0.00 177.43 176.21 1xw5 h GLN 167 N 0.08 0.48 -0.15 0.81 4.15 -0.79 0.74 115.11 120.43 1xw5 h GLN 167 Ca -0.03 -0.19 -0.21 0.00 0.77 0.00 0.00 58.65 58.99 1xw5 h GLN 167 Cb 1.47 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 29.14 1xw5 h GLN 167 CO 0.12 0.72 -0.73 -0.39 -1.93 0.00 0.00 178.83 176.62 1xw5 h VAL 168 N 0.42 1.30 -0.42 2.39 -1.51 -1.16 -1.69 116.25 115.59 1xw5 h VAL 168 Ca 0.06 -1.97 -0.02 0.00 -1.23 0.00 0.00 66.70 63.53 1xw5 h VAL 168 Cb 0.71 1.96 -0.02 0.00 -2.13 0.00 0.00 31.29 31.81 1xw5 h VAL 168 CO 0.05 0.62 0.18 0.15 -1.23 0.00 0.00 177.57 177.35 1xw5 h PHE 169 N 0.49 0.61 -2.89 5.19 3.57 -1.20 -3.40 116.94 119.31 1xw5 h PHE 169 Ca -0.04 -0.04 -0.49 0.00 3.53 0.00 0.00 57.97 60.93 1xw5 h PHE 169 Cb 1.34 -0.19 -0.40 0.00 2.79 0.00 0.00 35.95 39.49 1xw5 h PHE 169 CO 0.07 0.52 -0.76 -2.00 -2.23 0.00 0.00 178.31 173.91 1xw5 s GLU 170 N -5.63 0.13 0.42 1.11 2.56 0.24 -5.05 118.70 112.47 1xw5 s GLU 170 Ca -0.13 -0.31 0.20 0.00 0.00 0.00 0.00 54.97 54.73 1xw5 s GLU 170 Cb 0.10 -1.45 1.14 0.00 2.00 0.00 0.00 34.13 35.92 1xw5 s GLU 170 CO 0.75 -0.86 1.80 -1.35 -0.56 0.00 0.00 175.26 175.05 1xw5 h PRO 171 N 8.41 0.35 -0.02 4.30 0.11 -1.53 -2.82 132.00 140.81 1xw5 h PRO 171 Ca -0.18 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.91 1xw5 h PRO 171 Cb 1.08 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1xw5 h PRO 171 CO 0.37 0.23 -0.18 -1.13 -0.21 0.00 0.00 178.00 177.08 1xw5 n SER 172 N -4.55 1.78 0.10 -2.05 3.41 -1.26 -4.55 113.62 106.50 1xw5 n SER 172 Ca 0.23 -1.42 0.12 0.00 -0.26 0.00 0.00 58.87 57.54 1xw5 n SER 172 Cb 0.85 0.14 0.62 0.00 -0.26 0.00 0.00 64.21 65.57 1xw5 n SER 172 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xw5 n LEU 174 N -4.47 1.29 -0.18 0.00 4.32 -1.26 -4.48 117.00 112.22 1xw5 n LEU 174 Ca 0.04 -0.39 -0.03 0.00 -0.02 0.00 0.00 56.01 55.60 1xw5 n LEU 174 Cb 0.31 -0.06 0.03 0.00 -1.62 0.00 0.00 43.42 42.08 1xw5 n LEU 174 CO 0.35 0.22 0.70 0.44 -1.22 0.00 0.00 177.39 177.89 1xw5 h ASP 175 N 1.83 -0.77 0.24 -1.43 3.32 -1.70 -0.81 116.42 117.10 1xw5 h ASP 175 Ca 0.00 0.19 0.00 0.00 0.02 0.00 0.00 57.03 57.24 1xw5 h ASP 175 Cb 0.51 0.43 0.00 0.00 0.22 0.00 0.00 39.33 40.49 1xw5 h ASP 175 CO 0.00 -0.24 0.00 0.00 -1.72 0.00 0.00 179.24 177.28 1xw5 n ALA 176 N -3.03 1.43 -3.83 3.45 0.00 -1.26 -4.33 120.51 112.94 1xw5 n ALA 176 Ca 0.05 -0.03 -0.30 0.00 0.00 0.00 0.00 53.44 53.16 1xw5 n ALA 176 Cb 0.32 -1.13 -0.13 0.00 0.00 0.00 0.00 19.45 18.51 1xw5 n ALA 176 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1xw5 s PHE 177 N -2.87 2.66 0.19 0.00 0.08 -0.31 -4.99 117.98 112.74 1xw5 s PHE 177 Ca 0.05 -2.86 -0.13 0.00 0.12 0.00 0.00 56.93 54.11 1xw5 s PHE 177 Cb 0.05 -2.38 0.19 0.00 -0.57 0.00 0.00 43.02 40.32 1xw5 s PHE 