#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wu8 s THR 3 N 0.00 5.25 -0.06 1.39 -4.23 0.33 -0.22 115.64 118.09 1wu8 s THR 3 Ca 0.00 -0.73 0.02 0.00 -1.18 0.00 0.00 61.69 59.80 1wu8 s THR 3 Cb 0.00 -3.71 0.01 0.00 1.34 0.00 0.00 72.50 70.15 1wu8 s THR 3 CO 0.00 -0.10 -0.11 -0.76 -0.54 0.00 0.00 174.62 173.11 1wu8 s LEU 4 N -3.25 1.61 -0.10 4.79 1.43 -0.27 -0.84 118.68 122.04 1wu8 s LEU 4 Ca 0.34 -0.27 -0.03 0.00 -1.03 0.00 0.00 54.13 53.14 1wu8 s LEU 4 Cb -0.11 -0.76 0.04 0.00 0.03 0.00 0.00 46.19 45.40 1wu8 s LEU 4 CO 0.28 0.02 0.06 -0.89 0.23 0.00 0.00 176.35 176.06 1wu8 s THR 5 N 0.66 0.00 0.29 5.49 2.01 -0.66 -0.52 115.64 122.91 1wu8 s THR 5 Ca -0.13 0.12 0.02 0.00 0.31 0.00 0.00 61.69 62.00 1wu8 s THR 5 Cb -0.15 -0.41 -0.03 0.00 0.01 0.00 0.00 72.50 71.92 1wu8 s THR 5 CO 0.03 0.00 0.27 0.42 -0.69 0.00 0.00 174.62 174.65 1wu8 s THR 6 N 2.11 0.00 -0.18 -0.82 -4.23 -0.30 0.51 115.64 112.73 1wu8 s THR 6 Ca 0.04 -1.91 0.15 0.00 -1.18 0.00 0.00 61.69 58.79 1wu8 s THR 6 Cb -0.14 -2.51 0.38 0.00 1.34 0.00 0.00 72.50 71.58 1wu8 s THR 6 CO -0.06 0.00 1.24 -0.90 -0.54 0.00 0.00 174.62 174.36 1wu8 n ASP 7 N -1.06 2.40 0.20 3.99 5.75 -1.15 -3.14 116.55 123.53 1wu8 n ASP 7 Ca 0.04 -3.38 0.04 0.00 -0.01 0.00 0.00 54.79 51.49 1wu8 n ASP 7 Cb 0.63 -0.50 0.46 0.00 -1.03 0.00 0.00 41.12 40.68 1wu8 n ASP 7 CO 0.00 0.00 0.00 -0.26 -0.11 0.00 0.00 177.20 176.83 1wu8 h PHE 8 N 0.63 0.04 0.00 2.11 0.04 -1.82 -3.43 116.94 114.51 1wu8 h PHE 8 Ca 0.02 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.79 1wu8 h PHE 8 Cb 1.13 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 39.27 1wu8 h PHE 8 CO 0.38 0.25 0.00 0.41 -0.60 0.00 0.00 178.31 178.75 1wu8 n GLY 9 N -0.89 0.57 0.00 -1.45 0.00 0.12 -4.83 105.19 98.70 1wu8 n GLY 9 Ca -0.02 -1.78 0.09 0.00 0.00 0.00 0.00 46.02 44.30 1wu8 n GLY 9 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wu8 n LEU 10 N -0.69 0.84 -4.13 0.99 4.77 -1.26 -4.68 117.00 112.83 1wu8 n LEU 10 Ca 0.00 -0.49 -0.44 0.00 -0.03 0.00 0.00 56.01 55.06 1wu8 n LEU 10 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1wu8 n LEU 10 CO 0.00 0.21 1.19 1.17 -1.33 0.00 0.00 177.39 178.63 1wu8 n LYS 11 N -1.45 3.94 -3.19 3.23 4.81 -1.26 -4.92 118.16 119.32 1wu8 n LYS 11 Ca 0.03 -4.29 0.00 0.00 -0.87 0.00 0.00 58.31 53.19 1wu8 n LYS 11 Cb 0.29 -2.65 0.00 0.00 0.02 0.00 0.00 35.03 32.69 1wu8 n LYS 11 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1wu8 n GLY 12 N 2.27 -1.38 0.30 3.14 0.00 -1.26 -5.02 105.19 103.24 1wu8 n GLY 12 Ca 0.29 -1.01 0.11 0.00 0.00 0.00 0.00 46.02 45.41 1wu8 n GLY 12 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wu8 n PRO 13 N -0.12 0.75 -0.13 1.61 -0.04 -1.26 -4.65 135.00 131.16 1wu8 n PRO 13 Ca 0.00 -0.61 -0.05 0.00 -0.04 0.00 0.00 63.50 62.80 1wu8 n PRO 13 Cb 0.00 -1.49 0.01 0.00 -0.04 0.00 0.00 33.50 31.98 1wu8 n PRO 13 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1wu8 h TYR 14 N 1.48 -0.57 -0.40 0.54 0.99 -1.94 -0.55 116.97 116.52 1wu8 h TYR 14 Ca 0.00 0.05 -0.08 0.00 2.00 0.00 0.00 58.73 60.70 1wu8 h TYR 14 Cb 0.65 0.32 -0.02 0.00 1.00 0.00 0.00 36.73 38.68 1wu8 h TYR 14 CO 0.00 -0.30 -0.08 0.28 -0.00 0.00 0.00 178.16 178.06 1wu8 h VAL 15 N -0.14 1.24 -0.42 -2.88 2.07 -1.86 -2.99 116.25 111.28 1wu8 h VAL 15 Ca 0.20 -1.06 -0.04 0.00 0.82 0.00 0.00 66.70 66.62 1wu8 h VAL 15 Cb 0.46 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 1wu8 h VAL 15 CO -0.52 0.36 0.09 1.23 0.02 0.00 0.00 177.57 178.76 1wu8 h GLY 16 N 0.96 0.73 -1.53 2.17 0.00 -1.66 -2.30 103.07 101.43 1wu8 h GLY 16 Ca 0.12 -0.46 0.00 0.00 0.00 0.00 0.00 47.33 46.98 1wu8 h GLY 16 CO 0.03 0.43 0.00 1.18 0.00 0.00 0.00 176.54 178.18 1wu8 n GLU 17 N -4.53 0.11 0.00 4.80 1.02 -0.29 -1.29 120.64 120.45 1wu8 n GLU 17 Ca -0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1wu8 n GLU 17 Cb 0.22 -1.26 0.00 0.00 -0.02 0.00 0.00 31.44 30.37 1wu8 n GLU 17 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1wu8 n LYS 19 N 0.71 0.00 0.23 3.49 5.02 -0.87 -1.14 118.16 125.61 1wu8 n LYS 19 Ca 0.00 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.38 1wu8 n LYS 19 Cb 0.04 0.00 0.56 0.00 -0.02 0.00 0.00 35.03 35.61 1wu8 n LYS 19 CO 0.00 0.00 0.00 -0.39 -0.52 0.00 0.00 177.40 176.49 1wu8 h VAL 20 N 0.00 0.79 0.00 -0.18 -1.51 -1.47 0.01 116.25 113.90 1wu8 h VAL 20 Ca 0.00 -0.85 0.00 0.00 -1.23 0.00 0.00 66.70 64.62 1wu8 h VAL 20 Cb 0.00 1.52 0.00 0.00 -2.13 0.00 0.00 31.29 30.68 1wu8 h VAL 20 CO 0.00 0.21 0.00 0.00 -1.23 0.00 0.00 177.57 176.55 1wu8 n ALA 21 N -2.33 1.81 0.00 5.19 0.00 -0.30 -1.56 120.51 123.31 1wu8 n ALA 21 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1wu8 n ALA 21 Cb 0.32 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.77 1wu8 n ALA 21 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1wu8 n LEU 23 N 0.42 0.00 0.08 0.00 4.77 -0.01 -2.52 117.00 119.73 1wu8 n LEU 23 Ca 0.00 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.85 1wu8 n LEU 23 Cb 0.16 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.19 1wu8 n LEU 23 CO 0.00 0.00 0.15 -0.09 -1.33 0.00 0.00 177.39 176.12 1wu8 h ARG 24 N 0.00 0.35 0.02 3.23 2.43 -1.53 0.58 114.38 119.46 1wu8 h ARG 24 Ca 0.00 -0.41 -0.05 0.00 -0.81 0.00 0.00 59.98 58.72 1wu8 h ARG 24 Cb 0.00 0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 1wu8 h ARG 24 CO 0.00 1.10 -0.20 0.82 -1.51 0.00 0.00 179.97 180.18 1wu8 h ILE 25 N 0.18 1.65 -2.72 1.20 1.08 -1.78 -3.41 117.51 113.72 1wu8 h ILE 25 Ca -0.08 -2.17 -0.60 0.00 -0.39 0.00 0.00 64.86 61.61 1wu8 h ILE 25 Cb 1.64 3.10 -0.40 0.00 -3.07 0.00 0.00 36.82 38.09 1wu8 h ILE 25 CO 0.17 0.58 -0.81 0.21 -0.69 0.00 0.00 178.15 177.61 1wu8 s ASN 26 N -6.33 2.97 0.60 1.72 3.04 -1.25 -4.98 114.94 110.72 1wu8 s ASN 26 Ca -0.17 -3.05 0.30 0.00 0.04 0.00 0.00 52.86 49.98 1wu8 s ASN 26 Cb -0.01 -0.87 1.62 0.00 -1.54 0.00 0.00 41.25 40.45 1wu8 s ASN 26 CO 0.73 -0.19 1.90 1.55 -3.04 0.00 0.00 177.10 178.04 1wu8 h PRO 27 N 6.01 0.00 -0.30 0.43 0.13 -1.11 -2.16 132.00 135.00 1wu8 h PRO 27 Ca 0.14 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 65.11 1wu8 h PRO 27 Cb 0.88 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.92 1wu8 h PRO 27 CO 0.47 0.00 -0.18 0.27 -0.23 0.00 0.00 178.00 178.33 1wu8 n ASN 28 N -2.77 2.39 -4.75 1.44 6.94 -1.26 -4.95 115.26 112.31 1wu8 n ASN 28 Ca -0.02 -3.82 -0.40 0.00 -0.02 0.00 0.00 54.58 50.31 1wu8 n ASN 28 Cb 0.30 -0.61 -0.05 0.00 -2.36 0.00 0.00 39.78 37.06 1wu8 n ASN 28 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1wu8 s ALA 29 N -3.27 3.35 -0.47 -2.53 0.00 -0.81 -5.01 121.76 113.03 1wu8 s ALA 29 Ca 0.44 0.71 -0.19 0.00 0.00 0.00 0.00 51.96 52.92 1wu8 s ALA 29 Cb 0.40 -3.27 0.04 0.00 0.00 0.00 0.00 23.12 20.29 1wu8 s ALA 29 CO -0.02 0.03 0.57 0.21 0.00 0.00 0.00 175.76 176.55 1wu8 s LYS 30 N -0.99 3.14 -0.22 0.00 2.20 -1.26 -5.02 119.74 117.59 1wu8 s LYS 30 Ca 0.44 -0.76 -0.10 0.00 -0.36 0.00 0.00 55.97 55.19 1wu8 s LYS 30 Cb -0.28 -4.03 -0.05 0.00 -1.51 0.00 0.00 37.83 31.96 1wu8 s LYS 30 CO 0.34 -1.07 0.14 0.42 -0.36 0.00 0.00 175.35 174.83 1wu8 s ILE 31 N 2.50 5.33 -0.17 5.43 1.01 -1.26 -0.95 121.20 133.10 1wu8 s ILE 31 Ca 0.15 0.17 0.01 0.00 0.00 0.00 0.00 60.65 60.98 1wu8 s ILE 31 Cb -0.18 -3.46 0.01 0.00 0.01 0.00 0.00 42.46 38.84 1wu8 s ILE 31 CO 0.14 0.39 -0.18 -0.69 0.00 0.00 0.00 174.94 174.60 1wu8 s VAL 32 N 0.76 2.33 0.00 2.92 1.01 0.69 -4.98 120.40 123.14 1wu8 s VAL 32 Ca 0.07 -0.87 -0.30 0.00 0.00 0.00 0.00 61.98 60.88 1wu8 s VAL 32 Cb -0.12 -1.98 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 1wu8 s VAL 32 CO 0.02 0.53 1.00 -1.81 0.00 0.00 0.00 175.10 174.83 1wu8 s ASP 33 N 1.04 7.34 -0.17 3.32 1.01 -1.26 -1.12 116.67 126.84 1wu8 s ASP 33 Ca -0.01 1.69 -0.15 0.00 0.71 0.00 0.00 52.55 54.79 1wu8 s ASP 33 Cb -0.14 -2.57 -0.06 0.00 1.01 0.00 0.00 42.92 41.16 1wu8 s ASP 33 CO -0.05 -0.28 -0.26 0.52 0.21 0.00 0.00 175.17 175.31 1wu8 n VAL 34 N 3.91 1.47 -3.58 -1.27 0.31 0.32 -4.87 118.33 114.63 1wu8 n VAL 34 Ca 0.06 0.13 -0.08 0.00 -0.01 0.00 0.00 64.34 64.44 1wu8 n VAL 34 Cb 0.51 -2.32 -0.04 0.00 -0.91 0.00 0.00 33.84 31.08 1wu8 n VAL 34 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1wu8 s THR 35 N -2.60 0.00 -0.02 2.52 -1.32 -1.13 -5.02 115.64 108.06 1wu8 s THR 35 Ca -0.24 0.00 0.03 0.00 -1.21 0.00 0.00 61.69 60.27 1wu8 s THR 35 Cb 0.04 -1.00 0.05 0.00 -1.51 0.00 0.00 72.50 70.08 1wu8 s THR 35 CO 0.36 0.00 0.89 1.41 -2.21 0.00 0.00 174.62 175.08 1wu8 n HIS 36 N 0.42 0.00 -0.40 9.09 8.25 -1.24 -1.15 115.22 