#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xu9 s GLN 21 N 0.00 3.73 0.60 2.61 -1.52 -1.26 -4.88 119.66 118.94 1xu9 s GLN 21 Ca 0.00 -0.48 -0.17 0.00 -1.95 0.00 0.00 55.36 52.76 1xu9 s GLN 21 Cb 0.00 -3.73 -0.03 0.00 -0.22 0.00 0.00 33.01 29.03 1xu9 s GLN 21 CO 0.00 -0.31 1.13 -2.14 -0.25 0.00 0.00 175.29 173.72 1xu9 s PRO 22 N 1.75 3.04 0.10 2.91 0.02 -1.25 -4.90 135.00 136.67 1xu9 s PRO 22 Ca 0.07 1.54 -0.31 0.00 0.02 0.00 0.00 61.00 62.32 1xu9 s PRO 22 Cb -0.17 -1.97 -0.09 0.00 0.02 0.00 0.00 34.50 32.29 1xu9 s PRO 22 CO 0.11 -1.09 1.64 -0.51 -0.33 0.00 0.00 177.00 176.82 1xu9 s LEU 23 N -4.32 4.37 -1.34 -5.54 1.43 -0.20 -4.91 118.68 108.16 1xu9 s LEU 23 Ca 0.71 2.55 -0.12 0.00 -1.03 0.00 0.00 54.13 56.24 1xu9 s LEU 23 Cb -0.23 -3.57 0.12 0.00 0.03 0.00 0.00 46.19 42.53 1xu9 s LEU 23 CO 0.34 -0.88 1.98 -3.20 0.23 0.00 0.00 176.35 174.83 1xu9 n ASN 24 N 5.07 4.63 -3.55 2.29 5.15 -1.26 -4.86 115.26 122.73 1xu9 n ASN 24 Ca 0.15 -3.00 -0.09 0.00 -0.60 0.00 0.00 54.58 51.04 1xu9 n ASN 24 Cb 0.40 -1.56 -0.02 0.00 -0.53 0.00 0.00 39.78 38.07 1xu9 n ASN 24 CO 0.00 0.00 0.00 -1.83 1.40 0.00 0.00 177.26 176.83 1xu9 s GLU 25 N 1.64 1.24 0.34 1.20 -1.05 -1.26 -5.15 118.70 115.65 1xu9 s GLU 25 Ca 0.43 -0.54 -0.26 0.00 -0.15 0.00 0.00 54.97 54.46 1xu9 s GLU 25 Cb 0.10 0.52 -0.10 0.00 -0.44 0.00 0.00 34.13 34.21 1xu9 s GLU 25 CO -0.03 -0.55 0.98 -2.00 0.95 0.00 0.00 175.26 174.61 1xu9 s GLU 26 N -3.56 4.49 0.37 -4.83 2.12 -1.26 -5.00 118.70 111.02 1xu9 s GLU 26 Ca 0.05 1.39 -0.28 0.00 0.36 0.00 0.00 54.97 56.49 1xu9 s GLU 26 Cb -0.02 -2.75 -0.11 0.00 0.26 0.00 0.00 34.13 31.51 1xu9 s GLU 26 CO -0.07 0.18 1.51 0.12 -0.54 0.00 0.00 175.26 176.45 1xu9 s PHE 27 N -1.61 2.59 -0.01 5.30 5.36 -1.26 -5.03 117.98 123.32 1xu9 s PHE 27 Ca 0.52 1.11 0.02 0.00 -0.96 0.00 0.00 56.93 57.62 1xu9 s PHE 27 Cb -0.20 -4.04 -0.00 0.00 -0.34 0.00 0.00 43.02 38.43 1xu9 s PHE 27 CO 0.25 -3.11 -0.07 -0.98 -1.46 0.00 0.00 175.22 169.85 1xu9 s ARG 28 N -1.90 0.62 0.58 10.12 1.70 -1.26 -5.04 118.95 123.76 1xu9 s ARG 28 Ca 0.54 -0.27 0.28 0.00 -0.47 0.00 0.00 55.73 55.82 1xu9 s ARG 28 Cb -0.47 -0.60 1.58 0.00 -0.57 0.00 0.00 34.95 34.89 1xu9 s ARG 28 CO 0.62 0.16 2.05 -1.00 -1.08 0.00 0.00 175.30 176.04 1xu9 h PRO 29 N 5.99 0.00 0.00 3.89 0.13 -1.98 -0.92 132.00 139.11 1xu9 h PRO 29 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 1xu9 h PRO 29 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1xu9 h PRO 29 CO 0.50 0.00 0.00 0.93 -0.23 0.00 0.00 178.00 179.20 1xu9 h GLU 30 N 0.00 0.00 -0.19 0.86 3.07 -1.96 -1.81 114.58 114.55 1xu9 h GLU 30 Ca 0.13 0.00 0.05 0.00 -0.50 0.00 0.00 59.36 59.04 1xu9 h GLU 30 Cb 0.68 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.58 1xu9 h GLU 30 CO -0.00 0.00 0.24 0.52 -1.40 0.00 0.00 179.01 178.37 1xu9 h MET 31 N 0.00 0.00 -0.00 2.33 2.86 -1.55 -2.37 114.93 116.20 1xu9 h MET 31 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1xu9 h MET 31 Cb 0.21 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.87 1xu9 h MET 31 CO 0.00 0.00 -0.80 1.28 1.06 0.00 0.00 176.91 178.45 1xu9 n LEU 32 N -3.67 1.00 -4.68 1.22 7.99 -0.68 -4.84 117.00 113.34 1xu9 n LEU 32 Ca 0.02 -0.54 -0.44 0.00 -0.01 0.00 0.00 56.01 55.04 1xu9 n LEU 32 Cb 0.36 0.00 -0.04 0.00 -0.11 0.00 0.00 43.42 43.63 1xu9 n LEU 32 CO 0.26 0.23 1.46 1.67 -1.51 0.00 0.00 177.39 179.51 1xu9 n GLN 33 N -1.25 2.58 -0.65 3.23 7.27 -0.89 -1.53 117.38 126.14 1xu9 n GLN 33 Ca 0.04 0.94 0.00 0.00 0.07 0.00 0.00 57.00 58.05 1xu9 n GLN 33 Cb 0.30 -2.82 0.00 0.00 2.41 0.00 0.00 30.24 30.14 1xu9 n GLN 33 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1xu9 n GLY 34 N 4.21 1.17 3.80 1.69 0.00 -0.39 -4.91 105.19 110.76 1xu9 n GLY 34 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.88 1xu9 n GLY 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xu9 s LYS 35 N -0.17 3.62 -0.35 1.61 -0.14 -0.58 -4.61 119.74 119.12 1xu9 s LYS 35 Ca 0.00 1.32 -0.09 0.00 -1.36 0.00 0.00 55.97 55.84 1xu9 s LYS 35 Cb 0.00 -2.07 0.02 0.00 -1.68 0.00 0.00 37.83 34.10 1xu9 s LYS 35 CO 0.00 -0.58 0.16 0.15 -0.76 0.00 0.00 175.35 174.32 1xu9 s LYS 36 N -3.52 2.91 -0.05 1.68 1.02 -1.26 -0.49 119.74 120.02 1xu9 s LYS 36 Ca 0.66 -1.01 0.03 0.00 0.02 0.00 0.00 55.97 55.67 1xu9 s LYS 36 Cb -0.17 -3.60 0.01 0.00 -0.52 0.00 0.00 37.83 33.55 1xu9 s LYS 36 CO 0.26 -0.61 -0.13 0.08 -0.92 0.00 0.00 175.35 174.04 1xu9 s VAL 37 N 1.53 1.13 -0.09 3.17 1.01 -0.12 -0.31 120.40 126.71 1xu9 s VAL 37 Ca 0.02 -0.50 -0.12 0.00 0.00 0.00 0.00 61.98 61.38 1xu9 s VAL 37 Cb -0.19 -1.01 -0.05 0.00 0.00 0.00 0.00 36.38 35.13 1xu9 s VAL 37 CO 0.05 0.35 0.29 -0.63 0.00 0.00 0.00 175.10 175.16 1xu9 s ILE 38 N 0.48 5.26 -0.15 2.22 1.01 -0.54 -1.27 121.20 128.22 1xu9 s ILE 38 Ca -0.11 0.56 -0.00 0.00 0.00 0.00 0.00 60.65 61.10 1xu9 s ILE 38 Cb -0.14 -3.60 0.03 0.00 0.01 0.00 0.00 42.46 38.76 1xu9 s ILE 38 CO 0.03 0.52 -0.09 -0.69 0.00 0.00 0.00 174.94 174.71 1xu9 s VAL 39 N -0.47 1.26 0.46 2.92 1.01 -0.58 -0.88 120.40 124.12 1xu9 s VAL 39 Ca 0.19 -0.56 -0.02 0.00 0.00 0.00 0.00 61.98 61.59 1xu9 s VAL 39 Cb -0.14 -1.30 -0.02 0.00 0.00 0.00 0.00 36.38 34.92 1xu9 s VAL 39 CO 0.07 0.30 0.71 0.42 0.00 0.00 0.00 175.10 176.60 1xu9 s THR 40 N 1.60 4.41 -1.40 3.92 -4.23 -0.57 -2.26 115.64 117.11 1xu9 s THR 40 Ca 0.03 -0.23 -0.06 0.00 -1.18 0.00 0.00 61.69 60.25 1xu9 s THR 40 Cb -0.14 -3.66 0.03 0.00 1.34 0.00 0.00 72.50 70.08 1xu9 s THR 40 CO -0.09 -0.54 0.87 0.61 -0.54 0.00 0.00 174.62 174.93 1xu9 n GLY 41 N -2.15 -0.39 0.96 3.99 0.00 -0.65 -3.78 105.19 103.17 1xu9 n GLY 41 Ca 0.00 0.16 0.08 0.00 0.00 0.00 0.00 46.02 46.27 1xu9 n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xu9 n ALA 42 N -4.49 2.91 0.25 4.61 0.00 -0.41 -3.92 120.51 119.47 1xu9 n ALA 42 Ca -0.14 -2.02 0.12 0.00 0.00 0.00 0.00 53.44 51.40 1xu9 n ALA 42 Cb 0.61 -0.71 0.11 0.00 0.00 0.00 0.00 19.45 19.46 1xu9 n ALA 42 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1xu9 h SER 43 N 2.14 0.00 -2.78 0.00 4.64 -1.89 -3.20 113.55 112.45 1xu9 h SER 43 Ca 0.00 -0.03 -0.06 0.00 -0.47 0.00 0.00 61.79 61.23 1xu9 h SER 43 Cb 1.35 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.44 1xu9 h SER 43 CO 0.20 0.02 0.17 2.29 -0.87 0.00 0.00 176.83 178.64 1xu9 n LYS 44 N -2.70 0.88 0.00 4.77 2.85 -1.26 -4.72 118.16 117.98 1xu9 n LYS 44 Ca 0.02 -1.92 0.00 0.00 -1.05 0.00 0.00 58.31 55.37 1xu9 n LYS 44 Cb 0.52 2.29 0.00 0.00 -0.65 0.00 0.00 35.03 37.18 1xu9 n LYS 44 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1xu9 n GLY 45 N -0.45 1.57 0.31 2.58 0.00 -1.26 -2.00 105.19 105.94 1xu9 n GLY 45 Ca -0.06 -0.55 -0.05 0.00 0.00 0.00 0.00 46.02 45.37 1xu9 n GLY 45 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1xu9 h ILE 46 N 0.00 1.24 -0.35 -0.61 2.04 -1.88 -2.68 117.51 115.27 1xu9 h ILE 46 Ca 0.00 -0.92 0.01 0.00 1.00 0.00 0.00 64.86 64.95 1xu9 h ILE 46 Cb 0.00 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 36.73 1xu9 h ILE 46 CO 0.00 0.34 0.21 1.23 0.00 0.00 0.00 178.15 179.93 1xu9 h GLY 47 N 1.01 0.49 0.93 5.37 0.00 -1.67 0.78 103.07 109.99 1xu9 h GLY 47 Ca 0.19 -0.16 0.02 0.00 0.00 0.00 0.00 47.33 47.38 1xu9 h GLY 47 CO 0.00 0.14 0.40 -0.09 0.00 0.00 0.00 176.54 176.99 1xu9 h ARG 48 N 0.42 0.77 -0.42 4.80 2.43 -1.27 -1.30 114.38 119.82 1xu9 h ARG 48 Ca 0.14 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.20 1xu9 h ARG 48 Cb 0.00 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.36 1xu9 h ARG 48 CO -0.06 0.51 -0.02 0.93 -1.51 0.00 0.00 179.97 179.82 1xu9 h GLU 49 N 0.79 0.70 -0.44 0.20 4.39 -1.09 -1.59 114.58 117.54 1xu9 h GLU 49 Ca 0.24 -0.18 -0.01 0.00 0.34 0.00 0.00 59.36 59.75 1xu9 h GLU 49 Cb -0.03 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.52 1xu9 h GLU 49 CO -0.08 0.72 0.22 0.52 -1.16 0.00 0.00 179.01 179.23 1xu9 h MET 50 N 0.65 0.63 -0.77 2.33 2.86 -0.37 -1.36 114.93 118.90 1xu9 h MET 50 Ca 0.13 -0.09 0.06 0.00 -2.06 0.00 0.00 59.70 57.74 1xu9 h MET 50 Cb 0.43 -0.12 -0.06 0.00 0.06 0.00 0.00 31.60 31.91 1xu9 h MET 50 CO 0.02 0.53 0.45 0.00 1.06 0.00 0.00 176.91 178.97 1xu9 h ALA 51 N 1.06 1.05 -0.48 6.32 0.00 -0.82 -0.99 119.26 125.41 1xu9 h ALA 51 Ca 0.15 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 1xu9 h ALA 51 Cb 0.10 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1xu9 h ALA 51 CO -0.02 0.16 0.05 1.88 0.00 0.00 0.00 179.25 181.32 1xu9 h TYR 52 N 0.83 0.86 -0.52 0.00 0.05 -0.94 -0.28 116.97 116.98 1xu9 h TYR 52 Ca 0.34 -0.13 -0.04 0.00 0.05 0.00 0.00 58.73 58.95 1xu9 h TYR 52 Cb 0.19 -0.23 -0.02 0.00 1.01 0.00 0.00 36.73 37.68 1xu9 h TYR 52 CO -0.05 0.81 0.16 0.45 -1.05 0.00 0.00 178.16 178.48 1xu9 h HIS 53 N 0.67 0.83 -0.76 4.88 3.86 -0.96 -1.52 115.15 122.16 1xu9 h HIS 53 Ca 0.14 -0.08 0.01 0.00 -1.16 0.00 0.00 60.37 59.27 1xu9 h HIS 53 Cb 0.43 -0.24 -0.04 0.00 1.06 0.00 0.00 27.41 28.62 1xu9 h HIS 53 CO 0.03 0.72 0.50 -0.07 0.86 0.00 0.00 177.93 179.97 1xu9 h LEU 54 N 0.71 0.87 -0.14 2.43 3.38 -0.96 -1.69 115.31 119.91 1xu9 h LEU 54 Ca 0.17 -0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.12 1xu9 h LEU 54 Cb 0.27 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1xu9 h LEU 54 CO -0.01 0.64 0.05 0.00 0.09 0.00 0.00 178.44 179.21 1xu9 h ALA 55 N 1.27 0.16 -0.24 1.53 0.00 -0.77 -1.74 119.26 119.46 1xu9 h ALA 55 Ca 0.28 0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.24 1xu9 h ALA 55 Cb -0.11 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1xu9 h ALA 55 CO -0.06 -0.39 0.17 0.87 0.00 0.00 0.00 179.25 179.84 1xu9 h LYS 56 N 0.13 0.15 -0.00 0.00 1.57 -0.92 -0.78 116.57 116.72 1xu9 h LYS 56 Ca 0.06 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1xu9 h LYS 56 Cb 0.03 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.30 1xu9 h LYS 56 CO -0.06 0.10 -0.06 -1.33 -0.57 0.00 0.00 179.45 177.53 1xu9 n MET 57 N -4.49 0.49 -1.60 3.15 2.81 -0.67 -4.92 117.12 111.89 1xu9 n MET 57 Ca 0.02 -0.09 0.00 0.00 -1.81 0.00 0.00 57.70 55.82 1xu9 n MET 57 Cb 0.21 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.22 1xu9 n MET 57 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1xu9 n GLY 58 N 1.30 0.43 3.83 3.03 0.00 -0.34 -3.26 105.19 110.18 1xu9 n GLY 58 Ca 0.14 -0.92 -0.31 0.00 0.00 0.00 0.00 46.02 44.93 1xu9 n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xu9 s ALA 59 N -2.00 2.74 0.03 4.61 0.00 -0.71 -1.26 121.76 125.17 1xu9 s ALA 59 Ca 0.00 0.06 -0.25 0.00 0.00 0.00 0.00 51.96 51.77 1xu9 s ALA 59 Cb 0.00 -3.16 -0.05 0.00 0.00 0.00 0.00 23.12 19.91 1xu9 s ALA 59 CO 0.00 -1.15 0.75 -1.01 0.00 0.00 0.00 175.76 174.35 1xu9 s HIS 60 N -3.06 3.71 -0.01 0.00 3.76 0.35 -1.03 115.29 119.00 1xu9 s HIS 60 Ca 0.58 1.43 0.03 0.00 -0.15 0.00 0.00 55.06 56.95 1xu9 s HIS 60 Cb -0.14 -2.81 -0.00 0.00 1.11 0.00 0.00 32.58 30.74 1xu9 s HIS 60 CO 0.55 0.25 -0.10 0.14 -0.85 0.00 0.00 174.74 174.73 1xu9 s VAL 61 N 0.06 0.81 -0.13 -0.90 -7.23 -0.61 -0.94 120.40 111.46 1xu9 s VAL 61 Ca 0.38 -0.42 0.02 0.00 -1.81 0.00 0.00 61.98 60.15 1xu9 s VAL 61 Cb -0.20 -0.69 0.01 0.00 0.56 0.00 0.00 36.38 36.06 1xu9 s VAL 61 CO 0.22 0.24 -0.19 -0.69 -0.31 0.00 0.00 175.10 174.37 1xu9 s VAL 62 N -0.12 1.83 0.08 1.32 1.01 -0.40 -1.74 120.40 122.38 1xu9 s VAL 62 Ca 0.02 -0.83 0.05 0.00 0.00 0.00 0.00 61.98 61.22 1xu9 s VAL 62 Cb -0.05 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.65 1xu9 s VAL 62 CO -0.00 0.50 -0.04 0.68 0.00 0.00 0.00 175.10 176.24 1xu9 s VAL 63 N 0.95 3.78 0.07 2.92 -7.23 -0.31 -1.53 120.40 119.06 1xu9 s VAL 63 Ca -0.05 -1.04 -0.03 0.00 -1.81 0.00 0.00 61.98 59.05 1xu9 s VAL 63 Cb -0.15 -2.77 -0.03 0.00 0.56 0.00 0.00 36.38 33.99 1xu9 s VAL 63 CO -0.03 0.16 0.05 0.28 -0.31 0.00 0.00 175.10 175.25 1xu9 s THR 64 N -1.24 0.19 -1.00 5.32 -1.32 -0.96 -1.91 115.64 114.72 1xu9 s THR 64 Ca 0.23 -1.62 0.00 0.00 -1.21 0.00 0.00 61.69 59.09 1xu9 s THR 64 Cb -0.11 -1.51 0.00 0.00 -1.51 0.00 0.00 72.50 69.37 1xu9 s THR 64 CO 0.15 -0.84 0.00 0.00 -2.21 0.00 0.00 174.62 171.72 1xu9 n ALA 65 N 0.04 0.00 0.09 11.08 0.00 -1.26 -1.28 120.51 129.17 1xu9 n ALA 65 Ca -0.14 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.19 1xu9 n ALA 65 Cb 0.62 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.97 1xu9 n ALA 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xu9 h ARG 66 N 0.00 0.18 -5.44 0.00 3.08 -1.90 -1.09 114.38 109.20 1xu9 h ARG 66 Ca 0.00 -0.27 -0.65 0.00 0.07 0.00 0.00 59.98 59.14 1xu9 h ARG 66 Cb 0.00 0.09 -0.15 0.00 0.08 0.00 0.00 29.97 30.00 1xu9 h ARG 66 CO 0.00 1.09 0.14 -1.12 -1.07 0.00 0.00 179.97 179.01 1xu9 s SER 67 N -6.97 6.35 0.31 7.04 0.01 -1.26 -4.24 113.70 114.93 1xu9 s SER 67 Ca -0.02 -0.21 0.01 0.00 1.31 0.00 0.00 55.95 57.03 1xu9 s SER 67 Cb 0.09 -2.32 0.50 0.00 0.21 0.00 0.00 66.02 64.49 1xu9 s SER 67 CO 0.85 -0.74 1.87 0.07 0.41 0.00 0.00 173.24 175.70 1xu9 h LYS 68 N 8.78 0.74 -0.30 12.44 2.10 -1.97 -1.97 116.57 136.40 1xu9 h LYS 68 Ca -0.26 -0.13 -0.01 0.00 -2.00 0.00 0.00 60.65 58.25 1xu9 h LYS 68 Cb 1.10 -0.12 -0.01 0.00 -0.90 0.00 0.00 32.23 32.30 1xu9 h LYS 68 CO 0.88 0.66 0.17 1.49 -2.00 0.00 0.00 179.45 180.65 1xu9 h GLU 69 N 0.72 0.42 0.01 0.07 4.81 -2.00 0.34 114.58 118.95 1xu9 h GLU 69 Ca 0.16 -0.05 -0.23 0.00 -0.13 0.00 0.00 59.36 59.11 1xu9 h GLU 69 Cb 0.25 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.55 1xu9 h GLU 69 CO -0.01 0.35 -0.97 1.79 -0.73 0.00 0.00 179.01 179.45 1xu9 h THR 70 N 0.37 1.40 -0.79 0.32 1.35 -1.91 -3.02 112.91 110.63 1xu9 h THR 70 Ca 0.11 -2.47 -0.01 0.00 -0.55 0.00 0.00 66.41 63.49 1xu9 h THR 70 Cb 0.06 2.45 -0.04 0.00 -1.73 0.00 0.00 68.15 68.89 1xu9 h THR 70 CO -0.02 0.74 0.47 -0.07 -0.25 0.00 0.00 175.52 176.39 1xu9 h LEU 71 N 0.23 0.95 -0.77 3.87 3.38 -1.20 -2.52 115.31 119.24 1xu9 h LEU 71 Ca -0.09 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.79 1xu9 h LEU 71 Cb 1.61 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 42.08 1xu9 h LEU 71 CO 0.17 0.74 0.34 -0.61 0.09 0.00 0.00 178.44 179.16 1xu9 h GLN 72 N 1.09 1.14 -0.73 1.13 4.15 -0.84 -0.73 115.11 120.31 1xu9 h GLN 72 Ca 0.28 -0.19 -0.05 0.00 0.77 0.00 0.00 58.65 59.47 1xu9 h GLN 72 Cb -0.03 -0.19 -0.03 0.00 0.21 0.00 0.00 27.48 27.43 1xu9 h GLN 72 CO -0.05 0.90 0.26 0.87 -1.93 0.00 0.00 178.83 178.88 1xu9 h LYS 73 N 1.10 1.11 -0.35 1.69 1.57 -1.38 -0.72 116.57 119.60 1xu9 h LYS 73 Ca 0.26 -0.22 -0.02 0.00 -1.87 0.00 0.00 60.65 58.81 1xu9 h LYS 73 Cb 0.17 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 1xu9 h LYS 73 CO -0.03 0.93 0.15 0.28 -0.57 0.00 0.00 179.45 180.21 1xu9 h VAL 74 N 1.06 1.18 -0.72 0.50 2.07 -0.99 -2.15 116.25 117.20 1xu9 h VAL 74 Ca 0.24 -0.53 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1xu9 h VAL 74 Cb 0.25 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 1xu9 h VAL 74 CO -0.01 0.19 0.45 0.58 0.02 0.00 0.00 177.57 178.79 1xu9 h VAL 75 N 0.42 1.20 -0.68 2.57 2.07 -0.87 -0.29 116.25 120.66 1xu9 h VAL 75 Ca 0.12 -0.41 0.03 0.00 0.82 0.00 0.00 66.70 67.26 1xu9 h VAL 75 Cb 0.16 0.18 -0.05 0.00 -1.52 0.00 0.00 31.29 30.06 1xu9 h VAL 75 CO -0.01 0.20 0.42 0.28 0.02 0.00 0.00 177.57 178.48 1xu9 h SER 76 N 0.98 0.68 -0.18 0.57 0.02 -0.84 -0.96 113.55 113.81 1xu9 h SER 76 Ca 0.26 0.01 -0.18 0.00 -0.84 0.00 0.00 61.79 61.03 1xu9 h SER 76 Cb -0.06 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 62.34 1xu9 h SER 76 CO -0.05 0.47 -0.56 -0.74 -1.14 0.00 0.00 176.83 174.80 1xu9 h HIS 77 N 0.82 0.98 -0.82 3.45 6.17 -0.96 -2.53 115.15 122.25 1xu9 h HIS 77 Ca 0.28 -0.35 0.03 0.00 0.71 0.00 0.00 60.37 61.04 1xu9 h HIS 77 Cb 0.05 -0.18 -0.05 0.00 2.52 0.00 0.00 27.41 29.75 1xu9 h HIS 77 CO -0.05 1.16 0.53 0.00 0.71 0.00 0.00 177.93 180.28 1xu9 h LEU 79 N 1.04 1.00 -0.90 0.00 3.38 -1.07 -1.88 115.31 116.88 1xu9 h LEU 79 Ca 0.33 -0.26 -0.11 0.00 0.09 0.00 0.00 57.88 57.93 1xu9 h LEU 79 Cb -0.00 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 1xu9 h LEU 79 CO -0.11 1.01 -0.34 -0.08 0.09 0.00 0.00 178.44 179.00 1xu9 h GLU 80 N 0.96 0.39 0.00 1.13 4.81 -1.05 -2.95 114.58 117.87 1xu9 h GLU 80 Ca 0.19 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 1xu9 h GLU 80 Cb 0.43 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.80 1xu9 h GLU 80 CO 0.01 0.69 0.00 -0.07 -0.73 0.00 0.00 179.01 178.91 1xu9 h LEU 81 N 0.33 0.00 0.00 1.64 3.38 -0.78 -3.47 115.31 116.42 1xu9 h LEU 81 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1xu9 h LEU 81 Cb 0.77 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.52 1xu9 h LEU 81 CO 0.06 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.20 1xu9 n GLY 82 N 0.50 1.78 3.71 0.83 0.00 -0.98 -4.18 105.19 106.86 1xu9 n GLY 82 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1xu9 n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xu9 n ALA 83 N -0.59 1.50 -0.34 4.61 0.00 -0.74 -4.05 120.51 120.89 1xu9 n ALA 83 Ca 0.00 0.37 0.06 0.00 0.00 0.00 0.00 53.44 53.86 1xu9 n ALA 83 Cb 0.00 -2.29 0.24 0.00 0.00 0.00 0.00 19.45 17.39 1xu9 n ALA 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xu9 h ALA 84 N 2.99 1.52 -2.62 0.00 0.00 -1.16 -3.45 119.26 116.54 1xu9 h ALA 84 Ca -0.47 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.40 1xu9 h ALA 84 Cb 1.27 -0.24 -0.15 0.00 0.00 0.00 0.00 17.79 18.67 1xu9 h ALA 84 CO 0.66 0.29 0.17 -1.54 0.00 0.00 0.00 179.25 178.83 1xu9 s SER 85 N -5.85 -0.57 -0.13 0.00 1.04 -1.25 -4.96 113.70 101.99 1xu9 s SER 85 Ca -0.12 0.23 -0.06 0.00 0.48 0.00 0.00 55.95 56.48 1xu9 s SER 85 Cb 0.21 0.56 0.05 0.00 0.10 0.00 0.00 66.02 66.95 1xu9 s SER 85 CO 0.81 -0.82 0.30 0.00 0.98 0.00 0.00 173.24 174.50 1xu9 s ALA 86 N -2.78 -0.71 0.09 5.32 0.00 -1.26 -1.57 121.76 120.84 1xu9 s ALA 86 Ca -0.03 1.15 0.02 0.00 0.00 0.00 0.00 51.96 53.09 1xu9 s ALA 86 Cb -0.01 -0.80 -0.04 0.00 0.00 0.00 0.00 23.12 22.28 1xu9 s ALA 86 CO -0.04 -0.31 -0.07 -1.01 0.00 0.00 0.00 175.76 174.32 1xu9 s HIS 87 N 1.55 0.87 0.14 0.00 3.76 -0.71 -5.00 115.29 115.89 1xu9 s HIS 87 Ca -0.07 -0.78 0.09 0.00 -0.15 0.00 0.00 55.06 54.14 1xu9 s HIS 87 Cb -0.10 -0.50 -0.04 0.00 1.11 0.00 0.00 32.58 33.05 1xu9 s HIS 87 CO -0.10 -0.11 -0.20 1.52 -0.85 0.00 0.00 174.74 175.00 1xu9 s TYR 88 N -2.95 1.86 -0.06 1.40 -0.85 -1.26 -1.16 117.35 114.33 1xu9 s TYR 88 Ca 0.06 -0.44 -0.01 0.00 -0.52 0.00 0.00 57.07 56.16 1xu9 s TYR 88 Cb 0.01 -0.97 0.03 0.00 0.38 0.00 0.00 41.96 41.41 1xu9 s TYR 88 CO -0.03 0.29 0.01 0.42 -1.52 0.00 0.00 175.55 174.72 1xu9 s ILE 89 N -1.62 0.28 -0.02 -3.49 1.01 -0.80 -4.96 121.20 111.59 1xu9 s ILE 89 Ca 0.12 0.17 -0.14 0.00 0.00 0.00 0.00 