177 CO 0.14 -0.74 1.69 -1.35 -0.10 0.00 0.00 175.22 174.86 1xw5 h PRO 178 N 6.48 0.16 0.00 0.24 0.11 -1.77 -2.03 132.00 135.19 1xw5 h PRO 178 Ca -0.02 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.06 1xw5 h PRO 178 Cb 0.89 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 31.97 1xw5 h PRO 178 CO 0.60 0.10 -0.07 -2.95 -0.21 0.00 0.00 178.00 175.47 1xw5 h ASN 179 N 0.16 0.00 0.48 -2.05 -0.00 -1.94 0.25 115.58 112.48 1xw5 h ASN 179 Ca 0.25 0.00 -0.20 0.00 -0.00 0.00 0.00 56.30 56.35 1xw5 h ASN 179 Cb 0.37 0.00 -0.01 0.00 -0.00 0.00 0.00 38.32 38.68 1xw5 h ASN 179 CO -0.38 0.07 -0.87 -0.07 -0.00 0.00 0.00 177.43 176.17 1xw5 h LEU 180 N 0.00 0.35 -0.17 6.14 3.38 -1.74 -0.47 115.31 122.80 1xw5 h LEU 180 Ca -0.00 -0.28 -0.23 0.00 0.09 0.00 0.00 57.88 57.47 1xw5 h LEU 180 Cb 0.12 -0.11 0.01 0.00 0.09 0.00 0.00 40.66 40.77 1xw5 h LEU 180 CO 0.01 1.07 -0.89 0.11 0.09 0.00 0.00 178.44 178.82 1xw5 h LYS 181 N 0.16 0.57 -0.12 1.13 1.57 -0.88 -2.69 116.57 116.30 1xw5 h LYS 181 Ca -0.05 -0.55 -0.09 0.00 -1.87 0.00 0.00 60.65 58.10 1xw5 h LYS 181 Cb 1.49 0.14 -0.01 0.00 0.08 0.00 0.00 32.23 33.93 1xw5 h LYS 181 CO 0.14 1.17 -0.31 -0.44 -0.57 0.00 0.00 179.45 179.44 1xw5 h ASP 182 N 0.35 0.23 0.05 0.86 3.32 -0.47 -1.97 116.42 118.80 1xw5 h ASP 182 Ca -0.08 -0.08 -0.00 0.00 0.02 0.00 0.00 57.03 56.89 1xw5 h ASP 182 Cb 1.52 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 41.00 1xw5 h ASP 182 CO 0.17 0.54 -0.02 0.15 -1.72 0.00 0.00 179.24 178.35 1xw5 h PHE 183 N 0.21 -0.06 -0.40 4.55 3.57 -1.03 -0.46 116.94 123.31 1xw5 h PHE 183 Ca 0.03 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.57 1xw5 h PHE 183 Cb 0.65 0.02 -0.04 0.00 2.79 0.00 0.00 35.95 39.37 1xw5 h PHE 183 CO 0.01 0.13 0.15 0.82 -2.23 0.00 0.00 178.31 177.19 1xw5 h ILE 184 N -0.25 0.89 -0.40 1.41 2.04 -1.30 -0.94 117.51 118.97 1xw5 h ILE 184 Ca -0.01 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.75 1xw5 h ILE 184 Cb 0.22 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 36.83 1xw5 h ILE 184 CO 0.01 0.06 0.26 0.28 0.00 0.00 0.00 178.15 178.76 1xw5 h SER 185 N 0.32 0.46 -0.86 1.72 0.02 -1.30 -1.11 113.55 112.81 1xw5 h SER 185 Ca 0.18 -0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 61.09 1xw5 h SER 185 Cb 0.16 -0.12 -0.04 0.00 0.14 0.00 0.00 62.40 62.54 1xw5 h SER 185 CO -0.18 0.34 0.42 -0.09 -1.14 0.00 0.00 176.83 176.18 1xw5 h ARG 186 N 0.54 1.23 -0.03 3.45 2.43 -0.76 0.70 114.38 121.95 1xw5 h ARG 186 Ca 0.15 -0.18 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 1xw5 h ARG 186 Cb -0.06 -0.22 -0.00 0.00 -0.42 0.00 0.00 29.97 29.27 1xw5 h ARG 186 CO -0.03 0.94 -0.02 0.35 -1.51 0.00 0.00 179.97 179.70 1xw5 h PHE 187 N 1.22 0.07 0.00 2.20 3.04 -0.99 -2.94 116.94 119.54 1xw5 h PHE 187 