#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 3.85 0.72 2.61 -0.21 -1.26 -4.85 119.66 120.52 1xu9 s GLN 21 Ca 0.00 0.47 -0.11 0.00 0.02 0.00 0.00 55.36 55.74 1xu9 s GLN 21 Cb 0.00 -3.78 0.02 0.00 1.00 0.00 0.00 33.01 30.25 1xu9 s GLN 21 CO 0.00 -0.81 1.07 -1.25 -2.12 0.00 0.00 175.29 172.19 1xu9 s PRO 22 N 3.12 2.75 -0.07 2.91 0.04 -1.26 -4.93 135.00 137.57 1xu9 s PRO 22 Ca 0.33 0.72 -0.30 0.00 0.04 0.00 0.00 61.00 61.80 1xu9 s PRO 22 Cb -0.13 -1.99 -0.03 0.00 0.04 0.00 0.00 34.50 32.39 1xu9 s PRO 22 CO 0.16 -1.18 1.21 -0.51 0.04 0.00 0.00 177.00 176.72 1xu9 s LEU 23 N -5.53 4.27 -1.39 -3.56 1.43 -0.05 -4.94 118.68 108.91 1xu9 s LEU 23 Ca 0.58 1.80 -0.15 0.00 -1.03 0.00 0.00 54.13 55.33 1xu9 s LEU 23 Cb -0.13 -3.56 0.06 0.00 0.03 0.00 0.00 46.19 42.59 1xu9 s LEU 23 CO 0.54 -0.60 2.02 0.59 0.23 0.00 0.00 176.35 179.13 1xu9 n ASN 24 N 5.36 4.33 -3.71 2.29 4.13 -1.26 -4.87 115.26 121.53 1xu9 n ASN 24 Ca 0.11 -2.88 -0.12 0.00 1.68 0.00 0.00 54.58 53.37 1xu9 n ASN 24 Cb 0.46 -1.68 -0.07 0.00 -1.54 0.00 0.00 39.78 36.95 1xu9 n ASN 24 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1xu9 s GLU 25 N 3.40 0.88 0.22 3.52 2.02 -1.26 -5.15 118.70 122.33 1xu9 s GLU 25 Ca 0.49 -0.48 -0.30 0.00 0.02 0.00 0.00 54.97 54.70 1xu9 s GLU 25 Cb 0.10 0.39 -0.08 0.00 0.10 0.00 0.00 34.13 34.63 1xu9 s GLU 25 CO -0.02 -0.30 0.95 -2.00 0.02 0.00 0.00 175.26 173.91 1xu9 s GLU 26 N -2.69 4.82 0.31 1.61 2.12 -1.26 -5.02 118.70 118.58 1xu9 s GLU 26 Ca -0.04 1.50 -0.29 0.00 0.36 0.00 0.00 54.97 56.50 1xu9 s GLU 26 Cb -0.00 -3.29 -0.10 0.00 0.26 0.00 0.00 34.13 30.99 1xu9 s GLU 26 CO -0.04 0.45 1.42 0.12 -0.54 0.00 0.00 175.26 176.67 1xu9 s PHE 27 N -0.95 2.91 0.03 5.30 2.19 -1.26 -5.04 117.98 121.16 1xu9 s PHE 27 Ca 0.42 1.16 0.02 0.00 0.33 0.00 0.00 56.93 58.86 1xu9 s PHE 27 Cb -0.26 -3.84 -0.02 0.00 -1.31 0.00 0.00 43.02 37.59 1xu9 s PHE 27 CO 0.32 -2.56 -0.07 -0.98 1.83 0.00 0.00 175.22 173.76 1xu9 s ARG 28 N -1.23 0.48 0.61 10.12 1.70 -1.26 -5.04 118.95 124.33 1xu9 s ARG 28 Ca 0.55 -0.63 0.33 0.00 -0.47 0.00 0.00 55.73 55.51 1xu9 s ARG 28 Cb -0.43 -0.28 1.95 0.00 -0.57 0.00 0.00 34.95 35.63 1xu9 s ARG 28 CO 0.51 0.05 2.28 -1.00 -1.08 0.00 0.00 175.30 176.06 1xu9 h PRO 29 N 4.81 0.00 0.00 3.89 0.13 -1.98 -1.66 132.00 137.19 1xu9 h PRO 29 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1xu9 h PRO 29 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1xu9 h PRO 29 CO 0.43 0.01 0.00 0.39 -0.23 0.00 0.00 178.00 178.59 1xu9 n GLU 30 N -3.65 0.19 0.27 0.86 4.71 -1.26 -1.99 120.64 119.76 1xu9 n GLU 30 Ca -0.03 0.49 0.17 0.00 -0.01 0.00 0.00 57.16 57.79 1xu9 n GLU 30 Cb 0.09 -1.91 0.92 0.00 -1.01 0.00 0.00 31.44 29.52 1xu9 n GLU 30 CO 0.00 0.00 0.00 0.52 0.09 0.00 0.00 177.13 177.74 1xu9 h MET 31 N 0.00 0.00 -0.02 3.49 2.86 -1.68 -2.27 114.93 117.32 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 0.26 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.92 1xu9 h MET 31 CO 0.00 0.00 -0.30 1.28 1.06 0.00 0.00 176.91 178.95 1xu9 n LEU 32 N -3.65 2.08 -4.67 1.22 7.99 -0.84 -4.85 117.00 114.29 1xu9 n LEU 32 Ca -0.01 -0.83 -0.42 0.00 -0.01 0.00 0.00 56.01 54.74 1xu9 n LEU 32 Cb 0.21 0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 43.49 1xu9 n LEU 32 CO 0.25 0.38 1.50 -1.58 -1.51 0.00 0.00 177.39 176.44 1xu9 s GLN 33 N -2.08 4.16 0.00 3.23 0.74 -0.86 -1.70 119.66 123.15 1xu9 s GLN 33 Ca 0.18 2.47 0.00 0.00 0.05 0.00 0.00 55.36 58.07 1xu9 s GLN 33 Cb 0.16 -4.01 0.00 0.00 1.10 0.00 0.00 33.01 30.26 1xu9 s GLN 33 CO 0.43 -0.90 0.00 0.41 -0.55 0.00 0.00 175.29 174.69 1xu9 n GLY 34 N 4.35 0.59 3.82 2.59 0.00 -0.33 -4.92 105.19 111.29 1xu9 n GLY 34 Ca 0.19 0.00 -0.33 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 -0.40 3.86 -0.33 1.61 -0.14 -0.69 -4.64 119.74 119.01 1xu9 s LYS 35 Ca 0.00 1.16 -0.08 0.00 -1.36 0.00 0.00 55.97 55.69 1xu9 s LYS 35 Cb 0.00 -2.12 0.02 0.00 -1.68 0.00 0.00 37.83 34.06 1xu9 s LYS 35 CO 0.00 -0.35 0.13 0.15 -0.76 0.00 0.00 175.35 174.52 1xu9 s LYS 36 N -3.60 2.85 -0.07 1.68 1.02 -1.26 -0.56 119.74 119.79 1xu9 s LYS 36 Ca 0.63 -1.03 0.02 0.00 0.02 0.00 0.00 55.97 55.61 1xu9 s LYS 36 Cb -0.13 -3.52 0.01 0.00 -0.52 0.00 0.00 37.83 33.68 1xu9 s LYS 36 CO 0.24 -0.60 -0.12 0.08 -0.92 0.00 0.00 175.35 174.03 1xu9 s VAL 37 N 1.48 1.16 -0.07 3.17 1.01 -0.31 -0.41 120.40 126.43 1xu9 s VAL 37 Ca 0.01 -0.47 -0.18 0.00 0.00 0.00 0.00 61.98 61.34 1xu9 s VAL 37 Cb -0.19 -1.07 -0.05 0.00 0.00 0.00 0.00 36.38 35.08 1xu9 s VAL 37 CO 0.04 0.36 0.48 -0.63 0.00 0.00 0.00 175.10 175.36 1xu9 s ILE 38 N 0.80 5.09 -0.17 2.22 1.01 -0.60 -1.39 121.20 128.16 1xu9 s ILE 38 Ca -0.12 0.98 0.01 0.00 0.00 0.00 0.00 60.65 61.52 1xu9 s ILE 38 Cb -0.15 -3.81 0.03 0.00 0.01 0.00 0.00 42.46 38.53 1xu9 s ILE 38 CO 0.02 0.41 -0.16 -0.69 0.00 0.00 0.00 174.94 174.52 1xu9 s VAL 39 N 0.05 1.78 0.39 2.92 1.01 -0.51 -0.97 120.40 125.07 1xu9 s VAL 39 Ca 0.26 -0.83 -0.00 0.00 0.00 0.00 0.00 61.98 61.41 1xu9 s VAL 39 Cb -0.16 -1.68 -0.03 0.00 0.00 0.00 0.00 36.38 34.51 1xu9 s VAL 39 CO 0.12 0.43 0.61 0.42 0.00 0.00 0.00 175.10 176.68 1xu9 s THR 40 N 1.39 4.86 -1.29 3.92 -4.23 -0.64 -2.15 115.64 117.49 1xu9 s THR 40 Ca 0.04 -0.38 -0.01 0.00 -1.18 0.00 0.00 61.69 60.16 1xu9 s THR 40 Cb -0.14 -3.79 0.01 0.00 1.34 0.00 0.00 72.50 69.92 1xu9 s THR 40 CO -0.11 -0.56 0.81 0.61 -0.54 0.00 0.00 174.62 174.84 1xu9 n GLY 41 N -1.91 -0.33 0.65 3.99 0.00 -0.66 -3.91 105.19 103.01 1xu9 n GLY 41 Ca -0.03 0.13 0.06 0.00 0.00 0.00 0.00 46.02 46.17 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 -4.28 2.25 0.16 4.61 0.00 -0.61 -3.68 120.51 118.96 1xu9 n ALA 42 Ca -0.27 -1.25 0.05 0.00 0.00 0.00 0.00 53.44 51.97 1xu9 n ALA 42 Cb 0.66 -0.45 0.08 0.00 0.00 0.00 0.00 19.45 19.74 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 1.95 0.00 -2.73 0.00 4.64 -1.90 -3.24 113.55 112.27 1xu9 h SER 43 Ca 0.00 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.24 1xu9 h SER 43 Cb 0.79 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.87 1xu9 h SER 43 CO 0.02 0.38 0.11 2.29 -0.87 0.00 0.00 176.83 178.76 1xu9 n LYS 44 N -3.21 0.74 0.00 4.77 2.85 -1.26 -4.84 118.16 117.22 1xu9 n LYS 44 Ca 0.02 -1.77 0.00 0.00 -1.05 0.00 0.00 58.31 55.52 1xu9 n LYS 44 Cb 0.68 2.03 0.00 0.00 -0.65 0.00 0.00 35.03 37.08 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 -0.40 1.58 0.32 2.58 0.00 -1.26 -2.32 105.19 105.70 1xu9 n GLY 45 Ca -0.04 -0.55 -0.03 0.00 0.00 0.00 0.00 46.02 45.40 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 1.23 -0.53 -0.61 2.04 -1.88 -2.70 117.51 115.06 1xu9 h ILE 46 Ca 0.00 -0.73 -0.02 0.00 1.00 0.00 0.00 64.86 65.11 1xu9 h ILE 46 Cb 0.00 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 36.50 1xu9 h ILE 46 CO 0.00 0.29 0.23 1.23 0.00 0.00 0.00 178.15 179.91 1xu9 h GLY 47 N 1.05 0.83 0.98 5.37 0.00 -1.62 0.28 103.07 109.95 1xu9 h GLY 47 Ca 0.22 -0.43 0.01 0.00 0.00 0.00 0.00 47.33 47.13 1xu9 h GLY 47 CO -0.02 0.41 0.38 -0.09 0.00 0.00 0.00 176.54 177.22 1xu9 h ARG 48 N 0.71 0.75 -0.42 4.80 2.43 -1.28 -1.55 114.38 119.82 1xu9 h ARG 48 Ca 0.18 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.26 1xu9 h ARG 48 Cb 0.15 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.51 1xu9 h ARG 48 CO -0.02 0.50 0.07 0.93 -1.51 0.00 0.00 179.97 179.94 1xu9 h GLU 49 N 0.77 0.64 -0.42 0.20 4.39 -1.09 -1.70 114.58 117.37 1xu9 h GLU 49 Ca 0.22 -0.12 -0.04 0.00 0.34 0.00 0.00 59.36 59.75 1xu9 h GLU 49 Cb -0.07 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.46 1xu9 h GLU 49 CO -0.06 0.61 0.09 0.52 -1.16 0.00 0.00 179.01 179.01 1xu9 h MET 50 N 0.61 0.68 -0.50 2.33 2.86 -0.53 -1.42 114.93 118.97 1xu9 h MET 50 Ca 0.14 -0.17 0.07 0.00 -2.06 0.00 0.00 59.70 57.68 1xu9 h MET 50 Cb 0.28 -0.09 -0.06 0.00 0.06 0.00 0.00 31.60 31.80 1xu9 h MET 50 CO 0.00 0.70 0.16 0.00 1.06 0.00 0.00 176.91 178.84 1xu9 h ALA 51 N 0.95 0.60 -0.56 6.32 0.00 -0.85 -0.82 119.26 124.91 1xu9 h ALA 51 Ca 0.13 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 1xu9 h ALA 51 Cb 0.33 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1xu9 h ALA 51 CO 0.00 -0.23 0.17 1.88 0.00 