60.65 60.80 1xu9 s ILE 89 Cb -0.08 -0.44 -0.05 0.00 0.01 0.00 0.00 42.46 41.89 1xu9 s ILE 89 CO 0.06 0.24 0.37 0.00 0.00 0.00 0.00 174.94 175.60 1xu9 s ALA 90 N 1.90 3.72 0.00 9.38 0.00 -1.26 -4.02 121.76 131.47 1xu9 s ALA 90 Ca 0.03 -0.29 0.00 0.00 0.00 0.00 0.00 51.96 51.71 1xu9 s ALA 90 Cb -0.12 -2.33 0.00 0.00 0.00 0.00 0.00 23.12 20.66 1xu9 s ALA 90 CO -0.04 0.48 0.00 0.41 0.00 0.00 0.00 175.76 176.61 1xu9 n GLY 91 N 1.93 0.24 3.71 0.00 0.00 -0.41 -4.98 105.19 105.67 1xu9 n GLY 91 Ca -0.15 -0.95 -0.35 0.00 0.00 0.00 0.00 46.02 44.57 1xu9 n GLY 91 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1xu9 s THR 92 N -2.00 4.79 -2.05 2.61 -1.32 -1.26 -3.12 115.64 113.28 1xu9 s THR 92 Ca 0.00 -0.05 0.15 0.00 -1.21 0.00 0.00 61.69 60.57 1xu9 s THR 92 Cb 0.00 -3.09 0.39 0.00 -1.51 0.00 0.00 72.50 68.29 1xu9 s THR 92 CO 0.00 0.55 1.50 0.23 -2.21 0.00 0.00 174.62 174.69 1xu9 n MET 93 N 2.67 1.20 0.27 7.08 0.00 -1.26 -2.19 117.12 124.89 1xu9 n MET 93 Ca -0.18 -0.30 0.16 0.00 0.00 0.00 0.00 57.70 57.38 1xu9 n MET 93 Cb 0.53 -1.25 0.69 0.00 0.00 0.00 0.00 33.22 33.19 1xu9 n MET 93 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 175.97 176.90 1xu9 h GLU 94 N 0.57 0.00 -4.38 0.03 5.08 -1.92 -3.41 114.58 110.55 1xu9 h GLU 94 Ca 0.00 0.00 -0.73 0.00 -1.00 0.00 0.00 59.36 57.63 1xu9 h GLU 94 Cb 0.13 0.00 -0.26 0.00 0.50 0.00 0.00 28.75 29.12 1xu9 h GLU 94 CO 0.00 0.04 -0.40 0.34 -1.00 0.00 0.00 179.01 177.99 1xu9 s ASP 95 N -5.75 5.87 0.49 1.42 -1.08 -0.93 -4.95 116.67 111.73 1xu9 s ASP 95 Ca 0.01 -1.45 0.26 0.00 -0.52 0.00 0.00 52.55 50.85 1xu9 s ASP 95 Cb 0.10 -2.08 1.23 0.00 -1.46 0.00 0.00 42.92 40.71 1xu9 s ASP 95 CO 0.55 -0.60 1.97 0.24 0.52 0.00 0.00 175.17 177.85 1xu9 h MET 96 N 8.57 0.00 -0.38 4.34 2.86 -1.86 -1.87 114.93 126.59 1xu9 h MET 96 Ca -0.25 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.30 1xu9 h MET 96 Cb 1.09 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.74 1xu9 h MET 96 CO 0.82 0.17 -0.10 1.15 1.06 0.00 0.00 176.91 180.01 1xu9 h THR 97 N 0.00 1.28 -0.58 2.22 2.02 -1.95 -2.23 112.91 113.68 1xu9 h THR 97 Ca -0.00 -1.18 0.01 0.00 0.77 0.00 0.00 66.41 66.01 1xu9 h THR 97 Cb 0.51 1.27 -0.03 0.00 -1.74 0.00 0.00 68.15 68.16 1xu9 h THR 97 CO 0.02 0.39 0.37 0.15 0.37 0.00 0.00 175.52 176.83 1xu9 h PHE 98 N 0.53 0.70 -0.18 3.16 3.57 -1.71 -1.62 116.94 121.39 1xu9 h PHE 98 Ca 0.09 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.65 1xu9 h PHE 98 Cb 0.62 -0.23 -0.03 0.00 2.79 0.00 0.00 35.95 39.09 1xu9 h PHE 98 CO 0.05 0.43 -0.04 0.00 -2.23 0.00 0.00 178.31 176.52 1xu9 h ALA 99 N 1.23 0.13 -0.24 2.41 0.00 -1.16 0.34 119.26 121.96 1xu9 h ALA 99 Ca 0.22 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 1xu9 h ALA 99 Cb -0.05 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1xu9 h ALA 99 CO -0.06 -0.47 0.13 1.49 0.00 0.00 0.00 179.25 180.33 1xu9 h GLU 100 N 0.01 0.33 -0.06 0.00 4.81 -1.31 -2.92 114.58 115.44 1xu9 h GLU 100 Ca 0.09 -0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 59.15 1xu9 h GLU 100 Cb 0.13 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 1xu9 h GLU 100 CO -0.18 0.31 -0.51 1.96 -0.73 0.00 0.00 179.01 179.86 1xu9 h GLN 101 N 0.27 0.16 -0.22 1.92 4.20 -0.93 -2.96 115.11 117.56 1xu9 h GLN 101 Ca 0.08 -0.09 0.03 0.00 0.06 0.00 0.00 58.65 58.73 1xu9 h GLN 101 Cb 0.08 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 27.84 1xu9 h GLN 101 CO -0.01 0.64 0.04 0.35 -0.67 0.00 0.00 178.83 179.18 1xu9 h PHE 102 N 0.13 0.07 -0.78 2.96 3.57 -0.20 -1.43 116.94 121.25 1xu9 h PHE 102 Ca 0.00 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.48 1xu9 h PHE 102 Cb 0.95 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.66 1xu9 h PHE 102 CO 0.01 0.02 0.33 0.28 -2.23 0.00 0.00 178.31 176.72 1xu9 h VAL 103 N 0.12 1.25 -0.33 1.41 2.07 -1.37 0.50 116.25 119.91 1xu9 h VAL 103 Ca 0.10 -0.77 -0.03 0.00 0.82 0.00 0.00 66.70 66.82 1xu9 h VAL 103 Cb 0.09 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.15 1xu9 h VAL 103 CO -0.13 0.32 0.10 0.00 0.02 0.00 0.00 177.57 177.88 1xu9 h ALA 104 N 1.23 0.44 -0.63 1.67 0.00 -1.34 -0.69 119.26 119.95 1xu9 h ALA 104 Ca 0.26 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 1xu9 h ALA 104 Cb 0.18 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1xu9 h ALA 104 CO -0.03 0.07 0.03 0.37 0.00 0.00 0.00 179.25 179.70 1xu9 h GLN 105 N 0.39 1.09 -0.69 0.00 5.75 -0.96 -1.24 115.11 119.45 1xu9 h GLN 105 Ca 0.11 -0.33 -0.04 0.00 -0.15 0.00 0.00 58.65 58.24 1xu9 h GLN 105 Cb 0.25 -0.11 -0.03 0.00 1.07 0.00 0.00 27.48 28.66 1xu9 h GLN 105 CO -0.00 1.05 0.29 0.00 -2.65 0.00 0.00 178.83 177.51 1xu9 h ALA 106 N 1.01 0.89 -0.80 3.38 0.00 -0.73 -0.63 119.26 122.38 1xu9 h ALA 106 Ca 0.18 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1xu9 h ALA 106 Cb 0.53 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1xu9 h ALA 106 CO 0.03 0.50 0.38 0.78 0.00 0.00 0.00 179.25 180.94 1xu9 h GLY 107 N 0.98 1.24 1.12 0.00 0.00 -0.90 -2.23 103.07 103.28 1xu9 h GLY 107 Ca 0.23 -0.62 -0.10 0.00 0.00 0.00 0.00 47.33 46.84 1xu9 h GLY 107 CO -0.02 0.59 -0.02 1.70 0.00 0.00 0.00 176.54 178.79 1xu9 h LYS 108 N 1.14 1.04 -0.58 4.80 3.64 -0.83 0.10 116.57 125.88 1xu9 h LYS 108 Ca 0.27 -0.34 -0.06 0.00 -1.27 0.00 0.00 60.65 59.26 1xu9 h LYS 108 Cb 0.12 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.83 1xu9 h LYS 108 CO -0.03 1.03 0.13 -0.07 -2.27 0.00 0.00 179.45 178.23 1xu9 h LEU 109 N 0.95 0.85 0.00 5.20 3.38 -0.81 -3.19 115.31 121.69 1xu9 h LEU 109 Ca 0.17 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xu9 h LEU 109 Cb 0.58 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1xu9 h LEU 109 CO 0.03 0.84 -1.12 0.23 0.09 0.00 0.00 178.44 178.51 1xu9 n MET 110 N -4.25 0.17 -2.48 1.13 2.81 -0.87 -4.98 117.12 108.64 1xu9 n MET 110 Ca 0.04 -0.03 -0.08 0.00 -1.81 0.00 0.00 57.70 55.82 1xu9 n MET 110 Cb 0.24 -1.52 0.01 0.00 -0.71 0.00 0.00 33.22 31.24 1xu9 n MET 110 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1xu9 n GLY 111 N 1.43 0.23 0.00 3.03 0.00 0.23 -4.92 105.19 105.19 1xu9 n GLY 111 Ca 0.02 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.57 1xu9 n GLY 111 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xu9 n GLY 112 N -1.02 0.86 3.40 -0.02 0.00 -0.50 -5.04 105.19 102.87 1xu9 n GLY 112 Ca -0.05 -1.99 -0.08 0.00 0.00 0.00 0.00 46.02 43.90 1xu9 n GLY 112 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1xu9 s LEU 113 N 0.00 -0.51 -0.16 0.99 2.96 -1.26 -4.57 118.68 116.13 1xu9 s LEU 113 Ca 0.00 1.13 0.09 0.00 -0.22 0.00 0.00 54.13 55.13 1xu9 s LEU 113 Cb 0.00 1.70 -0.16 0.00 0.50 0.00 0.00 46.19 48.23 1xu9 s LEU 113 CO 0.00 -0.21 -0.03 0.47 -1.32 0.00 0.00 176.35 175.26 1xu9 n ASP 114 N 4.58 1.76 -3.75 3.68 8.00 0.57 -4.10 116.55 127.30 1xu9 n ASP 114 Ca -0.19 -0.04 -0.13 0.00 0.71 0.00 0.00 54.79 55.15 1xu9 n ASP 114 Cb 0.55 0.45 -0.13 0.00 -0.02 0.00 0.00 41.12 41.96 1xu9 n ASP 114 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 1xu9 s MET 115 N -2.37 0.17 -0.32 -1.24 1.75 -0.81 -1.36 119.30 115.13 1xu9 s MET 115 Ca -0.14 0.44 -0.05 0.00 -1.25 0.00 0.00 55.69 54.69 1xu9 s MET 115 Cb 0.05 -0.10 0.04 0.00 2.84 0.00 0.00 34.83 37.66 1xu9 s MET 115 CO 0.55 -0.14 0.06 -1.17 -0.65 0.00 0.00 175.02 173.67 1xu9 s LEU 116 N 1.03 4.10 -0.33 4.11 2.96 -0.15 -1.46 118.68 128.95 1xu9 s LEU 116 Ca -0.08 -1.15 -0.09 0.00 -0.22 0.00 0.00 54.13 52.60 1xu9 s LEU 116 Cb -0.09 -1.81 0.01 0.00 0.50 0.00 0.00 46.19 44.80 1xu9 s LEU 116 CO -0.06 -0.29 0.14 -0.63 -1.32 0.00 0.00 176.35 174.19 1xu9 s ILE 117 N 1.35 4.33 -0.38 6.68 1.01 -0.05 -0.63 121.20 133.52 1xu9 s ILE 117 Ca -0.03 -0.70 -0.11 0.00 0.00 0.00 0.00 60.65 59.82 1xu9 s ILE 117 Cb -0.19 -3.30 0.03 0.00 0.01 0.00 0.00 42.46 39.01 1xu9 s ILE 117 CO 0.01 -0.04 0.21 -0.76 0.00 0.00 0.00 174.94 174.36 1xu9 s LEU 118 N 1.54 4.76 0.00 2.97 1.43 0.28 -1.51 118.68 128.16 1xu9 s LEU 118 Ca 0.03 -1.06 0.00 0.00 -1.03 0.00 0.00 54.13 52.06 1xu9 s LEU 118 Cb -0.18 -2.02 0.00 0.00 0.03 0.00 0.00 46.19 44.03 1xu9 s LEU 118 CO 0.05 -0.40 0.00 -3.20 0.23 0.00 0.00 176.35 173.03 1xu9 n ASN 119 N 4.98 1.25 -4.72 2.29 2.85 -1.26 -1.37 115.26 119.29 1xu9 n ASN 119 Ca -0.12 0.00 -0.36 0.00 -0.11 0.00 0.00 54.58 54.00 1xu9 n ASN 119 Cb 0.46 0.20 0.09 0.00 1.24 0.00 0.00 39.78 41.77 1xu9 n ASN 119 CO 0.00 0.00 0.00 -1.38 -2.11 0.00 0.00 177.26 173.77 1xu9 s HIS 120 N -0.79 1.96 0.05 1.20 -3.43 -1.25 -4.81 115.29 108.22 1xu9 s HIS 120 Ca 0.00 1.55 -0.03 0.00 -0.80 0.00 0.00 55.06 55.78 1xu9 s HIS 120 Cb 0.00 -3.63 -0.03 0.00 -1.43 0.00 0.00 32.58 27.49 1xu9 s HIS 120 CO 0.00 -2.93 0.03 0.96 -2.00 0.00 0.00 174.74 170.80 1xu9 s ILE 121 N -1.66 0.18 0.56 -5.38 -4.36 -1.26 -4.76 121.20 104.52 1xu9 s ILE 121 Ca 0.79 -1.52 -0.17 0.00 -0.26 0.00 0.00 60.65 59.50 1xu9 s ILE 121 Cb -0.35 -1.31 -0.05 0.00 1.25 0.00 0.00 42.46 42.00 1xu9 s ILE 121 CO 0.44 -0.84 1.05 0.28 0.24 0.00 0.00 174.94 176.11 1xu9 s THR 122 N -3.55 3.80 0.11 8.37 -1.32 -1.26 -4.95 115.64 116.84 1xu9 s THR 122 Ca 0.03 0.94 -0.33 0.00 -1.21 0.00 0.00 61.69 61.12 1xu9 s THR 122 Cb 0.05 -3.41 -0.13 0.00 -1.51 0.00 0.00 72.50 67.50 1xu9 s THR 122 CO -0.09 -0.42 1.68 0.59 -2.21 0.00 0.00 174.62 174.17 1xu9 n ASN 123 