Ca 0.29 -0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.22 1xw5 h PHE 187 Cb 0.11 -0.02 0.00 0.00 2.56 0.00 0.00 35.95 38.61 1xw5 h PHE 187 CO 0.01 0.52 0.00 0.93 -2.02 0.00 0.00 178.31 177.75 1xw5 h GLU 188 N -0.39 0.00 0.00 1.11 5.08 -1.08 -2.54 114.58 116.76 1xw5 h GLU 188 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1xw5 h GLU 188 Cb 0.50 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 1xw5 h GLU 188 CO 0.01 0.00 -0.40 0.78 -1.00 0.00 0.00 179.01 178.39 1xw5 h GLY 189 N 1.23 0.00 -4.57 -3.84 0.00 -0.71 -3.25 103.07 91.93 1xw5 h GLY 189 Ca 0.00 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 46.74 1xw5 h GLY 189 CO 0.00 0.00 0.49 1.04 0.00 0.00 0.00 176.54 178.07 1xw5 n LEU 190 N -2.95 2.84 -0.20 3.11 4.77 -0.96 -4.71 117.00 118.90 1xw5 n LEU 190 Ca 0.02 1.16 -0.06 0.00 -0.03 0.00 0.00 56.01 57.10 1xw5 n LEU 190 Cb 0.55 -1.40 -0.05 0.00 -2.33 0.00 0.00 43.42 40.19 1xw5 n LEU 190 CO 0.37 -0.70 0.49 -0.33 -1.33 0.00 0.00 177.39 175.89 1xw5 h GLU 191 N 3.49 -0.03 -0.65 3.23 4.39 -1.90 0.14 114.58 123.25 1xw5 h GLU 191 Ca -0.44 0.00 0.03 0.00 0.34 0.00 0.00 59.36 59.29 1xw5 h GLU 191 Cb 1.29 0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.91 1xw5 h GLU 191 CO 0.70 -0.02 0.43 0.87 -1.16 0.00 0.00 179.01 179.83 1xw5 h LYS 192 N -0.04 0.75 -0.10 2.33 1.79 -1.90 -2.07 116.57 117.33 1xw5 h LYS 192 Ca 0.08 -0.05 -0.17 0.00 -2.18 0.00 0.00 60.65 58.33 1xw5 h LYS 192 Cb 0.24 -0.17 0.01 0.00 -1.58 0.00 0.00 32.23 30.73 1xw5 h LYS 192 CO -0.48 0.50 -0.62 0.82 -1.08 0.00 0.00 179.45 178.59 1xw5 h ILE 193 N 0.77 1.34 -0.42 1.86 1.08 -1.65 -2.52 117.51 117.98 1xw5 h ILE 193 Ca 0.26 -1.91 0.01 0.00 -0.39 0.00 0.00 64.86 62.83 1xw5 h ILE 193 Cb 0.07 2.19 -0.02 0.00 -3.07 0.00 0.00 36.82 35.99 1xw5 h ILE 193 CO -0.07 0.58 0.26 -1.28 -0.69 0.00 0.00 178.15 176.95 1xw5 h SER 194 N 0.23 0.44 -0.71 1.72 0.87 -0.54 -1.26 113.55 114.31 1xw5 h SER 194 Ca -0.05 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.50 1xw5 h SER 194 Cb 1.27 -0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 63.09 1xw5 h SER 194 CO 0.13 0.32 0.42 0.00 -0.53 0.00 0.00 176.83 177.16 1xw5 h ALA 195 N 1.17 0.91 -0.54 6.23 0.00 -1.43 -2.87 119.26 122.72 1xw5 h ALA 195 Ca 0.16 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1xw5 h ALA 195 Cb -0.03 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 1xw5 h ALA 195 CO -0.05 0.39 0.07 -0.92 0.00 0.00 0.00 179.25 178.73 1xw5 h TYR 196 N 0.97 0.98 0.00 0.00 3.20 -1.11 -2.50 116.97 118.50 1xw5 h TYR 196 Ca 0.25 -0.14 -0.01 0.00 3.14 0.00 0.00 58.73 61.97 1xw5 h TYR 196 Cb -0.02 -0.27 -0.00 0.00 1.54 0.00 0.00 36.73 37.99 1xw5 h TYR 196 CO -0.01 0.88 -0.04 0.52 -1.64 0.00 0.00 178.16 177.87 1xw5 h MET 197 N 0.80 0.00 0.00 1.82 