0.00 0.00 179.25 181.07 1xu9 h TYR 52 N 0.33 0.91 -0.40 0.00 0.05 -1.11 -0.61 116.97 116.14 1xu9 h TYR 52 Ca 0.24 -0.10 -0.00 0.00 0.05 0.00 0.00 58.73 58.93 1xu9 h TYR 52 Cb 0.27 -0.26 -0.02 0.00 1.01 0.00 0.00 36.73 37.73 1xu9 h TYR 52 CO -0.17 0.77 0.25 0.45 -1.05 0.00 0.00 178.16 178.40 1xu9 h HIS 53 N 0.79 0.52 -0.93 4.88 3.86 -0.96 -1.21 115.15 122.10 1xu9 h HIS 53 Ca 0.18 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.38 1xu9 h HIS 53 Cb 0.29 -0.17 -0.04 0.00 1.06 0.00 0.00 27.41 28.55 1xu9 h HIS 53 CO 0.02 0.37 0.54 -0.07 0.86 0.00 0.00 177.93 179.65 1xu9 h LEU 54 N 0.53 1.14 -0.31 2.43 3.38 -0.93 -1.56 115.31 119.99 1xu9 h LEU 54 Ca 0.14 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1xu9 h LEU 54 Cb -0.01 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.44 1xu9 h LEU 54 CO -0.03 0.89 0.14 0.00 0.09 0.00 0.00 178.44 179.53 1xu9 h ALA 55 N 1.30 0.40 -0.28 1.53 0.00 -0.78 -1.58 119.26 119.85 1xu9 h ALA 55 Ca 0.33 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.15 1xu9 h ALA 55 Cb -0.02 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1xu9 h ALA 55 CO -0.06 -0.03 0.19 0.87 0.00 0.00 0.00 179.25 180.21 1xu9 h LYS 56 N 0.36 0.33 0.00 0.00 1.57 -0.79 -1.17 116.57 116.87 1xu9 h LYS 56 Ca 0.11 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1xu9 h LYS 56 Cb 0.13 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1xu9 h LYS 56 CO -0.01 0.22 0.00 -1.33 -0.57 0.00 0.00 179.45 177.76 1xu9 n MET 57 N -4.50 0.41 -1.35 3.15 2.81 -0.63 -4.91 117.12 112.10 1xu9 n MET 57 Ca 0.01 0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.92 1xu9 n MET 57 Cb 0.10 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.11 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 1.09 0.50 3.83 3.03 0.00 -0.48 -3.45 105.19 109.71 1xu9 n GLY 58 Ca 0.13 -0.88 -0.31 0.00 0.00 0.00 0.00 46.02 44.96 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 2.79 -0.03 4.61 0.00 -0.65 -1.19 121.76 125.29 1xu9 s ALA 59 Ca 0.00 0.04 -0.25 0.00 0.00 0.00 0.00 51.96 51.75 1xu9 s ALA 59 Cb 0.00 -3.15 -0.04 0.00 0.00 0.00 0.00 23.12 19.93 1xu9 s ALA 59 CO 0.00 -1.09 0.76 -1.01 0.00 0.00 0.00 175.76 174.42 1xu9 s HIS 60 N -3.08 3.63 -0.01 0.00 3.76 0.27 -0.74 115.29 119.13 1xu9 s HIS 60 Ca 0.57 1.38 0.04 0.00 -0.15 0.00 0.00 55.06 56.90 1xu9 s HIS 60 Cb -0.13 -2.86 -0.01 0.00 1.11 0.00 0.00 32.58 30.69 1xu9 s HIS 60 CO 0.55 0.12 -0.13 0.14 -0.85 0.00 0.00 174.74 174.57 1xu9 s VAL 61 N 0.60 1.04 -0.14 -0.90 -7.23 -0.43 -1.16 120.40 112.17 1xu9 s VAL 61 Ca 0.40 -0.56 0.02 0.00 -1.81 0.00 0.00 61.98 60.03 1xu9 s VAL 61 Cb -0.19 -0.87 0.01 0.00 0.56 0.00 0.00 36.38 35.90 1xu9 s VAL 61 CO 0.21 0.29 -0.20 -0.69 -0.31 0.00 0.00 175.10 174.41 1xu9 s VAL 62 N -0.28 1.92 0.08 1.32 1.01 -0.48 -1.98 120.40 121.99 1xu9 s VAL 62 Ca 0.04 -0.89 0.04 0.00 0.00 0.00 0.00 61.98 61.18 1xu9 s VAL 62 Cb -0.05 -1.72 -0.04 0.00 0.00 0.00 0.00 36.38 34.56 1xu9 s VAL 62 CO -0.00 0.52 0.01 0.68 0.00 0.00 0.00 175.10 176.31 1xu9 s VAL 63 N 0.99 4.09 0.05 2.92 -7.23 -0.32 -1.43 120.40 119.47 1xu9 s VAL 63 Ca -0.04 -0.92 -0.06 0.00 -1.81 0.00 0.00 61.98 59.15 1xu9 s VAL 63 Cb -0.15 -2.94 -0.01 0.00 0.56 0.00 0.00 36.38 33.85 1xu9 s VAL 63 CO -0.05 0.15 0.12 0.28 -0.31 0.00 0.00 175.10 175.29 1xu9 s THR 64 N -1.29 0.14 -0.32 5.32 -1.32 -0.91 -1.86 115.64 115.39 1xu9 s THR 64 Ca 0.25 -1.14 0.00 0.00 -1.21 0.00 0.00 61.69 59.59 1xu9 s THR 64 Cb -0.12 -1.03 0.00 0.00 -1.51 0.00 0.00 72.50 69.84 1xu9 s THR 64 CO 0.18 -0.63 0.00 0.00 -2.21 0.00 0.00 174.62 171.96 1xu9 n ALA 65 N 0.55 0.00 0.11 11.08 0.00 -1.25 -1.57 120.51 129.42 1xu9 n ALA 65 Ca -0.18 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.24 1xu9 n ALA 65 Cb 0.59 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.05 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 0.00 -5.99 0.00 3.08 -1.90 -0.99 114.38 108.58 1xu9 h ARG 66 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 1xu9 h ARG 66 Cb 0.00 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 29.94 1xu9 h ARG 66 CO 0.00 0.75 1.41 -1.12 -1.07 0.00 0.00 179.97 179.94 1xu9 s SER 67 N -6.64 6.50 0.15 7.04 0.01 -1.26 -4.46 113.70 115.05 1xu9 s SER 67 Ca 0.01 -1.48 -0.24 0.00 1.31 0.00 0.00 55.95 55.56 1xu9 s SER 67 Cb 0.10 -2.55 0.02 0.00 0.21 0.00 0.00 66.02 63.80 1xu9 s SER 67 CO 0.78 -1.47 1.61 0.50 0.41 0.00 0.00 173.24 175.07 1xu9 h LYS 68 N 9.70 -0.29 -0.58 12.44 3.64 -1.97 -0.56 116.57 138.94 1xu9 h LYS 68 Ca 0.18 0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.47 1xu9 h LYS 68 Cb 1.01 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.88 1xu9 h LYS 68 CO 1.39 -0.20 -0.04 1.49 -2.27 0.00 0.00 179.45 179.82 1xu9 h GLU 69 N -0.30 1.05 -0.26 1.90 4.81 -2.00 -1.55 114.58 118.22 1xu9 h GLU 69 Ca 0.13 -0.36 -0.15 0.00 -0.13 0.00 0.00 59.36 58.86 1xu9 h GLU 69 Cb 0.51 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.80 1xu9 h GLU 69 CO -0.42 1.05 -0.44 1.15 -0.73 0.00 0.00 179.01 179.63 1xu9 h THR 70 N 0.95 1.30 -0.87 0.32 2.02 -1.92 -2.73 112.91 111.98 1xu9 h THR 70 Ca 0.16 -1.62 -0.01 0.00 0.77 0.00 0.00 66.41 65.71 1xu9 h THR 70 Cb 0.60 1.57 -0.04 0.00 -1.74 0.00 0.00 68.15 68.54 1xu9 h THR 70 CO 0.04 0.52 0.51 -0.07 0.37 0.00 0.00 175.52 176.88 1xu9 h LEU 71 N 0.53 1.05 -0.83 2.58 3.38 -0.80 -0.38 115.31 120.84 1xu9 h LEU 71 Ca 0.04 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 1xu9 h LEU 71 Cb 0.97 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.42 1xu9 h LEU 71 CO 0.09 0.82 0.43 -0.61 0.09 0.00 0.00 178.44 179.26 1xu9 h GLN 72 N 1.20 1.17 -0.47 1.13 5.75 -1.04 -0.49 115.11 122.36 1xu9 h GLN 72 Ca 0.31 -0.15 -0.09 0.00 -0.15 0.00 0.00 58.65 58.57 1xu9 h GLN 72 Cb -0.03 -0.22 -0.02 0.00 1.07 0.00 0.00 27.48 28.28 1xu9 h GLN 72 CO -0.06 0.87 -0.09 0.87 -2.65 0.00 0.00 178.83 177.78 1xu9 h LYS 73 N 1.16 0.84 -0.47 1.69 1.57 -1.07 -1.10 116.57 119.18 1xu9 h LYS 73 Ca 0.29 -0.27 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 1xu9 h LYS 73 Cb 0.06 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 1xu9 h LYS 73 CO -0.04 0.89 0.20 0.28 -0.57 0.00 0.00 179.45 180.21 1xu9 h VAL 74 N 0.76 1.20 -0.40 0.50 2.07 -0.59 -1.82 116.25 117.97 1xu9 h VAL 74 Ca 0.13 -0.60 -0.01 0.00 0.82 0.00 0.00 66.70 67.04 1xu9 h VAL 74 Cb 0.58 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 1xu9 h VAL 74 CO 0.04 0.23 0.23 0.58 0.02 0.00 0.00 177.57 178.66 1xu9 h VAL 75 N 0.61 1.14 -0.76 2.57 2.07 -0.83 -0.33 116.25 120.72 1xu9 h VAL 75 Ca 0.16 -0.35 -0.03 0.00 0.82 0.00 0.00 66.70 67.30 1xu9 h VAL 75 Cb 0.17 0.65 -0.04 0.00 -1.52 0.00 0.00 31.29 30.56 1xu9 h VAL 75 CO -0.02 0.15 0.37 0.28 0.02 0.00 0.00 177.57 178.37 1xu9 h SER 76 N 0.52 0.99 -0.45 0.57 0.02 -1.00 -1.40 113.55 112.80 1xu9 h SER 76 Ca 0.14 -0.13 -0.10 0.00 -0.84 0.00 0.00 61.79 60.86 1xu9 h SER 76 Cb 0.03 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.30 1xu9 h SER 76 CO -0.02 0.84 -0.11 -0.74 -1.14 0.00 0.00 176.83 175.66 1xu9 h HIS 77 N 1.07 1.01 -0.85 3.45 6.17 -1.03 -2.02 115.15 122.95 1xu9 h HIS 77 Ca 0.26 -0.20 0.03 0.00 0.71 0.00 0.00 60.37 61.17 1xu9 h HIS 77 Cb 0.11 -0.26 -0.05 0.00 2.52 0.00 0.00 27.41 29.73 1xu9 h HIS 77 CO 0.01 0.96 0.55 0.00 0.71 0.00 0.00 177.93 180.16 1xu9 h LEU 79 N 1.08 0.69 -1.15 0.00 3.38 -1.02 -1.55 115.31 116.74 1xu9 h LEU 79 Ca 0.33 -0.21 0.02 0.00 0.09 0.00 0.00 57.88 58.11 1xu9 h LEU 79 Cb -0.03 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.49 1xu9 h LEU 79 CO -0.10 0.72 0.58 -0.33 0.09 0.00 0.00 178.44 179.39 1xu9 h GLU 80 N 0.63 1.12 0.00 1.13 5.08 -0.77 -2.21 114.58 119.57 1xu9 h GLU 80 Ca 0.15 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1xu9 h GLU 80 Cb 0.27 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1xu9 h GLU 80 CO -0.00 0.74 0.00 1.28 -1.00 0.00 0.00 179.01 180.03 1xu9 n LEU 81 N -4.42 0.73 0.00 1.33 4.77 -0.10 -4.90 117.00 114.41 1xu9 n LEU 81 Ca 0.11 0.64 0.00 0.00 -0.03 0.00 0.00 56.01 56.73 1xu9 n LEU 81 Cb 0.05 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.64 1xu9 n LEU 81 CO 0.36 -0.45 0.00 0.61 -1.33 0.00 0.00 177.39 176.58 1xu9 n GLY 82 N 0.40 1.56 