N -1.69 3.36 -3.94 8.08 4.13 -1.26 -4.96 115.26 118.99 1xu9 n ASN 123 Ca 0.09 1.05 -0.21 0.00 1.68 0.00 0.00 54.58 57.18 1xu9 n ASN 123 Cb 0.53 -1.44 -0.16 0.00 -1.54 0.00 0.00 39.78 37.16 1xu9 n ASN 123 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 1xu9 s THR 124 N 1.78 0.73 0.35 3.41 -1.32 -1.26 -5.08 115.64 114.25 1xu9 s THR 124 Ca 0.82 -0.24 0.08 0.00 -1.21 0.00 0.00 61.69 61.13 1xu9 s THR 124 Cb -0.64 -0.71 -0.07 0.00 -1.51 0.00 0.00 72.50 69.57 1xu9 s THR 124 CO 0.40 0.27 -0.05 -0.94 -2.21 0.00 0.00 174.62 172.09 1xu9 s SER 125 N 0.81 3.54 -0.23 8.08 1.04 -1.26 -5.02 113.70 120.66 1xu9 s SER 125 Ca -0.13 -1.27 -0.29 0.00 0.48 0.00 0.00 55.95 54.75 1xu9 s SER 125 Cb -0.15 -0.32 -0.00 0.00 0.10 0.00 0.00 66.02 65.65 1xu9 s SER 125 CO 0.01 -0.33 1.25 -0.76 0.98 0.00 0.00 173.24 174.39 1xu9 s LEU 126 N -3.61 4.05 -0.01 2.42 1.43 -1.26 -4.85 118.68 116.85 1xu9 s LEU 126 Ca 0.33 1.45 -0.23 0.00 -1.03 0.00 0.00 54.13 54.65 1xu9 s LEU 126 Cb 0.05 -3.54 0.05 0.00 0.03 0.00 0.00 46.19 42.79 1xu9 s LEU 126 CO 0.16 -0.88 0.51 0.20 0.23 0.00 0.00 176.35 176.57 1xu9 s ASN 127 N 2.21 -0.44 0.53 2.29 0.01 -0.86 -5.06 114.94 113.61 1xu9 s ASN 127 Ca 0.54 0.35 -0.22 0.00 -0.71 0.00 0.00 52.86 52.81 1xu9 s ASN 127 Cb -0.19 0.45 -0.05 0.00 0.41 0.00 0.00 41.25 41.87 1xu9 s ASN 127 CO 0.17 -0.60 1.33 -0.76 -1.51 0.00 0.00 177.10 175.74 1xu9 s LEU 128 N -1.49 3.89 -0.05 0.60 1.43 -1.26 -4.22 118.68 117.58 1xu9 s LEU 128 Ca -0.10 2.71 -0.26 0.00 -1.03 0.00 0.00 54.13 55.45 1xu9 s LEU 128 Cb -0.02 -4.24 -0.03 0.00 0.03 0.00 0.00 46.19 41.93 1xu9 s LEU 128 CO 0.04 -1.44 0.82 0.12 0.23 0.00 0.00 176.35 176.12 1xu9 s PHE 129 N -1.33 3.59 0.00 0.29 5.36 -1.26 -4.96 117.98 119.66 1xu9 s PHE 129 Ca 0.70 1.42 0.00 0.00 -0.96 0.00 0.00 56.93 58.08 1xu9 s PHE 129 Cb -0.39 -2.95 0.00 0.00 -0.34 0.00 0.00 43.02 39.34 1xu9 s PHE 129 CO 0.46 0.01 0.00 0.72 -1.46 0.00 0.00 175.22 174.95 1xu9 n HIS 130 N 4.01 0.00 -2.06 10.12 8.25 -1.26 -5.02 115.22 129.26 1xu9 n HIS 130 Ca 0.02 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.47 1xu9 n HIS 130 Cb 0.51 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.61 1xu9 n HIS 130 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 1xu9 n ASP 131 N -2.21 -0.06 -4.20 0.41 5.75 -1.26 -5.01 116.55 109.96 1xu9 n ASP 131 Ca 0.00 -1.58 -0.43 0.00 -0.01 0.00 0.00 54.79 52.77 1xu9 n ASP 131 Cb 0.00 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.06 1xu9 n ASP 131 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 1xu9 n ASP 132 N 0.06 5.12 0.21 -1.12 -0.08 -1.26 -4.68 116.55 114.80 1xu9 n ASP 132 Ca -0.04 -3.03 0.05 0.00 -1.51 0.00 0.00 54.79 50.26 1xu9 n ASP 132 Cb 0.67 -1.54 0.44 0.00 2.34 0.00 0.00 41.12 43.03 1xu9 n ASP 132 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 1xu9 h ILE 133 N 4.30 1.13 -0.69 5.18 2.04 -1.99 -2.40 117.51 125.09 1xu9 h ILE 133 Ca 0.36 -1.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.23 1xu9 h ILE 133 Cb 0.77 1.55 -0.03 0.00 -0.74 0.00 0.00 36.82 38.36 1xu9 h ILE 133 CO 1.43 0.28 0.42 -0.74 0.00 0.00 0.00 178.15 179.54 1xu9 h HIS 134 N 0.00 0.90 -0.42 1.37 2.76 -2.00 0.79 115.15 118.55 1xu9 h HIS 134 Ca -0.00 0.00 -0.12 0.00 -2.20 0.00 0.00 60.37 58.05 1xu9 h HIS 134 Cb 0.52 -0.30 -0.01 0.00 1.55 0.00 0.00 27.41 29.17 1xu9 h HIS 134 CO 0.00 0.60 -0.22 1.25 -1.30 0.00 0.00 177.93 178.26 1xu9 h HIS 135 N 0.94 0.97 -0.12 5.26 -0.00 -1.85 -0.82 115.15 119.52 1xu9 h HIS 135 Ca 0.25 -0.22 -0.00 0.00 -0.00 0.00 0.00 60.37 60.39 1xu9 h HIS 135 Cb -0.04 -0.23 -0.01 0.00 -0.00 0.00 0.00 27.41 27.13 1xu9 h HIS 135 CO -0.02 0.98 0.06 0.28 -0.00 0.00 0.00 177.93 179.24 1xu9 h VAL 136 N 0.74 1.12 -0.45 5.26 2.07 -0.96 -0.21 116.25 123.82 1xu9 h VAL 136 Ca 0.10 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 67.27 1xu9 h VAL 136 Cb 0.75 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 31.62 1xu9 h VAL 136 CO 0.06 0.11 0.23 -0.09 0.02 0.00 0.00 177.57 177.90 1xu9 h ARG 137 N 0.07 0.64 -0.54 1.57 2.43 -0.75 -1.51 114.38 116.28 1xu9 h ARG 137 Ca 0.04 -0.08 -0.07 0.00 -0.81 0.00 0.00 59.98 59.06 1xu9 h ARG 137 Cb 0.12 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 1xu9 h ARG 137 CO -0.01 0.52 0.05 -0.22 -1.51 0.00 0.00 179.97 178.80 1xu9 h LYS 138 N 0.59 0.89 -0.45 0.20 3.64 -1.02 0.49 116.57 120.91 1xu9 h LYS 138 Ca 0.16 -0.23 -0.01 0.00 -1.27 0.00 0.00 60.65 59.29 1xu9 h LYS 138 Cb 0.08 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.77 1xu9 h LYS 138 CO -0.02 0.86 0.24 0.77 -2.27 0.00 0.00 179.45 179.03 1xu9 h SER 139 N 0.83 0.57 -0.36 4.20 0.02 -0.83 0.52 113.55 118.50 1xu9 h SER 139 Ca 0.17 -0.10 -0.09 0.00 -0.84 0.00 0.00 61.79 60.93 1xu9 h SER 139 Cb 0.43 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.81 1xu9 h SER 139 CO 0.02 0.50 -0.07 0.24 -1.14 0.00 0.00 176.83 176.38 1xu9 h MET 140 N 0.59 0.78 -0.02 3.45 2.86 -0.62 0.60 114.93 122.58 1xu9 h MET 140 Ca 0.16 -0.24 -0.05 0.00 -2.06 0.00 0.00 59.70 57.51 1xu9 h MET 140 Cb 0.07 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.65 1xu9 h MET 140 CO -0.02 0.83 -0.17 0.93 1.06 0.00 0.00 176.91 179.54 1xu9 h GLU 141 N 0.72 0.15 0.05 1.72 4.39 -0.60 -0.08 114.58 120.93 1xu9 h GLU 141 Ca 0.13 -0.14 -0.15 0.00 0.34 0.00 0.00 59.36 59.55 1xu9 h GLU 141 Cb 0.53 0.03 0.01 0.00 -0.10 0.00 0.00 28.75 29.23 1xu9 h GLU 141 CO 0.03 0.82 -0.60 0.28 -1.16 0.00 0.00 179.01 178.39 1xu9 h VAL 142 N -0.47 1.49 0.00 3.13 2.07 -0.91 -0.68 116.25 120.88 1xu9 h VAL 142 Ca -0.02 -2.22 -0.05 0.00 0.82 0.00 0.00 66.70 65.23 1xu9 h VAL 142 Cb 0.87 2.85 -0.01 0.00 -1.52 0.00 0.00 31.29 33.49 1xu9 h VAL 142 CO 0.03 0.63 -0.42 0.78 0.02 0.00 0.00 177.57 178.62 1xu9 h ASN 143 N -0.29 0.00 0.00 0.57 2.35 -1.02 -3.38 115.58 113.82 1xu9 h ASN 143 Ca -0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 1xu9 h ASN 143 Cb 1.37 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.74 1xu9 h ASN 143 CO 0.12 0.21 0.00 0.33 -1.65 0.00 0.00 177.43 176.43 1xu9 n PHE 144 N -3.06 -0.30 -0.24 1.19 7.35 -0.98 -4.70 117.46 116.71 1xu9 n PHE 144 Ca 0.02 0.05 -0.02 0.00 -0.76 0.00 0.00 57.45 56.74 1xu9 n PHE 144 Cb 0.62 0.10 0.16 0.00 0.35 0.00 0.00 39.48 40.71 1xu9 n PHE 144 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 1xu9 h LEU 145 N 0.00 0.96 -1.46 -2.13 3.38 -0.91 -1.14 115.31 114.01 1xu9 h LEU 145 Ca 0.00 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 1xu9 h LEU 145 Cb 0.00 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1xu9 h LEU 145 CO 0.00 0.80 -0.08 0.77 0.09 0.00 0.00 178.44 180.02 1xu9 h SER 146 N 1.07 0.24 -0.69 -0.43 4.64 -1.30 -1.08 113.55 115.99 1xu9 h SER 146 Ca 0.26 -0.04 -0.04 0.00 -0.47 0.00 0.00 61.79 61.50 1xu9 h SER 146 Cb 0.07 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 62.07 1xu9 h SER 146 CO -0.04 0.35 0.27 1.88 -0.87 0.00 0.00 176.83 178.42 1xu9 h TYR 147 N 0.25 1.08 -0.31 4.77 -1.99 -1.44 0.01 116.97 119.34 1xu9 h TYR 147 Ca 0.05 -0.08 -0.04 0.00 2.00 0.00 0.00 58.73 60.66 1xu9 h TYR 147 Cb 0.30 -0.32 -0.01 0.00 2.00 0.00 0.00 36.73 38.69 1xu9 h TYR 147 CO 0.00 0.83 0.03 0.28 -0.00 0.00 0.00 178.16 179.31 1xu9 h VAL 148 N 1.04 1.24 -0.50 -2.88 2.07 -1.00 -1.33 116.25 114.89 1xu9 h VAL 148 Ca 0.24 -0.86 0.00 0.00 0.82 0.00 0.00 66.70 66.90 1xu9 h VAL 148 Cb 0.22 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.18 1xu9 h VAL 148 CO -0.02 0.28 0.32 0.58 0.02 0.00 0.00 177.57 178.75 1xu9 h VAL 149 N 0.33 1.14 -0.76 2.57 2.07 -1.00 -0.47 116.25 120.13 1xu9 h VAL 149 Ca 0.09 -0.28 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 1xu9 h VAL 149 Cb 0.38 0.43 -0.04 0.00 -1.52 0.00 0.00 31.29 30.54 1xu9 h VAL 149 CO 0.01 0.14 0.39 -0.07 0.02 0.00 0.00 177.57 178.05 1xu9 h LEU 150 N 0.67 0.97 -0.39 2.57 3.38 -0.91 -1.81 115.31 119.80 1xu9 h LEU 150 Ca 0.18 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1xu9 h LEU 150 Cb -0.05 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 1xu9 h LEU 150 CO -0.04 0.81 0.19 0.74 0.09 0.00 0.00 178.44 180.24 1xu9 h THR 151 N 1.05 1.17 -0.65 0.22 2.02 -0.81 -1.09 112.91 114.82 1xu9 h THR 151 Ca 0.26 -0.47 0.01 0.00 0.77 0.00 0.00 66.41 66.98 1xu9 h THR 151 Cb 0.08 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.22 1xu9 h THR 151 CO -0.04 0.18 0.43 0.58 0.37 0.00 0.00 175.52 177.04 1xu9 h VAL 152 N 0.49 1.16 -0.46 3.16 2.07 -0.84 -0.59 116.25 121.24 1xu9 h VAL 152 Ca 0.13 -0.30 -0.04 0.00 0.82 0.00 0.00 66.70 67.31 1xu9 h VAL 152 Cb 0.11 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.06 1xu9 h VAL 152 CO -0.02 0.16 0.10 0.00 0.02 0.00 0.00 177.57 177.84 1xu9 h ALA 153 N 1.24 1.33 0.00 1.67 0.00 -1.14 -3.17 119.26 119.19 1xu9 h ALA 153 Ca 0.24 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 1xu9 h ALA 153 Cb -0.10 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1xu9 h ALA 153 CO -0.06 0.48 -0.94 0.00 0.00 0.00 0.00 179.25 178.74 1xu9 h ALA 154 N 1.45 0.64 -0.62 0.00 0.00 -0.60 -3.41 119.26 116.71 1xu9 h ALA 154 Ca 0.15 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1xu9 h ALA 154 Cb 0.26 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1xu9 h ALA 154 CO -0.00 0.37 0.40 1.25 0.00 0.00 0.00 179.25 181.27 1xu9 h LEU 155 N 0.00 0.72 -0.78 0.00 5.85 -1.10 -1.40 115.31 