2.86 -1.06 -1.91 114.93 117.44 1xw5 h MET 197 Ca 0.16 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.80 1xw5 h MET 197 Cb 0.44 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.10 1xw5 h MET 197 CO 0.01 0.04 -0.76 1.63 1.06 0.00 0.00 176.91 178.89 1xw5 n LYS 198 N -3.23 0.30 -2.07 1.72 5.02 -1.04 -4.88 118.16 113.98 1xw5 n LYS 198 Ca -0.01 0.06 -0.27 0.00 -2.02 0.00 0.00 58.31 56.07 1xw5 n LYS 198 Cb 0.22 -1.66 0.08 0.00 -0.02 0.00 0.00 35.03 33.64 1xw5 n LYS 198 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1xw5 s SER 199 N -4.17 4.70 0.49 4.39 1.04 -0.72 -4.98 113.70 114.45 1xw5 s SER 199 Ca 0.05 0.61 0.29 0.00 0.48 0.00 0.00 55.95 57.38 1xw5 s SER 199 Cb 0.14 -1.20 0.92 0.00 0.10 0.00 0.00 66.02 65.98 1xw5 s SER 199 CO 0.75 -1.72 1.82 0.77 0.98 0.00 0.00 173.24 175.83 1xw5 h SER 200 N -0.79 0.00 1.39 7.02 4.64 -1.93 -3.21 113.55 120.66 1xw5 h SER 200 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1xw5 h SER 200 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 1xw5 h SER 200 CO 0.63 0.00 0.00 0.03 -0.87 0.00 0.00 176.83 176.62 1xw5 h ARG 201 N 0.00 0.00 -6.57 4.77 3.08 -1.94 -3.45 114.38 110.27 1xw5 h ARG 201 Ca 0.00 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.53 1xw5 h ARG 201 Cb 0.72 0.00 0.05 0.00 0.08 0.00 0.00 29.97 30.81 1xw5 h ARG 201 CO 0.00 0.00 1.03 0.12 -1.07 0.00 0.00 179.97 180.05 1xw5 s PHE 202 N -3.43 2.58 -0.55 3.04 5.36 -1.22 -4.96 117.98 118.81 1xw5 s PHE 202 Ca 0.04 0.23 0.04 0.00 -0.96 0.00 0.00 56.93 56.28 1xw5 s PHE 202 Cb 0.08 -4.11 0.16 0.00 -0.34 0.00 0.00 43.02 38.80 1xw5 s PHE 202 CO 0.58 -4.38 0.38 -1.17 -1.46 0.00 0.00 175.22 169.17 1xw5 s LEU 203 N 1.93 3.34 0.17 6.12 2.96 -1.26 -4.93 118.68 127.02 1xw5 s LEU 203 Ca 0.77 -3.29 0.23 0.00 -0.22 0.00 0.00 54.13 51.62 1xw5 s LEU 203 Cb -0.47 -1.16 0.17 0.00 0.50 0.00 0.00 46.19 45.23 1xw5 s LEU 203 CO 0.34 -0.16 1.20 1.55 -1.32 0.00 0.00 176.35 177.95 1xw5 h PRO 204 N 5.85 0.00 -3.79 0.98 0.13 -1.95 -3.36 132.00 129.86 1xw5 h PRO 204 Ca 0.13 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 65.09 1xw5 h PRO 204 Cb 0.85 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 31.76 1xw5 h PRO 204 CO 0.56 0.00 -0.63 1.03 -0.23 0.00 0.00 178.00 178.74 1xw5 s ARG 205 N -3.26 0.34 0.58 0.86 0.52 -1.26 -4.16 118.95 112.57 1xw5 s ARG 205 Ca 0.03 -0.47 -0.17 0.00 -0.52 0.00 0.00 55.73 54.60 1xw5 s ARG 205 Cb 0.11 0.13 -0.04 0.00 0.52 0.00 0.00 34.95 35.67 1xw5 s ARG 205 CO 0.75 -0.07 1.08 -1.25 0.02 0.00 0.00 175.30 175.84 1xw5 s PRO 206 N -1.27 3.27 0.05 3.54 0.04 -1.26 -4.72 135.00 134.64 1xw5 s PRO 206 Ca -0.14 1.35 -0.21 0.00 0.04 0.00 0.00 61.00 62.05 1xw5 s PRO 206 Cb -0.08 -2.02 -0.13 0.00 0.04 0.00 0.00 34.50 32.31 1xw5 s PRO 206 CO -0.00 -0.87 1.41 0.28 