130.18 1wu8 n HIS 36 Ca -0.07 -0.23 0.07 0.00 -0.26 0.00 0.00 57.72 57.23 1wu8 n HIS 36 Cb 0.59 -0.05 0.22 0.00 1.12 0.00 0.00 29.99 31.87 1wu8 n HIS 36 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1wu8 n SER 37 N -0.31 3.50 -4.70 0.41 7.64 -1.23 0.12 113.62 119.05 1wu8 n SER 37 Ca 0.03 -2.23 -0.43 0.00 1.01 0.00 0.00 58.87 57.25 1wu8 n SER 37 Cb 0.59 -0.37 -0.01 0.00 -1.01 0.00 0.00 64.21 63.41 1wu8 n SER 37 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1wu8 n VAL 38 N 0.60 1.93 -1.66 0.44 0.31 -1.19 -4.81 118.33 113.95 1wu8 n VAL 38 Ca 0.17 -0.48 -0.47 0.00 -0.01 0.00 0.00 64.34 63.55 1wu8 n VAL 38 Cb 0.60 -1.59 -0.04 0.00 -0.91 0.00 0.00 33.84 31.90 1wu8 n VAL 38 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1wu8 n THR 39 N 0.44 0.08 -1.43 2.52 -1.04 -1.26 -4.53 114.28 109.06 1wu8 n THR 39 Ca 0.05 -0.02 -0.56 0.00 -2.04 0.00 0.00 64.05 61.48 1wu8 n THR 39 Cb 0.36 -1.43 -0.08 0.00 -1.82 0.00 0.00 70.33 67.36 1wu8 n THR 39 CO 0.00 0.00 0.00 -2.11 -0.64 0.00 0.00 175.07 172.32 1wu8 n ARG 40 N 3.17 0.00 -0.80 -2.82 1.85 -1.26 -0.51 116.66 116.30 1wu8 n ARG 40 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.02 1wu8 n ARG 40 Cb 0.28 -1.39 0.00 0.00 -1.05 0.00 0.00 32.46 30.30 1wu8 n ARG 40 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 1wu8 n HIS 41 N 1.85 0.00 -2.50 2.89 8.25 -1.26 -4.91 115.22 119.54 1wu8 n HIS 41 Ca 0.20 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.27 1wu8 n HIS 41 Cb 0.05 -1.77 -0.03 0.00 1.12 0.00 0.00 29.99 29.36 1wu8 n HIS 41 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1wu8 s SER 42 N -2.01 6.37 0.35 0.41 0.15 0.33 -4.82 113.70 114.49 1wu8 s SER 42 Ca 0.00 -1.49 0.04 0.00 0.70 0.00 0.00 55.95 55.20 1wu8 s SER 42 Cb 0.00 -2.57 0.63 0.00 -1.71 0.00 0.00 66.02 62.37 1wu8 s SER 42 CO 0.00 -1.63 1.92 0.40 1.20 0.00 0.00 173.24 175.14 1wu8 h ILE 43 N 6.70 1.18 -0.18 6.45 2.04 -1.89 -1.85 117.51 129.95 1wu8 h ILE 43 Ca 0.22 -0.60 -0.03 0.00 1.00 0.00 0.00 64.86 65.45 1wu8 h ILE 43 Cb 0.99 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.79 1wu8 h ILE 43 CO 1.41 0.22 0.01 0.25 0.00 0.00 0.00 178.15 180.04 1wu8 h LEU 44 N 0.60 0.31 -0.52 1.44 5.85 -1.93 -1.01 115.31 120.04 1wu8 h LEU 44 Ca 0.14 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.56 1wu8 h LEU 44 Cb 0.19 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 1wu8 h LEU 44 CO -0.01 0.53 0.29 -0.08 -0.34 0.00 0.00 178.44 178.84 1wu8 h GLU 45 N 0.08 0.72 -0.66 1.25 4.81 -1.73 -1.60 114.58 117.44 1wu8 h GLU 45 Ca 0.05 -0.08 0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1wu8 h GLU 45 Cb 0.37 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.57 1wu8 h GLU 45 CO 0.01 0.55 0.44 0.78 -0.73 0.00 0.00 179.01 180.05 1wu8 h GLY 46 N 0.69 0.93 1.11 1.92 0.00 -1.24 -2.13 103.07 104.35 1wu8 h GLY 46 Ca 0.18 -0.35 0.02 0.00 0.00 0.00 0.00 47.33 47.18 1wu8 h GLY 46 CO -0.03 0.34 0.57 0.23 0.00 0.00 0.00 176.54 177.65 1wu8 h SER 47 N 0.90 0.97 -0.17 0.19 0.87 -0.63 -2.61 113.55 113.07 1wu8 h SER 47 Ca 0.24 -0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 60.75 1wu8 h SER 47 Cb -0.10 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.62 1wu8 h SER 47 CO -0.05 0.69 -0.03 0.15 -0.53 0.00 0.00 176.83 177.06 1wu8 h PHE 48 N 1.13 0.36 0.00 2.24 3.57 -0.88 -1.66 116.94 121.70 1wu8 h PHE 48 Ca 0.33 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.75 1wu8 h PHE 48 Cb -0.07 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 38.58 1wu8 h PHE 48 CO -0.00 0.57 0.00 0.28 -2.23 0.00 0.00 178.31 176.93 1wu8 n VAL 49 N -4.69 0.00 0.00 1.41 0.31 -0.84 -2.18 118.33 112.35 1wu8 n VAL 49 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 1wu8 n VAL 49 Cb 0.25 -0.06 0.00 0.00 -0.91 0.00 0.00 33.84 33.12 1wu8 n VAL 49 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1wu8 n GLU 51 N 0.28 0.00 -0.18 5.55 2.13 -0.62 -2.41 120.64 125.39 1wu8 n GLU 51 Ca 0.00 0.00 -0.04 0.00 0.66 0.00 0.00 57.16 57.78 1wu8 n GLU 51 Cb 0.00 0.00 0.06 0.00 0.27 0.00 0.00 31.44 31.77 1wu8 n GLU 51 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 1wu8 h GLN 52 N 0.00 0.52 -0.44 5.31 1.08 -1.72 -1.71 115.11 118.16 1wu8 h GLN 52 Ca 0.00 -0.03 -0.09 0.00 -1.45 0.00 0.00 58.65 57.08 1wu8 h GLN 52 Cb 0.00 -0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 27.30 1wu8 h GLN 52 CO 0.00 0.35 -0.09 0.28 -0.95 0.00 0.00 178.83 178.42 1wu8 h VAL 53 N 0.54 1.27 -0.99 -0.54 2.07 -1.76 -3.03 116.25 113.81 1wu8 h VAL 53 Ca 0.23 -1.19 0.02 0.00 0.82 0.00 0.00 66.70 66.58 1wu8 h VAL 53 Cb 0.13 1.14 -0.05 0.00 -1.52 0.00 0.00 31.29 30.98 1wu8 h VAL 53 CO -0.15 0.40 0.66 0.58 0.02 0.00 0.00 177.57 179.08 1wu8 h VAL 54 N 0.67 1.23 -0.21 2.57 2.07 -1.74 -1.78 116.25 119.07 1wu8 h VAL 54 Ca 0.11 -0.45 0.06 0.00 0.82 0.00 0.00 66.70 67.24 1wu8 h VAL 54 Cb 0.62 -0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 1wu8 h VAL 54 CO 0.04 0.24 0.17 0.11 0.02 0.00 0.00 177.57 178.15 1wu8 h LYS 55 N 1.32 0.00 -0.01 1.57 1.57 -1.19 -2.85 116.57 116.98 1wu8 h LYS 55 Ca 0.37 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.15 1wu8 h LYS 55 Cb -0.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.20 1wu8 h LYS 55 CO -0.09 0.00 -0.30 0.66 -0.57 0.00 0.00 179.45 179.15 1wu8 n TYR 56 N -4.23 0.00 -2.63 -1.35 4.01 -0.93 -5.01 117.16 107.02 1wu8 n TYR 56 Ca 0.02 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.41 1wu8 n TYR 56 Cb 0.31 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.29 1wu8 n TYR 56 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1wu8 s SER 57 N -1.62 6.76 0.73 7.72 0.01 -0.71 -5.02 113.70 121.56 1wu8 s SER 57 Ca 0.09 1.91 -0.13 0.00 1.31 0.00 0.00 55.95 59.13 1wu8 s SER 57 Cb 0.09 -2.57 0.03 0.00 0.21 0.00 0.00 66.02 63.79 1wu8 s SER 57 CO 0.33 -0.49 1.10 -2.16 0.41 0.00 0.00 173.24 172.44 1wu8 s PRO 58 N -2.78 2.45 0.44 12.44 0.04 -1.26 -4.95 135.00 141.38 1wu8 s PRO 58 Ca 0.60 1.29 -0.26 0.00 0.04 0.00 0.00 61.00 62.68 1wu8 s PRO 58 Cb -0.17 -1.91 -0.08 0.00 0.04 0.00 0.00 34.50 32.37 1wu8 s PRO 58 CO 0.22 -1.51 1.39 0.15 0.04 0.00 0.00 177.00 177.29 1wu8 s LYS 59 N -4.52 3.78 0.00 4.56 -0.14 -1.26 -2.43 119.74 119.72 1wu8 s LYS 59 Ca 0.64 2.33 0.00 0.00 -1.36 0.00 0.00 55.97 57.58 1wu8 s LYS 59 Cb -0.19 -2.69 0.00 0.00 -1.68 0.00 0.00 37.83 33.27 1wu8 s LYS 59 CO 0.50 -0.71 0.00 0.41 -0.76 0.00 0.00 175.35 174.78 1wu8 n GLY 60 N 0.60 2.98 3.78 -3.33 0.00 0.32 -5.01 105.19 104.53 1wu8 n GLY 60 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 1wu8 n GLY 60 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1wu8 n THR 61 N -1.83 2.06 -4.09 2.61 -1.04 -1.02 -4.70 114.28 106.27 1wu8 n THR 61 Ca 0.00 -0.50 -0.34 0.00 -2.04 0.00 0.00 64.05 61.17 1wu8 n THR 61 Cb 0.00 -1.97 -0.10 0.00 -1.82 0.00 0.00 70.33 66.43 1wu8 n THR 61 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1wu8 s VAL 62 N -1.12 4.56 -0.24 12.58 1.01 -1.26 -0.82 120.40 135.10 1wu8 s VAL 62 Ca 0.54 -0.12 0.01 0.00 0.00 0.00 0.00 61.98 62.41 1wu8 s VAL 62 Cb -0.47 -3.05 0.04 0.00 0.00 0.00 0.00 36.38 32.90 1wu8 s VAL 62 CO 0.63 0.47 -0.11 -1.00 0.00 0.00 0.00 175.10 175.09 1wu8 s HIS 63 N 0.40 3.09 -0.24 5.22 3.76 -0.42 -0.52 115.29 126.58 1wu8 s HIS 63 Ca 0.01 -1.88 -0.11 0.00 -0.15 0.00 0.00 55.06 52.93 1wu8 s HIS 63 Cb -0.13 -1.98 -0.05 0.00 1.11 0.00 0.00 32.58 31.53 1wu8 s HIS 63 CO 0.01 -0.81 0.20 0.08 -0.85 0.00 0.00 174.74 173.37 1wu8 s VAL 64 N 1.23 5.33 -0.08 -0.90 1.01 -0.02 -0.70 120.40 126.27 1wu8 s VAL 64 Ca -0.02 0.27 0.03 0.00 0.00 0.00 0.00 61.98 62.25 1wu8 s VAL 64 Cb -0.17 -3.54 0.01 0.00 0.00 0.00 0.00 36.38 32.68 1wu8 s VAL 64 CO -0.06 0.32 -0.15 -0.83 0.00 0.00 0.00 175.10 174.37 1wu8 s GLY 65 N 1.10 0.96 -0.37 4.51 0.00 -0.56 -1.65 107.32 111.29 1wu8 s GLY 65 Ca 0.09 -0.59 0.00 0.00 0.00 0.00 0.00 44.72 44.23 1wu8 s GLY 65 CO 0.05 0.03 0.20 0.14 0.00 0.00 0.00 173.10 173.52 1wu8 s VAL 66 N 0.63 0.73 -0.41 1.40 1.01 0.18 -4.27 120.40 119.66 1wu8 s VAL 66 Ca -0.15 -1.91 0.03 0.00 0.00 0.00 0.00 61.98 59.96 1wu8 s VAL 66 Cb -0.16 -1.53 0.12 0.00 0.00 0.00 0.00 36.38 34.81 1wu8 s VAL 66 CO 0.04 -0.88 0.16 -0.63 0.00 0.00 0.00 175.10 173.79 1wu8 s ILE 67 N 0.97 2.07 -0.65 2.22 1.09 -1.26 -2.94 121.20 122.70 1wu8 s ILE 67 Ca 0.16 -2.59 0.05 0.00 -1.10 0.00 0.00 60.65 57.17 1wu8 s ILE 67 Cb -0.22 -2.49 0.18 0.00 -1.06 0.00 0.00 42.46 38.88 1wu8 s ILE 67 CO -0.06 -0.72 0.51 -0.67 -0.10 0.00 0.00 174.94 173.89 1wu8 n ASP 68 N 3.83 2.52 0.23 3.58 4.64 -1.26 -4.88 116.55 125.21 1wu8 n