3.70 -0.72 0.00 -0.83 -4.08 105.19 105.22 1xu9 n GLY 82 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.88 1.40 -0.27 4.61 0.00 -0.62 -4.16 120.51 120.60 1xu9 n ALA 83 Ca 0.00 0.37 0.05 0.00 0.00 0.00 0.00 53.44 53.86 1xu9 n ALA 83 Cb 0.00 -2.27 0.28 0.00 0.00 0.00 0.00 19.45 17.46 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 2.82 1.59 -2.51 0.00 0.00 -1.03 -3.45 119.26 116.67 1xu9 h ALA 84 Ca -0.46 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.48 1xu9 h ALA 84 Cb 1.28 -0.24 -0.14 0.00 0.00 0.00 0.00 17.79 18.69 1xu9 h ALA 84 CO 0.64 0.28 0.38 -1.54 0.00 0.00 0.00 179.25 179.01 1xu9 s SER 85 N -6.05 -0.45 -0.18 0.00 1.04 -1.25 -4.94 113.70 101.86 1xu9 s SER 85 Ca -0.11 0.04 -0.11 0.00 0.48 0.00 0.00 55.95 56.26 1xu9 s SER 85 Cb 0.20 0.47 0.06 0.00 0.10 0.00 0.00 66.02 66.85 1xu9 s SER 85 CO 0.79 -0.74 0.45 0.00 0.98 0.00 0.00 173.24 174.72 1xu9 s ALA 86 N -3.20 -1.17 0.04 5.32 0.00 -1.26 -1.31 121.76 120.19 1xu9 s ALA 86 Ca 0.03 1.62 -0.02 0.00 0.00 0.00 0.00 51.96 53.59 1xu9 s ALA 86 Cb -0.01 -0.97 -0.03 0.00 0.00 0.00 0.00 23.12 22.11 1xu9 s ALA 86 CO -0.09 -0.27 0.00 -1.01 0.00 0.00 0.00 175.76 174.39 1xu9 s HIS 87 N 1.30 0.39 0.20 0.00 3.76 -0.84 -4.98 115.29 115.11 1xu9 s HIS 87 Ca -0.09 -0.82 0.11 0.00 -0.15 0.00 0.00 55.06 54.11 1xu9 s HIS 87 Cb -0.07 -0.28 -0.04 0.00 1.11 0.00 0.00 32.58 33.29 1xu9 s HIS 87 CO -0.12 -0.34 -0.22 1.52 -0.85 0.00 0.00 174.74 174.72 1xu9 s TYR 88 N -3.13 2.19 -0.05 1.40 -0.85 -1.26 -1.17 117.35 114.48 1xu9 s TYR 88 Ca -0.00 -0.38 -0.01 0.00 -0.52 0.00 0.00 57.07 56.16 1xu9 s TYR 88 Cb 0.02 -1.07 0.03 0.00 0.38 0.00 0.00 41.96 41.32 1xu9 s TYR 88 CO -0.07 0.48 0.00 0.42 -1.52 0.00 0.00 175.55 174.86 1xu9 s ILE 89 N -1.84 0.29 -0.07 -3.49 1.01 -0.78 -4.95 121.20 111.38 1xu9 s ILE 89 Ca 0.21 0.11 -0.11 0.00 0.00 0.00 0.00 60.65 60.86 1xu9 s ILE 89 Cb -0.07 -0.42 -0.05 0.00 0.01 0.00 0.00 42.46 41.93 1xu9 s ILE 89 CO 0.10 0.22 0.26 0.00 0.00 0.00 0.00 174.94 175.51 1xu9 s ALA 90 N 1.58 3.79 0.00 9.38 0.00 -1.26 -3.94 121.76 131.32 1xu9 s ALA 90 Ca -0.01 -0.45 0.00 0.00 0.00 0.00 0.00 51.96 51.50 1xu9 s ALA 90 Cb -0.13 -2.17 0.00 0.00 0.00 0.00 0.00 23.12 20.82 1xu9 s ALA 90 CO -0.03 0.54 0.00 0.41 0.00 0.00 0.00 175.76 176.68 1xu9 n GLY 91 N 1.95 0.49 3.76 0.00 0.00 -0.37 -4.98 105.19 106.04 1xu9 n GLY 91 Ca -0.17 -0.90 -0.36 0.00 0.00 0.00 0.00 46.02 44.59 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 5.23 -2.03 2.61 -1.32 -1.26 -3.13 115.64 113.75 1xu9 s THR 92 Ca 0.00 0.12 0.14 0.00 -1.21 0.00 0.00 61.69 60.74 1xu9 s THR 92 Cb 0.00 -3.33 0.39 0.00 -1.51 0.00 0.00 72.50 68.05 1xu9 s THR 92 CO 0.00 0.52 1.52 0.23 -2.21 0.00 0.00 174.62 174.68 1xu9 n MET 93 N 2.85 1.10 0.25 7.08 0.00 -1.26 -1.87 117.12 125.27 1xu9 n MET 93 Ca -0.18 -0.15 0.13 0.00 0.00 0.00 0.00 57.70 57.50 1xu9 n MET 93 Cb 0.53 -1.23 0.60 0.00 0.00 0.00 0.00 33.22 33.12 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 0.28 0.00 -4.64 0.03 5.08 -1.92 -3.41 114.58 110.00 1xu9 h GLU 94 Ca 0.00 0.00 -0.71 0.00 -1.00 0.00 0.00 59.36 57.65 1xu9 h GLU 94 Cb 0.06 0.00 -0.20 0.00 0.50 0.00 0.00 28.75 29.11 1xu9 h GLU 94 CO 0.00 0.14 -0.14 0.34 -1.00 0.00 0.00 179.01 178.35 1xu9 s ASP 95 N -6.02 6.19 0.39 1.42 -1.08 -0.78 -4.94 116.67 111.84 1xu9 s ASP 95 Ca -0.00 -1.12 0.16 0.00 -0.52 0.00 0.00 52.55 51.07 1xu9 s ASP 95 Cb 0.11 -2.24 0.80 0.00 -1.46 0.00 0.00 42.92 40.13 1xu9 s ASP 95 CO 0.59 -0.77 1.83 0.24 0.52 0.00 0.00 175.17 177.59 1xu9 h MET 96 N 8.88 0.00 -0.49 4.34 2.86 -1.86 -1.75 114.93 126.91 1xu9 h MET 96 Ca -0.28 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.28 1xu9 h MET 96 Cb 1.10 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.75 1xu9 h MET 96 CO 0.92 0.35 -0.02 1.15 1.06 0.00 0.00 176.91 180.37 1xu9 h THR 97 N 0.00 1.26 -0.44 2.22 2.02 -1.96 -1.98 112.91 114.04 1xu9 h THR 97 Ca -0.00 -1.11 0.03 0.00 0.77 0.00 0.00 66.41 66.10 1xu9 h THR 97 Cb 0.68 1.00 -0.03 0.00 -1.74 0.00 0.00 68.15 68.06 1xu9 h THR 97 CO 0.05 0.39 0.23 0.15 0.37 0.00 0.00 175.52 176.70 1xu9 h PHE 98 N 0.73 0.43 -0.24 3.16 3.57 -1.72 -0.89 116.94 121.98 1xu9 h PHE 98 Ca 0.14 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.70 1xu9 h PHE 98 Cb 0.54 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.12 1xu9 h PHE 98 CO 0.04 0.23 -0.02 0.00 -2.23 0.00 0.00 178.31 176.33 1xu9 h ALA 99 N 1.22 0.20 -0.05 2.41 0.00 -1.15 0.23 119.26 122.11 1xu9 h ALA 99 Ca 0.18 0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.20 1xu9 h ALA 99 Cb 0.07 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1xu9 h ALA 99 CO -0.12 -0.44 -0.10 0.93 0.00 0.00 0.00 179.25 179.53 1xu9 h GLU 100 N 0.05 -0.13 -0.21 0.00 5.08 -1.10 -2.83 114.58 115.45 1xu9 h GLU 100 Ca 0.12 0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.40 1xu9 h GLU 100 Cb 0.16 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 1xu9 h GLU 100 CO -0.21 -0.09 -0.25 1.96 -1.00 0.00 0.00 179.01 179.42 1xu9 h GLN 101 N -0.14 0.38 -0.24 2.33 4.20 -0.85 -2.95 115.11 117.85 1xu9 h GLN 101 Ca 0.06 -0.14 0.00 0.00 0.06 0.00 0.00 58.65 58.63 1xu9 h GLN 101 Cb 0.22 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.96 1xu9 h GLN 101 CO -0.14 0.61 0.16 0.35 -0.67 0.00 0.00 178.83 179.13 1xu9 h PHE 102 N 0.34 0.30 -0.67 2.96 3.57 -0.36 -1.29 116.94 121.79 1xu9 h PHE 102 Ca 0.05 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.49 1xu9 h PHE 102 Cb 0.62 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.23 1xu9 h PHE 102 CO 0.02 0.19 0.14 0.28 -2.23 0.00 0.00 178.31 176.71 1xu9 h VAL 103 N 0.32 1.26 -0.57 1.41 2.07 -1.34 0.10 116.25 119.51 1xu9 h VAL 103 Ca 0.09 -0.99 -0.03 0.00 0.82 0.00 0.00 66.70 66.58 1xu9 h VAL 103 Cb -0.04 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.32 1xu9 h VAL 103 CO -0.02 0.38 0.22 0.00 0.02 0.00 0.00 177.57 178.17 1xu9 h ALA 104 N 1.06 0.74 -0.31 1.67 0.00 -1.36 -0.91 119.26 120.15 1xu9 h ALA 104 Ca 0.21 -0.16 -0.17 0.00 0.00 0.00 0.00 54.91 54.78 1xu9 h ALA 104 Cb 0.40 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 1xu9 h ALA 104 CO 0.01 0.35 -0.49 0.37 0.00 0.00 0.00 179.25 179.49 1xu9 h GLN 105 N 0.78 0.87 -0.98 0.00 5.75 -0.95 -2.45 115.11 118.13 1xu9 h GLN 105 Ca 0.19 -0.53 0.01 0.00 -0.15 0.00 0.00 58.65 58.17 1xu9 h GLN 105 Cb 0.21 0.05 -0.05 0.00 1.07 0.00 0.00 27.48 28.76 1xu9 h GLN 105 CO -0.01 1.17 0.65 0.00 -2.65 0.00 0.00 178.83 177.98 1xu9 h ALA 106 N 0.70 1.25 -0.66 3.38 0.00 -0.58 -0.49 119.26 122.86 1xu9 h ALA 106 Ca 0.03 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1xu9 h ALA 106 Cb 1.10 -0.39 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 1xu9 h ALA 106 CO 0.11 0.62 0.23 0.78 0.00 0.00 0.00 179.25 180.99 1xu9 h GLY 107 N 1.32 1.07 1.38 0.00 0.00 -1.06 -2.11 103.07 103.67 1xu9 h GLY 107 Ca 0.37 -0.60 -0.15 0.00 0.00 0.00 0.00 47.33 46.95 1xu9 h GLY 107 CO -0.09 0.56 -0.43 0.50 0.00 0.00 0.00 176.54 177.09 1xu9 h LYS 108 N 0.97 0.67 -0.26 4.80 1.57 -0.88 0.19 116.57 123.63 1xu9 h LYS 108 Ca 0.22 -0.36 -0.05 0.00 -1.87 0.00 0.00 60.65 58.58 1xu9 h LYS 108 Cb 0.25 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.56 1xu9 h LYS 108 CO -0.01 0.97 -0.07 -0.07 -0.57 0.00 0.00 179.45 179.70 1xu9 h LEU 109 N 0.55 0.39 0.00 2.94 3.38 -0.68 -3.23 115.31 118.66 1xu9 h LEU 109 Ca 0.04 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1xu9 h LEU 109 Cb 0.97 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.61 1xu9 h LEU 109 CO 0.09 0.51 -0.83 0.23 0.09 0.00 0.00 178.44 178.53 1xu9 n MET 110 N -4.26 1.66 -2.82 1.13 2.81 -0.83 -5.00 117.12 109.81 1xu9 n MET 110 Ca 0.01 -0.01 -0.11 0.00 -1.81 0.00 0.00 57.70 55.77 1xu9 n MET 110 Cb 0.27 -1.26 0.03 0.00 -0.71 0.00 0.00 33.22 31.55 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 1.39 0.14 0.00 3.03 0.00 0.55 -4.91 105.19 105.39 1xu9 n GLY 111 Ca 0.03 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.19 0.90 3.40 -0.02 0.00 -0.51 -5.04 105.19 102.73 1xu9 n GLY 112 Ca -0.03 -1.99 -0.07 0.00 0.00 0.00 0.00 46.02 43.93 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 -0.64 -0.18 0.99 2.96 -1.26 -4.56 