0.04 0.00 0.00 177.00 177.86 1xw5 h VAL 207 N 0.65 1.31 -4.70 -0.36 2.07 -1.63 -0.75 116.25 112.83 1xw5 h VAL 207 Ca -0.48 -1.08 -0.34 0.00 0.82 0.00 0.00 66.70 65.62 1xw5 h VAL 207 Cb 1.23 1.69 -0.05 0.00 -1.52 0.00 0.00 31.29 32.64 1xw5 h VAL 207 CO 0.57 0.32 -0.22 0.49 0.02 0.00 0.00 177.57 178.75 1xw5 n PHE 208 N -4.65 0.11 -1.49 1.57 3.72 -0.13 -1.04 117.46 115.55 1xw5 n PHE 208 Ca -0.05 -1.31 -0.29 0.00 -0.05 0.00 0.00 57.45 55.74 1xw5 n PHE 208 Cb 0.29 -0.20 0.11 0.00 -0.94 0.00 0.00 39.48 38.75 1xw5 n PHE 208 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1xw5 s THR 209 N -1.81 2.62 -0.02 4.37 -4.23 -1.26 -4.58 115.64 110.72 1xw5 s THR 209 Ca 0.05 0.20 0.28 0.00 -1.18 0.00 0.00 61.69 61.04 1xw5 s THR 209 Cb -0.00 -2.91 0.28 0.00 1.34 0.00 0.00 72.50 71.21 1xw5 s THR 209 CO 0.03 -0.26 1.85 0.11 -0.54 0.00 0.00 174.62 175.81 1xw5 h LYS 210 N -1.31 0.00 -0.00 3.99 1.57 -1.91 -1.70 116.57 117.20 1xw5 h LYS 210 Ca -0.49 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 1xw5 h LYS 210 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.60 1xw5 h LYS 210 CO 0.60 0.00 -0.04 -1.33 -0.57 0.00 0.00 179.45 178.11 1xw5 n MET 211 N -2.48 0.38 -2.47 3.15 2.81 -1.26 -4.84 117.12 112.41 1xw5 n MET 211 Ca -0.01 -0.04 -0.34 0.00 -1.81 0.00 0.00 57.70 55.50 1xw5 n MET 211 Cb 0.08 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 31.07 1xw5 n MET 211 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1xw5 s ALA 212 N -2.65 2.83 -0.01 3.04 0.00 -0.64 -4.93 121.76 119.41 1xw5 s ALA 212 Ca 0.25 0.63 0.11 0.00 0.00 0.00 0.00 51.96 52.96 1xw5 s ALA 212 Cb 0.20 -3.27 -0.20 0.00 0.00 0.00 0.00 23.12 19.85 1xw5 s ALA 212 CO 0.49 -0.42 0.92 0.28 0.00 0.00 0.00 175.76 177.03 1xw5 h VAL 213 N 1.43 1.08 -4.06 0.00 2.07 -0.96 -3.41 116.25 112.40 1xw5 h VAL 213 Ca -0.49 -2.83 -0.49 0.00 0.82 0.00 0.00 66.70 63.71 1xw5 h VAL 213 Cb 1.23 2.51 -0.30 0.00 -1.52 0.00 0.00 31.29 33.21 1xw5 h VAL 213 CO 0.59 0.62 -0.81 0.86 0.02 0.00 0.00 177.57 178.84 1xw5 s TRP 214 N -2.69 1.29 -0.05 1.57 -0.00 -0.69 -4.78 118.94 113.60 1xw5 s TRP 214 Ca -0.02 -0.29 0.00 0.00 -0.00 0.00 0.00 56.10 55.79 1xw5 s TRP 214 Cb 0.09 -0.86 0.00 0.00 -0.00 0.00 0.00 33.47 32.70 1xw5 s TRP 214 CO 0.82 -0.07 0.00 0.41 -0.00 0.00 0.00 176.95 178.11 1xw5 n GLY 215 N 2.94 0.43 0.06 5.86 0.00 -1.26 -4.74 105.19 108.49 1xw5 n GLY 215 Ca -0.16 -0.93 0.13 0.00 0.00 0.00 0.00 46.02 45.07 1xw5 n GLY 215 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1xw5 n ASN 216 N 1.65 0.48 0.00 1.61 0.23 -1.26 -0.96 115.26 117.01 1xw5 n ASN 216 Ca -0.00 0.52 0.00 0.00 -0.53 0.00 0.00 54.58 54.56 1xw5 n ASN 216 Cb 0.02 -0.63 0.00 0.00 -2.08 0.00 0.00 39.78 37.09 1xw5 n ASN 216 CO 0.00 0.00 0.00 2.29 -0.93 0.00 0.00 177.26 178.62