ASP 68 Ca 0.04 -3.10 0.09 0.00 -1.38 0.00 0.00 54.79 50.44 1wu8 n ASP 68 Cb 0.37 -0.71 0.55 0.00 -1.04 0.00 0.00 41.12 40.29 1wu8 n ASP 68 CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 1wu8 h PRO 69 N 5.23 0.00 -0.72 -0.67 0.11 -1.97 -2.91 132.00 131.06 1wu8 h PRO 69 Ca 0.17 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 66.11 1wu8 h PRO 69 Cb 0.77 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 31.77 1wu8 h PRO 69 CO 0.67 0.22 0.22 0.41 -0.21 0.00 0.00 178.00 179.32 1wu8 n GLY 70 N -0.43 3.49 3.65 -0.55 0.00 -1.26 -4.99 105.19 105.10 1wu8 n GLY 70 Ca -0.01 -0.98 -0.46 0.00 0.00 0.00 0.00 46.02 44.57 1wu8 n GLY 70 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1wu8 n VAL 71 N 0.03 0.57 -0.25 1.61 3.14 -1.10 -1.19 118.33 121.14 1wu8 n VAL 71 Ca 0.38 -0.14 0.00 0.00 -2.96 0.00 0.00 64.34 61.62 1wu8 n VAL 71 Cb 1.36 -1.33 0.00 0.00 -1.06 0.00 0.00 33.84 32.81 1wu8 n VAL 71 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1wu8 n GLY 72 N 2.53 1.46 0.00 7.55 0.00 -1.13 -4.75 105.19 110.85 1wu8 n GLY 72 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1wu8 n GLY 72 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1wu8 n THR 73 N -2.00 0.00 1.43 2.61 -2.24 -0.33 -4.98 114.28 108.77 1wu8 n THR 73 Ca 0.00 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 61.92 1wu8 n THR 73 Cb 0.00 -1.34 0.75 0.00 -2.10 0.00 0.00 70.33 67.63 1wu8 n THR 73 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1wu8 n GLU 74 N -0.38 0.48 -1.75 -0.78 4.71 -1.26 -4.87 120.64 116.79 1wu8 n GLU 74 Ca 0.00 0.01 -0.42 0.00 -0.01 0.00 0.00 57.16 56.75 1wu8 n GLU 74 Cb 0.00 -1.50 -0.01 0.00 -1.01 0.00 0.00 31.44 28.92 1wu8 n GLU 74 CO 0.00 0.00 0.00 2.89 0.09 0.00 0.00 177.13 180.11 1wu8 n ARG 75 N -1.25 2.53 -2.02 3.49 -4.01 -1.26 -4.96 116.66 109.18 1wu8 n ARG 75 Ca 0.15 0.89 -0.31 0.00 -1.04 0.00 0.00 57.85 57.53 1wu8 n ARG 75 Cb 0.21 -2.60 -0.00 0.00 -3.04 0.00 0.00 32.46 27.04 1wu8 n ARG 75 CO 0.00 0.00 0.00 1.03 -3.04 0.00 0.00 177.63 175.62 1wu8 s ARG 76 N -1.70 3.64 -0.23 2.89 0.52 -1.26 -4.88 118.95 117.93 1wu8 s ARG 76 Ca 0.56 0.86 -0.03 0.00 -0.52 0.00 0.00 55.73 56.59 1wu8 s ARG 76 Cb -0.51 -2.09 -0.00 0.00 0.52 0.00 0.00 34.95 32.87 1wu8 s ARG 76 CO 0.60 -0.53 -0.05 0.00 0.02 0.00 0.00 175.30 175.34 1wu8 s ALA 77 N -2.95 2.78 0.36 2.13 0.00 -1.26 0.31 121.76 123.12 1wu8 s ALA 77 Ca 0.57 -1.23 0.09 0.00 0.00 0.00 0.00 51.96 51.39 1wu8 s ALA 77 Cb -0.11 -1.70 -0.07 0.00 0.00 0.00 0.00 23.12 21.24 1wu8 s ALA 77 CO 0.46 -0.51 -0.07 0.96 0.00 0.00 0.00 175.76 176.59 1wu8 s ILE 78 N 1.45 2.18 -0.10 0.00 -4.36 -0.21 -0.19 121.20 119.97 1wu8 s ILE 78 Ca 0.05 -2.16 0.00 0.00 -0.26 0.00 0.00 60.65 58.28 1wu8 s ILE 78 Cb -0.15 -2.72 0.02 0.00 1.25 0.00 0.00 42.46 40.87 1wu8 s ILE 78 CO -0.04 -0.16 -0.08 -0.69 0.24 0.00 0.00 174.94 174.21 1wu8 s VAL 79 N -2.64 1.01 -0.38 8.37 1.01 -0.35 -2.09 120.40 125.33 1wu8 s VAL 79 Ca 0.33 -0.31 -0.11 0.00 0.00 0.00 0.00 61.98 61.89 1wu8 s VAL 79 Cb 0.04 -1.00 0.03 0.00 0.00 0.00 0.00 36.38 35.45 1wu8 s VAL 79 CO 0.17 0.36 0.21 -0.63 0.00 0.00 0.00 175.10 175.20 1wu8 s ILE 80 N 1.45 4.57 -0.17 2.22 1.01 0.37 -0.42 121.20 130.23 1wu8 s ILE 80 Ca -0.00 -0.89 -0.18 0.00 0.00 0.00 0.00 60.65 59.59 1wu8 s ILE 80 Cb -0.13 -3.56 -0.04 0.00 0.01 0.00 0.00 42.46 38.74 1wu8 s ILE 80 CO -0.05 -0.25 0.47 -0.70 0.00 0.00 0.00 174.94 174.41 1wu8 s GLU 81 N 1.55 4.24 0.00 2.79 2.12 0.91 -1.94 118.70 128.36 1wu8 s GLU 81 Ca 0.02 0.38 0.00 0.00 0.36 0.00 0.00 54.97 55.72 1wu8 s GLU 81 Cb -0.19 -3.51 0.00 0.00 0.26 0.00 0.00 34.13 30.69 1wu8 s GLU 81 CO 0.07 -0.00 0.00 0.41 -0.54 0.00 0.00 175.26 175.19 1wu8 n GLY 82 N 3.65 3.43 0.00 -1.50 0.00 -1.26 0.31 105.19 109.83 1wu8 n GLY 82 Ca -0.06 -0.65 0.10 0.00 0.00 0.00 0.00 46.02 45.41 1wu8 n GLY 82 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1wu8 n ASP 83 N 0.00 0.00 -3.68 1.61 5.75 -1.17 -4.58 116.55 114.48 1wu8 n ASP 83 Ca 0.00 -0.57 -0.12 0.00 -0.01 0.00 0.00 54.79 54.09 1wu8 n ASP 83 Cb 0.00 -0.04 -0.06 0.00 -1.03 0.00 0.00 41.12 40.00 1wu8 n ASP 83 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 1wu8 s GLN 84 N -2.07 0.94 0.16 0.11 -0.21 -1.26 -0.52 119.66 116.81 1wu8 s GLN 84 Ca 0.30 -0.52 0.07 0.00 0.02 0.00 0.00 55.36 55.23 1wu8 s GLN 84 Cb 0.14 0.42 -0.04 0.00 1.00 0.00 0.00 33.01 34.53 1wu8 s GLN 84 CO 0.25 -0.34 -0.01 0.71 -2.12 0.00 0.00 175.29 173.79 1wu8 s TYR 85 N -2.97 2.86 -0.06 0.91 1.51 -0.00 -4.68 117.35 114.92 1wu8 s TYR 85 Ca -0.02 -0.12 0.01 0.00 -1.01 0.00 0.00 57.07 55.92 1wu8 s TYR 85 Cb 0.00 -1.40 0.02 0.00 -0.11 0.00 0.00 41.96 40.47 1wu8 s TYR 85 CO -0.06 0.51 -0.05 -0.51 -1.11 0.00 0.00 175.55 174.33 1wu8 s LEU 86 N -2.82 1.23 -0.29 -1.29 1.43 -0.82 -1.30 118.68 114.82 1wu8 s LEU 86 Ca 0.27 -0.16 0.03 0.00 -1.03 0.00 0.00 54.13 53.24 1wu8 s LEU 86 Cb -0.10 -0.52 0.08 0.00 0.03 0.00 0.00 46.19 45.67 1wu8 s LEU 86 CO 0.18 -0.07 -0.04 -0.69 0.23 0.00 0.00 176.35 175.96 1wu8 s VAL 87 N 1.14 2.04 0.21 -1.59 1.01 0.13 -0.48 120.40 122.86 1wu8 s VAL 87 Ca -0.07 -1.80 -0.11 0.00 0.00 0.00 0.00 61.98 59.99 1wu8 s VAL 87 Cb -0.14 -2.31 -0.00 0.00 0.00 0.00 0.00 36.38 33.92 1wu8 s VAL 87 CO -0.01 -0.26 0.39 0.68 0.00 0.00 0.00 175.10 175.90 1wu8 s VAL 88 N 1.10 0.03 0.35 2.92 -7.23 -0.89 -1.50 120.40 115.18 1wu8 s VAL 88 Ca -0.01 -1.36 -0.25 0.00 -1.81 0.00 0.00 61.98 58.55 1wu8 s VAL 88 Cb -0.19 -2.02 -0.10 0.00 0.56 0.00 0.00 36.38 34.62 1wu8 s VAL 88 CO -0.07 -0.11 0.96 -2.16 -0.31 0.00 0.00 175.10 173.41 1wu8 s PRO 89 N -3.99 4.46 -1.25 4.82 0.04 -1.26 -1.04 135.00 136.78 1wu8 s PRO 89 Ca 0.20 1.32 -0.18 0.00 0.04 0.00 0.00 61.00 62.38 1wu8 s PRO 89 Cb 0.01 -2.65 0.00 0.00 0.04 0.00 0.00 34.50 31.90 1wu8 s PRO 89 CO 0.05 0.17 1.93 -3.47 0.04 0.00 0.00 177.00 175.71 1wu8 n ASP 90 N 0.26 3.99 -0.27 6.66 2.03 0.15 -4.34 116.55 125.03 1wu8 n ASP 90 Ca 0.03 -2.83 0.01 0.00 0.52 0.00 0.00 54.79 52.53 1wu8 n ASP 90 Cb 0.51 -1.64 0.01 0.00 -0.72 0.00 0.00 41.12 39.28 1wu8 n ASP 90 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 1wu8 n ASN 91 N 8.82 0.29 0.00 1.67 0.23 -1.26 -4.50 115.26 120.51 1wu8 n ASN 91 Ca 0.49 -1.74 0.00 0.00 -0.53 0.00 0.00 54.58 52.80 1wu8 n ASN 91 Cb 0.44 -0.14 0.00 0.00 -2.08 0.00 0.00 39.78 38.00 1wu8 n ASN 91 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1wu8 n GLY 92 N -0.14 0.57 0.31 4.83 0.00 -1.24 -4.86 105.19 104.66 1wu8 n GLY 92 Ca 0.01 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.18 1wu8 n GLY 92 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1wu8 h LEU 93 N 0.00 0.00 -0.16 0.99 5.85 -1.84 -1.64 115.31 118.51 1wu8 h LEU 93 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1wu8 h LEU 93 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 1wu8 h LEU 93 CO 0.00 0.00 -0.14 0.00 -0.34 0.00 0.00 178.44 177.96 1wu8 n ALA 94 N -2.40 2.78 -0.13 1.25 0.00 -1.26 -4.24 120.51 116.50 1wu8 n ALA 94 Ca -0.00 -0.25 -0.08 0.00 0.00 0.00 0.00 53.44 53.12 1wu8 n ALA 94 Cb 0.23 -1.33 -0.06 0.00 0.00 0.00 0.00 19.45 18.29 1wu8 n ALA 94 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1wu8 h THR 95 N 0.38 0.00 -0.40 0.00 2.02 -1.59 -1.33 112.91 111.99 1wu8 h THR 95 Ca 0.00 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.13 1wu8 h THR 95 Cb 0.40 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 66.79 1wu8 h THR 95 CO 0.00 0.00 0.07 -0.07 0.37 0.00 0.00 175.52 175.89 1wu8 h LEU 96 N -0.16 0.64 -1.20 2.58 3.38 -1.80 -3.11 115.31 115.64 1wu8 h LEU 96 Ca 0.06 -0.26 0.07 0.00 0.09 0.00 0.00 57.88 57.84 1wu8 h LEU 96 Cb 0.31 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 40.84 1wu8 h LEU 96 CO -0.41 0.73 0.56 -0.65 0.09 0.00 0.00 178.44 178.77 1wu8 h PRO 97 N 0.52 0.93 -0.28 1.13 0.11 -1.69 -1.50 132.00 131.21 1wu8 h PRO 97 Ca 0.12 -0.06 0.08 0.00 0.11 0.00 0.00 66.00 66.26 1wu8 h PRO 97 Cb 0.37 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.25 1wu8 h PRO 97 CO 0.01 0.62 0.28 -0.07 -0.21 0.00 0.00 178.00 178.62 1wu8 h LEU 98 N 0.96 0.00 -0.50 2.35 3.38 -1.17 -0.71 115.31 119.62 1wu8 h LEU 98 Ca 0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.34 1wu8 h LEU 98 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1wu8 h LEU 98 CO -0.14 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.68 1wu8 n LYS 99 N -3.92 0.06 -0.49 1.13 5.02 -0.57 -2.26 118.16 117.13 1wu8 n LYS 99 Ca 0.04 0.52 0.05 0.00 -2.02 0.00 0.00 58.31 56.90 1wu8 n LYS 99 Cb 0.43 -1.67 0.07 0.00 -0.02 0.00 0.00 35.03 33.84 1wu8 n LYS 99 