118.68 115.99 1xu9 s LEU 113 Ca 0.00 1.16 0.14 0.00 -0.22 0.00 0.00 54.13 55.22 1xu9 s LEU 113 Cb 0.00 1.70 -0.21 0.00 0.50 0.00 0.00 46.19 48.19 1xu9 s LEU 113 CO 0.00 -0.22 0.04 0.47 -1.32 0.00 0.00 176.35 175.32 1xu9 n ASP 114 N 4.92 0.84 -3.73 3.68 8.00 0.45 -4.07 116.55 126.64 1xu9 n ASP 114 Ca -0.15 -0.01 -0.12 0.00 0.71 0.00 0.00 54.79 55.22 1xu9 n ASP 114 Cb 0.53 0.81 -0.12 0.00 -0.02 0.00 0.00 41.12 42.32 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 -2.42 0.30 -0.29 -1.24 1.75 -0.90 -1.40 119.30 115.09 1xu9 s MET 115 Ca -0.11 0.59 -0.01 0.00 -1.25 0.00 0.00 55.69 54.91 1xu9 s MET 115 Cb 0.05 -0.03 0.05 0.00 2.84 0.00 0.00 34.83 37.74 1xu9 s MET 115 CO 0.70 -0.14 -0.02 -1.17 -0.65 0.00 0.00 175.02 173.74 1xu9 s LEU 116 N 1.08 3.77 -0.37 4.11 2.96 -0.16 -1.56 118.68 128.51 1xu9 s LEU 116 Ca -0.07 -1.22 -0.11 0.00 -0.22 0.00 0.00 54.13 52.51 1xu9 s LEU 116 Cb -0.08 -1.70 0.03 0.00 0.50 0.00 0.00 46.19 44.94 1xu9 s LEU 116 CO -0.08 -0.24 0.20 -0.63 -1.32 0.00 0.00 176.35 174.29 1xu9 s ILE 117 N 1.25 4.56 -0.39 6.68 1.01 -0.14 -0.66 121.20 133.52 1xu9 s ILE 117 Ca -0.05 -0.86 -0.15 0.00 0.00 0.00 0.00 60.65 59.60 1xu9 s ILE 117 Cb -0.19 -3.54 0.01 0.00 0.01 0.00 0.00 42.46 38.74 1xu9 s ILE 117 CO -0.02 -0.23 0.32 -0.76 0.00 0.00 0.00 174.94 174.26 1xu9 s LEU 118 N 1.55 4.87 0.00 2.97 1.43 0.46 -1.62 118.68 128.34 1xu9 s LEU 118 Ca 0.02 -0.68 0.00 0.00 -1.03 0.00 0.00 54.13 52.43 1xu9 s LEU 118 Cb -0.19 -2.22 0.00 0.00 0.03 0.00 0.00 46.19 43.81 1xu9 s LEU 118 CO 0.07 -0.42 0.00 -3.20 0.23 0.00 0.00 176.35 173.03 1xu9 n ASN 119 N 5.26 1.24 -4.73 2.29 2.85 -1.26 -1.35 115.26 119.57 1xu9 n ASN 119 Ca -0.10 0.00 -0.35 0.00 -0.11 0.00 0.00 54.58 54.01 1xu9 n ASN 119 Cb 0.48 0.20 0.08 0.00 1.24 0.00 0.00 39.78 41.78 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 -0.82 2.06 0.06 1.20 -3.43 -1.25 -4.83 115.29 108.28 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 -3.57 -0.03 0.00 -1.43 0.00 0.00 32.58 27.55 1xu9 s HIS 120 CO 0.00 -2.75 0.03 0.96 -2.00 0.00 0.00 174.74 170.98 1xu9 s ILE 121 N -1.71 0.20 0.61 -5.38 -4.36 -1.26 -4.76 121.20 104.54 1xu9 s ILE 121 Ca 0.78 -1.62 -0.12 0.00 -0.26 0.00 0.00 60.65 59.43 1xu9 s ILE 121 Cb -0.33 -1.44 -0.04 0.00 1.25 0.00 0.00 42.46 41.90 1xu9 s ILE 121 CO 0.42 -0.90 1.03 0.28 0.24 0.00 0.00 174.94 176.01 1xu9 s THR 122 N -3.83 4.62 0.00 8.37 -1.32 -1.26 -4.96 115.64 117.27 1xu9 s THR 122 Ca 0.06 0.90 -0.36 0.00 -1.21 0.00 0.00 61.69 61.08 1xu9 s THR 122 Cb 0.07 -3.81 -0.15 0.00 -1.51 0.00 0.00 72.50 67.10 1xu9 s THR 122 CO -0.10 -1.06 1.61 -3.20 -2.21 0.00 0.00 174.62 169.65 1xu9 n ASN 123 N -2.63 2.63 -3.83 8.08 2.85 -1.26 -4.96 115.26 116.14 1xu9 n ASN 123 Ca 0.06 1.07 -0.20 0.00 -0.11 0.00 0.00 54.58 55.40 1xu9 n ASN 123 Cb 0.54 -1.29 -0.17 0.00 1.24 0.00 0.00 39.78 40.10 1xu9 n ASN 123 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 1xu9 s THR 124 N 1.96 0.35 0.32 -0.44 2.01 -1.26 -5.06 115.64 113.52 1xu9 s THR 124 Ca 0.87 0.03 0.03 0.00 0.31 0.00 0.00 61.69 62.93 1xu9 s THR 124 Cb -0.83 -0.44 -0.05 0.00 0.01 0.00 0.00 72.50 71.19 1xu9 s THR 124 CO 0.48 0.20 0.09 -0.94 -0.69 0.00 0.00 174.62 173.77 1xu9 s SER 125 N 1.26 2.03 -0.39 3.53 1.04 -1.26 -5.00 113.70 114.91 1xu9 s SER 125 Ca -0.06 -1.45 -0.28 0.00 0.48 0.00 0.00 55.95 54.64 1xu9 s SER 125 Cb -0.13 0.14 0.02 0.00 0.10 0.00 0.00 66.02 66.15 1xu9 s SER 125 CO -0.02 -0.73 1.03 -0.76 0.98 0.00 0.00 173.24 173.74 1xu9 s LEU 126 N -3.45 3.88 -0.01 2.42 1.43 -1.26 -4.82 118.68 116.88 1xu9 s LEU 126 Ca 0.34 0.66 -0.19 0.00 -1.03 0.00 0.00 54.13 53.91 1xu9 s LEU 126 Cb 0.07 -3.42 0.03 0.00 0.03 0.00 0.00 46.19 42.91 1xu9 s LEU 126 CO 0.15 -0.98 0.40 0.20 0.23 0.00 0.00 176.35 176.35 1xu9 s ASN 127 N 1.99 -0.30 0.59 2.29 -0.87 -0.92 -5.07 114.94 112.66 1xu9 s ASN 127 Ca 0.43 0.18 -0.19 0.00 -1.57 0.00 0.00 52.86 51.71 1xu9 s ASN 127 Cb -0.11 0.38 -0.04 0.00 -0.02 0.00 0.00 41.25 41.47 1xu9 s ASN 127 CO 0.22 -0.53 1.22 -0.76 -2.57 0.00 0.00 177.10 174.68 1xu9 s LEU 128 N -1.47 3.68 -0.58 0.60 1.43 -1.26 -4.25 118.68 116.82 1xu9 s LEU 128 Ca -0.11 2.42 -0.28 0.00 -1.03 0.00 0.00 54.13 55.13 1xu9 s LEU 128 Cb -0.03 -4.58 0.02 0.00 0.03 0.00 0.00 46.19 41.64 1xu9 s LEU 128 CO 0.04 -1.61 1.27 0.12 0.23 0.00 0.00 176.35 176.40 1xu9 s PHE 129 N -1.56 2.48 -0.39 0.29 5.36 -1.26 -4.96 117.98 117.94 1xu9 s PHE 129 Ca 0.77 0.40 0.03 0.00 -0.96 0.00 0.00 56.93 57.18 1xu9 s PHE 129 Cb -0.31 -4.48 0.11 0.00 -0.34 0.00 0.00 43.02 37.99 1xu9 s PHE 129 CO 0.34 -1.75 0.13 -1.01 -1.46 0.00 0.00 175.22 171.47 1xu9 s HIS 130 N 5.37 3.07 0.00 10.12 3.76 -1.26 -4.92 115.29 131.42 1xu9 s HIS 130 Ca 0.46 -2.77 0.00 0.00 -0.15 0.00 0.00 55.06 52.59 1xu9 s HIS 130 Cb -0.09 -2.58 0.00 0.00 1.11 0.00 0.00 32.58 31.03 1xu9 s HIS 130 CO 0.25 -0.87 0.00 -0.40 -0.85 0.00 0.00 174.74 172.87 1xu9 n ASP 131 N 3.98 -4.61 -3.76 1.40 5.75 -1.26 -4.88 116.55 113.17 1xu9 n ASP 131 Ca 0.04 0.00 -0.42 0.00 -0.01 0.00 0.00 54.79 54.40 1xu9 n ASP 131 Cb 0.39 -2.42 0.00 0.00 -1.03 0.00 0.00 41.12 38.06 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 -0.61 5.28 0.21 -1.12 -0.08 -1.26 -4.67 116.55 114.29 1xu9 n ASP 132 Ca 0.00 -3.03 0.05 0.00 -1.51 0.00 0.00 54.79 50.30 1xu9 n ASP 132 Cb 0.31 -1.51 0.48 0.00 2.34 0.00 0.00 41.12 42.73 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 3.64 1.15 -0.62 5.18 2.04 -1.99 -2.33 117.51 124.58 1xu9 h ILE 133 Ca 0.49 -0.68 -0.00 0.00 1.00 0.00 0.00 64.86 65.66 1xu9 h ILE 133 Cb 0.58 1.34 -0.03 0.00 -0.74 0.00 0.00 36.82 37.97 1xu9 h ILE 133 CO 1.68 0.20 0.37 0.45 0.00 0.00 0.00 178.15 180.85 1xu9 h HIS 134 N 0.03 0.82 -0.31 1.37 3.86 -2.00 -0.25 115.15 118.67 1xu9 h HIS 134 Ca 0.01 -0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.10 1xu9 h HIS 134 Cb 0.35 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.54 1xu9 h HIS 134 CO 0.00 0.56 -0.27 1.25 0.86 0.00 0.00 177.93 180.33 1xu9 h HIS 135 N 0.84 0.73 -0.31 2.45 -0.00 -1.83 -0.23 115.15 116.80 1xu9 h HIS 135 Ca 0.22 -0.17 -0.01 0.00 -0.00 0.00 0.00 60.37 60.40 1xu9 h HIS 135 Cb -0.02 -0.17 -0.01 0.00 -0.00 0.00 0.00 27.41 27.20 1xu9 h HIS 135 CO -0.02 0.85 0.14 0.28 -0.00 0.00 0.00 177.93 179.17 1xu9 h VAL 136 N 0.55 1.17 -0.45 5.26 2.07 -1.01 0.02 116.25 123.85 1xu9 h VAL 136 Ca 0.07 -0.50 -0.05 0.00 0.82 0.00 0.00 66.70 67.03 1xu9 h VAL 136 Cb 0.75 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 31.43 1xu9 h VAL 136 CO 0.06 0.18 0.07 -0.09 0.02 0.00 0.00 177.57 177.81 1xu9 h ARG 137 N 0.36 0.75 -0.49 1.57 2.43 -0.86 -1.45 114.38 116.70 1xu9 h ARG 137 Ca 0.11 -0.20 -0.10 0.00 -0.81 0.00 0.00 59.98 58.98 1xu9 h ARG 137 Cb 0.15 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.60 1xu9 h ARG 137 CO -0.01 0.77 -0.08 -0.22 -1.51 0.00 0.00 179.97 178.92 1xu9 h LYS 138 N 0.61 0.92 -0.59 0.20 3.64 -0.92 -0.24 116.57 120.20 1xu9 h LYS 138 Ca 0.14 -0.33 -0.00 0.00 -1.27 0.00 0.00 60.65 59.18 1xu9 h LYS 138 Cb 0.39 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.11 1xu9 h LYS 138 CO 0.01 0.99 0.35 0.77 -2.27 0.00 0.00 179.45 179.30 1xu9 h SER 139 N 0.78 0.71 -0.49 4.20 0.02 -0.92 -0.01 113.55 117.85 1xu9 h SER 139 Ca 0.13 -0.06 -0.07 0.00 -0.84 0.00 0.00 61.79 60.95 1xu9 h SER 139 Cb 0.62 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.96 1xu9 h SER 139 CO 0.04 0.56 0.06 -0.03 -1.14 0.00 0.00 176.83 176.32 1xu9 h MET 140 N 0.79 0.88 0.02 3.45 1.85 -0.86 0.67 114.93 121.73 1xu9 h MET 140 Ca 0.21 -0.22 -0.00 0.00 -0.61 0.00 0.00 59.70 59.08 1xu9 h MET 140 Cb -0.02 -0.11 0.00 0.00 0.43 0.00 0.00 31.60 31.91 1xu9 h MET 140 CO -0.04 0.84 -0.01 0.93 -0.40 0.00 0.00 176.91 178.23 1xu9 h GLU 141 N 0.83 -0.02 0.04 0.39 4.39 -0.65 0.35 114.58 119.90 1xu9 h GLU 141 Ca 0.17 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.75 1xu9 h GLU 141 Cb 0.41 0.01 0.01 0.00 -0.10 0.00 0.00 28.75 29.08 1xu9 h GLU 141 CO 0.01 0.53 -0.49 0.28 -1.16 0.00 0.00 179.01 178.18 1xu9 h VAL 142 N -0.59 1.52 0.00 3.13 2.07 -1.01 -0.05 116.25 121.33 1xu9 h VAL 142 Ca -0.00 -2.19 -0.06 0.00 0.82 0.00 0.00 66.70 65.27 1xu9 h VAL 142 Cb 0.56 2.89 -0.01 0.00 -1.52 0.00 0.00 31.29 33.22 1xu9 h VAL 142 CO 0.00 0.61 -0.50 0.78 0.02 0.00 0.00 177.57 178.49 1xu9 h ASN 143 N -0.39 0.00 0.00 0.57 2.35 -1.00 -3.39 115.58 113.72 1xu9 h ASN 143 Ca -0.07 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 1xu9 h ASN 143 Cb 1.