118.60 1xu9 h LEU 155 Ca -0.05 -0.03 0.10 0.00 0.84 0.00 0.00 57.88 58.73 1xu9 h LEU 155 Cb 1.24 -0.18 -0.07 0.00 0.37 0.00 0.00 40.66 42.01 1xu9 h LEU 155 CO 0.02 0.54 0.42 -0.65 -0.34 0.00 0.00 178.44 178.44 1xu9 h PRO 156 N 0.84 0.68 -0.59 5.25 0.11 -1.79 0.19 132.00 136.68 1xu9 h PRO 156 Ca 0.23 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 66.19 1xu9 h PRO 156 Cb -0.07 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 30.87 1xu9 h PRO 156 CO -0.05 0.45 -0.03 0.52 -0.21 0.00 0.00 178.00 178.68 1xu9 h MET 157 N 0.70 1.07 -0.16 1.05 2.86 -1.70 -2.26 114.93 116.48 1xu9 h MET 157 Ca 0.39 -0.36 -0.09 0.00 -2.06 0.00 0.00 59.70 57.57 1xu9 h MET 157 Cb 0.40 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 1xu9 h MET 157 CO -0.27 1.06 -0.32 -0.07 1.06 0.00 0.00 176.91 178.38 1xu9 h LEU 158 N 0.96 0.32 -0.78 1.22 3.38 -0.50 -2.47 115.31 117.46 1xu9 h LEU 158 Ca 0.16 -0.12 -0.10 0.00 0.09 0.00 0.00 57.88 57.91 1xu9 h LEU 158 Cb 0.60 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 1xu9 h LEU 158 CO 0.04 0.63 -0.18 0.11 0.09 0.00 0.00 178.44 179.13 1xu9 h LYS 159 N 0.28 0.73 -0.56 1.13 1.57 -0.47 0.65 116.57 119.91 1xu9 h LYS 159 Ca 0.04 -0.27 -0.04 0.00 -1.87 0.00 0.00 60.65 58.51 1xu9 h LYS 159 Cb 0.70 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.94 1xu9 h LYS 159 CO 0.05 0.86 0.18 1.96 -0.57 0.00 0.00 179.45 181.94 1xu9 h GLN 160 N 0.65 0.83 -0.20 3.15 4.20 -1.08 -3.07 115.11 119.59 1xu9 h GLN 160 Ca 0.10 -0.15 0.00 0.00 0.06 0.00 0.00 58.65 58.66 1xu9 h GLN 160 Cb 0.66 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.30 1xu9 h GLN 160 CO 0.05 0.71 0.00 -1.13 -0.67 0.00 0.00 178.83 177.79 1xu9 n SER 161 N -4.30 3.23 -3.88 1.46 3.41 -0.96 -4.96 113.62 107.63 1xu9 n SER 161 Ca 0.04 -2.00 -0.25 0.00 -0.26 0.00 0.00 58.87 56.41 1xu9 n SER 161 Cb 0.19 -0.12 -0.00 0.00 -0.26 0.00 0.00 64.21 64.02 1xu9 n SER 161 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1xu9 n ASN 162 N 1.43 -0.89 -2.02 4.04 3.02 -0.23 -4.96 115.26 115.64 1xu9 n ASN 162 Ca 0.17 -0.97 0.00 0.00 -0.03 0.00 0.00 54.58 53.75 1xu9 n ASN 162 Cb 0.61 -3.29 0.00 0.00 -0.61 0.00 0.00 39.78 36.49 1xu9 n ASN 162 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xu9 n GLY 163 N -1.87 0.39 3.12 7.41 0.00 0.06 -4.80 105.19 109.50 1xu9 n GLY 163 Ca -0.29 -1.73 -0.13 0.00 0.00 0.00 0.00 46.02 43.87 1xu9 n GLY 163 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xu9 s SER 164 N -1.00 -0.23 -0.14 1.61 0.01 -0.46 -1.80 113.70 111.69 1xu9 s SER 164 Ca 0.00 0.42 -0.01 0.00 1.31 0.00 0.00 55.95 57.67 1xu9 s SER 164 Cb 0.00 0.46 -0.02 0.00 0.21 0.00 0.00 66.02 66.68 1xu9 s SER 164 CO 0.00 -0.11 -0.11 -0.63 0.41 0.00 0.00 173.24 172.80 1xu9 s ILE 165 N -0.02 3.24 -0.18 1.44 1.01 0.42 -0.97 121.20 126.14 1xu9 s ILE 165 Ca -0.01 -0.59 0.01 0.00 0.00 0.00 0.00 60.65 60.05 1xu9 s ILE 165 Cb -0.02 -2.38 0.02 0.00 0.01 0.00 0.00 42.46 40.09 1xu9 s ILE 165 CO 0.01 0.51 -0.19 -0.69 0.00 0.00 0.00 174.94 174.58 1xu9 s VAL 166 N 0.39 2.18 -0.24 2.92 1.01 0.20 -1.04 120.40 125.82 1xu9 s VAL 166 Ca -0.09 -0.90 -0.04 0.00 0.00 0.00 0.00 61.98 60.95 1xu9 s VAL 166 Cb -0.15 -1.92 0.00 0.00 0.00 0.00 0.00 36.38 34.31 1xu9 s VAL 166 CO 0.05 0.53 -0.02 -0.69 0.00 0.00 0.00 175.10 174.97 1xu9 s VAL 167 N 1.24 3.38 -0.21 2.92 1.01 0.28 -0.56 120.40 128.48 1xu9 s VAL 167 Ca 0.04 -0.66 -0.21 0.00 0.00 0.00 0.00 61.98 61.15 1xu9 s VAL 167 Cb -0.13 -2.63 -0.02 0.00 0.00 0.00 0.00 36.38 33.60 1xu9 s VAL 167 CO -0.11 0.30 0.66 -0.69 0.00 0.00 0.00 175.10 175.26 1xu9 s VAL 168 N 1.45 4.99 0.00 2.92 1.01 -0.47 -0.85 120.40 129.45 1xu9 s VAL 168 Ca 0.04 1.23 0.00 0.00 0.00 0.00 0.00 61.98 63.25 1xu9 s VAL 168 Cb -0.15 -3.97 0.00 0.00 0.00 0.00 0.00 36.38 32.26 1xu9 s VAL 168 CO -0.02 0.08 0.00 -0.24 0.00 0.00 0.00 175.10 174.92 1xu9 n SER 169 N 5.21 0.22 -3.56 3.32 2.88 0.94 -4.86 113.62 117.76 1xu9 n SER 169 Ca -0.00 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.37 1xu9 n SER 169 Cb 0.49 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.89 1xu9 n SER 169 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1xu9 s SER 170 N 1.00 -0.54 0.31 -3.46 0.01 -1.22 -2.60 113.70 107.20 1xu9 s SER 170 Ca 0.00 0.48 0.06 0.00 1.31 0.00 0.00 55.95 57.80 1xu9 s SER 170 Cb 0.00 0.50 0.74 0.00 0.21 0.00 0.00 66.02 67.48 1xu9 s SER 170 CO 0.00 -0.63 1.79 -0.07 0.41 0.00 0.00 173.24 174.74 1xu9 h LEU 171 N 3.02 0.78 0.00 2.44 3.38 -1.62 0.13 115.31 123.45 1xu9 h LEU 171 Ca -0.29 0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1xu9 h LEU 171 Cb 1.17 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1xu9 h LEU 171 CO 0.40 0.29 0.00 0.00 0.09 0.00 0.00 178.44 179.22 1xu9 n ALA 172 N -2.34 2.40 0.43 1.53 0.00 -1.26 -1.35 120.51 119.92 1xu9 n ALA 172 Ca 0.23 -0.10 0.12 0.00 0.00 0.00 0.00 53.44 53.68 1xu9 n ALA 172 Cb 0.56 -1.27 0.19 0.00 0.00 0.00 0.00 19.45 18.93 1xu9 n ALA 172 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xu9 n GLY 173 N 0.50 1.55 0.00 0.00 0.00 0.46 -4.46 105.19 103.25 1xu9 n GLY 173 Ca 0.12 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.43 1xu9 n GLY 173 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xu9 n LYS 174 N 1.42 1.71 -4.30 1.61 4.76 -0.48 -4.23 118.16 118.65 1xu9 n LYS 174 Ca 0.18 0.00 -0.16 0.00 -2.87 0.00 0.00 58.31 55.46 1xu9 n LYS 174 Cb 0.59 -0.78 -0.10 0.00 -1.84 0.00 0.00 35.03 32.90 1xu9 n LYS 174 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 1xu9 s VAL 175 N -1.56 0.85 0.05 -0.18 -7.23 -0.46 -5.14 120.40 106.74 1xu9 s VAL 175 Ca 0.00 -2.01 -0.16 0.00 -1.81 0.00 0.00 61.98 58.00 1xu9 s VAL 175 Cb 0.00 -2.33 -0.06 0.00 0.56 0.00 0.00 36.38 34.55 1xu9 s VAL 175 CO 0.00 -0.31 0.48 0.00 -0.31 0.00 0.00 175.10 174.96 1xu9 s ALA 176 N -3.54 3.65 0.03 1.32 0.00 -1.26 -4.20 121.76 117.75 1xu9 s ALA 176 Ca 0.29 -0.13 0.02 0.00 0.00 0.00 0.00 51.96 52.14 1xu9 s ALA 176 Cb 0.06 -2.48 -0.02 0.00 0.00 0.00 0.00 23.12 20.69 1xu9 s ALA 176 CO 0.08 0.46 -0.08 0.71 0.00 0.00 0.00 175.76 176.93 1xu9 s TYR 177 N -1.17 0.69 0.73 0.00 1.51 -1.26 -5.06 117.35 112.79 1xu9 s TYR 177 Ca 0.28 -0.35 -0.11 0.00 -1.01 0.00 0.00 57.07 55.89 1xu9 s TYR 177 Cb -0.17 -0.42 0.03 0.00 -0.11 0.00 0.00 41.96 41.29 1xu9 s TYR 177 CO 0.16 -0.04 1.08 -1.25 -1.11 0.00 0.00 175.55 174.39 1xu9 s PRO 178 N -1.05 2.56 0.00 -1.71 0.04 -1.26 -4.05 135.00 129.54 1xu9 s PRO 178 Ca -0.04 1.10 0.00 0.00 0.04 0.00 0.00 61.00 62.09 1xu9 s PRO 178 Cb -0.07 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.53 1xu9 s PRO 178 CO 0.00 -1.40 0.00 -1.33 0.04 0.00 0.00 177.00 174.31 1xu9 n MET 179 N -3.29 0.00 -2.26 4.56 2.81 -1.26 -4.84 117.12 112.83 1xu9 n MET 179 Ca 0.09 0.00 -0.03 0.00 -1.81 0.00 0.00 57.70 55.95 1xu9 n MET 179 Cb 0.53 -2.23 0.05 0.00 -0.71 0.00 0.00 33.22 30.86 1xu9 n MET 179 CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 1xu9 n VAL 180 N -2.00 1.27 0.14 2.03 0.24 -1.26 -2.02 118.33 116.73 1xu9 n VAL 180 Ca 0.00 -2.75 -0.14 0.00 -2.04 0.00 0.00 64.34 59.41 1xu9 n VAL 180 Cb 0.00 0.73 -0.08 0.00 -1.47 0.00 0.00 33.84 33.02 1xu9 n VAL 180 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1xu9 h ALA 181 N 2.08 -0.28 -0.68 2.33 0.00 -1.86 0.16 119.26 121.02 1xu9 h ALA 181 Ca -0.06 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1xu9 h ALA 181 Cb 1.43 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 19.30 1xu9 h ALA 181 CO 0.25 -0.65 0.39 0.00 0.00 0.00 0.00 179.25 179.24 1xu9 h ALA 182 N 0.50 0.87 -0.24 0.00 0.00 -1.95 -1.22 119.26 117.23 1xu9 h ALA 182 Ca -0.03 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1xu9 h ALA 182 Cb 0.22 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1xu9 h ALA 182 CO 0.05 0.36 0.06 -0.92 0.00 0.00 0.00 179.25 178.80 1xu9 h TYR 183 N 0.93 0.41 -0.87 0.00 3.20 -1.89 -2.56 116.97 116.19 1xu9 h TYR 183 Ca 0.24 -0.05 0.02 0.00 3.14 0.00 0.00 58.73 62.08 1xu9 h TYR 183 Cb 0.01 -0.11 -0.05 0.00 1.54 0.00 0.00 36.73 38.12 1xu9 h TYR 183 CO -0.01 0.48 0.57 1.03 -1.64 0.00 0.00 178.16 178.59 1xu9 h SER 184 N 0.22 0.98 -0.57 -2.11 0.87 -0.48 -1.36 113.55 111.10 1xu9 h SER 184 Ca 0.08 -0.02 0.07 0.00 -1.23 0.00 0.00 61.79 60.69 1xu9 h SER 184 Cb 0.28 -0.24 -0.06 0.00 -0.44 0.00 0.00 62.40 61.94 1xu9 h SER 184 CO 0.00 0.70 0.25 0.00 -0.53 0.00 0.00 176.83 177.25 1xu9 h ALA 185 N 1.33 0.73 -0.43 6.23 0.00 -1.07 0.26 119.26 126.31 1xu9 h ALA 185 Ca 0.33 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 55.19 1xu9 h ALA 185 Cb -0.10 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1xu9 h ALA 185 CO -0.08 -0.14 -0.14 0.66 0.00 0.00 0.00 179.25 179.55 1xu9 h SER 186 N 0.46 0.81 0.08 0.00 4.64 -0.93 -1.07 113.55 117.54 1xu9 h SER 186 Ca 0.27 -0.26 -0.27 0.00 -0.47 0.00 0.00 61.79 61.06 1xu9 h SER 186 Cb 0.26 -0.22 0.02 0.00 -0.31 0.00 0.00 62.40 62.15 1xu9 h SER 186 CO -0.24 0.96 -1.07 0.11 -0.87 0.00 0.00 176.83 175.73 1xu9 h LYS 187 N 0.72 0.64 -0.75 4.77 1.79 -0.87 -2.22 116.57 120.65 1xu9 h LYS 187 Ca 0.11 -0.72 0.07 0.00 -2.18 0.00 0.00 60.65 57.93 1xu9 h LYS 187 Cb 0.65 0.21 -0.06 0.00 -1.58 0.00 0.00 32.23 31.44 1xu9 h LYS 187 CO 0.05 1.30 0.43 0.74 -1.08 0.00 0.00 179.45 180.89 1xu9 h PHE 188 N 0.35 0.78 -0.83 -1.35 0.04 -0.92 -2.63 116.94 112.39 