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1wu8 n HIS 100 N -1.79 0.00 -4.31 2.13 8.25 -0.27 -5.03 115.22 114.21 1wu8 n HIS 100 Ca -0.00 -0.58 -0.22 0.00 -0.26 0.00 0.00 57.72 56.65 1wu8 n HIS 100 Cb 0.04 -0.12 -0.17 0.00 1.12 0.00 0.00 29.99 30.86 1wu8 n HIS 100 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1wu8 s ILE 101 N -1.36 0.81 -0.45 1.59 1.01 -0.96 -4.93 121.20 116.91 1wu8 s ILE 101 Ca 0.20 -0.27 -0.19 0.00 0.00 0.00 0.00 60.65 60.38 1wu8 s ILE 101 Cb 0.19 -0.79 0.03 0.00 0.01 0.00 0.00 42.46 41.90 1wu8 s ILE 101 CO -0.02 0.29 0.59 -1.59 0.00 0.00 0.00 174.94 174.21 1wu8 s LYS 102 N 0.90 3.19 0.21 2.79 -2.85 -1.26 -4.92 119.74 117.80 1wu8 s LYS 102 Ca -0.11 -0.59 -0.30 0.00 -1.00 0.00 0.00 55.97 53.97 1wu8 s LYS 102 Cb -0.15 -3.99 -0.09 0.00 -2.06 0.00 0.00 37.83 31.54 1wu8 s LYS 102 CO 0.01 -1.02 1.35 0.08 0.10 0.00 0.00 175.35 175.87 1wu8 s VAL 103 N 2.61 3.06 -0.21 1.79 1.01 -1.26 -3.03 120.40 124.36 1wu8 s VAL 103 Ca 0.18 0.87 -0.08 0.00 0.00 0.00 0.00 61.98 62.95 1wu8 s VAL 103 Cb -0.16 -3.55 -0.10 0.00 0.00 0.00 0.00 36.38 32.57 1wu8 s VAL 103 CO 0.16 0.13 -0.25 1.17 0.00 0.00 0.00 175.10 176.30 1wu8 n LYS 104 N 2.63 0.46 -3.78 2.72 4.81 0.15 -4.94 118.16 120.20 1wu8 n LYS 104 Ca 0.07 0.18 -0.10 0.00 -0.87 0.00 0.00 58.31 57.59 1wu8 n LYS 104 Cb 0.42 -1.28 -0.06 0.00 0.02 0.00 0.00 35.03 34.13 1wu8 n LYS 104 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 1wu8 s SER 105 N -6.72 -0.04 -0.01 3.14 0.01 -0.60 -5.02 113.70 104.45 1wu8 s SER 105 Ca -0.29 -0.55 0.03 0.00 1.31 0.00 0.00 55.95 56.45 1wu8 s SER 105 Cb 0.11 0.42 -0.01 0.00 0.21 0.00 0.00 66.02 66.75 1wu8 s SER 105 CO 0.39 -0.82 -0.11 -0.69 0.41 0.00 0.00 173.24 172.42 1wu8 s VAL 106 N -3.86 0.89 0.14 3.43 1.01 -1.26 -0.07 120.40 120.68 1wu8 s VAL 106 Ca 0.06 -0.46 0.06 0.00 0.00 0.00 0.00 61.98 61.64 1wu8 s VAL 106 Cb 0.03 -0.75 -0.04 0.00 0.00 0.00 0.00 36.38 35.62 1wu8 s VAL 106 CO -0.09 0.26 -0.13 -0.31 0.00 0.00 0.00 175.10 174.83 1wu8 s TYR 107 N -0.13 1.38 -0.21 5.22 2.02 0.44 -0.97 117.35 125.10 1wu8 s TYR 107 Ca 0.02 -0.61 -0.04 0.00 -0.37 0.00 0.00 57.07 56.07 1wu8 s TYR 107 Cb -0.06 -0.71 -0.01 0.00 -0.40 0.00 0.00 41.96 40.79 1wu8 s TYR 107 CO -0.00 0.15 -0.04 -2.00 -1.57 0.00 0.00 175.55 172.09 1wu8 s GLU 108 N -3.06 3.42 0.06 -0.62 2.12 0.21 -1.21 118.70 119.62 1wu8 s GLU 108 Ca 0.12 -0.61 -0.31 0.00 0.36 0.00 0.00 54.97 54.54 1wu8 s GLU 108 Cb -0.02 -3.01 -0.07 0.00 0.26 0.00 0.00 34.13 31.28 1wu8 s GLU 108 CO 0.03 -0.15 1.46 0.42 -0.54 0.00 0.00 175.26 176.48 1wu8 s ILE 109 N 1.37 3.36 -0.42 -3.70 1.01 0.74 -1.74 121.20 121.82 1wu8 s ILE 109 Ca 0.04 0.87 -0.17 0.00 0.00 0.00 0.00 60.65 61.39 1wu8 s ILE 109 Cb -0.14 -3.56 0.02 0.00 0.01 0.00 0.00 42.46 38.79 1wu8 s ILE 109 CO -0.02 0.02 0.44 -0.63 0.00 0.00 0.00 174.94 174.76 1wu8 s ILE 110 N 1.95 5.08 0.24 2.92 1.01 -0.35 -4.72 121.20 127.33 1wu8 s ILE 110 Ca 0.67 -0.34 -0.11 0.00 0.00 0.00 0.00 60.65 60.86 1wu8 s ILE 110 Cb -0.36 -4.05 0.34 0.00 0.01 0.00 0.00 42.46 38.40 1wu8 s ILE 110 CO 0.29 -0.43 1.59 -0.65 0.00 0.00 0.00 174.94 175.74 1wu8 h PRO 111 N 8.74 -0.01 -0.09 2.79 0.11 -1.94 -0.18 132.00 141.43 1wu8 h PRO 111 Ca -0.26 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.84 1wu8 h PRO 111 Cb 1.11 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 1wu8 h PRO 111 CO 0.80 -0.01 -0.00 -0.44 -0.21 0.00 0.00 178.00 178.14 1wu8 h ASP 112 N -0.01 0.10 0.56 -2.05 5.19 -1.96 -0.54 116.42 117.72 1wu8 h ASP 112 Ca 0.38 -0.01 -0.21 0.00 -0.62 0.00 0.00 57.03 56.58 1wu8 h ASP 112 Cb 0.60 -0.03 -0.01 0.00 0.18 0.00 0.00 39.33 40.07 1wu8 h ASP 112 CO -0.84 0.14 -0.92 0.11 -3.12 0.00 0.00 179.24 174.60 1wu8 h LYS 113 N 0.12 0.23 -0.33 3.56 1.57 -1.37 -3.12 116.57 117.23 1wu8 h LYS 113 Ca 0.03 -0.26 -0.15 0.00 -1.87 0.00 0.00 60.65 58.40 1wu8 h LYS 113 Cb 0.09 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1wu8 h LYS 113 CO 0.00 1.00 -0.40 0.82 -0.57 0.00 0.00 179.45 180.30 1wu8 h ILE 114 N 0.12 1.28 0.00 1.86 1.08 -0.68 -2.83 117.51 118.35 1wu8 h ILE 114 Ca -0.06 -1.57 -0.02 0.00 -0.39 0.00 0.00 64.86 62.83 1wu8 h ILE 114 Cb 1.56 1.45 -0.00 0.00 -3.07 0.00 0.00 36.82 36.76 1wu8 h ILE 114 CO 0.14 0.51 -0.07 -0.09 -0.69 0.00 0.00 178.15 177.95 1wu8 h ARG 115 N 0.65 0.00 0.00 2.37 2.43 -1.13 -0.23 114.38 118.46 1wu8 h ARG 115 Ca 0.05 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.13 1wu8 h ARG 115 Cb 0.96 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.49 1wu8 h ARG 115 CO 0.09 0.07 -0.45 0.87 -1.51 0.00 0.00 179.97 179.04 1wu8 h LYS 116 N 0.00 0.00 0.17 0.20 1.57 -1.44 -1.66 116.57 115.41 1wu8 h LYS 116 Ca -0.00 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.43 1wu8 h LYS 116 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1wu8 h LYS 116 CO 0.01 0.45 -1.78 0.74 -0.57 0.00 0.00 179.45 178.30 1wu8 h PHE 117 N 0.00 0.63 0.01 -1.35 0.04 -1.12 -3.40 116.94 111.75 1wu8 h PHE 117 Ca -0.00 -0.46 -0.00 0.00 2.80 0.00 0.00 57.97 60.30 1wu8 h PHE 117 Cb 0.81 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.93 1wu8 h PHE 117 CO 0.00 1.66 -0.00 1.79 -0.60 0.00 0.00 178.31 181.16 1wu8 h THR 118 N 0.10 1.54 0.00 -1.55 1.35 -1.28 -3.49 112.91 109.58 1wu8 h THR 118 Ca -0.35 -2.00 0.00 0.00 -0.55 0.00 0.00 66.41 63.51 1wu8 h THR 118 Cb 2.08 2.84 0.00 0.00 -1.73 0.00 0.00 68.15 71.34 1wu8 h THR 118 CO 0.16 0.49 0.00 0.61 -0.25 0.00 0.00 175.52 176.53 1wu8 n GLY 119 N 1.36 0.34 3.46 5.82 0.00 -0.63 -5.04 105.19 110.51 1wu8 n GLY 119 Ca -0.09 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.67 1wu8 n GLY 119 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1wu8 s TRP 120 N -2.10 2.35 0.53 1.61 -2.14 -1.26 -5.09 118.94 112.83 1wu8 s TRP 120 Ca 0.00 -0.33 -0.22 0.00 2.66 0.00 0.00 56.10 58.21 1wu8 s TRP 120 Cb 0.00 -1.11 -0.05 0.00 -3.10 0.00 0.00 33.47 29.21 1wu8 s TRP 120 CO 0.00 0.58 1.34 -2.00 -2.66 0.00 0.00 176.95 174.21 1wu8 s GLU 121 N -3.01 3.27 -0.21 3.25 2.12 -1.26 -4.87 118.70 117.99 1wu8 s GLU 121 Ca 0.25 2.19 -0.18 0.00 0.36 0.00 0.00 54.97 57.58 1wu8 s GLU 121 Cb -0.07 -2.31 -0.03 0.00 0.26 0.00 0.00 34.13 31.98 1wu8 s GLU 121 CO 0.12 -1.07 0.53 0.42 -0.54 0.00 0.00 175.26 174.72 1wu8 s ILE 122 N -1.32 5.09 1.12 -3.70 1.01 -1.26 -4.99 121.20 117.15 1wu8 s ILE 122 Ca 0.69 0.96 -0.18 0.00 0.00 0.00 0.00 60.65 62.12 1wu8 s ILE 122 Cb -0.39 -3.85 0.26 0.00 0.01 0.00 0.00 42.46 38.49 1wu8 s ILE 122 CO 0.47 0.15 1.20 -0.94 0.00 0.00 0.00 174.94 175.81 1wu8 s SER 123 N 1.24 1.70 -0.03 3.58 1.04 -1.26 -5.00 113.70 114.96 1wu8 s SER 123 Ca 0.24 0.47 0.17 0.00 0.48 0.00 0.00 55.95 57.30 1wu8 s SER 123 Cb -0.15 -0.61 -0.26 0.00 0.10 0.00 0.00 66.02 65.09 1wu8 s SER 123 CO 0.09 -3.63 0.36 -1.20 0.98 0.00 0.00 173.24 169.84 1wu8 n SER 124 N -4.40 1.11 -0.37 7.02 7.64 -1.26 -4.60 113.62 118.76 1wu8 n SER 124 Ca 0.14 0.00 0.04 0.00 1.01 0.00 0.00 58.87 60.07 1wu8 n SER 124 Cb 0.59 1.73 0.04 0.00 -1.01 0.00 0.00 64.21 65.57 1wu8 n SER 124 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1wu8 n THR 125 N -2.12 0.06 -3.19 0.44 -2.24 -1.26 -2.86 114.28 103.12 1wu8 n THR 125 Ca -0.04 -0.53 -0.22 0.00 -2.27 0.00 0.00 64.05 60.98 1wu8 n THR 125 Cb 0.48 1.14 -0.06 0.00 -2.10 0.00 0.00 70.33 69.79 1wu8 n THR 125 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1wu8 n PHE 126 N 0.49 -0.18 0.25 4.78 -0.00 -1.26 -4.92 117.46 116.62 1wu8 n PHE 126 Ca 0.06 -3.65 0.14 0.00 -0.00 0.00 0.00 57.45 54.00 1wu8 n PHE 126 Cb 0.24 -0.37 0.50 0.00 -0.00 0.00 0.00 39.48 39.84 1wu8 n PHE 126 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 1wu8 h HIS 127 N 3.68 0.00 -0.69 -5.13 3.86 -1.87 -2.84 115.15 112.16 1wu8 h HIS 127 Ca 0.08 0.00 0.02 0.00 -1.16 0.00 0.00 60.37 59.31 1wu8 h HIS 127 Cb 0.91 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.34 1wu8 h HIS 127 CO 0.40 0.07 0.45 0.78 0.86 0.00 0.00 177.93 180.50 1wu8 h GLY 128 N 2.53 0.95 1.40 2.45 0.00 -1.95 0.54 103.07 108.99 1wu8 h GLY 128 Ca -0.00 -0.34 -0.28 0.00 0.00 0.00 0.00 47.33 46.71 1wu8 h GLY 128 CO 0.01 0.31 -1.42 -0.09 0.00 0.00 0.00 176.54 175.36 1wu8 h ARG 129 N 0.87 0.16 -0.00 4.80 2.43 -1.89 0.13 114.38 120.88 1wu8 h ARG 129 Ca 0.26 -0.27 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1wu8 h ARG 129 Cb -0.01 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 1wu8 h ARG 129 CO -0.07 1.01 -0.85 -0.25 -1.51 0.00 0.00 179.97 178.30 1wu8 n ASP 130 N -3.38 0.89 0.09 -3.80 10.43 -1.03 -4.49 116.55 115.25 1wu8 n ASP 130 Ca -0.12 -0.94 0.00 0.00 2.57 0.00 