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.65 1xu9 h ASN 143 CO 0.09 0.25 0.00 0.33 -1.65 0.00 0.00 177.43 176.45 1xu9 n PHE 144 N -3.06 -0.20 -0.26 1.19 7.35 -0.98 -4.69 117.46 116.80 1xu9 n PHE 144 Ca 0.01 0.04 -0.05 0.00 -0.76 0.00 0.00 57.45 56.68 1xu9 n PHE 144 Cb 0.64 0.06 0.06 0.00 0.35 0.00 0.00 39.48 40.59 1xu9 n PHE 144 CO 0.00 0.00 0.00 1.25 -0.76 0.00 0.00 176.76 177.25 1xu9 h LEU 145 N 0.00 0.90 -1.67 -2.13 5.85 -0.74 -1.58 115.31 115.93 1xu9 h LEU 145 Ca 0.00 -0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.64 1xu9 h LEU 145 Cb 0.00 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 1xu9 h LEU 145 CO 0.00 0.73 0.23 0.77 -0.34 0.00 0.00 178.44 179.84 1xu9 h SER 146 N 1.00 0.38 -0.71 1.25 4.64 -1.19 -0.91 113.55 118.01 1xu9 h SER 146 Ca 0.26 -0.01 -0.06 0.00 -0.47 0.00 0.00 61.79 61.51 1xu9 h SER 146 Cb 0.03 -0.09 -0.03 0.00 -0.31 0.00 0.00 62.40 61.99 1xu9 h SER 146 CO -0.04 0.27 0.20 1.88 -0.87 0.00 0.00 176.83 178.27 1xu9 h TYR 147 N 0.44 1.16 -0.44 4.77 -1.99 -1.53 -0.22 116.97 119.17 1xu9 h TYR 147 Ca 0.13 -0.13 -0.06 0.00 2.00 0.00 0.00 58.73 60.67 1xu9 h TYR 147 Cb -0.01 -0.33 -0.02 0.00 2.00 0.00 0.00 36.73 38.37 1xu9 h TYR 147 CO -0.00 0.93 0.03 0.28 -0.00 0.00 0.00 178.16 179.40 1xu9 h VAL 148 N 1.05 1.25 -0.52 -2.88 2.07 -0.99 -1.58 116.25 114.66 1xu9 h VAL 148 Ca 0.23 -0.98 -0.04 0.00 0.82 0.00 0.00 66.70 66.73 1xu9 h VAL 148 Cb 0.33 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 1xu9 h VAL 148 CO -0.00 0.34 0.17 0.58 0.02 0.00 0.00 177.57 178.68 1xu9 h VAL 149 N 0.60 1.23 -0.65 2.57 2.07 -0.98 -0.59 116.25 120.51 1xu9 h VAL 149 Ca 0.13 -0.76 -0.02 0.00 0.82 0.00 0.00 66.70 66.86 1xu9 h VAL 149 Cb 0.45 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.92 1xu9 h VAL 149 CO 0.02 0.28 0.31 -0.07 0.02 0.00 0.00 177.57 178.13 1xu9 h LEU 150 N 0.72 0.84 -0.22 2.57 3.38 -0.99 -1.74 115.31 119.87 1xu9 h LEU 150 Ca 0.17 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1xu9 h LEU 150 Cb 0.26 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1xu9 h LEU 150 CO -0.01 0.74 0.09 0.74 0.09 0.00 0.00 178.44 180.09 1xu9 h THR 151 N 0.89 1.16 -0.72 0.22 2.02 -0.95 -0.69 112.91 114.84 1xu9 h THR 151 Ca 0.22 -0.49 0.02 0.00 0.77 0.00 0.00 66.41 66.94 1xu9 h THR 151 Cb 0.12 1.08 -0.04 0.00 -1.74 0.00 0.00 68.15 67.57 1xu9 h THR 151 CO -0.03 0.16 0.47 0.58 0.37 0.00 0.00 175.52 177.07 1xu9 h VAL 152 N 0.20 1.14 -0.14 3.16 2.07 -0.96 -0.26 116.25 121.47 1xu9 h VAL 152 Ca 0.07 -0.32 -0.07 0.00 0.82 0.00 0.00 66.70 67.20 1xu9 h VAL 152 Cb 0.17 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.05 1xu9 h VAL 152 CO -0.01 0.17 -0.23 0.00 0.02 0.00 0.00 177.57 177.52 1xu9 h ALA 153 N 1.29 1.36 0.00 1.67 0.00 -1.10 -3.15 119.26 119.33 1xu9 h ALA 153 Ca 0.28 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1xu9 h ALA 153 Cb -0.05 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1xu9 h ALA 153 CO -0.08 0.44 -0.74 0.00 0.00 0.00 0.00 179.25 178.86 1xu9 h ALA 154 N 1.55 0.63 -0.77 0.00 0.00 -0.44 -3.41 119.26 116.81 1xu9 h ALA 154 Ca 0.04 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1xu9 h ALA 154 Cb 0.54 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 1xu9 h ALA 154 CO 0.04 0.00 0.41 1.25 0.00 0.00 0.00 179.25 180.94 1xu9 h LEU 155 N 0.00 0.98 -0.55 0.00 5.85 -1.02 -1.44 115.31 119.13 1xu9 h LEU 155 Ca 0.00 -0.11 0.08 0.00 0.84 0.00 0.00 57.88 58.69 1xu9 h LEU 155 Cb 0.99 -0.25 -0.06 0.00 0.37 0.00 0.00 40.66 41.71 1xu9 h LEU 155 CO 0.00 0.81 0.19 -0.65 -0.34 0.00 0.00 178.44 178.46 1xu9 h PRO 156 N 1.08 0.36 -0.64 5.25 0.11 -1.79 0.12 132.00 136.49 1xu9 h PRO 156 Ca 0.27 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 66.29 1xu9 h PRO 156 Cb 0.07 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 31.07 1xu9 h PRO 156 CO -0.04 0.24 0.12 0.52 -0.21 0.00 0.00 178.00 178.63 1xu9 h MET 157 N 0.37 1.05 -0.11 1.05 2.86 -1.73 -2.27 114.93 116.15 1xu9 h MET 157 Ca 0.27 -0.27 -0.11 0.00 -2.06 0.00 0.00 59.70 57.53 1xu9 h MET 157 Cb 0.31 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 1xu9 h MET 157 CO -0.28 0.96 -0.41 -0.07 1.06 0.00 0.00 176.91 178.18 1xu9 h LEU 158 N 0.97 0.26 -0.68 1.22 3.38 -0.66 -2.36 115.31 117.44 1xu9 h LEU 158 Ca 0.20 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.95 1xu9 h LEU 158 Cb 0.41 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1xu9 h LEU 158 CO 0.01 0.65 -0.10 0.11 0.09 0.00 0.00 178.44 179.20 1xu9 h LYS 159 N 0.21 0.92 -0.68 1.13 1.57 -0.62 0.40 116.57 119.50 1xu9 h LYS 159 Ca 0.02 -0.32 -0.01 0.00 -1.87 0.00 0.00 60.65 58.46 1xu9 h LYS 159 Cb 0.81 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 33.02 1xu9 h LYS 159 CO 0.06 0.98 0.36 0.37 -0.57 0.00 0.00 179.45 180.65 1xu9 h GLN 160 N 0.83 0.94 -0.03 3.15 5.75 -1.01 -3.04 115.11 121.70 1xu9 h GLN 160 Ca 0.14 -0.10 0.00 0.00 -0.15 0.00 0.00 58.65 58.53 1xu9 h GLN 160 Cb 0.63 -0.19 0.00 0.00 1.07 0.00 0.00 27.48 28.99 1xu9 h GLN 160 CO 0.04 0.70 -0.01 -1.13 -2.65 0.00 0.00 178.83 175.78 1xu9 n SER 161 N -4.37 2.97 -3.83 -0.69 3.41 -0.92 -4.95 113.62 105.24 1xu9 n SER 161 Ca 0.07 -1.99 -0.24 0.00 -0.26 0.00 0.00 58.87 56.45 1xu9 n SER 161 Cb 0.10 0.01 0.01 0.00 -0.26 0.00 0.00 64.21 64.08 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 1.31 -1.00 -2.08 4.04 3.02 -0.17 -4.97 115.26 115.40 1xu9 n ASN 162 Ca 0.14 -0.90 0.00 0.00 -0.03 0.00 0.00 54.58 53.79 1xu9 n ASN 162 Cb 0.60 -3.60 0.00 0.00 -0.61 0.00 0.00 39.78 36.17 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 -1.75 0.49 3.15 7.41 0.00 -0.05 -4.78 105.19 109.67 1xu9 n GLY 163 Ca -0.28 -1.70 -0.13 0.00 0.00 0.00 0.00 46.02 43.91 1xu9 n GLY 163 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1xu9 s SER 164 N -1.00 -0.26 -0.14 1.61 0.15 -0.49 -1.68 113.70 111.89 1xu9 s SER 164 Ca 0.00 0.47 -0.01 0.00 0.70 0.00 0.00 55.95 57.12 1xu9 s SER 164 Cb 0.00 0.51 -0.01 0.00 -1.71 0.00 0.00 66.02 64.81 1xu9 s SER 164 CO 0.00 -0.13 -0.12 -0.63 1.20 0.00 0.00 173.24 173.57 1xu9 s ILE 165 N -0.02 3.13 -0.18 6.45 1.01 0.43 -0.99 121.20 131.03 1xu9 s ILE 165 Ca -0.02 -0.63 -0.00 0.00 0.00 0.00 0.00 60.65 60.00 1xu9 s ILE 165 Cb -0.02 -2.33 0.01 0.00 0.01 0.00 0.00 42.46 40.13 1xu9 s ILE 165 CO 0.01 0.52 -0.15 -0.69 0.00 0.00 0.00 174.94 174.62 1xu9 s VAL 166 N 0.44 2.55 -0.22 2.92 1.01 0.17 -0.98 120.40 126.28 1xu9 s VAL 166 Ca -0.09 -0.79 -0.03 0.00 0.00 0.00 0.00 61.98 61.07 1xu9 s VAL 166 Cb -0.16 -2.09 -0.00 0.00 0.00 0.00 0.00 36.38 34.13 1xu9 s VAL 166 CO 0.05 0.51 -0.06 -0.69 0.00 0.00 0.00 175.10 174.90 1xu9 s VAL 167 N 1.15 3.17 -0.17 2.92 1.01 0.56 -0.40 120.40 128.64 1xu9 s VAL 167 Ca 0.01 -0.59 -0.20 0.00 0.00 0.00 0.00 61.98 61.20 1xu9 s VAL 167 Cb -0.14 -2.44 -0.03 0.00 0.00 0.00 0.00 36.38 33.76 1xu9 s VAL 167 CO -0.06 0.42 0.58 -0.69 0.00 0.00 0.00 175.10 175.35 1xu9 s VAL 168 N 1.44 5.07 0.00 2.92 1.01 -0.46 -0.89 120.40 129.50 1xu9 s VAL 168 Ca 0.05 1.12 0.00 0.00 0.00 0.00 0.00 61.98 63.15 1xu9 s VAL 168 Cb -0.14 -3.91 0.00 0.00 0.00 0.00 0.00 36.38 32.33 1xu9 s VAL 168 CO -0.05 0.18 0.00 -0.24 0.00 0.00 0.00 175.10 175.00 1xu9 n SER 169 N 4.58 0.14 -3.50 3.32 2.88 0.17 -4.88 113.62 116.33 1xu9 n SER 169 Ca -0.03 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.35 1xu9 n SER 169 Cb 0.50 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.92 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 -0.59 0.28 -3.46 0.01 -1.21 -2.74 113.70 106.99 1xu9 s SER 170 Ca 0.00 0.41 0.02 0.00 1.31 0.00 0.00 55.95 57.69 1xu9 s SER 170 Cb 0.00 0.55 0.60 0.00 0.21 0.00 0.00 66.02 67.38 1xu9 s SER 170 CO 0.00 -0.73 1.79 -0.07 0.41 0.00 0.00 173.24 174.64 1xu9 h LEU 171 N 2.69 0.76 0.00 2.44 3.38 -1.64 0.69 115.31 123.63 1xu9 h LEU 171 Ca -0.30 0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1xu9 h LEU 171 Cb 1.20 