1xu9 h PHE 188 Ca -0.13 0.03 0.02 0.00 2.80 0.00 0.00 57.97 60.68 1xu9 h PHE 188 Cb 1.72 -0.24 -0.04 0.00 2.20 0.00 0.00 35.95 39.59 1xu9 h PHE 188 CO 0.10 0.36 0.54 0.00 -0.60 0.00 0.00 178.31 178.71 1xu9 h ALA 189 N 1.40 1.06 -0.87 2.45 0.00 -0.98 -1.65 119.26 120.68 1xu9 h ALA 189 Ca 0.35 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.25 1xu9 h ALA 189 Cb 0.25 -0.32 -0.06 0.00 0.00 0.00 0.00 17.79 17.67 1xu9 h ALA 189 CO -0.21 0.42 0.55 -0.07 0.00 0.00 0.00 179.25 179.94 1xu9 h LEU 190 N 1.09 0.89 0.06 0.00 3.38 -1.08 -0.07 115.31 119.58 1xu9 h LEU 190 Ca 0.31 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.29 1xu9 h LEU 190 Cb -0.08 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.49 1xu9 h LEU 190 CO -0.08 0.59 -0.03 -0.78 0.09 0.00 0.00 178.44 178.23 1xu9 h ASP 191 N 1.03 -0.07 -0.33 -0.43 3.58 -1.02 -0.51 116.42 118.68 1xu9 h ASP 191 Ca 0.36 -0.17 0.03 0.00 0.42 0.00 0.00 57.03 57.68 1xu9 h ASP 191 Cb 0.09 0.02 -0.03 0.00 1.72 0.00 0.00 39.33 41.12 1xu9 h ASP 191 CO -0.14 0.13 0.12 1.23 -2.88 0.00 0.00 179.24 177.69 1xu9 h GLY 192 N -0.27 0.41 0.59 -0.78 0.00 -1.02 -0.49 103.07 101.52 1xu9 h GLY 192 Ca -0.01 -0.07 -0.02 0.00 0.00 0.00 0.00 47.33 47.23 1xu9 h GLY 192 CO 0.01 0.04 -0.22 -2.75 0.00 0.00 0.00 176.54 173.63 1xu9 h PHE 193 N 0.26 -0.56 -0.05 5.60 3.04 -0.96 -2.60 116.94 121.68 1xu9 h PHE 193 Ca 0.15 -0.01 -0.11 0.00 3.98 0.00 0.00 57.97 61.98 1xu9 h PHE 193 Cb 0.11 0.18 -0.01 0.00 2.56 0.00 0.00 35.95 38.79 1xu9 h PHE 193 CO -0.13 -0.25 -0.46 0.74 -2.02 0.00 0.00 178.31 176.19 1xu9 h PHE 194 N -1.02 0.14 -0.22 0.41 -1.00 -1.10 -0.78 116.94 113.36 1xu9 h PHE 194 Ca -0.06 -0.04 -0.10 0.00 2.81 0.00 0.00 57.97 60.58 1xu9 h PHE 194 Cb 0.56 -0.03 -0.01 0.00 3.61 0.00 0.00 35.95 40.08 1xu9 h PHE 194 CO 0.02 0.56 -0.29 0.77 -1.61 0.00 0.00 178.31 177.76 1xu9 h SER 195 N 0.10 0.45 -0.12 2.17 0.02 -1.18 -0.97 113.55 114.02 1xu9 h SER 195 Ca 0.00 -0.16 -0.03 0.00 -0.84 0.00 0.00 61.79 60.76 1xu9 h SER 195 Cb 0.85 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 63.27 1xu9 h SER 195 CO 0.07 0.72 -0.06 0.28 -1.14 0.00 0.00 176.83 176.70 1xu9 h SER 196 N 0.39 0.26 -0.16 3.07 0.02 -1.02 -2.91 113.55 113.19 1xu9 h SER 196 Ca 0.05 -0.42 -0.04 0.00 -0.84 0.00 0.00 61.79 60.54 1xu9 h SER 196 Cb 0.70 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 63.15 1xu9 h SER 196 CO 0.05 0.62 -0.02 0.40 -1.14 0.00 0.00 176.83 176.75 1xu9 h ILE 197 N -0.11 1.18 -0.69 3.27 1.08 -1.09 -1.52 117.51 119.63 1xu9 h ILE 197 Ca 0.03 -0.72 0.04 0.00 -0.39 0.00 0.00 64.86 63.82 1xu9 h ILE 197 Cb 0.52 0.99 -0.05 0.00 -3.07 0.00 0.00 36.82 35.22 1xu9 h ILE 197 CO 0.02 0.24 0.42 -0.09 -0.69 0.00 0.00 178.15 178.05 1xu9 h ARG 198 N 0.42 0.78 -0.61 2.37 2.43 -1.13 0.14 114.38 118.77 1xu9 h ARG 198 Ca 0.09 -0.05 -0.06 0.00 -0.81 0.00 0.00 59.98 59.15 1xu9 h ARG 198 Cb 0.30 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 29.65 1xu9 h ARG 198 CO 0.01 0.51 0.13 0.87 -1.51 0.00 0.00 179.97 179.99 1xu9 h LYS 199 N 0.80 0.96 -0.58 0.20 1.57 -1.20 -2.12 116.57 116.20 1xu9 h LYS 199 Ca 0.29 -0.22 -0.09 0.00 -1.87 0.00 0.00 60.65 58.76 1xu9 h LYS 199 Cb 0.07 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 1xu9 h LYS 199 CO -0.13 0.86 0.03 0.93 -0.57 0.00 0.00 179.45 180.57 1xu9 h GLU 200 N 0.91 1.00 -0.14 3.15 5.08 -0.33 -2.38 114.58 121.87 1xu9 h GLU 200 Ca 0.19 -0.29 -0.07 0.00 -1.00 0.00 0.00 59.36 58.19 1xu9 h GLU 200 Cb 0.35 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 1xu9 h GLU 200 CO 0.00 0.96 -0.24 1.88 -1.00 0.00 0.00 179.01 180.62 1xu9 h TYR 201 N 0.92 0.27 -0.27 4.33 0.05 -0.48 -0.32 116.97 121.46 1xu9 h TYR 201 Ca 0.17 -0.05 -0.03 0.00 0.05 0.00 0.00 58.73 58.88 1xu9 h TYR 201 Cb 0.50 -0.07 -0.01 0.00 1.01 0.00 0.00 36.73 38.16 1xu9 h TYR 201 CO 0.03 0.47 0.05 1.03 -1.05 0.00 0.00 178.16 178.70 1xu9 h SER 202 N 0.22 0.43 0.84 3.88 0.87 -0.92 0.24 113.55 119.11 1xu9 h SER 202 Ca 0.04 -0.25 -0.16 0.00 -1.23 0.00 0.00 61.79 60.19 1xu9 h SER 202 Cb 0.55 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 62.37 1xu9 h SER 202 CO 0.04 0.57 -0.75 -0.37 -0.53 0.00 0.00 176.83 175.78 1xu9 h VAL 203 N 0.27 1.49 -0.01 2.23 -1.51 -1.22 -3.09 116.25 114.40 1xu9 h VAL 203 Ca 0.08 -2.62 0.00 0.00 -1.23 0.00 0.00 66.70 62.94 1xu9 h VAL 203 Cb 0.32 2.43 0.00 0.00 -2.13 0.00 0.00 31.29 31.91 1xu9 h VAL 203 CO 0.00 0.74 -0.05 -1.54 -1.23 0.00 0.00 177.57 175.49 1xu9 n SER 204 N -3.57 1.27 -3.66 4.19 3.41 -0.15 -4.96 113.62 110.16 1xu9 n SER 204 Ca -0.00 -1.32 -0.23 0.00 -0.26 0.00 0.00 58.87 57.06 1xu9 n SER 204 Cb 0.75 0.02 0.06 0.00 -0.26 0.00 0.00 64.21 64.77 1xu9 n SER 204 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1xu9 n ARG 205 N -0.10 -6.28 -3.24 4.33 1.74 -0.12 -4.98 116.66 108.00 1xu9 n ARG 205 Ca 0.18 0.73 -0.40 0.00 -0.77 0.00 0.00 57.85 57.58 1xu9 n ARG 205 Cb 0.33 -5.61 -0.08 0.00 -1.02 0.00 0.00 32.46 26.09 1xu9 n ARG 205 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1xu9 s VAL 206 N -3.42 5.06 -0.98 1.55 1.01 -0.12 -4.98 120.40 118.53 1xu9 s VAL 206 Ca 0.31 0.80 -0.05 0.00 0.00 0.00 0.00 61.98 63.04 1xu9 s VAL 206 Cb -0.14 -3.84 0.11 0.00 0.00 0.00 0.00 36.38 32.50 1xu9 s VAL 206 CO 0.77 0.04 2.51 -3.20 0.00 0.00 0.00 175.10 175.23 1xu9 n ASN 207 N 5.57 7.43 -4.07 3.32 5.15 -1.26 -4.67 115.26 126.73 1xu9 n ASN 207 Ca -0.04 -3.19 -0.31 0.00 -0.60 0.00 0.00 54.58 50.44 1xu9 n ASN 207 Cb 0.50 -1.30 -0.16 0.00 -0.53 0.00 0.00 39.78 38.28 1xu9 n ASN 207 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1xu9 s VAL 208 N -1.70 1.72 0.39 3.44 1.01 -1.26 -3.88 120.40 120.12 1xu9 s VAL 208 Ca 0.55 -0.75 -0.15 0.00 0.00 0.00 0.00 61.98 61.64 1xu9 s VAL 208 Cb 0.26 -1.57 -0.08 0.00 0.00 0.00 0.00 36.38 34.98 1xu9 s VAL 208 CO -0.15 0.48 0.82 -0.94 0.00 0.00 0.00 175.10 175.32 1xu9 s SER 209 N 1.20 6.71 -0.11 3.32 1.04 -0.74 -4.93 113.70 120.19 1xu9 s SER 209 Ca -0.00 1.35 0.01 0.00 0.48 0.00 0.00 55.95 57.79 1xu9 s SER 209 Cb -0.14 -2.41 0.02 0.00 0.10 0.00 0.00 66.02 63.59 1xu9 s SER 209 CO -0.07 -0.34 -0.11 -0.63 0.98 0.00 0.00 173.24 173.06 1xu9 s ILE 210 N -2.22 1.24 -0.19 -1.02 1.01 -1.26 -0.44 121.20 118.32 1xu9 s ILE 210 Ca 0.55 -0.47 0.01 0.00 0.00 0.00 0.00 60.65 60.74 1xu9 s ILE 210 Cb -0.10 -1.18 0.02 0.00 0.01 0.00 0.00 42.46 41.21 1xu9 s ILE 210 CO 0.22 0.39 -0.17 -0.89 0.00 0.00 0.00 174.94 174.50 1xu9 s THR 211 N 1.25 2.22 -0.22 2.92 2.01 -0.21 -4.39 115.64 119.23 1xu9 s THR 211 Ca -0.03 -0.95 -0.11 0.00 0.31 0.00 0.00 61.69 60.91 1xu9 s THR 211 Cb -0.14 -1.98 -0.05 0.00 0.01 0.00 0.00 72.50 70.34 1xu9 s THR 211 CO -0.04 0.47 0.18 -0.22 -0.69 0.00 0.00 174.62 174.32 1xu9 s LEU 212 N 1.29 4.16 -0.15 4.42 2.96 0.22 -0.55 118.68 131.04 1xu9 s LEU 212 Ca 0.04 0.22 -0.05 0.00 -0.22 0.00 0.00 54.13 54.11 1xu9 s LEU 212 Cb -0.14 -2.16 -0.04 0.00 0.50 0.00 0.00 46.19 44.36 1xu9 s LEU 212 CO -0.11 0.09 0.04 0.00 -1.32 0.00 0.00 176.35 175.05 1xu9 s VAL 214 N -0.04 2.24 -0.10 0.00 1.01 0.19 -0.04 120.40 123.67 1xu9 s VAL 214 Ca 0.05 -1.58 -0.01 0.00 0.00 0.00 0.00 61.98 60.44 1xu9 s VAL 214 Cb -0.12 -2.30 -0.03 0.00 0.00 0.00 0.00 36.38 33.93 1xu9 s VAL 214 CO 0.01 -0.01 -0.05 -0.76 0.00 0.00 0.00 175.10 174.30 1xu9 s LEU 215 N 1.12 3.26 0.00 3.92 1.43 -1.07 -1.71 118.68 125.63 1xu9 s LEU 215 Ca -0.08 -0.03 0.00 0.00 -1.03 0.00 0.00 54.13 52.99 1xu9 s LEU 215 Cb -0.20 -1.74 0.00 0.00 0.03 0.00 0.00 46.19 44.29 1xu9 s LEU 215 CO -0.05 0.31 0.00 0.61 0.23 0.00 0.00 176.35 177.45 1xu9 n GLY 216 N 2.60 0.48 3.68 -3.19 0.00 -0.24 -1.66 105.19 106.86 1xu9 n GLY 216 Ca -0.18 -1.66 -0.42 0.00 0.00 0.00 0.00 46.02 43.75 1xu9 n GLY 216 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1xu9 s LEU 217 N 0.00 4.29 -0.03 0.99 2.96 -1.26 -4.92 118.68 120.71 1xu9 s LEU 217 Ca 0.00 2.03 0.07 0.00 -0.22 0.00 0.00 54.13 56.02 1xu9 s LEU 217 Cb 0.00 -3.55 -0.02 0.00 0.50 0.00 0.00 46.19 43.12 1xu9 s LEU 217 CO 0.00 -0.77 -0.25 -0.63 -1.32 0.00 0.00 176.35 173.39 1xu9 s ILE 218 N 2.97 1.97 0.00 6.68 -1.09 -1.26 -1.20 121.20 129.26 1xu9 s ILE 218 Ca 0.63 -1.06 0.00 0.00 -2.23 0.00 0.00 60.65 58.00 1xu9 s ILE 218 Cb -0.29 -1.64 0.00 0.00 -1.58 0.00 0.00 42.46 38.95 1xu9 s ILE 218 CO 0.24 0.56 1.23 -0.90 -1.23 0.00 0.00 174.94 174.84 1xu9 n ASP 219 N 2.56 3.37 -4.75 3.58 3.85 -0.11 -4.63 116.55 120.41 1xu9 n ASP 219 Ca -0.16 -1.86 -0.33 0.00 -0.71 0.00 0.00 54.79 51.73 1xu9 n ASP 219 Cb 0.51 -0.67 0.07 0.00 -1.35 0.00 0.00 41.12 39.68 1xu9 n ASP 219 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.20 176.61 1xu9 s THR 220 N 0.40 2.92 0.25 2.12 -4.23 -1.26 -4.82 115.64 111.01 1xu9 s THR 220 Ca 0.00 0.43 -0.04 0.00 -1.18 0.00 0.00 61.69 60.90 1xu9 s THR 220 Cb 0.00 -2.95 0.22 0.00 1.34 0.00 0.00 72.50 71.12 1xu9 s THR 220 CO 0.00 -0.26 1.83 -0.33 -0.54 0.00 0.00 174.62 175.31 1xu9 h GLU 221 N -0.14 0.86 -0.25 3.99 4.39 -1.98 -0.73 114.58 120.71 1xu9 h GLU 221 Ca -0.47 -0.05 0.04 0.00 0.34 0.00 0.00 59.36 59.22 1xu9 h GLU 221 Cb 1.26 -0.19 -0.03 0.00 -0.10 0.00 0.00 28.75 29.68 1xu9 h GLU 221 CO 0.52 0.57 0.03 1.15 -1.16 0.00 0.00 179.01 180.12 1xu9 h THR 222 N 0.89 0.86 -0.41 1.13 2.02 -1.95 -1.21 112.91 114.24 1xu9 h THR 222 Ca 0.40 -0.04 -0.10 0.00 0.77 0.00 0.00 