0.00 54.79 56.29 1wu8 n ASP 130 Cb 1.02 0.98 0.00 0.00 1.84 0.00 0.00 41.12 44.96 1wu8 n ASP 130 CO 0.00 0.00 0.00 -0.38 -1.07 0.00 0.00 177.20 175.75 1wu8 n ILE 131 N -1.39 0.31 0.11 0.53 5.41 0.18 -4.81 119.36 119.69 1wu8 n ILE 131 Ca 0.04 0.10 -0.13 0.00 1.00 0.00 0.00 62.75 63.75 1wu8 n ILE 131 Cb 0.29 -0.73 -0.08 0.00 -0.71 0.00 0.00 39.64 38.41 1wu8 n ILE 131 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 176.55 176.29 1wu8 h PHE 132 N 0.00 -0.21 0.09 1.39 0.04 -1.31 -0.63 116.94 116.31 1wu8 h PHE 132 Ca 0.00 -0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.79 1wu8 h PHE 132 Cb 0.00 0.07 -0.04 0.00 2.20 0.00 0.00 35.95 38.18 1wu8 h PHE 132 CO 0.00 -0.03 -0.33 0.78 -0.60 0.00 0.00 178.31 178.13 1wu8 h GLY 133 N -0.35 -0.62 0.37 -1.45 0.00 -0.94 -0.61 103.07 99.47 1wu8 h GLY 133 Ca -0.02 0.40 0.09 0.00 0.00 0.00 0.00 47.33 47.79 1wu8 h GLY 133 CO 0.04 -0.25 0.14 -2.55 0.00 0.00 0.00 176.54 173.92 1wu8 h PRO 134 N -0.54 0.28 -0.35 4.80 0.11 -1.77 -1.26 132.00 133.27 1wu8 h PRO 134 Ca 0.04 -0.02 0.05 0.00 0.11 0.00 0.00 66.00 66.18 1wu8 h PRO 134 Cb 0.59 -0.06 -0.05 0.00 0.11 0.00 0.00 31.00 31.58 1wu8 h PRO 134 CO -0.21 0.19 0.04 0.00 -0.21 0.00 0.00 178.00 177.81 1wu8 h ALA 135 N 1.40 0.35 -0.41 -0.75 0.00 -0.56 0.13 119.26 119.40 1wu8 h ALA 135 Ca 0.27 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1wu8 h ALA 135 Cb 0.35 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1wu8 h ALA 135 CO -0.32 -0.36 0.27 0.78 0.00 0.00 0.00 179.25 179.62 1wu8 h GLY 136 N 0.15 0.59 1.01 0.00 0.00 -0.58 -1.82 103.07 102.42 1wu8 h GLY 136 Ca 0.17 -0.23 -0.00 0.00 0.00 0.00 0.00 47.33 47.26 1wu8 h GLY 136 CO -0.24 0.22 0.56 0.00 0.00 0.00 0.00 176.54 177.08 1wu8 h ALA 137 N 1.14 1.15 -0.23 3.60 0.00 -0.54 -0.80 119.26 123.57 1wu8 h ALA 137 Ca 0.15 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1wu8 h ALA 137 Cb -0.04 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.38 1wu8 h ALA 137 CO -0.03 0.59 0.06 -0.07 0.00 0.00 0.00 179.25 179.80 1wu8 h LEU 138 N 1.24 0.36 -1.20 0.00 3.38 -0.42 -2.65 115.31 116.01 1wu8 h LEU 138 Ca 0.33 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1wu8 h LEU 138 Cb -0.08 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 1wu8 h LEU 138 CO -0.06 0.50 0.36 0.40 0.09 0.00 0.00 178.44 179.72 1wu8 h ILE 139 N 0.20 1.20 -0.32 1.22 2.04 -1.06 -1.40 117.51 119.38 1wu8 h ILE 139 Ca 0.07 -0.50 -0.03 0.00 1.00 0.00 0.00 64.86 65.40 1wu8 h ILE 139 Cb 0.28 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 1wu8 h ILE 139 CO 0.00 0.22 0.06 -0.08 0.00 0.00 0.00 178.15 178.35 1wu8 h GLU 140 N 0.92 0.48 -0.58 2.37 4.57 -0.88 -2.23 114.58 119.23 1wu8 h GLU 140 Ca 0.23 -0.08 0.00 0.00 -1.18 0.00 0.00 59.36 58.33 1wu8 h GLU 140 Cb 0.03 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 28.54 1wu8 h GLU 140 CO -0.04 0.46 0.00 0.36 -1.18 0.00 0.00 179.01 178.61 1wu8 n LYS 141 N -4.34 2.60 0.00 1.92 2.85 -0.99 -4.94 118.16 115.26 1wu8 n LYS 141 Ca 0.02 -2.02 0.00 0.00 -1.05 0.00 0.00 58.31 55.25 1wu8 n LYS 141 Cb 0.19 -1.56 0.00 0.00 -0.65 0.00 0.00 35.03 33.01 1wu8 n LYS 141 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1wu8 n GLY 142 N 1.17 0.43 3.73 2.58 0.00 -0.84 -5.08 105.19 107.18 1wu8 n GLY 142 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 1wu8 n GLY 142 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wu8 s ILE 143 N -2.00 3.71 0.28 -0.61 1.09 -0.56 -4.99 121.20 118.12 1wu8 s ILE 143 Ca 0.00 1.42 -0.29 0.00 -1.10 0.00 0.00 60.65 60.68 1wu8 s ILE 143 Cb 0.00 -3.91 -0.09 0.00 -1.06 0.00 0.00 42.46 37.40 1wu8 s ILE 143 CO 0.00 0.22 1.07 -1.00 -0.10 0.00 0.00 174.94 175.13 1wu8 s HIS 144 N 0.02 3.63 0.50 3.97 3.76 -1.26 -4.10 115.29 121.81 1wu8 s HIS 144 Ca 0.52 1.73 0.24 0.00 -0.15 0.00 0.00 55.06 57.41 1wu8 s HIS 144 Cb -0.31 -3.23 1.33 0.00 1.11 0.00 0.00 32.58 31.47 1wu8 s HIS 144 CO 0.35 -0.40 1.95 -1.35 -0.85 0.00 0.00 174.74 174.44 1wu8 h PRO 145 N 3.81 0.11 -0.21 8.40 0.11 -1.96 -1.28 132.00 140.97 1wu8 h PRO 145 Ca -0.47 -0.01 0.06 0.00 0.11 0.00 0.00 66.00 65.70 1wu8 h PRO 145 Cb 1.21 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1wu8 h PRO 145 CO 0.67 0.07 0.16 0.93 -0.21 0.00 0.00 178.00 179.62 1wu8 h GLU 146 N 0.11 0.00 0.00 1.05 3.07 -1.92 -1.34 114.58 115.55 1wu8 h GLU 146 Ca 0.33 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.19 1wu8 h GLU 146 Cb 1.14 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.05 1wu8 h GLU 146 CO -0.04 0.00 -0.02 0.93 -1.40 0.00 0.00 179.01 178.48 1wu8 h GLU 147 N 0.00 0.00 0.00 2.33 4.39 -1.62 -3.02 114.58 116.66 1wu8 h GLU 147 Ca 0.10 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.74 1wu8 h GLU 147 Cb 0.41 0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 28.93 1wu8 h GLU 147 CO -0.00 0.02 -0.61 1.97 -1.16 0.00 0.00 179.01 179.22 1wu8 n PHE 148 N -4.51 0.00 -3.76 4.33 -1.74 -0.60 -4.91 117.46 106.27 1wu8 n PHE 148 Ca -0.03 -0.93 -0.02 0.00 -0.56 0.00 0.00 57.45 55.90 1wu8 n PHE 148 Cb 0.11 -0.18 -0.00 0.00 1.52 0.00 0.00 39.48 40.92 1wu8 n PHE 148 CO 0.00 0.00 0.00 0.20 -0.56 0.00 0.00 176.76 176.40 1wu8 s GLY 149 N -2.53 -0.19 0.01 4.97 0.00 -0.65 -1.22 107.32 107.71 1wu8 s GLY 149 Ca 0.32 0.13 0.07 0.00 0.00 0.00 0.00 44.72 45.24 1wu8 s GLY 149 CO -0.08 0.59 -0.21 1.09 0.00 0.00 0.00 173.10 174.48 1wu8 s ARG 150 N -2.88 1.60 0.39 2.90 1.70 -0.71 -4.41 118.95 117.54 1wu8 s ARG 150 Ca 0.15 -0.86 -0.27 0.00 -0.47 0.00 0.00 55.73 54.28 1wu8 s ARG 150 Cb -0.00 -1.63 -0.09 0.00 -0.57 0.00 0.00 34.95 32.65 1wu8 s ARG 150 CO 0.02 0.43 1.35 -2.00 -1.08 0.00 0.00 175.30 174.02 1wu8 s GLU 151 N -0.83 4.04 0.08 3.89 2.12 -1.26 -0.62 118.70 126.12 1wu8 s GLU 151 Ca 0.08 2.26 0.01 0.00 0.36 0.00 0.00 54.97 57.69 1wu8 s GLU 151 Cb -0.09 -2.85 -0.04 0.00 0.26 0.00 0.00 34.13 31.42 1wu8 s GLU 151 CO 0.00 -0.47 -0.05 0.96 -0.54 0.00 0.00 175.26 175.16 1wu8 s ILE 152 N -1.21 0.55 0.17 -3.70 -4.36 -0.14 -4.84 121.20 107.68 1wu8 s ILE 152 Ca 0.55 -1.90 -0.32 0.00 -0.26 0.00 0.00 60.65 58.72 1wu8 s ILE 152 Cb -0.40 -1.64 -0.11 0.00 1.25 0.00 0.00 42.46 41.56 1wu8 s ILE 152 CO 0.53 -0.91 1.76 -2.84 0.24 0.00 0.00 174.94 173.72 1wu8 s PRO 153 N -3.86 4.13 0.36 0.37 0.02 -1.26 -4.18 135.00 130.58 1wu8 s PRO 153 Ca 0.10 2.59 0.12 0.00 0.02 0.00 0.00 61.00 63.83 1wu8 s PRO 153 Cb 0.06 -3.27 0.90 0.00 0.02 0.00 0.00 34.50 32.21 1wu8 s PRO 153 CO -0.06 -0.78 1.81 0.28 -0.33 0.00 0.00 177.00 177.92 1wu8 h VAL 154 N 4.15 0.69 -0.45 3.83 2.07 -1.97 0.92 116.25 125.50 1wu8 h VAL 154 Ca -0.44 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 66.87 1wu8 h VAL 154 Cb 1.21 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 1wu8 h VAL 154 CO 0.95 0.11 0.00 -0.90 0.02 0.00 0.00 177.57 177.75 1wu8 n ASP 155 N -4.63 2.90 -0.35 0.57 5.75 -1.26 -3.77 116.55 115.76 1wu8 n ASP 155 Ca 0.21 -2.15 0.13 0.00 -0.01 0.00 0.00 54.79 52.98 1wu8 n ASP 155 Cb 0.64 -0.39 0.32 0.00 -1.03 0.00 0.00 41.12 40.66 1wu8 n ASP 155 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1wu8 n SER 156 N 0.77 1.33 -4.85 -1.12 3.41 0.32 -4.92 113.62 108.56 1wu8 n SER 156 Ca 0.16 -1.12 -0.34 0.00 -0.26 0.00 0.00 58.87 57.31 1wu8 n SER 156 Cb 0.51 0.17 -0.06 0.00 -0.26 0.00 0.00 64.21 64.57 1wu8 n SER 156 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1wu8 s ILE 157 N -2.41 4.83 0.45 -1.33 -4.36 -1.25 -5.04 121.20 112.10 1wu8 s ILE 157 Ca 0.25 0.74 -0.25 0.00 -0.26 0.00 0.00 60.65 61.14 1wu8 s ILE 157 Cb 0.19 -3.68 -0.09 0.00 1.25 0.00 0.00 42.46 40.14 1wu8 s ILE 157 CO 0.49 0.05 1.29 0.52 0.24 0.00 0.00 174.94 177.54 1wu8 n VAL 158 N 0.25 2.77 -4.21 8.37 0.31 -1.26 -4.99 118.33 119.57 1wu8 n VAL 158 Ca -0.01 -0.50 -0.17 0.00 -0.01 0.00 0.00 64.34 63.65 1wu8 n VAL 158 Cb 0.52 -1.61 -0.13 0.00 -0.91 0.00 0.00 33.84 31.71 1wu8 n VAL 158 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1wu8 s LYS 159 N -2.34 0.67 0.39 5.55 -0.14 -1.26 -3.66 119.74 118.95 1wu8 s LYS 159 Ca 0.63 -0.61 0.00 0.00 -1.36 0.00 0.00 55.97 54.62 1wu8 s LYS 159 Cb -0.48 -0.59 -0.02 0.00 -1.68 0.00 0.00 37.83 35.06 1wu8 s LYS 159 CO 0.57 0.14 0.61 -0.51 -0.76 0.00 0.00 175.35 175.39 1wu8 s LEU 160 N -1.03 3.86 -0.45 3.17 1.43 -1.26 -4.89 118.68 119.51 1wu8 s LEU 160 Ca -0.02 0.41 -0.16 0.00 -1.03 0.00 0.00 54.13 53.33 1wu8 s LEU 160 Cb -0.07 -3.29 0.05 0.00 0.03 0.00 0.00 46.19 42.91 1wu8 s LEU 160 CO 0.01 -0.46 0.38 0.21 0.23 0.00 0.00 176.35 176.72 1wu8 s ASN 161 N -4.11 6.15 0.00 2.29 2.47 -1.26 -4.86 114.94 115.62 1wu8 s ASN 161 Ca 0.44 -1.06 0.02 0.00 0.42 0.00 0.00 52.86 52.68 1wu8 s ASN 161 Cb -0.10 -2.19 0.02 0.00 -1.45 0.00 0.00 41.25 37.53 1wu8 s ASN 161 CO 0.37 -0.59 0.58 1.33 -3.72 0.00 0.00 177.10 175.07 1wu8 n VAL 162 N 5.25 0.00 -2.49 -5.21 0.24 -1.26 -5.03 118.33 109.84 1wu8 n VAL 162 Ca -0.11 -0.50 -0.41 0.00 -2.04 0.00 0.00 64.34 61.28 1wu8 n VAL 162 Cb 0.45 1.05 -0.04 0.00 -1.47 0.00 0.00 33.84 33.84 1wu8 n VAL 162 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1wu8 s GLU 163 N -0.21 4.53 0.13 7.34 0.41 -1.26 -4.92 118.70 124.72 1wu8 s GLU 163 Ca 0.03 1.73 -0.19 0.00 -0.41 0.00 0.00 54.97 56.12 1wu8 s GLU 163 Cb 0.02 -3.31 -0.07 0.00 -1.78 0.00 0.00 34.13 28.99 1wu8 s GLU 163 CO 0.03 -0.05 0.63 -1.25 -0.49 0.00 0.00 175.26 174.13 1wu8 s PRO 164 N 0.15 4.23 0.16 0.39 0.04 -1.26 -5.01 135.00 133.69 1wu8 s PRO 164 Ca 0.53 0.78 0.05 0.00 0.04 0.00 0.00 61.00 62.40 1wu8 s PRO 164 Cb -0.29 -3.12 -0.04 0.00 0.04 0.00 0.00 34.50 31.09 1wu8 s PRO 164 CO 0.33 0.55 0.12 -0.98 0.04 0.00 0.00 177.00 177.07 1wu8 s ARG 165 N -1.43 2.86 -0.08 4.56 1.70 -1.16 -4.97 118.95 120.43 1wu8 s ARG 165 Ca 0.34 -0.88 0.02 0.00 -0.47 0.00 0.00 55.73 54.74 1wu8 s ARG 165 Cb -0.19 -2.63 0.02 0.00 -0.57 0.00 0.00 34.95 31.58 1wu8 s ARG 165 CO 0.21 0.49 -0.11 0.21 -1.08 0.00 0.00 175.30 175.01 1wu8 s LYS 166 N -3.06 1.70 -0.33 3.89 2.20 -1.26 -0.41 119.74 122.47 1wu8 s LYS 166 Ca 0.31 -0.39 -0.01 0.00 -0.36 0.00 0.00 55.97 55.52 1wu8 s LYS 166 Cb -0.10 -1.48 0.07 0.00 -1.51 0.00 0.00 37.83 34.81 1wu8 s LYS 166 CO 0.23 -0.05 0.05 -1.21 -0.36 0.00 0.00 175.35 174.02 1wu8 s GLU 167 N 0.92 2.19 7.92 4.03 0.41 0.13 -4.96 118.70 129.34 1wu8 s GLU 167 Ca -0.10 -1.49 0.00 0.00 -0.41 0.00 0.00 54.97 52.97 1wu8 s GLU 167 Cb -0.15 -3.27 0.00 0.00 -1.78 0.00 0.00 34.13 28.93 1wu8 s GLU 167 CO 0.01 -0.77 0.00 0.41 -0.49 0.00 0.00 175.26 174.41 1wu8 n GLY 168 N 4.56 2.62 0.96 -1.39 0.00 -1.26 -2.34 105.19 108.34 1wu8 n GLY 168 Ca -0.08 -0.34 0.08 0.00 0.00 0.00 0.00 46.02 45.67 1wu8 n GLY 168 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1wu8 n ASP 169 N 8.88 3.51 -4.49 1.61 5.68 -1.26 -4.96 116.55 125.52 1wu8 n ASP 169 Ca 0.00 -2.15 -0.34 0.00 -0.50 0.00 0.00 54.79 51.80 1wu8 n ASP 169 Cb 0.00 -0.37 -0.12 0.00 -1.14 0.00 0.00 41.12 39.49 1wu8 n ASP 169 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1wu8 s VAL 170 N -1.27 3.89 -0.07 2.12 1.01 -0.99 -4.38 120.40 120.71 1wu8 s VAL 170 Ca 0.35 -0.35 -0.20 0.00 0.00 0.00 0.00 61.98 61.78 1wu8 s VAL 170 Cb 0.20 -2.71 -0.04 0.00 0.00 0.00 0.00 36.38 33.82 1wu8 s VAL 170 CO 0.21 0.48 0.55 0.26 0.00 0.00 0.00 175.10 176.60 1wu8 s TRP 171 N 0.46 3.58 -0.50 5.22 0.52 0.22 -0.70 118.94 127.75 1wu8 s TRP 171 Ca -0.03 1.05 -0.12 0.00 0.02 0.00 0.00 56.10 57.02 1wu8 s TRP 171 Cb -0.14 -2.61 0.12 0.00 -1.15 0.00 0.00 33.47 29.69 1wu8 s TRP 171 CO 0.03 0.21 0.41 0.42 0.02 0.00 0.00 176.95 178.04 1wu8 s ILE 172 N 0.40 4.60 -0.02 2.03 1.01 0.45 0.10 121.20 129.76 1wu8 s ILE 172 Ca 0.30 -1.68 0.01 0.00 0.00 0.00 0.00 60.65 59.28 1wu8 s ILE 172 Cb -0.16 -3.99 -0.03 0.00 0.01 0.00 0.00 42.46 38.28 1wu8 s ILE 172 CO 0.14 -0.81 -0.01 -0.76 0.00 0.00 0.00 174.94 173.49 1wu8 s LEU 173 N 1.45 3.47 -0.00 2.97 1.43 0.11 -2.97 118.68 125.15 1wu8 s LEU 173 Ca 0.05 0.01 -0.01 0.00 -1.03 0.00 0.00 54.13 53.15 1wu8 s LEU 173 Cb -0.28 -1.94 -0.04 0.00 0.03 0.00 0.00 46.19 43.97 1wu8 s LEU 173 CO 0.01 0.31 0.09 -0.75 0.23 0.00 0.00 176.35 176.23 1wu8 s LYS 174 N -1.36 3.10 -0.68 1.70 2.20 -1.26 0.13 119.74 123.57 1wu8 s LYS 174 Ca 0.18 -0.47 -0.27 0.00 -0.36 0.00 0.00 55.97 55.04 1wu8 s LYS 174 Cb -0.11 -2.88 0.03 0.00 -1.51 0.00 0.00 37.83 33.36 1wu8 s LYS 174 CO 0.08 0.65 1.23 0.08 -0.36 0.00 0.00 175.35 177.02 1wu8 s VAL 175 N -1.22 3.86 -2.03 4.02 1.01 0.68 -1.71 120.40 125.01 1wu8 s VAL 175 Ca 0.24 0.54 0.27 0.00 0.00 0.00 0.00 61.98 63.03 1wu8 s VAL 175 Cb -0.12 -4.83 0.37 0.00 0.00 0.00 0.00 36.38 31.79 1wu8 s VAL 175 CO 0.15 -1.65 1.62 2.30 0.00 0.00 0.00 175.10 177.52 1wu8 n ILE 176 N 6.46 0.00 -3.63 2.22 -5.35 -0.70 0.35 119.36 118.71 1wu8 n ILE 176 Ca 0.05 -0.18 -0.04 0.00 -0.27 0.00 0.00 62.75 62.31 1wu8 n ILE 176 Cb 0.49 0.45 -0.05 0.00 -1.74 0.00 0.00 39.64 38.79 1wu8 n ILE 176 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 1wu8 s TYR 177 N -2.32 -0.12 -0.04 4.28 5.04 -1.22 -4.48 117.35 118.49 1wu8 s TYR 177 Ca 0.29 0.22 -0.01 0.00 -2.44 0.00 0.00 57.07 55.13 1wu8 s TYR 177 Cb 0.20 0.48 0.03 0.00 0.35 0.00 0.00 41.96 43.02 1wu8 s TYR 177 CO 0.45 -0.11 0.06 0.42 -1.34 0.00 0.00 175.55 175.04 1wu8 s ILE 178 N -0.95 -0.09 0.72 3.14 1.01 -1.26 -1.46 121.20 122.30 1wu8 s ILE 178 Ca 0.06 0.30 -0.00 0.00 0.00 0.00 0.00 60.65 61.01 1wu8 s ILE 178 Cb -0.01 -0.14 0.13 0.00 0.01 0.00 0.00 42.46 42.45 1wu8 s ILE 178 CO -0.06 0.12 0.99 1.51 0.00 0.00 0.00 174.94 177.50 1wu8 s ASP 179 N 1.56 4.36 0.48 3.58 3.84 -1.03 -4.93 116.67 124.53 1wu8 s ASP 179 Ca -0.03 -0.41 0.33 0.00 -0.00 0.00 0.00 52.55 52.44 1wu8 s ASP 179 Cb -0.12 0.03 1.72 0.00 -1.38 0.00 0.00 42.92 43.17 1wu8 s ASP 179 CO -0.04 -1.85 2.00 0.44 -0.00 0.00 0.00 175.17 175.72 1wu8 h ASP 180 N -0.50 0.00 0.65 2.11 5.19 -2.02 0.11 116.42 121.95 1wu8 h ASP 180 Ca -0.36 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.05 1wu8 h ASP 180 Cb 1.27 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.78 1wu8 h ASP 180 CO 0.40 0.00 -0.56 0.49 -3.12 0.00 0.00 179.24 176.44 1wu8 n PHE 181 N -2.67 0.22 -0.41 4.55 3.72 -1.26 -4.92 117.46 116.69 1wu8 n PHE 181 Ca -0.02 0.06 0.00 0.00 -0.05 0.00 0.00 57.45 57.45 1wu8 n PHE 181 Cb 0.08 -0.42 0.00 0.00 -0.94 0.00 0.00 39.48 38.20 1wu8 n PHE 181 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1wu8 n GLY 182 N 1.43 0.72 3.75 1.37 0.00 0.37 -3.94 105.19 108.89 1wu8 n GLY 182 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1wu8 n GLY 182 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1wu8 s ASN 183 N -2.88 6.38 -0.16 1.61 0.01 -1.26 -1.00 114.94 117.63 1wu8 s ASN 183 Ca 0.00 2.94 -0.08 0.00 -0.71 0.00 0.00 52.86 55.01 1wu8 s ASN 183 Cb 0.00 -2.63 -0.04 0.00 0.41 0.00 0.00 41.25 38.98 1wu8 s ASN 183 CO 0.00 -0.91 0.12 -0.69 -1.51 0.00 0.00 177.10 174.11 1wu8 s VAL 184 N 0.01 5.29 -0.19 1.60 1.01 0.31 -2.48 120.40 125.95 1wu8 s VAL 184 Ca 0.63 0.14 -0.01 0.00 0.00 0.00 0.00 61.98 62.74 1wu8 s VAL 184 Cb -0.48 -3.36 0.01 0.00 0.00 0.00 0.00 36.38 32.55 1wu8 s VAL 184 CO 0.48 0.51 -0.14 -0.63 0.00 0.00 0.00 175.10 175.31 1wu8 s ILE 185 N -0.16 2.53 0.06 2.22 1.01 -0.54 0.15 121.20 126.48 1wu8 s ILE 185 Ca 0.10 -0.78 -0.03 0.00 0.00 0.00 0.00 60.65 59.94 1wu8 s ILE 185 Cb -0.12 -2.10 -0.05 0.00 0.01 0.00 0.00 42.46 40.21 1wu8 s ILE 185 CO 0.01 0.50 0.26 -0.76 0.00 0.00 0.00 174.94 174.95 1wu8 s LEU 186 N 1.32 4.34 0.00 2.97 1.43 -0.23 -1.72 118.68 126.79 1wu8 s LEU 186 Ca 0.05 0.42 -0.02 0.00 -1.03 0.00 0.00 54.13 53.54 1wu8 s LEU 186 Cb -0.14 -2.95 -0.11 0.00 0.03 0.00 0.00 46.19 43.03 1wu8 s LEU 186 CO -0.09 0.17 2.34 -0.46 0.23 0.00 0.00 176.35 178.54 1wu8 n ASN 187 N 0.49 4.36 -4.27 2.29 6.94 -0.69 -3.55 115.26 120.82 1wu8 n ASN 187 Ca -0.06 -2.23 -0.33 0.00 -0.02 0.00 0.00 54.58 51.93 1wu8 n ASN 187 Cb 0.52 -1.05 -0.15 0.00 -2.36 0.00 0.00 39.78 36.74 1wu8 n ASN 187 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 1wu8 s LEU 188 N 0.00 2.51 0.16 -4.53 2.96 -1.26 -4.42 118.68 114.11 1wu8 s LEU 188 Ca 0.27 -0.46 -0.00 0.00 -0.22 0.00 0.00 54.13 53.72 1wu8 s LEU 188 Cb 0.13 -1.58 -0.04 0.00 0.50 0.00 0.00 46.19 45.20 1wu8 s LEU 188 CO 0.00 0.08 0.06 -1.83 -1.32 0.00 0.00 176.35 173.34 1wu8 s GLU 189 N 0.84 1.06 -1.31 1.98 -1.05 -1.26 -1.74 118.70 117.22 1wu8 s GLU 189 Ca -0.05 -1.52 -0.00 0.00 -0.15 0.00 0.00 54.97 53.25 1wu8 s GLU 189 Cb -0.15 0.09 0.00 0.00 -0.44 0.00 0.00 34.13 33.63 1wu8 s GLU 189 CO -0.00 -0.26 0.71 0.09 0.95 0.00 0.00 175.26 176.75 1wu8 n ASN 190 N -0.19 -1.24 -4.60 0.83 3.02 -1.26 -5.00 115.26 106.82 1wu8 n ASN 190 Ca -0.04 -0.82 -0.24 0.00 -0.03 0.00 0.00 54.58 53.45 1wu8 n ASN 190 Cb 0.64 -4.06 -0.08 0.00 -0.61 0.00 0.00 39.78 35.67 1wu8 n ASN 190 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 1wu8 s TYR 191 N -3.66 2.62 0.06 3.10 1.13 -1.26 -5.09 117.35 114.25 1wu8 s TYR 191 Ca 0.02 -0.24 -0.27 0.00 -1.41 0.00 0.00 57.07 55.17 1wu8 s TYR 191 Cb -0.01 -1.19 -0.05 0.00 -1.10 0.00 0.00 41.96 39.61 1wu8 s TYR 191 CO 0.81 0.61 0.86 -1.21 -2.51 0.00 0.00 175.55 174.11 1wu8 s GLU 192 N -3.42 4.58 -0.39 -3.49 0.41 -1.26 -4.91 118.70 110.23 1wu8 s GLU 192 Ca 0.29 1.25 -0.38 0.00 -0.41 0.00 0.00 54.97 55.72 1wu8 s GLU 192 Cb -0.07 -3.38 -0.14 0.00 -1.78 0.00 0.00 34.13 28.76 1wu8 s GLU 192 CO 0.18 0.21 2.14 1.17 -0.49 0.00 0.00 175.26 178.47 1wu8 n LYS 193 N 2.96 0.73 -2.12 1.61 4.81 -1.26 -4.94 118.16 119.95 1wu8 n LYS 193 Ca 0.00 0.21 -0.27 0.00 -0.87 0.00 0.00 58.31 57.38 1wu8 n LYS 193 Cb 0.50 -2.12 0.08 0.00 0.02 0.00 0.00 35.03 33.51 1wu8 n LYS 193 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1wu8 s PRO 194 N 5.94 2.03 -0.19 1.64 0.04 -1.26 -5.01 135.00 138.19 1wu8 s PRO 194 Ca 1.12 -0.20 0.15 0.00 0.04 0.00 0.00 61.00 62.12 1wu8 s PRO 194 Cb -1.08 -2.10 -0.23 0.00 0.04 0.00 0.00 34.50 31.13 1wu8 s PRO 194 CO 0.56 -1.40 0.04 0.54 0.04 0.00 0.00 177.00 176.77 1wu8 n ARG 195 N -3.07 0.88 -3.81 4.56 1.74 -0.77 -4.73 116.66 111.47 1wu8 n ARG 195 Ca 0.09 0.01 -0.12 0.00 -0.77 0.00 0.00 57.85 57.05 1wu8 n ARG 195 Cb 0.61 -1.49 -0.11 0.00 -1.02 0.00 0.00 32.46 30.45 1wu8 n ARG 195 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1wu8 s THR 196 N -2.46 0.02 -0.16 0.55 2.01 0.00 -2.39 115.64 113.21 1wu8 s THR 196 Ca -0.12 -0.16 0.01 0.00 0.31 0.00 0.00 61.69 61.73 1wu8 s THR 196 Cb 0.06 -0.36 0.00 0.00 0.01 0.00 0.00 72.50 72.21 1wu8 s THR 196 CO 0.75 -0.09 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.74 1wu8 s VAL 197 N -0.26 2.53 -0.21 3.82 1.01 0.15 -1.09 120.40 126.35 1wu8 s VAL 197 Ca -0.04 -0.81 -0.06 0.00 0.00 0.00 0.00 61.98 61.07 1wu8 s VAL 197 Cb -0.03 -2.06 -0.03 0.00 0.00 0.00 0.00 36.38 34.26 1wu8 s VAL 197 CO 0.01 0.52 0.03 -0.70 0.00 0.00 0.00 175.10 174.96 1wu8 s GLU 198 N 0.89 3.68 -0.77 2.72 2.12 -0.27 0.36 118.70 127.44 1wu8 s GLU 198 Ca -0.04 -0.48 -0.15 0.00 0.36 0.00 0.00 54.97 54.66 1wu8 s GLU 198 Cb -0.15 -3.19 0.19 0.00 0.26 0.00 0.00 34.13 31.24 1wu8 s GLU 198 CO -0.02 -0.02 0.74 -0.51 -0.54 0.00 0.00 175.26 174.91 1wu8 s LEU 199 N 1.12 6.44 0.29 2.70 1.43 -0.11 -0.72 118.68 129.84 1wu8 s LEU 199 Ca 0.03 -2.39 0.04 0.00 -1.03 0.00 0.00 54.13 50.78 1wu8 s LEU 199 Cb -0.14 -2.23 0.71 0.00 0.03 0.00 0.00 46.19 44.55 1wu8 s LEU 199 CO 0.02 -0.70 1.76 -0.07 0.23 0.00 0.00 176.35 177.60 1wu8 h LEU 200 N 8.32 0.67 -1.58 1.79 3.38 -1.60 -1.12 115.31 125.18 1wu8 h LEU 200 Ca 0.01 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1wu8 h LEU 200 Cb 1.05 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1wu8 h LEU 200 CO 0.86 0.22 0.00 0.44 0.09 0.00 0.00 178.44 180.04 1wu8 h ASP 201 N 0.68 0.00 -0.00 -0.43 3.32 -1.93 -2.44 116.42 115.62 1wu8 h ASP 201 Ca 0.56 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.61 1wu8 h ASP 201 Cb 0.89 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.44 1wu8 h ASP 201 CO -0.40 0.00 -0.01 0.49 -1.72 0.00 0.00 179.24 177.60 1wu8 n PHE 202 N -2.46 0.00 -3.99 4.55 3.72 -0.51 -5.00 117.46 113.77 1wu8 n PHE 202 Ca -0.01 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.08 1wu8 n PHE 202 Cb 0.10 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.64 1wu8 n PHE 202 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1wu8 n ASN 203 N -0.36 -3.69 -4.61 4.37 5.03 -0.67 -4.96 115.26 110.38 1wu8 n ASN 203 Ca 0.00 -0.87 -0.34 0.00 0.87 0.00 0.00 54.58 54.24 1wu8 n ASN 203 Cb 0.01 -3.50 -0.10 0.00 -1.02 0.00 0.00 39.78 35.17 1wu8 n ASN 203 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1wu8 s LEU 204 N -7.20 3.63 -0.30 3.41 1.43 -1.02 -4.99 118.68 113.63 1wu8 s LEU 204 Ca 0.58 0.04 -0.06 0.00 -1.03 0.00 0.00 54.13 53.66 1wu8 s LEU 204 Cb -0.30 -1.89 0.02 0.00 0.03 0.00 0.00 46.19 44.05 1wu8 s LEU 204 CO 0.86 0.21 0.07 -0.13 0.23 0.00 0.00 176.35 177.59 1wu8 s ARG 205 N 0.15 2.88 -0.02 1.70 0.52 -1.26 -0.94 118.95 121.98 1wu8 s ARG 205 Ca 0.03 -0.99 0.02 0.00 -0.52 0.00 0.00 55.73 54.26 1wu8 s ARG 205 Cb -0.13 -3.35 -0.03 0.00 0.52 0.00 0.00 34.95 31.96 1wu8 s ARG 205 CO 0.01 -0.52 -0.03 -0.51 0.02 0.00 0.00 175.30 174.27 1wu8 s LEU 206 N 1.44 3.36 0.20 2.53 1.43 0.16 -4.95 118.68 122.85 1wu8 s LEU 206 Ca 0.01 -0.04 -0.30 0.00 -1.03 0.00 0.00 54.13 52.77 1wu8 s LEU 206 Cb -0.18 -1.88 -0.08 0.00 0.03 0.00 0.00 46.19 44.08 1wu8 s LEU 206 CO 0.02 0.31 0.95 -2.16 0.23 0.00 0.00 176.35 175.69 1wu8 s PRO 207 N -1.31 4.81 -0.67 1.29 0.04 -1.26 0.31 135.00 138.20 1wu8 s PRO 207 Ca 0.17 1.49 -0.18 0.00 0.04 0.00 0.00 61.00 62.52 1wu8 s PRO 207 Cb -0.11 -3.31 0.13 0.00 0.04 0.00 0.00 34.50 31.25 1wu8 s PRO 207 CO 0.07 0.43 0.75 -0.47 0.04 0.00 0.00 177.00 177.82 1wu8 s TYR 208 N -0.84 3.18 0.43 0.56 6.14 -1.01 -1.51 117.35 124.30 1wu8 s TYR 208 Ca 0.43 -1.24 0.07 0.00 0.64 0.00 0.00 57.07 56.97 1wu8 s TYR 208 Cb -0.25 -3.99 -0.04 0.00 0.42 0.00 0.00 41.96 38.10 1wu8 s TYR 208 CO 0.32 -1.24 0.24 -0.51 0.64 0.00 0.00 175.55 174.99 1wu8 s LEU 209 N 2.12 3.10 0.17 6.97 1.43 -0.46 -4.88 118.68 127.13 1wu8 s LEU 209 Ca 0.15 -1.05 -0.03 0.00 -1.03 0.00 0.00 54.13 52.16 1wu8 s LEU 209 Cb -0.20 -1.51 0.06 0.00 0.03 0.00 0.00 46.19 44.57 1wu8 s LEU 209 CO 0.01 -0.64 1.45 -0.33 0.23 0.00 0.00 176.35 177.07 1wu8 h GLU 210 N 1.27 0.50 -3.22 1.70 4.39 -1.96 -3.35 114.58 113.90 1wu8 h GLU 210 Ca -0.42 -0.37 -0.04 0.00 0.34 0.00 0.00 59.36 58.87 1wu8 h GLU 210 Cb 1.26 0.07 -0.12 0.00 -0.10 0.00 0.00 28.75 29.85 1wu8 h GLU 210 CO 0.66 0.99 0.05 -0.08 -1.16 0.00 0.00 179.01 179.48 1wu8 s THR 211 N -3.76 0.04 0.23 1.13 -1.32 -1.26 -4.73 115.64 105.97 1wu8 s THR 211 Ca -0.07 -0.34 -0.16 0.00 -1.21 0.00 0.00 61.69 59.91 1wu8 s THR 211 Cb 0.11 -1.11 0.27 0.00 -1.51 0.00 0.00 72.50 70.25 1wu8 s THR 211 CO 0.85 -0.18 1.56 1.88 -2.21 0.00 0.00 174.62 176.52 1wu8 h TYR 212 N 2.21 -0.92 0.00 9.09 0.05 -1.97 -1.38 116.97 124.03 1wu8 h TYR 212 Ca -0.34 0.10 0.00 0.00 0.05 0.00 0.00 58.73 58.54 1wu8 h TYR 212 Cb 1.28 0.54 0.00 0.00 1.01 0.00 0.00 36.73 39.56 1wu8 h TYR 212 CO 0.29 -0.40 0.00 0.41 -1.05 0.00 0.00 178.16 177.40 1wu8 n GLY 213 N -1.50 -0.54 0.00 3.88 0.00 -1.26 -2.81 105.19 102.97 1wu8 n GLY 213 Ca 0.10 -0.02 0.09 0.00 0.00 0.00 0.00 46.02 46.20 1wu8 n GLY 213 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wu8 n LEU 214 N -1.41 0.00 -4.36 0.99 4.77 -0.52 -4.75 117.00 111.71 1wu8 n LEU 214 Ca 0.01 0.00 -0.20 0.00 -0.03 0.00 0.00 56.01 55.79 1wu8 n LEU 214 Cb 0.04 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.04 1wu8 n LEU 214 CO 0.03 0.00 -0.20 0.68 -1.33 0.00 0.00 177.39 176.57 1wu8 s VAL 215 N -2.00 0.40 0.57 4.08 -7.23 -1.12 -5.08 120.40 110.02 1wu8 s VAL 215 Ca 0.26 -2.00 -0.16 0.00 -1.81 0.00 0.00 61.98 58.27 1wu8 s VAL 215 Cb 0.12 -2.50 -0.05 0.00 0.56 0.00 0.00 36.38 34.51 1wu8 s VAL 215 CO 0.20 0.00 1.04 -1.61 -0.31 0.00 0.00 175.10 174.43 1wu8 s GLU 216 N -3.79 3.45 0.03 4.82 0.41 -1.26 -4.95 118.70 117.42 1wu8 s GLU 216 Ca 0.34 1.17 -0.30 0.00 -0.41 0.00 0.00 54.97 55.77 1wu8 s GLU 216 Cb 0.05 -2.05 -0.08 0.00 -1.78 0.00 0.00 34.13 30.26 1wu8 s GLU 216 CO 0.17 -0.70 1.86 0.21 -0.49 0.00 0.00 175.26 176.32 1wu8 s LYS 217 N -4.03 4.15 0.00 1.61 2.20 -1.26 -1.09 119.74 121.32 1wu8 s LYS 217 Ca 0.63 2.50 0.00 0.00 -0.36 0.00 0.00 55.97 58.74 1wu8 s LYS 217 Cb -0.15 -4.01 0.00 0.00 -1.51 0.00 0.00 37.83 32.16 1wu8 s LYS 217 CO 0.35 -0.90 0.00 0.41 -0.36 0.00 0.00 175.35 174.85 1wu8 n GLY 218 N 4.38 2.19 0.00 5.54 0.00 -0.63 -5.01 105.19 111.64 1wu8 n GLY 218 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 1wu8 n GLY 218 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1wu8 n GLU 219 N -1.44 1.98 0.00 1.61 1.02 -0.25 -4.75 120.64 118.80 1wu8 n GLU 219 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1wu8 n GLU 219 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1wu8 n GLU 219 CO 0.00 0.00 0.00 1.47 1.18 0.00 0.00 177.13 179.78 1wu8 n LEU 221 N 0.00 0.00 -4.47 -4.62 -0.00 0.82 -1.29 117.00 107.44 1wu8 n LEU 221 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 56.01 55.72 1wu8 n LEU 221 Cb 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 43.42 43.30 1wu8 n LEU 221 CO 0.00 0.00 -0.50 0.00 -0.00 0.00 0.00 177.39 176.89 1wu8 s ALA 222 N -2.00 2.63 0.09 1.47 0.00 -0.57 -0.74 121.76 122.65 1wu8 s ALA 222 Ca 0.00 -1.37 -0.07 0.00 0.00 0.00 0.00 51.96 50.53 1wu8 s ALA 222 Cb 0.00 -0.61 -0.01 0.00 0.00 0.00 0.00 23.12 22.50 1wu8 s ALA 222 CO 0.00 0.58 0.16 -0.51 0.00 0.00 0.00 175.76 175.99 1wu8 s LEU 223 N -2.11 1.57 0.31 0.00 1.02 -0.05 -1.36 118.68 118.06 1wu8 s LEU 223 Ca 0.17 -0.78 0.25 0.00 0.02 0.00 0.00 54.13 53.80 1wu8 s LEU 223 Cb -0.10 0.86 1.03 0.00 0.02 0.00 0.00 46.19 48.00 1wu8 s LEU 223 CO 0.09 -0.73 1.76 1.55 0.02 0.00 0.00 176.35 179.05 1wu8 h PRO 