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1xu9 h LEU 171 CO 0.39 0.34 0.00 0.00 0.09 0.00 0.00 178.44 179.26 1xu9 n ALA 172 N -2.36 2.27 0.49 1.53 0.00 -1.26 -1.50 120.51 119.67 1xu9 n ALA 172 Ca 0.20 -0.09 0.11 0.00 0.00 0.00 0.00 53.44 53.65 1xu9 n ALA 172 Cb 0.45 -1.24 0.15 0.00 0.00 0.00 0.00 19.45 18.81 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 0.30 1.30 0.00 0.00 0.00 0.23 -4.45 105.19 102.57 1xu9 n GLY 173 Ca 0.11 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.49 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 1.26 2.29 -4.22 1.61 4.76 -0.56 -4.16 118.16 119.13 1xu9 n LYS 174 Ca 0.15 0.00 -0.13 0.00 -2.87 0.00 0.00 58.31 55.47 1xu9 n LYS 174 Cb 0.55 -0.83 -0.10 0.00 -1.84 0.00 0.00 35.03 32.81 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 -1.66 0.60 -0.01 -0.18 -7.23 -0.58 -5.14 120.40 106.20 1xu9 s VAL 175 Ca 0.00 -1.97 -0.16 0.00 -1.81 0.00 0.00 61.98 58.04 1xu9 s VAL 175 Cb 0.00 -2.06 -0.06 0.00 0.56 0.00 0.00 36.38 34.82 1xu9 s VAL 175 CO 0.00 -0.52 0.45 0.00 -0.31 0.00 0.00 175.10 174.72 1xu9 s ALA 176 N -3.70 3.63 0.05 1.32 0.00 -1.26 -4.20 121.76 117.59 1xu9 s ALA 176 Ca 0.23 -0.17 0.05 0.00 0.00 0.00 0.00 51.96 52.06 1xu9 s ALA 176 Cb 0.06 -2.48 -0.02 0.00 0.00 0.00 0.00 23.12 20.68 1xu9 s ALA 176 CO 0.03 0.37 -0.14 0.71 0.00 0.00 0.00 175.76 176.72 1xu9 s TYR 177 N -0.72 1.20 0.75 0.00 1.51 -1.26 -5.07 117.35 113.75 1xu9 s TYR 177 Ca 0.25 -0.38 -0.11 0.00 -1.01 0.00 0.00 57.07 55.82 1xu9 s TYR 177 Cb -0.17 -0.70 0.04 0.00 -0.11 0.00 0.00 41.96 41.02 1xu9 s TYR 177 CO 0.14 0.04 1.08 -1.25 -1.11 0.00 0.00 175.55 174.45 1xu9 s PRO 178 N -1.30 2.47 0.00 -1.71 0.04 -1.26 -4.07 135.00 129.17 1xu9 s PRO 178 Ca 0.00 1.12 0.00 0.00 0.04 0.00 0.00 61.00 62.16 1xu9 s PRO 178 Cb -0.08 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.53 1xu9 s PRO 178 CO 0.01 -1.47 0.00 -1.33 0.04 0.00 0.00 177.00 174.25 1xu9 n MET 179 N -3.36 0.00 -2.58 4.56 2.81 -1.26 -4.83 117.12 112.46 1xu9 n MET 179 Ca 0.09 0.00 -0.01 0.00 -1.81 0.00 0.00 57.70 55.96 1xu9 n MET 179 Cb 0.53 -2.30 0.05 0.00 -0.71 0.00 0.00 33.22 30.79 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 -2.01 1.23 0.02 2.03 0.24 -1.26 -2.16 118.33 116.41 1xu9 n VAL 180 Ca 0.00 -2.79 -0.11 0.00 -2.04 0.00 0.00 64.34 59.40 1xu9 n VAL 180 Cb 0.00 1.05 -0.06 0.00 -1.47 0.00 0.00 33.84 33.36 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 2.35 0.07 -0.51 2.33 0.00 -1.86 0.14 119.26 121.79 1xu9 h ALA 181 Ca -0.11 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 1xu9 h ALA 181 Cb 1.37 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.12 1xu9 h ALA 181 CO 0.21 -0.44 0.05 0.00 0.00 0.00 0.00 179.25 179.08 1xu9 h ALA 182 N 1.02 0.68 -0.23 0.00 0.00 -1.93 -1.31 119.26 117.48 1xu9 h ALA 182 Ca 0.02 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1xu9 h ALA 182 Cb -0.01 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1xu9 h ALA 182 CO -0.01 0.44 0.11 -0.92 0.00 0.00 0.00 179.25 178.88 1xu9 h TYR 183 N 0.74 0.33 -0.75 0.00 3.20 -1.87 -2.57 116.97 116.04 1xu9 h TYR 183 Ca 0.15 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.02 1xu9 h TYR 183 Cb 0.44 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.57 1xu9 h TYR 183 CO 0.03 0.32 0.49 0.77 -1.64 0.00 0.00 178.16 178.14 1xu9 h SER 184 N 0.25 0.85 -0.64 -2.11 0.02 -0.54 -1.01 113.55 110.37 1xu9 h SER 184 Ca 0.08 -0.02 0.10 0.00 -0.84 0.00 0.00 61.79 61.11 1xu9 h SER 184 Cb 0.11 -0.21 -0.08 0.00 0.14 0.00 0.00 62.40 62.37 1xu9 h SER 184 CO -0.01 0.61 0.25 0.00 -1.14 0.00 0.00 176.83 176.53 1xu9 h ALA 185 N 1.29 0.84 -0.24 3.77 0.00 -1.07 0.52 119.26 124.38 1xu9 h ALA 185 Ca 0.28 0.09 -0.13 0.00 0.00 0.00 0.00 54.91 55.15 1xu9 h ALA 185 Cb -0.09 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1xu9 h ALA 185 CO -0.07 -0.18 -0.41 0.66 0.00 0.00 0.00 179.25 179.25 1xu9 h SER 186 N 0.43 0.59 0.23 0.00 4.64 -0.90 -1.17 113.55 117.38 1xu9 h SER 186 Ca 0.33 -0.27 -0.30 0.00 -0.47 0.00 0.00 61.79 61.09 1xu9 h SER 186 Cb 0.42 -0.17 0.03 0.00 -0.31 0.00 0.00 62.40 62.37 1xu9 h SER 186 CO -0.32 0.93 -1.26 0.11 -0.87 0.00 0.00 176.83 175.42 1xu9 h LYS 187 N 0.46 0.55 -0.66 4.77 1.79 -0.71 -2.42 116.57 120.36 1xu9 h LYS 187 Ca 0.04 -0.77 0.06 0.00 -2.18 0.00 0.00 60.65 57.80 1xu9 h LYS 187 Cb 0.91 0.26 -0.06 0.00 -1.58 0.00 0.00 32.23 31.76 1xu9 h LYS 187 CO 0.08 1.35 0.35 0.74 -1.08 0.00 0.00 179.45 180.89 1xu9 h PHE 188 N 0.23 0.65 -0.94 -1.35 0.04 -0.90 -2.71 116.94 111.96 1xu9 h PHE 188 Ca -0.18 0.03 0.06 0.00 2.80 0.00 0.00 57.97 60.67 1xu9 h PHE 188 Cb 1.94 -0.19 -0.06 0.00 2.20 0.00 0.00 35.95 39.83 1xu9 h PHE 188 CO 0.11 0.30 0.60 0.00 -0.60 0.00 0.00 178.31 178.71 1xu9 h ALA 189 N 1.35 1.28 -0.72 2.45 0.00 -1.04 -1.21 119.26 121.38 1xu9 h ALA 189 Ca 0.30 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.22 1xu9 h ALA 189 Cb 0.21 -0.29 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 1xu9 h ALA 189 CO -0.19 0.40 0.44 -0.07 0.00 0.00 0.00 179.25 179.83 1xu9 h LEU 190 N 1.11 0.71 0.03 0.00 3.38 -1.15 0.01 115.31 119.41 1xu9 h LEU 190 Ca 0.40 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.37 1xu9 h LEU 190 Cb 0.13 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1xu9 h LEU 190 CO -0.16 0.48 -0.02 -0.78 0.09 0.00 0.00 178.44 178.06 1xu9 h ASP 191 N 0.85 -0.04 -0.17 -0.43 3.58 -0.99 -0.42 116.42 118.81 1xu9 h ASP 191 Ca 0.30 -0.13 0.03 0.00 0.42 0.00 0.00 57.03 57.65 1xu9 h ASP 191 Cb 0.06 0.01 -0.03 0.00 1.72 0.00 0.00 39.33 41.10 1xu9 h ASP 191 CO -0.13 0.10 -0.02 1.23 -2.88 0.00 0.00 179.24 177.55 1xu9 h GLY 192 N -0.18 0.14 0.68 -0.78 0.00 -1.05 -0.38 103.07 101.50 1xu9 h GLY 192 Ca -0.00 0.03 -0.02 0.00 0.00 0.00 0.00 47.33 47.34 1xu9 h GLY 192 CO 0.01 -0.04 -0.17 -2.75 0.00 0.00 0.00 176.54 173.58 1xu9 h PHE 193 N 0.03 -0.45 0.00 5.60 3.04 -0.91 -2.41 116.94 121.84 1xu9 h PHE 193 Ca 0.08 -0.01 -0.11 0.00 3.98 0.00 0.00 57.97 61.91 1xu9 h PHE 193 Cb 0.11 0.15 -0.02 0.00 2.56 0.00 0.00 35.95 38.75 1xu9 h PHE 193 CO -0.17 -0.13 -0.52 0.74 -2.02 0.00 0.00 178.31 176.21 1xu9 h PHE 194 N -0.81 0.00 -0.04 0.41 -1.00 -1.09 -1.67 116.94 112.74 1xu9 h PHE 194 Ca -0.05 0.00 -0.15 0.00 2.81 0.00 0.00 57.97 60.58 1xu9 h PHE 194 Cb 0.53 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.07 1xu9 h PHE 194 CO 0.02 0.52 -0.67 0.77 -1.61 0.00 0.00 178.31 177.34 1xu9 h SER 195 N 0.00 0.21 -0.06 2.17 0.02 -1.12 -1.23 113.55 113.54 1xu9 h SER 195 Ca -0.01 -0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 60.80 1xu9 h SER 195 Cb 0.94 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.42 1xu9 h SER 195 CO 0.07 0.82 -0.02 0.28 -1.14 0.00 0.00 176.83 176.84 1xu9 h SER 196 N 0.13 0.12 0.44 3.07 0.02 -1.12 -2.71 113.55 113.50 1xu9 h SER 196 Ca -0.01 -0.38 -0.06 0.00 -0.84 0.00 0.00 61.79 60.50 1xu9 h SER 196 Cb 1.20 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.70 1xu9 h SER 196 CO 0.10 0.47 -0.28 0.40 -1.14 0.00 0.00 176.83 176.38 1xu9 h ILE 197 N -0.23 0.98 -0.53 3.27 5.03 -1.30 -1.47 117.51 123.27 1xu9 h ILE 197 Ca 0.02 -1.04 0.03 0.00 -0.12 0.00 0.00 64.86 63.74 1xu9 h ILE 197 Cb 0.42 1.60 -0.04 0.00 -3.03 0.00 0.00 36.82 35.77 1xu9 h ILE 197 CO 0.01 0.28 0.30 -0.09 -0.68 0.00 0.00 178.15 177.96 1xu9 h ARG 198 N 0.00 0.57 -0.75 2.37 2.43 -1.14 0.12 114.38 117.97 1xu9 h ARG 198 Ca -0.00 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.11 1xu9 h ARG 198 Cb 0.58 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.96 1xu9 h ARG 198 CO 0.04 0.38 0.39 0.87 -1.51 0.00 0.00 179.97 180.13 1xu9 h LYS 199 N 0.59 1.07 -0.67 0.20 1.79 -0.99 -1.78 116.57 116.77 1xu9 h LYS 199 Ca 0.22 -0.14 -0.03 0.00 -2.18 0.00 0.00 60.65 58.52 1xu9 h LYS 199 Cb 0.07 -0.20 -0.03 0.00 -1.58 0.00 0.00 32.23 30.49 1xu9 h LYS 199 CO -0.12 0.81 0.32 0.93 -1.08 0.00 0.00 179.45 180.31 1xu9 h GLU 200 N 1.05 0.98 -0.09 3.15 5.08 -0.53 -2.18 114.58 122.05 1xu9 h GLU 200 Ca 0.26 -0.15 -0.10 0.00 -1.00 0.00 0.00 59.36 58.37 1xu9 h GLU 200 Cb 0.08 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 1xu9 h GLU 200 CO -0.04 0.78 -0.39 1.88 -1.00 0.00 0.00 179.01 180.24 1xu9 