66.41 67.45 1xu9 h THR 222 Cb 0.31 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 67.44 1xu9 h THR 222 CO -0.22 0.02 -0.11 0.00 0.37 0.00 0.00 175.52 175.58 1xu9 h ALA 223 N 1.19 0.57 -0.47 6.16 0.00 -1.70 -1.48 119.26 123.53 1xu9 h ALA 223 Ca 0.11 -0.33 -0.11 0.00 0.00 0.00 0.00 54.91 54.58 1xu9 h ALA 223 Cb 0.13 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1xu9 h ALA 223 CO -0.17 0.46 -0.16 0.52 0.00 0.00 0.00 179.25 179.90 1xu9 h MET 224 N 0.63 0.91 -0.51 0.00 2.07 -0.93 -1.50 114.93 115.59 1xu9 h MET 224 Ca 0.10 -0.35 -0.09 0.00 -2.07 0.00 0.00 59.70 57.30 1xu9 h MET 224 Cb 0.65 -0.05 -0.02 0.00 -1.87 0.00 0.00 31.60 30.31 1xu9 h MET 224 CO 0.04 1.00 -0.02 0.87 1.07 0.00 0.00 176.91 179.87 1xu9 h LYS 225 N 0.80 0.91 -0.27 1.72 1.57 -1.20 -3.09 116.57 117.00 1xu9 h LYS 225 Ca 0.12 -0.30 -0.09 0.00 -1.87 0.00 0.00 60.65 58.51 1xu9 h LYS 225 Cb 0.70 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.92 1xu9 h LYS 225 CO 0.05 0.94 -0.21 0.00 -0.57 0.00 0.00 179.45 179.67 1xu9 h ALA 226 N 0.93 1.14 -0.02 3.86 0.00 -0.63 -3.11 119.26 121.43 1xu9 h ALA 226 Ca 0.14 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1xu9 h ALA 226 Cb 0.54 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1xu9 h ALA 226 CO 0.03 0.54 -0.34 1.33 0.00 0.00 0.00 179.25 180.81 1xu9 n VAL 227 N -4.15 0.00 -1.69 0.00 0.24 -0.62 -4.67 118.33 107.43 1xu9 n VAL 227 Ca -0.00 -0.26 -0.52 0.00 -2.04 0.00 0.00 64.34 61.52 1xu9 n VAL 227 Cb 0.38 1.06 -0.06 0.00 -1.47 0.00 0.00 33.84 33.75 1xu9 n VAL 227 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1xu9 n SER 228 N 0.03 3.01 0.00 -1.34 2.88 -1.17 -0.67 113.62 116.36 1xu9 n SER 228 Ca 0.11 1.01 0.00 0.00 -1.33 0.00 0.00 58.87 58.66 1xu9 n SER 228 Cb 0.45 -1.28 0.00 0.00 -0.75 0.00 0.00 64.21 62.64 1xu9 n SER 228 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1xu9 n GLY 229 N 4.36 2.58 0.13 0.46 0.00 -1.26 -4.81 105.19 106.65 1xu9 n GLY 229 Ca 0.24 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.07 1xu9 n GLY 229 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1xu9 n ILE 230 N -2.00 1.52 -4.84 -0.61 2.08 0.16 -5.00 119.36 110.67 1xu9 n ILE 230 Ca 0.00 -0.57 -0.27 0.00 0.56 0.00 0.00 62.75 62.48 1xu9 n ILE 230 Cb 0.00 -1.48 -0.15 0.00 -0.75 0.00 0.00 39.64 37.26 1xu9 n ILE 230 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 1xu9 s VAL 231 N -2.52 1.70 -0.48 1.39 1.01 -0.78 -5.08 120.40 115.64 1xu9 s VAL 231 Ca -0.34 -1.07 0.03 0.00 0.00 0.00 0.00 61.98 60.60 1xu9 s VAL 231 Cb 0.09 -1.44 0.16 0.00 0.00 0.00 0.00 36.38 35.19 1xu9 s VAL 231 CO 0.61 0.34 0.34 -1.00 0.00 0.00 0.00 175.10 175.39 1xu9 s HIS 232 N -0.66 1.80 0.26 5.22 3.76 -1.26 -4.81 115.29 119.60 1xu9 s HIS 232 Ca 0.08 -2.50 0.01 0.00 -0.15 0.00 0.00 55.06 52.50 1xu9 s HIS 232 Cb -0.09 -1.53 -0.03 0.00 1.11 0.00 0.00 32.58 32.05 1xu9 s HIS 232 CO 0.01 -0.75 0.24 0.00 -0.85 0.00 0.00 174.74 173.39 1xu9 s MET 233 N -0.11 1.49 0.37 1.40 0.23 -1.26 -5.14 119.30 116.27 1xu9 s MET 233 Ca 0.26 -1.74 -0.26 0.00 -1.03 0.00 0.00 55.69 52.92 1xu9 s MET 233 Cb -0.07 0.32 -0.09 0.00 -1.53 0.00 0.00 34.83 33.47 1xu9 s MET 233 CO -0.13 -0.54 1.14 -0.65 -2.03 0.00 0.00 175.02 172.82 1xu9 s GLN 234 N -3.79 4.22 -0.13 3.16 -1.52 -1.26 -5.03 119.66 115.31 1xu9 s GLN 234 Ca 0.37 1.80 -0.01 0.00 -1.95 0.00 0.00 55.36 55.57 1xu9 s GLN 234 Cb 0.04 -2.79 -0.02 0.00 -0.22 0.00 0.00 33.01 30.01 1xu9 s GLN 234 CO 0.18 -0.16 -0.08 0.00 -0.25 0.00 0.00 175.29 174.98 1xu9 s ALA 235 N -1.38 2.87 0.47 6.09 0.00 -1.26 -4.79 121.76 123.76 1xu9 s ALA 235 Ca 0.54 -0.86 -0.20 0.00 0.00 0.00 0.00 51.96 51.44 1xu9 s ALA 235 Cb -0.30 -1.37 -0.09 0.00 0.00 0.00 0.00 23.12 21.36 1xu9 s ALA 235 CO 0.38 0.31 0.99 0.00 0.00 0.00 0.00 175.76 177.44 1xu9 s ALA 236 N 0.08 2.97 0.07 0.00 0.00 -0.34 -4.68 121.76 119.86 1xu9 s ALA 236 Ca -0.02 0.44 -0.31 0.00 0.00 0.00 0.00 51.96 52.07 1xu9 s ALA 236 Cb -0.14 -3.19 -0.07 0.00 0.00 0.00 0.00 23.12 19.73 1xu9 s ALA 236 CO 0.03 -0.13 1.37 -1.25 0.00 0.00 0.00 175.76 175.79 1xu9 s PRO 237 N -3.37 4.32 0.44 0.00 0.04 -1.26 -0.94 135.00 134.24 1xu9 s PRO 237 Ca 0.64 2.00 0.10 0.00 0.04 0.00 0.00 61.00 63.77 1xu9 s PRO 237 Cb -0.12 -3.37 0.97 0.00 0.04 0.00 0.00 34.50 32.02 1xu9 s PRO 237 CO 0.19 -0.46 2.08 1.57 0.04 0.00 0.00 177.00 180.42 1xu9 h LYS 238 N 7.17 0.40 -0.39 4.56 2.10 -1.93 -1.39 116.57 127.08 1xu9 h LYS 238 Ca -0.41 -0.02 -0.02 0.00 -2.00 0.00 0.00 60.65 58.20 1xu9 h LYS 238 Cb 1.20 -0.09 -0.02 0.00 -0.90 0.00 0.00 32.23 32.42 1xu9 h LYS 238 CO 0.87 0.26 0.18 0.93 -2.00 0.00 0.00 179.45 179.69 1xu9 h GLU 239 N 0.41 0.57 -0.35 0.07 3.07 -1.94 -1.35 114.58 115.07 1xu9 h GLU 239 Ca 0.12 -0.09 -0.17 0.00 -0.50 0.00 0.00 59.36 58.71 1xu9 h GLU 239 Cb -0.03 -0.10 -0.00 0.00 -0.84 0.00 0.00 28.75 27.78 1xu9 h GLU 239 CO -0.03 0.52 -0.45 1.49 -1.40 0.00 0.00 179.01 179.15 1xu9 h GLU 240 N 0.49 0.91 -0.15 2.33 4.81 -1.83 -2.55 114.58 118.60 1xu9 h GLU 240 Ca 0.13 -0.52 0.04 0.00 -0.13 0.00 0.00 59.36 58.88 1xu9 h GLU 240 Cb 0.15 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.52 1xu9 h GLU 240 CO -0.01 1.17 -0.11 0.00 -0.73 0.00 0.00 179.01 179.33 1xu9 h ALA 242 N 1.00 1.25 -0.46 0.00 0.00 -1.18 -1.90 119.26 117.98 1xu9 h ALA 242 Ca 0.09 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 1xu9 h ALA 242 Cb 0.25 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1xu9 h ALA 242 CO -0.22 0.43 -0.18 1.25 0.00 0.00 0.00 179.25 180.53 1xu9 h LEU 243 N 1.13 0.96 -1.28 0.00 5.85 -1.00 -2.20 115.31 118.78 1xu9 h LEU 243 Ca 0.38 -0.39 -0.06 0.00 0.84 0.00 0.00 57.88 58.65 1xu9 h LEU 243 Cb 0.06 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.82 1xu9 h LEU 243 CO -0.14 1.13 -0.18 -0.33 -0.34 0.00 0.00 178.44 178.58 1xu9 h GLU 244 N 0.78 0.27 -0.08 1.25 4.39 -0.84 -0.37 114.58 119.98 1xu9 h GLU 244 Ca 0.11 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.72 1xu9 h GLU 244 Cb 0.75 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.37 1xu9 h GLU 244 CO 0.06 0.45 0.01 0.82 -1.16 0.00 0.00 179.01 179.19 1xu9 h ILE 245 N 0.25 1.22 -0.42 3.13 2.04 -1.15 -1.45 117.51 121.14 1xu9 h ILE 245 Ca 0.05 -0.69 0.01 0.00 1.00 0.00 0.00 64.86 65.23 1xu9 h ILE 245 Cb 0.47 1.53 -0.03 0.00 -0.74 0.00 0.00 36.82 38.05 1xu9 h ILE 245 CO 0.03 0.19 0.25 0.40 0.00 0.00 0.00 178.15 179.03 1xu9 h ILE 246 N -0.12 1.06 -0.32 -0.67 2.04 -1.05 -1.73 117.51 116.72 1xu9 h ILE 246 Ca 0.02 -0.18 0.03 0.00 1.00 0.00 0.00 64.86 65.74 1xu9 h ILE 246 Cb 0.29 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 36.85 1xu9 h ILE 246 CO 0.00 0.09 0.13 0.11 0.00 0.00 0.00 178.15 178.48 1xu9 h LYS 247 N 0.51 0.27 -0.73 2.37 1.57 -1.03 0.63 116.57 120.16 1xu9 h LYS 247 Ca 0.16 -0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.95 1xu9 h LYS 247 Cb -0.01 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.20 1xu9 h LYS 247 CO -0.06 0.18 0.47 0.78 -0.57 0.00 0.00 179.45 180.24 1xu9 h GLY 248 N 0.28 1.05 0.94 3.86 0.00 -1.03 -0.72 103.07 107.45 1xu9 h GLY 248 Ca 0.14 -0.36 -0.06 0.00 0.00 0.00 0.00 47.33 47.05 1xu9 h GLY 248 CO -0.12 0.33 0.02 -1.33 0.00 0.00 0.00 176.54 175.43 1xu9 h GLY 249 N 0.94 0.74 1.33 4.60 0.00 -0.89 -1.55 103.07 108.23 1xu9 h GLY 249 Ca 0.28 -0.53 -0.03 0.00 0.00 0.00 0.00 47.33 47.06 1xu9 h GLY 249 CO -0.09 0.49 0.28 0.00 0.00 0.00 0.00 176.54 177.21 1xu9 h ALA 250 N 0.89 1.34 -0.10 3.60 0.00 -0.63 -1.93 119.26 122.44 1xu9 h ALA 250 Ca 0.11 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1xu9 h ALA 250 Cb 0.44 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1xu9 h ALA 250 CO 0.02 0.51 0.00 1.28 0.00 0.00 0.00 179.25 181.05 1xu9 n LEU 251 N -4.34 1.36 -2.86 0.00 4.77 -0.30 -4.89 117.00 110.73 1xu9 n LEU 251 Ca 0.05 -0.54 -0.22 0.00 -0.03 0.00 0.00 56.01 55.28 1xu9 n LEU 251 Cb 0.14 -0.06 0.03 0.00 -2.33 0.00 0.00 43.42 41.20 1xu9 n LEU 251 CO 0.38 0.27 -0.05 0.54 -1.33 0.00 0.00 177.39 177.20 1xu9 n ARG 252 N 0.10 -4.26 -2.43 3.23 1.74 -0.72 -1.04 116.66 113.28 1xu9 n ARG 252 Ca 0.17 0.93 -0.36 0.00 -0.77 0.00 0.00 57.85 57.82 1xu9 n ARG 252 Cb 0.30 -5.73 -0.03 0.00 -1.02 0.00 0.00 32.46 25.98 1xu9 n ARG 252 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1xu9 s GLN 253 N -5.56 3.89 0.11 5.56 -0.21 -0.65 -3.85 119.66 118.94 1xu9 s GLN 253 Ca 0.24 1.57 -0.14 0.00 0.02 0.00 0.00 55.36 57.05 1xu9 s GLN 253 Cb -0.11 -2.35 -0.08 0.00 1.00 0.00 0.00 33.01 31.47 1xu9 s GLN 253 CO 0.30 -0.39 1.42 0.93 -2.12 0.00 0.00 175.29 175.43 1xu9 h GLU 254 N 2.04 0.74 -4.01 2.91 5.08 -1.89 -3.35 114.58 116.09 1xu9 h GLU 254 Ca -0.49 -0.39 -0.25 0.00 -1.00 0.00 0.00 59.36 57.22 1xu9 h GLU 254 Cb 1.23 0.02 -0.27 0.00 0.50 0.00 0.00 28.75 30.23 1xu9 h GLU 254 CO 0.60 1.02 -0.73 -1.21 -1.00 0.00 0.00 179.01 177.69 1xu9 s GLU 255 N -4.35 0.21 -0.11 2.33 2.02 -1.26 -0.61 118.70 116.94 1xu9 s GLU 255 Ca -0.12 -0.20 0.03 0.00 0.02 0.00 0.00 54.97 54.70 1xu9 s GLU 255 Cb 0.09 -0.14 0.00 0.00 0.10 0.00 0.00 34.13 34.19 1xu9 s GLU 255 CO 0.84 0.03 -0.22 0.08 0.02 0.00 0.00 175.26 176.01 1xu9 s VAL 256 N -0.35 2.18 -0.12 2.63 1.01 -0.34 -4.93 120.40 120.48 1xu9 s VAL 256 Ca -0.02 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 61.00 1xu9 s VAL 256 Cb -0.03 -1.85 -0.01 0.00 0.00 