224 N 2.80 0.00 0.00 1.29 0.13 -1.85 -2.36 132.00 132.00 1wu8 h PRO 224 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1wu8 h PRO 224 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1wu8 h PRO 224 CO 0.57 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.75 1wu8 n GLY 225 N 0.11 -1.04 0.12 1.56 0.00 -1.26 -3.95 105.19 100.73 1wu8 n GLY 225 Ca 0.02 -1.20 0.02 0.00 0.00 0.00 0.00 46.02 44.85 1wu8 n GLY 225 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1wu8 n SER 226 N -0.69 0.89 -0.07 1.61 3.41 -1.26 -4.74 113.62 112.77 1wu8 n SER 226 Ca 0.00 -1.80 0.01 0.00 -0.26 0.00 0.00 58.87 56.82 1wu8 n SER 226 Cb 0.00 -0.11 0.02 0.00 -0.26 0.00 0.00 64.21 63.86 1wu8 n SER 226 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1wu8 n HIS 227 N -0.35 0.00 -2.47 7.33 8.25 -1.26 -5.00 115.22 121.71 1wu8 n HIS 227 Ca 0.02 -0.34 -0.11 0.00 -0.26 0.00 0.00 57.72 57.03 1wu8 n HIS 227 Cb 0.50 -0.05 0.01 0.00 1.12 0.00 0.00 29.99 31.57 1wu8 n HIS 227 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1wu8 n ASP 228 N -0.40 -3.80 -4.01 0.41 8.00 -1.26 -5.03 116.55 110.46 1wu8 n ASP 228 Ca 0.02 -0.09 -0.11 0.00 0.71 0.00 0.00 54.79 55.32 1wu8 n ASP 228 Cb 0.44 -2.84 -0.11 0.00 -0.02 0.00 0.00 41.12 38.59 1wu8 n ASP 228 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1wu8 s TYR 229 N -2.73 0.42 0.18 1.24 2.02 -1.25 -4.42 117.35 112.81 1wu8 s TYR 229 Ca 0.09 -0.50 -0.32 0.00 -0.37 0.00 0.00 57.07 55.98 1wu8 s TYR 229 Cb -0.04 -0.27 -0.11 0.00 -0.40 0.00 0.00 41.96 41.13 1wu8 s TYR 229 CO 0.12 -0.14 1.70 -1.17 -1.57 0.00 0.00 175.55 174.48 1wu8 s LEU 230 N -1.45 4.37 -0.10 -1.29 2.96 -0.71 -4.28 118.68 118.19 1wu8 s LEU 230 Ca -0.13 2.79 0.04 0.00 -0.22 0.00 0.00 54.13 56.60 1wu8 s LEU 230 Cb -0.10 -3.59 -0.01 0.00 0.50 0.00 0.00 46.19 42.99 1wu8 s LEU 230 CO -0.00 -0.94 -0.22 -0.70 -1.32 0.00 0.00 176.35 173.17 1wu8 s GLU 231 N 1.38 3.00 -0.21 1.98 2.12 -0.89 -1.06 118.70 125.01 1wu8 s GLU 231 Ca 0.74 -0.84 -0.05 0.00 0.36 0.00 0.00 54.97 55.18 1wu8 s GLU 231 Cb -0.48 -2.34 -0.02 0.00 0.26 0.00 0.00 34.13 31.55 1wu8 s GLU 231 CO 0.32 0.24 0.01 0.42 -0.54 0.00 0.00 175.26 175.72 1wu8 s ILE 232 N 0.20 3.93 0.24 -3.70 -1.09 0.12 -0.87 121.20 120.03 1wu8 s ILE 232 Ca -0.13 -0.31 0.01 0.00 -2.23 0.00 0.00 60.65 57.99 1wu8 s ILE 232 Cb -0.16 -2.79 -0.04 0.00 -1.58 0.00 0.00 42.46 37.88 1wu8 s ILE 232 CO 0.07 0.41 0.14 0.00 -1.23 0.00 0.00 174.94 174.33 1wu8 s ALA 233 N 1.21 1.46 -0.12 9.38 0.00 0.08 -0.53 121.76 133.24 1wu8 s ALA 233 Ca 0.03 -1.78 -0.00 0.00 0.00 0.00 0.00 51.96 50.21 1wu8 s ALA 233 Cb -0.15 1.30 0.02 0.00 0.00 0.00 0.00 23.12 24.30 1wu8 s ALA 233 CO 0.01 -0.56 -0.10 0.08 0.00 0.00 0.00 175.76 175.20 1wu8 s VAL 234 N -3.93 1.19 0.00 0.00 1.01 -1.26 -0.13 120.40 117.28 1wu8 s VAL 234 Ca 0.38 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 61.97 1wu8 s VAL 234 Cb 0.06 -1.17 0.00 0.00 0.00 0.00 0.00 36.38 35.27 1wu8 s VAL 234 CO 0.15 0.40 0.00 -3.20 0.00 0.00 0.00 175.10 172.44 1wu8 n ASN 235 N 4.88 0.00 0.00 3.32 5.15 -0.41 -4.49 115.26 123.70 1wu8 n ASN 235 Ca -0.14 -0.32 0.00 0.00 -0.60 0.00 0.00 54.58 53.52 1wu8 n ASN 235 Cb 0.50 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.75 1wu8 n ASN 235 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1wu8 n GLY 237 N 1.22 0.77 3.33 8.20 0.00 -1.26 -1.61 105.19 115.84 1wu8 n GLY 237 Ca 0.00 -2.26 -0.37 0.00 0.00 0.00 0.00 46.02 43.39 1wu8 n GLY 237 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wu8 s SER 238 N 0.00 5.16 0.13 1.61 0.15 -1.25 -4.74 113.70 114.76 1wu8 s SER 238 Ca 0.00 -0.79 -0.11 0.00 0.70 0.00 0.00 55.95 55.74 1wu8 s SER 238 Cb 0.00 -1.88 -0.07 0.00 -1.71 0.00 0.00 66.02 62.36 1wu8 s SER 238 CO 0.00 -0.22 1.43 0.00 1.20 0.00 0.00 173.24 175.65 1wu8 h ALA 239 N 8.23 0.50 -0.14 5.45 0.00 -1.75 -2.80 119.26 128.75 1wu8 h ALA 239 Ca -0.30 -0.50 -0.04 0.00 0.00 0.00 0.00 54.91 54.08 1wu8 h ALA 239 Cb 1.12 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1wu8 h ALA 239 CO 0.60 0.68 -0.10 0.00 0.00 0.00 0.00 179.25 180.44 1wu8 h ALA 240 N 0.72 1.57 0.57 0.00 0.00 -1.39 -1.41 119.26 119.31 1wu8 h ALA 240 Ca 0.03 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1wu8 h ALA 240 Cb 1.10 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1wu8 h ALA 240 CO 0.11 0.31 -0.45 1.49 0.00 0.00 0.00 179.25 180.72 1wu8 h GLU 241 N 0.21 -0.95 0.77 0.00 4.57 -1.75 0.12 114.58 117.55 1wu8 h GLU 241 Ca 0.05 0.06 -0.04 0.00 -1.18 0.00 0.00 59.36 58.25 1wu8 h GLU 241 Cb 0.31 0.22 0.01 0.00 -0.16 0.00 0.00 28.75 29.13 1wu8 h GLU 241 CO 0.02 -0.63 -0.37 0.00 -1.18 0.00 0.00 179.01 176.84 1wu8 h ARG 242 N -0.99 -1.00 0.00 1.92 3.08 -1.36 -2.83 114.38 113.20 1wu8 h ARG 242 Ca -0.07 0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1wu8 h ARG 242 Cb 0.83 0.23 0.00 0.00 0.08 0.00 0.00 29.97 31.11 1wu8 h ARG 242 CO 0.00 -0.66 0.01 1.28 -1.07 0.00 0.00 179.97 179.54 1wu8 n LEU 243 N -5.47 0.53 -3.82 3.04 4.77 -0.55 -4.83 117.00 110.67 1wu8 n LEU 243 Ca -0.13 0.75 -0.28 0.00 -0.03 0.00 0.00 56.01 56.32 1wu8 n LEU 243 Cb 0.41 -0.81 0.01 0.00 -2.33 0.00 0.00 43.42 40.71 1wu8 n LEU 243 CO 0.32 -0.93 -0.15 -3.20 -1.33 0.00 0.00 177.39 172.10 1wu8 n ASN 244 N -2.22 -2.42 -4.82 -1.43 4.05 0.40 -4.99 115.26 103.82 1wu8 n ASN 244 Ca -0.01 -0.99 -0.27 0.00 0.45 0.00 0.00 54.58 53.76 1wu8 n ASN 244 Cb 0.04 -3.29 -0.04 0.00 1.23 0.00 0.00 39.78 37.72 1wu8 n ASN 244 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 177.26 174.89 1wu8 s VAL 245 N -3.72 1.80 0.08 3.44 -7.23 -1.05 -5.05 120.40 108.66 1wu8 s VAL 245 Ca 0.19 -1.65 -0.17 0.00 -1.81 0.00 0.00 61.98 58.54 1wu8 s VAL 245 Cb -0.07 -2.46 0.04 0.00 0.56 0.00 0.00 36.38 34.45 1wu8 s VAL 245 CO 0.87 0.00 0.42 -1.59 -0.31 0.00 0.00 175.10 174.48 1wu8 s LYS 246 N -4.07 1.00 -0.08 4.82 -2.85 -1.26 -4.88 119.74 112.42 1wu8 s LYS 246 Ca 0.31 -0.51 -0.38 0.00 -1.00 0.00 0.00 55.97 54.39 1wu8 s LYS 246 Cb 0.00 0.44 -0.16 0.00 -2.06 0.00 0.00 37.83 36.06 1wu8 s LYS 246 CO 0.18 -0.37 1.55 0.28 0.10 0.00 0.00 175.35 177.09 1wu8 n VAL 247 N 0.17 0.16 0.00 1.79 0.31 -1.26 -1.55 118.33 117.94 1wu8 n VAL 247 Ca -0.17 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.13 1wu8 n VAL 247 Cb 0.62 -1.06 0.00 0.00 -0.91 0.00 0.00 33.84 32.48 1wu8 n VAL 247 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1wu8 n GLY 248 N 3.36 1.25 3.74 2.92 0.00 0.16 -4.99 105.19 111.63 1wu8 n GLY 248 Ca 0.22 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.89 1wu8 n GLY 248 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1wu8 s ASP 249 N -0.43 4.76 -0.19 1.61 1.01 -0.60 -4.60 116.67 118.23 1wu8 s ASP 249 Ca 0.00 2.41 -0.02 0.00 0.71 0.00 0.00 52.55 55.65 1wu8 s ASP 249 Cb 0.00 -2.60 -0.01 0.00 1.01 0.00 0.00 42.92 41.32 1wu8 s ASP 249 CO 0.00 -1.89 -0.08 -1.61 0.21 0.00 0.00 175.17 171.80 1wu8 s GLU 250 N -3.55 3.36 -0.10 8.23 2.02 -1.26 -0.23 118.70 127.16 1wu8 s GLU 250 Ca 0.77 -0.65 -0.03 0.00 0.02 0.00 0.00 54.97 55.07 1wu8 s GLU 250 Cb -0.31 -2.87 -0.03 0.00 0.10 0.00 0.00 34.13 31.01 1wu8 s GLU 250 CO 0.39 -0.08 0.03 -0.51 0.02 0.00 0.00 175.26 175.11 1wu8 s LEU 251 N 1.14 3.75 -0.38 1.80 1.43 0.34 -4.89 118.68 121.87 1wu8 s LEU 251 Ca 0.01 0.20 -0.25 0.00 -1.03 0.00 0.00 54.13 53.06 1wu8 s LEU 251 Cb -0.14 -1.88 0.01 0.00 0.03 0.00 0.00 46.19 44.21 1wu8 s LEU 251 CO -0.02 0.36 0.87 -0.13 0.23 0.00 0.00 176.35 177.67 1wu8 s ARG 252 N -0.78 3.76 -0.03 1.70 0.52 -1.26 -0.71 118.95 122.16 1wu8 s ARG 252 Ca 0.12 0.42 0.07 0.00 -0.52 0.00 0.00 55.73 55.83 1wu8 s ARG 252 Cb -0.12 -3.82 -0.02 0.00 0.52 0.00 0.00 34.95 31.52 1wu8 s ARG 252 CO 0.02 -0.95 -0.25 0.08 0.02 0.00 0.00 175.30 174.23 1wu8 s VAL 253 N 3.38 1.96 -0.19 3.52 1.01 0.28 -1.71 120.40 128.66 1wu8 s VAL 253 Ca 0.35 -1.05 -0.05 0.00 0.00 0.00 0.00 61.98 61.24 1wu8 s VAL 253 Cb -0.12 -1.64 -0.03 0.00 0.00 0.00 0.00 36.38 34.59 1wu8 s VAL 253 CO 0.19 0.55 -0.01 -0.60 0.00 0.00 0.00 175.10 175.23 1wu8 s ARG 254 N -0.42 3.64 -0.43 2.72 3.52 0.10 0.71 118.95 128.79 1wu8 s ARG 254 Ca 0.05 -0.52 -0.14 0.00 -0.13 0.00 0.00 55.73 54.98 1wu8 s ARG 254 Cb -0.11 -3.03 0.05 0.00 -1.56 0.00 0.00 34.95 30.30 1wu8 s ARG 254 CO 0.01 0.09 0.33 -0.51 -0.81 0.00 0.00 175.30 174.40 1wu8 s LEU 255 N 0.79 5.30 0.00 -0.88 1.02 -1.26 -1.11 118.68 122.54 1wu8 s LEU 255 Ca -0.00 -1.13 0.18 0.00 0.02 0.00 0.00 54.13 53.20 1wu8 s LEU 255 Cb -0.14 -2.15 0.14 0.00 0.02 0.00 0.00 46.19 44.06 1wu8 s LEU 255 CO 0.02 -0.53 1.08 0.18 0.02 0.00 0.00 176.35 177.11