h TYR 201 N 0.94 0.22 -0.07 4.33 0.05 -0.48 -0.21 116.97 121.75 1xu9 h TYR 201 Ca 0.23 -0.05 -0.01 0.00 0.05 0.00 0.00 58.73 58.95 1xu9 h TYR 201 Cb 0.13 -0.05 -0.00 0.00 1.01 0.00 0.00 36.73 37.82 1xu9 h TYR 201 CO 0.01 0.56 0.02 1.03 -1.05 0.00 0.00 178.16 178.72 1xu9 h SER 202 N 0.16 0.10 0.60 3.88 0.87 -1.00 -0.15 113.55 118.01 1xu9 h SER 202 Ca 0.02 -0.21 -0.13 0.00 -1.23 0.00 0.00 61.79 60.23 1xu9 h SER 202 Cb 0.77 -0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.69 1xu9 h SER 202 CO 0.06 0.28 -0.62 -0.37 -0.53 0.00 0.00 176.83 175.65 1xu9 h VAL 203 N -0.09 1.44 -0.16 2.23 -1.51 -1.19 -2.98 116.25 114.00 1xu9 h VAL 203 Ca 0.02 -2.12 0.00 0.00 -1.23 0.00 0.00 66.70 63.37 1xu9 h VAL 203 Cb 0.22 2.14 0.00 0.00 -2.13 0.00 0.00 31.29 31.52 1xu9 h VAL 203 CO -0.00 0.61 0.00 -1.54 -1.23 0.00 0.00 177.57 175.41 1xu9 n SER 204 N -3.81 2.11 -3.78 4.19 3.41 -0.11 -4.95 113.62 110.68 1xu9 n SER 204 Ca -0.01 -1.75 -0.27 0.00 -0.26 0.00 0.00 58.87 56.57 1xu9 n SER 204 Cb 0.62 -0.10 0.05 0.00 -0.26 0.00 0.00 64.21 64.52 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 0.62 -6.65 -2.93 4.33 5.12 -0.38 -4.97 116.66 111.79 1xu9 n ARG 205 Ca 0.17 0.70 -0.41 0.00 -1.93 0.00 0.00 57.85 56.38 1xu9 n ARG 205 Cb 0.42 -5.67 -0.05 0.00 -1.16 0.00 0.00 32.46 26.00 1xu9 n ARG 205 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1xu9 s VAL 206 N -3.31 4.87 -0.82 1.55 1.01 -0.21 -4.97 120.40 118.53 1xu9 s VAL 206 Ca 0.63 1.50 -0.04 0.00 0.00 0.00 0.00 61.98 64.07 1xu9 s VAL 206 Cb -0.30 -4.09 0.16 0.00 0.00 0.00 0.00 36.38 32.15 1xu9 s VAL 206 CO 0.79 -0.04 2.44 -3.20 0.00 0.00 0.00 175.10 175.08 1xu9 n ASN 207 N 5.86 7.18 -4.10 3.32 5.15 -1.26 -4.63 115.26 126.78 1xu9 n ASN 207 Ca 0.04 -3.35 -0.32 0.00 -0.60 0.00 0.00 54.58 50.35 1xu9 n ASN 207 Cb 0.48 -1.23 -0.16 0.00 -0.53 0.00 0.00 39.78 38.34 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 -2.68 1.99 0.43 3.44 1.01 -1.26 -3.81 120.40 119.53 1xu9 s VAL 208 Ca 0.54 -0.95 -0.15 0.00 0.00 0.00 0.00 61.98 61.43 1xu9 s VAL 208 Cb 0.32 -1.83 -0.08 0.00 0.00 0.00 0.00 36.38 34.78 1xu9 s VAL 208 CO -0.21 0.49 0.86 -0.94 0.00 0.00 0.00 175.10 175.29 1xu9 s SER 209 N 1.31 6.66 -0.11 3.32 1.04 -0.68 -4.93 113.70 120.31 1xu9 s SER 209 Ca 0.04 1.38 -0.01 0.00 0.48 0.00 0.00 55.95 57.84 1xu9 s SER 209 Cb -0.13 -2.42 0.03 0.00 0.10 0.00 0.00 66.02 63.59 1xu9 s SER 209 CO -0.12 -0.42 -0.07 -0.63 0.98 0.00 0.00 173.24 172.99 1xu9 s ILE 210 N -2.35 0.93 -0.19 -1.02 1.01 -1.26 -0.43 121.20 117.90 1xu9 s ILE 210 Ca 0.56 -0.23 -0.00 0.00 0.00 0.00 0.00 60.65 60.98 1xu9 s ILE 210 Cb -0.10 -0.97 0.01 0.00 0.01 0.00 0.00 42.46 41.41 1xu9 s ILE 210 CO 0.26 0.35 -0.16 -0.89 0.00 0.00 0.00 174.94 174.51 1xu9 s THR 211 N 1.73 2.45 -0.21 2.92 2.01 -0.15 -4.41 115.64 119.98 1xu9 s THR 211 Ca 0.05 -0.81 -0.09 0.00 0.31 0.00 0.00 61.69 61.15 1xu9 s THR 211 Cb -0.13 -2.05 -0.04 0.00 0.01 0.00 0.00 72.50 70.29 1xu9 s THR 211 CO -0.08 0.51 0.10 -0.22 -0.69 0.00 0.00 174.62 174.24 1xu9 s LEU 212 N 1.26 3.91 -0.15 4.42 2.96 -0.02 -0.32 118.68 130.73 1xu9 s LEU 212 Ca 0.03 0.07 -0.05 0.00 -0.22 0.00 0.00 54.13 53.96 1xu9 s LEU 212 Cb -0.14 -2.02 -0.04 0.00 0.50 0.00 0.00 46.19 44.50 1xu9 s LEU 212 CO -0.09 0.11 0.02 0.00 -1.32 0.00 0.00 176.35 175.08 1xu9 s VAL 214 N 0.09 2.75 -0.12 0.00 1.01 0.10 0.44 120.40 124.67 1xu9 s VAL 214 Ca 0.03 -1.60 -0.02 0.00 0.00 0.00 0.00 61.98 60.38 1xu9 s VAL 214 Cb -0.13 -2.66 -0.03 0.00 0.00 0.00 0.00 36.38 33.56 1xu9 s VAL 214 CO 0.01 -0.19 -0.03 -0.76 0.00 0.00 0.00 175.10 174.14 1xu9 s LEU 215 N 1.17 3.35 0.00 3.92 1.43 -1.11 -1.83 118.68 125.62 1xu9 s LEU 215 Ca -0.03 -0.02 0.00 0.00 -1.03 0.00 0.00 54.13 53.05 1xu9 s LEU 215 Cb -0.20 -1.78 0.00 0.00 0.03 0.00 0.00 46.19 44.24 1xu9 s LEU 215 CO -0.03 0.27 0.00 0.61 0.23 0.00 0.00 176.35 177.43 1xu9 n GLY 216 N 2.86 -0.53 3.66 -3.19 0.00 -0.07 -1.77 105.19 106.15 1xu9 n GLY 216 Ca -0.18 -1.59 -0.43 0.00 0.00 0.00 0.00 46.02 43.83 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 4.22 -0.04 0.99 2.96 -1.26 -4.92 118.68 120.63 1xu9 s LEU 217 Ca 0.00 1.97 0.05 0.00 -0.22 0.00 0.00 54.13 55.94 1xu9 s LEU 217 Cb 0.00 -3.53 -0.02 0.00 0.50 0.00 0.00 46.19 43.13 1xu9 s LEU 217 CO 0.00 -0.91 -0.20 -0.63 -1.32 0.00 0.00 176.35 173.29 1xu9 s ILE 218 N 3.98 2.58 0.00 6.68 -1.09 -1.26 -1.04 121.20 131.05 1xu9 s ILE 218 Ca 0.67 -0.90 0.00 0.00 -2.23 0.00 0.00 60.65 58.18 1xu9 s ILE 218 Cb -0.28 -1.96 0.00 0.00 -1.58 0.00 0.00 42.46 38.63 1xu9 s ILE 218 CO 0.24 0.58 1.42 -0.90 -1.23 0.00 0.00 174.94 175.06 1xu9 n ASP 219 N 2.45 3.88 -4.76 3.58 3.85 0.04 -4.63 116.55 120.95 1xu9 n ASP 219 Ca -0.17 -2.02 -0.33 0.00 -0.71 0.00 0.00 54.79 51.57 1xu9 n ASP 219 Cb 0.52 -0.79 0.06 0.00 -1.35 0.00 0.00 41.12 39.56 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 0.32 3.17 0.25 2.12 -4.23 -1.26 -4.82 115.64 111.18 1xu9 s THR 220 Ca 0.00 0.50 -0.04 0.00 -1.18 0.00 0.00 61.69 60.97 1xu9 s THR 220 Cb 0.00 -3.00 0.23 0.00 1.34 0.00 0.00 72.50 71.07 1xu9 s THR 220 CO 0.00 -0.38 1.85 -0.33 -0.54 0.00 0.00 174.62 175.22 1xu9 h GLU 221 N -0.33 0.97 -0.17 3.99 4.39 -1.99 -1.07 114.58 120.37 1xu9 h GLU 221 Ca -0.46 -0.06 0.04 0.00 0.34 0.00 0.00 59.36 59.23 1xu9 h GLU 221 Cb 1.25 -0.22 -0.04 0.00 -0.10 0.00 0.00 28.75 29.63 1xu9 h GLU 221 CO 0.53 0.64 -0.11 1.15 -1.16 0.00 0.00 179.01 180.06 1xu9 h THR 222 N 1.00 0.68 -0.37 1.13 2.02 -1.95 -1.52 112.91 113.90 1xu9 h THR 222 Ca 0.40 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.49 1xu9 h THR 222 Cb 0.21 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 67.28 1xu9 h THR 222 CO -0.19 0.00 -0.11 0.00 0.37 0.00 0.00 175.52 175.59 1xu9 h ALA 223 N 1.03 0.51 -0.35 6.16 0.00 -1.65 -1.77 119.26 123.19 1xu9 h ALA 223 Ca 0.10 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 1xu9 h ALA 223 Cb 0.25 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1xu9 h ALA 223 CO -0.23 0.39 -0.00 0.52 0.00 0.00 0.00 179.25 179.92 1xu9 h MET 224 N 0.53 0.54 -0.15 0.00 2.07 -1.03 -0.86 114.93 116.03 1xu9 h MET 224 Ca 0.09 -0.12 -0.20 0.00 -2.07 0.00 0.00 59.70 57.40 1xu9 h MET 224 Cb 0.64 -0.08 0.00 0.00 -1.87 0.00 0.00 31.60 30.29 1xu9 h MET 224 CO 0.04 0.56 -0.72 0.87 1.07 0.00 0.00 176.91 178.74 1xu9 h LYS 225 N 0.51 0.65 -0.12 1.72 1.57 -1.21 -2.91 116.57 116.79 1xu9 h LYS 225 Ca 0.11 -0.51 -0.07 0.00 -1.87 0.00 0.00 60.65 58.31 1xu9 h LYS 225 Cb 0.34 0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 1xu9 h LYS 225 CO 0.01 1.13 -0.23 0.00 -0.57 0.00 0.00 179.45 179.79 1xu9 h ALA 226 N 0.73 1.40 -0.51 3.86 0.00 -0.49 -3.07 119.26 121.18 1xu9 h ALA 226 Ca -0.03 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1xu9 h ALA 226 Cb 1.32 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1xu9 h ALA 226 CO 0.14 0.42 0.00 1.33 0.00 0.00 0.00 179.25 181.14 1xu9 n VAL 227 N -4.19 1.35 0.27 0.00 0.24 -0.41 -4.59 118.33 110.99 1xu9 n VAL 227 Ca -0.01 -1.15 0.09 0.00 -2.04 0.00 0.00 64.34 61.23 1xu9 n VAL 227 Cb 0.34 0.33 0.69 0.00 -1.47 0.00 0.00 33.84 33.73 1xu9 n VAL 227 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1xu9 h SER 228 N 3.07 0.00 -0.63 -1.34 4.64 -1.41 -2.27 113.55 115.61 1xu9 h SER 228 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xu9 h SER 228 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 1xu9 h SER 228 CO 0.08 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.67 1xu9 n GLY 229 N -1.44 2.42 0.55 -0.77 0.00 -1.26 -5.14 105.19 99.55 1xu9 n GLY 229 Ca -0.03 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.22 1xu9 n GLY 229 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1xu9 n ILE 230 N 1.17 0.00 0.00 -0.61 -5.35 -0.86 -5.26 119.36 108.46 1xu9 n ILE 230 Ca 0.24 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.72 1xu9 n ILE 230 Cb 0.77 -0.43 0.00 0.00 -1.74 0.00 0.00 39.64 38.23 1xu9 n ILE 230 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1xu9 n ALA 235 N -1.60 0.00 -1.86 -1.28 0.00 -1.26 -5.16 120.51 109.35 1xu9 n ALA 235 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 1xu9 n ALA 235 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 