0.00 0.00 36.38 34.49 1xu9 s VAL 256 CO -0.00 0.55 -0.16 -0.31 0.00 0.00 0.00 175.10 175.18 1xu9 s TYR 257 N 0.48 2.74 -0.03 5.22 1.51 -1.26 0.53 117.35 126.54 1xu9 s TYR 257 Ca -0.15 -0.80 -0.01 0.00 -1.01 0.00 0.00 57.07 55.11 1xu9 s TYR 257 Cb -0.17 -1.81 0.03 0.00 -0.11 0.00 0.00 41.96 39.90 1xu9 s TYR 257 CO 0.06 -0.29 0.05 -0.47 -1.11 0.00 0.00 175.55 173.79 1xu9 s TYR 258 N 0.39 -0.02 0.13 2.71 6.14 -0.69 -4.95 117.35 121.05 1xu9 s TYR 258 Ca -0.13 0.19 -0.25 0.00 0.64 0.00 0.00 57.07 57.52 1xu9 s TYR 258 Cb -0.16 -0.15 0.07 0.00 0.42 0.00 0.00 41.96 42.13 1xu9 s TYR 258 CO 0.06 -0.09 0.82 0.34 0.64 0.00 0.00 175.55 177.33 1xu9 s ASP 259 N 0.84 -0.32 0.47 4.32 -1.08 -1.26 -1.08 116.67 118.56 1xu9 s ASP 259 Ca -0.07 -0.25 0.12 0.00 -0.52 0.00 0.00 52.55 51.83 1xu9 s ASP 259 Cb -0.10 0.53 1.07 0.00 -1.46 0.00 0.00 42.92 42.96 1xu9 s ASP 259 CO -0.03 -0.92 2.09 0.28 0.52 0.00 0.00 175.17 177.11 1xu9 h SER 260 N 2.00 0.18 -3.86 -0.34 0.02 -1.88 -3.44 113.55 106.23 1xu9 h SER 260 Ca -0.24 -0.01 -0.67 0.00 -0.84 0.00 0.00 61.79 60.03 1xu9 h SER 260 Cb 1.25 -0.05 -0.32 0.00 0.14 0.00 0.00 62.40 63.43 1xu9 h SER 260 CO 0.29 0.16 -0.88 -0.55 -1.14 0.00 0.00 176.83 174.72 1xu9 s SER 261 N -6.92 2.94 0.56 3.07 0.15 -1.26 -5.00 113.70 107.24 1xu9 s SER 261 Ca -0.06 -0.50 0.32 0.00 0.70 0.00 0.00 55.95 56.41 1xu9 s SER 261 Cb 0.17 -0.93 1.63 0.00 -1.71 0.00 0.00 66.02 65.19 1xu9 s SER 261 CO 0.70 0.21 2.12 -0.07 1.20 0.00 0.00 173.24 177.40 1xu9 h LEU 262 N 6.23 0.00 -1.01 3.45 3.38 -1.99 -2.04 115.31 123.33 1xu9 h LEU 262 Ca -0.29 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.72 1xu9 h LEU 262 Cb 1.19 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.88 1xu9 h LEU 262 CO 0.47 0.07 0.66 -0.50 0.09 0.00 0.00 178.44 179.23 1xu9 h TRP 263 N 0.00 1.24 0.10 1.13 4.06 -1.99 -1.02 115.95 119.48 1xu9 h TRP 263 Ca -0.00 0.03 -0.01 0.00 2.06 0.00 0.00 58.89 60.97 1xu9 h TRP 263 Cb 0.28 -0.41 0.00 0.00 -1.00 0.00 0.00 29.16 28.03 1xu9 h TRP 263 CO 0.00 0.70 -0.05 1.15 -3.56 0.00 0.00 178.44 176.68 1xu9 h THR 264 N 1.27 1.06 -0.27 1.49 2.02 -1.80 -2.84 112.91 113.83 1xu9 h THR 264 Ca 0.41 -1.30 -0.09 0.00 0.77 0.00 0.00 66.41 66.20 1xu9 h THR 264 Cb 0.02 1.80 -0.01 0.00 -1.74 0.00 0.00 68.15 68.21 1xu9 h THR 264 CO -0.13 0.28 -0.21 0.71 0.37 0.00 0.00 175.52 176.54 1xu9 h THR 265 N -0.81 1.25 0.16 3.16 1.35 -1.42 -1.52 112.91 115.09 1xu9 h THR 265 Ca -0.01 -1.18 -0.29 0.00 -0.55 0.00 0.00 66.41 64.37 1xu9 h THR 265 Cb 0.57 1.28 0.02 0.00 -1.73 0.00 0.00 68.15 68.28 1xu9 h THR 265 CO 0.02 0.38 -1.31 -0.07 -0.25 0.00 0.00 175.52 174.29 1xu9 h LEU 266 N 0.44 0.59 0.00 3.87 3.38 -1.32 -3.33 115.31 118.94 1xu9 h LEU 266 Ca 0.07 -0.62 -0.16 0.00 0.09 0.00 0.00 57.88 57.27 1xu9 h LEU 266 Cb 0.61 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1xu9 h LEU 266 CO 0.04 1.48 -0.92 -0.07 0.09 0.00 0.00 178.44 179.06 1xu9 h LEU 267 N 0.11 0.00 -0.76 1.67 3.38 -1.39 -3.29 115.31 115.04 1xu9 h LEU 267 Ca -0.17 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.74 1xu9 h LEU 267 Cb 2.02 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.76 1xu9 h LEU 267 CO 0.23 0.67 -0.25 -0.29 0.09 0.00 0.00 178.44 178.89 1xu9 h ILE 268 N 0.00 0.53 -4.04 1.22 6.09 -1.43 -3.44 117.51 116.44 1xu9 h ILE 268 Ca -0.06 -1.32 -0.52 0.00 -1.37 0.00 0.00 64.86 61.59 1xu9 h ILE 268 Cb 1.57 1.93 0.08 0.00 0.47 0.00 0.00 36.82 40.87 1xu9 h ILE 268 CO 0.08 0.24 0.49 0.00 -3.07 0.00 0.00 178.15 175.89 1xu9 s ARG 269 N -3.45 3.46 -0.56 2.19 1.70 -1.24 -4.98 118.95 116.08 1xu9 s ARG 269 Ca 0.02 1.83 0.06 0.00 -0.47 0.00 0.00 55.73 57.17 1xu9 s ARG 269 Cb 0.09 -2.24 0.22 0.00 -0.57 0.00 0.00 34.95 32.45 1xu9 s ARG 269 CO 0.66 -0.81 0.58 -1.71 -1.08 0.00 0.00 175.30 172.94 1xu9 n ASN 270 N -0.89 2.10 0.27 -2.89 4.05 -1.26 -4.95 115.26 111.70 1xu9 n ASN 270 Ca 0.10 -3.06 0.13 0.00 0.45 0.00 0.00 54.58 52.19 1xu9 n ASN 270 Cb 0.48 -0.66 0.78 0.00 1.23 0.00 0.00 39.78 41.61 1xu9 n ASN 270 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 1xu9 h PRO 271 N 4.56 0.00 -0.57 1.20 0.13 -1.97 -2.15 132.00 133.20 1xu9 h PRO 271 Ca 0.16 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.27 1xu9 h PRO 271 Cb 0.77 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.87 1xu9 h PRO 271 CO 0.65 0.07 0.26 0.77 -0.23 0.00 0.00 178.00 179.53 1xu9 h SER 272 N 0.00 0.72 -0.34 1.44 0.02 -1.99 -1.79 113.55 111.61 1xu9 h SER 272 Ca -0.00 -0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 60.87 1xu9 h SER 272 Cb 0.18 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.52 1xu9 h SER 272 CO 0.01 0.62 0.20 -0.09 -1.14 0.00 0.00 176.83 176.43 1xu9 h ARG 273 N 0.80 0.46 -0.52 3.45 2.43 -1.82 -1.17 114.38 118.01 1xu9 h ARG 273 Ca 0.20 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.25 1xu9 h ARG 273 Cb 0.10 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 1xu9 h ARG 273 CO -0.02 0.37 0.05 0.87 -1.51 0.00 0.00 179.97 179.72 1xu9 h LYS 274 N 0.43 0.85 -0.26 0.20 1.57 -1.52 -1.21 116.57 116.64 1xu9 h LYS 274 Ca 0.12 -0.22 -0.04 0.00 -1.87 0.00 0.00 60.65 58.65 1xu9 h LYS 274 Cb 0.03 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 1xu9 h LYS 274 CO -0.02 0.82 0.02 0.82 -0.57 0.00 0.00 179.45 180.52 1xu9 h ILE 275 N 0.80 1.24 -0.61 1.86 2.04 -1.12 -2.07 117.51 119.65 1xu9 h ILE 275 Ca 0.16 -0.84 -0.08 0.00 1.00 0.00 0.00 64.86 65.10 1xu9 h ILE 275 Cb 0.42 1.29 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 1xu9 h ILE 275 CO 0.01 0.27 0.07 -0.07 0.00 0.00 0.00 178.15 178.43 1xu9 h LEU 276 N 0.23 0.98 -0.69 1.44 3.38 -0.99 -0.44 115.31 119.22 1xu9 h LEU 276 Ca 0.08 -0.24 0.04 0.00 0.09 0.00 0.00 57.88 57.84 1xu9 h LEU 276 Cb 0.37 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 1xu9 h LEU 276 CO 0.01 1.00 0.43 -0.33 0.09 0.00 0.00 178.44 179.63 1xu9 h GLU 277 N 0.95 0.80 -0.06 1.13 5.08 -1.16 0.10 114.58 121.43 1xu9 h GLU 277 Ca 0.19 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.49 1xu9 h GLU 277 Cb 0.46 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 1xu9 h GLU 277 CO 0.02 0.53 0.02 0.35 -1.00 0.00 0.00 179.01 178.92 1xu9 h PHE 278 N 0.82 0.11 -0.71 4.33 3.57 -0.91 -1.95 116.94 122.21 1xu9 h PHE 278 Ca 0.28 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.76 1xu9 h PHE 278 Cb 0.05 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.73 1xu9 h PHE 278 CO -0.05 0.29 0.39 -0.07 -2.23 0.00 0.00 178.31 176.65 1xu9 h LEU 279 N -0.11 0.87 -0.98 0.59 3.38 -0.80 -1.89 115.31 116.37 1xu9 h LEU 279 Ca 0.02 -0.07 -0.09 0.00 0.09 0.00 0.00 57.88 57.84 1xu9 h LEU 279 Cb 0.24 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1xu9 h LEU 279 CO 0.00 0.70 -0.18 1.88 0.09 0.00 0.00 178.44 180.93 1xu9 h TYR 280 N 0.98 0.59 0.00 1.13 0.99 -0.67 -2.95 116.97 117.04 1xu9 h TYR 280 Ca 0.25 -0.11 -0.09 0.00 2.00 0.00 0.00 58.73 60.79 1xu9 h TYR 280 Cb 0.02 -0.15 -0.01 0.00 1.00 0.00 0.00 36.73 37.58 1xu9 h TYR 280 CO 0.01 0.69 -0.42 0.66 -0.00 0.00 0.00 178.16 179.10 1xu9 h SER 281 N 0.49 0.00 0.50 3.88 4.64 -0.54 -2.20 113.55 120.32 1xu9 h SER 281 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 1xu9 h SER 281 Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 1xu9 h SER 281 CO 0.04 0.42 0.00 0.35 -0.87 0.00 0.00 176.83 176.77 1xu9 n THR 282 N -3.91 0.99 0.07 2.95 -2.24 -1.07 -2.83 114.28 108.23 1xu9 n THR 282 Ca -0.01 0.35 0.08 0.00 -2.27 0.00 0.00 64.05 62.19 1xu9 n THR 282 Cb 0.46 -1.26 -0.04 0.00 -2.10 0.00 0.00 70.33 67.39 1xu9 n THR 282 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1xu9 n SER 283 N -2.04 0.73 -4.48 3.42 2.88 -0.83 -4.97 113.62 108.33 1xu9 n SER 283 Ca 0.02 0.29 -0.29 0.00 -1.33 0.00 0.00 58.87 57.56 1xu9 n SER 283 Cb 0.17 0.59 -0.11 0.00 -0.75 0.00 0.00 64.21 64.10 1xu9 n SER 283 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 1xu9 s TYR 284 N -3.26 2.51 -0.33 0.66 1.51 -1.13 -5.11 117.35 112.21 1xu9 s TYR 284 Ca -0.02 -0.27 -0.10 0.00 -1.01 0.00 0.00 57.07 55.66 1xu9 s TYR 284 Cb 0.10 -1.33 -0.00 0.00 -0.11 0.00 0.00 41.96 40.62 1xu9 s TYR 284 CO 0.81 0.39 0.18 1.21 -1.11 0.00 0.00 175.55 177.03 1xu9 s ASN 285 N -2.17 5.67 0.00 2.29 3.84 -1.26 -4.97 114.94 118.33 1xu9 s ASN 285 Ca 0.18 -0.58 0.28 0.00 0.21 0.00 0.00 52.86 52.95 1xu9 s ASN 285 Cb -0.10 -2.03 1.02 0.00 -0.55 0.00 0.00 41.25 39.59 1xu9 s ASN 285 CO 0.10 -0.23 1.73 0.23 -2.79 0.00 0.00 177.10 176.14 1xu9 n MET 286 N 5.01 1.63 -0.15 0.43 2.81 -1.26 -4.10 117.12 121.49 1xu9 n MET 286 Ca -0.13 -0.95 0.10 0.00 -1.81 0.00 0.00 57.70 54.90 1xu9 n MET 286 Cb 0.49 -1.48 0.43 0.00 -0.71 0.00 0.00 33.22 31.95 1xu9 n MET 286 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 1xu9 h ASP 287 N 2.33 0.51 0.00 7.83 3.32 -1.98 -3.42 116.42 125.01 1xu9 h ASP 287 Ca 0.00 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1xu9 h ASP 287 Cb 0.51 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.96 1xu9 h ASP 287 CO 0.00 0.31 0.00 -1.14 -1.72 0.00 0.00 179.24 176.69 1xu9 n ARG 288 N -4.49 0.00 0.00 3.56 0.63 -1.26 -5.25 116.66 109.86 1xu9 n ARG 288 Ca 0.11 0.00 0.15 0.00 -0.92 0.00 0.00 57.85 57.20 1xu9 n ARG 288 Cb 0.34 0.00 0.90 0.00 0.45 0.00 0.00 32.46 34.16 1xu9 n ARG 288 CO 0.00 0.00 0.00 1.97 -2.51 0.00 0.00 177.63 177.09