1xu9 n ALA 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xu9 s ALA 236 N -0.72 3.08 0.09 0.00 0.00 -0.20 -4.68 121.76 119.32 1xu9 s ALA 236 Ca 0.00 0.25 -0.31 0.00 0.00 0.00 0.00 51.96 51.90 1xu9 s ALA 236 Cb 0.00 -3.10 -0.07 0.00 0.00 0.00 0.00 23.12 19.96 1xu9 s ALA 236 CO 0.00 -0.04 1.31 -1.25 0.00 0.00 0.00 175.76 175.79 1xu9 s PRO 237 N -3.62 4.36 0.43 0.00 0.04 -1.26 -0.78 135.00 134.17 1xu9 s PRO 237 Ca 0.60 1.94 0.11 0.00 0.04 0.00 0.00 61.00 63.69 1xu9 s PRO 237 Cb -0.10 -3.31 0.92 0.00 0.04 0.00 0.00 34.50 32.06 1xu9 s PRO 237 CO 0.23 -0.37 2.00 1.57 0.04 0.00 0.00 177.00 180.46 1xu9 h LYS 238 N 6.87 0.23 -0.48 4.56 2.10 -1.93 -1.67 116.57 126.25 1xu9 h LYS 238 Ca -0.42 -0.03 -0.05 0.00 -2.00 0.00 0.00 60.65 58.15 1xu9 h LYS 238 Cb 1.21 -0.04 -0.02 0.00 -0.90 0.00 0.00 32.23 32.48 1xu9 h LYS 238 CO 0.85 0.28 0.11 1.49 -2.00 0.00 0.00 179.45 180.18 1xu9 h GLU 239 N 0.23 0.77 -0.29 0.07 4.81 -1.95 -1.36 114.58 116.86 1xu9 h GLU 239 Ca 0.05 -0.19 -0.18 0.00 -0.13 0.00 0.00 59.36 58.91 1xu9 h GLU 239 Cb 0.20 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.48 1xu9 h GLU 239 CO 0.01 0.76 -0.53 1.49 -0.73 0.00 0.00 179.01 180.00 1xu9 h GLU 240 N 0.65 0.88 -0.19 1.92 4.81 -1.85 -2.64 114.58 118.15 1xu9 h GLU 240 Ca 0.15 -0.55 0.05 0.00 -0.13 0.00 0.00 59.36 58.87 1xu9 h GLU 240 Cb 0.33 0.06 -0.05 0.00 0.63 0.00 0.00 28.75 29.73 1xu9 h GLU 240 CO 0.00 1.19 -0.12 0.00 -0.73 0.00 0.00 179.01 179.36 1xu9 h ALA 242 N 1.05 1.19 -0.54 0.00 0.00 -1.19 -1.83 119.26 117.93 1xu9 h ALA 242 Ca 0.11 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 1xu9 h ALA 242 Cb 0.27 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1xu9 h ALA 242 CO -0.26 0.30 -0.05 1.25 0.00 0.00 0.00 179.25 180.49 1xu9 h LEU 243 N 0.99 0.99 -1.13 0.00 5.85 -1.06 -2.49 115.31 118.47 1xu9 h LEU 243 Ca 0.37 -0.33 -0.08 0.00 0.84 0.00 0.00 57.88 58.69 1xu9 h LEU 243 Cb 0.15 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 1xu9 h LEU 243 CO -0.17 1.08 -0.20 -0.33 -0.34 0.00 0.00 178.44 178.48 1xu9 h GLU 244 N 0.87 0.37 -0.06 1.25 4.39 -0.68 -0.61 114.58 120.11 1xu9 h GLU 244 Ca 0.15 -0.12 -0.00 0.00 0.34 0.00 0.00 59.36 59.73 1xu9 h GLU 244 Cb 0.61 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.22 1xu9 h GLU 244 CO 0.04 0.56 0.03 0.82 -1.16 0.00 0.00 179.01 179.30 1xu9 h ILE 245 N 0.33 1.11 -0.62 3.13 2.04 -1.18 -1.55 117.51 120.77 1xu9 h ILE 245 Ca 0.06 -0.33 0.02 0.00 1.00 0.00 0.00 64.86 65.61 1xu9 h ILE 245 Cb 0.55 1.23 -0.04 0.00 -0.74 0.00 0.00 36.82 37.83 1xu9 h ILE 245 CO 0.04 0.10 0.39 0.40 0.00 0.00 0.00 178.15 179.07 1xu9 h ILE 246 N -0.04 1.09 -0.44 -0.67 2.04 -1.04 -2.05 117.51 116.40 1xu9 h ILE 246 Ca 0.02 -0.26 -0.00 0.00 1.00 0.00 0.00 64.86 65.61 1xu9 h ILE 246 Cb 0.13 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.44 1xu9 h ILE 246 CO -0.00 0.14 0.26 0.11 0.00 0.00 0.00 178.15 178.66 1xu9 h LYS 247 N 0.77 0.61 -0.47 2.37 1.57 -1.00 -0.10 116.57 120.31 1xu9 h LYS 247 Ca 0.25 -0.06 0.01 0.00 -1.87 0.00 0.00 60.65 58.98 1xu9 h LYS 247 Cb 0.00 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.16 1xu9 h LYS 247 CO -0.09 0.46 0.29 0.78 -0.57 0.00 0.00 179.45 180.32 1xu9 h GLY 248 N 0.58 0.66 0.98 3.86 0.00 -1.01 -1.03 103.07 107.12 1xu9 h GLY 248 Ca 0.16 -0.23 -0.03 0.00 0.00 0.00 0.00 47.33 47.23 1xu9 h GLY 248 CO -0.03 0.20 0.20 -1.33 0.00 0.00 0.00 176.54 175.58 1xu9 h GLY 249 N 0.59 0.86 1.20 4.60 0.00 -1.05 -1.47 103.07 107.79 1xu9 h GLY 249 Ca 0.18 -0.48 -0.06 0.00 0.00 0.00 0.00 47.33 46.98 1xu9 h GLY 249 CO -0.07 0.45 0.18 0.00 0.00 0.00 0.00 176.54 177.11 1xu9 h ALA 250 N 1.05 1.10 -0.01 3.60 0.00 -0.77 -2.00 119.26 122.23 1xu9 h ALA 250 Ca 0.17 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1xu9 h ALA 250 Cb 0.22 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1xu9 h ALA 250 CO -0.01 0.61 0.00 1.28 0.00 0.00 0.00 179.25 181.13 1xu9 n LEU 251 N -4.26 0.50 -3.06 0.00 4.77 -0.41 -4.91 117.00 109.62 1xu9 n LEU 251 Ca 0.05 -0.17 -0.22 0.00 -0.03 0.00 0.00 56.01 55.64 1xu9 n LEU 251 Cb 0.23 -0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.36 1xu9 n LEU 251 CO 0.41 0.08 0.04 0.54 -1.33 0.00 0.00 177.39 177.13 1xu9 n ARG 252 N -0.61 -5.35 -2.49 3.23 1.74 -0.75 -0.87 116.66 111.56 1xu9 n ARG 252 Ca 0.22 0.89 -0.36 0.00 -0.77 0.00 0.00 57.85 57.84 1xu9 n ARG 252 Cb 0.19 -5.75 -0.03 0.00 -1.02 0.00 0.00 32.46 25.85 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 -5.78 3.95 0.11 5.56 -0.21 -0.62 -3.99 119.66 118.67 1xu9 s GLN 253 Ca 0.35 1.51 -0.16 0.00 0.02 0.00 0.00 55.36 57.07 1xu9 s GLN 253 Cb -0.15 -2.35 -0.04 0.00 1.00 0.00 0.00 33.01 31.47 1xu9 s GLN 253 CO 0.43 -0.33 1.57 0.93 -2.12 0.00 0.00 175.29 175.77 1xu9 h GLU 254 N 2.06 0.59 -3.99 2.91 5.08 -1.89 -3.35 114.58 115.99 1xu9 h GLU 254 Ca -0.49 -0.17 -0.18 0.00 -1.00 0.00 0.00 59.36 57.52 1xu9 h GLU 254 Cb 1.22 -0.06 -0.22 0.00 0.50 0.00 0.00 28.75 30.20 1xu9 h GLU 254 CO 0.61 0.69 -0.70 -1.21 -1.00 0.00 0.00 179.01 177.39 1xu9 s GLU 255 N -5.09 0.30 -0.07 2.33 2.02 -1.26 -0.84 118.70 116.08 1xu9 s GLU 255 Ca -0.13 -0.57 0.04 0.00 0.02 0.00 0.00 54.97 54.33 1xu9 s GLU 255 Cb 0.09 0.08 -0.00 0.00 0.10 0.00 0.00 34.13 34.40 1xu9 s GLU 255 CO 0.77 -0.04 -0.20 0.08 0.02 0.00 0.00 175.26 175.88 1xu9 s VAL 256 N -1.33 1.73 -0.14 2.63 1.01 -0.40 -4.93 120.40 118.96 1xu9 s VAL 256 Ca -0.14 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 60.99 1xu9 s VAL 256 Cb -0.09 -1.50 -0.00 0.00 0.00 0.00 0.00 36.38 34.79 1xu9 s VAL 256 CO -0.01 0.49 -0.17 -0.31 0.00 0.00 0.00 175.10 175.10 1xu9 s TYR 257 N 0.22 2.75 -0.03 5.22 1.51 -1.26 0.03 117.35 125.78 1xu9 s TYR 257 Ca -0.11 -1.05 0.00 0.00 -1.01 0.00 0.00 57.07 54.90 1xu9 s TYR 257 Cb -0.15 -1.86 0.03 0.00 -0.11 0.00 0.00 41.96 39.87 1xu9 s TYR 257 CO 0.05 -0.46 0.01 -0.47 -1.11 0.00 0.00 175.55 173.57 1xu9 s TYR 258 N 0.72 0.29 0.16 2.71 6.14 -0.76 -4.96 117.35 121.64 1xu9 s TYR 258 Ca -0.07 0.02 -0.23 0.00 0.64 0.00 0.00 57.07 57.42 1xu9 s TYR 258 Cb -0.16 -0.42 0.07 0.00 0.42 0.00 0.00 41.96 41.87 1xu9 s TYR 258 CO 0.01 -0.14 0.66 0.34 0.64 0.00 0.00 175.55 177.07 1xu9 s ASP 259 N 1.15 -0.49 0.52 4.32 -1.08 -1.26 -0.89 116.67 118.95 1xu9 s ASP 259 Ca -0.08 -0.11 0.20 0.00 -0.52 0.00 0.00 52.55 52.04 1xu9 s ASP 259 Cb -0.13 0.59 1.37 0.00 -1.46 0.00 0.00 42.92 43.29 1xu9 s ASP 259 CO -0.02 -0.99 2.14 0.28 0.52 0.00 0.00 175.17 177.11 1xu9 h SER 260 N 2.00 0.00 -3.92 -0.34 0.02 -1.94 -3.43 113.55 105.93 1xu9 h SER 260 Ca -0.30 0.00 -0.69 0.00 -0.84 0.00 0.00 61.79 59.97 1xu9 h SER 260 Cb 1.29 0.00 -0.29 0.00 0.14 0.00 0.00 62.40 63.54 1xu9 h SER 260 CO 0.34 0.04 -0.84 -0.55 -1.14 0.00 0.00 176.83 174.69 1xu9 s SER 261 N -6.77 3.46 0.54 3.07 0.15 -1.26 -5.00 113.70 107.89 1xu9 s SER 261 Ca -0.05 -0.40 0.30 0.00 0.70 0.00 0.00 55.95 56.50 1xu9 s SER 261 Cb 0.16 -0.95 1.51 0.00 -1.71 0.00 0.00 66.02 65.03 1xu9 s SER 261 CO 0.64 0.26 2.08 -0.07 1.20 0.00 0.00 173.24 177.35 1xu9 h LEU 262 N 5.97 0.00 -0.83 3.45 3.38 -1.99 -2.31 115.31 122.98 1xu9 h LEU 262 Ca -0.35 0.00 0.06 0.00 0.09 0.00 0.00 57.88 57.69 1xu9 h LEU 262 Cb 1.17 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.86 1xu9 h LEU 262 CO 0.49 0.10 0.51 -0.50 0.09 0.00 0.00 178.44 179.13 1xu9 h TRP 263 N 0.00 0.93 0.24 1.13 4.06 -1.98 -1.23 115.95 119.10 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 0.35 -0.30 0.00 0.00 -1.00 0.00 0.00 29.16 28.21 1xu9 h TRP 263 CO 0.00 0.46 -0.11 1.15 -3.56 0.00 0.00 178.44 176.38 1xu9 h THR 264 N 0.92 0.76 -0.04 1.49 2.02 -1.84 -2.69 112.91 113.52 1xu9 h THR 264 Ca 0.37 -0.85 -0.10 0.00 0.77 0.00 0.00 66.41 66.60 1xu9 h THR 264 Cb 0.19 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 1xu9 h THR 264 CO -0.18 0.16 -0.45 0.71 0.37 0.00 0.00 175.52 176.14 1xu9 h THR 265 N -0.81 1.32 0.23 3.16 1.35 -1.41 -1.68 112.91 115.08 1xu9 h THR 265 Ca -0.03 -1.56 -0.30 0.00 -0.55 0.00 0.00 66.41 63.96 1xu9 h THR 265 Cb 0.51 1.79 0.04 0.00 -1.73 0.00 0.00 68.15 68.76 1xu9 h THR 265 CO 0.05 0.45 -1.33 -0.07 -0.25 0.00 0.00 175.52 174.38 1xu9 h LEU 266 N 0.07 0.77 0.00 3.87 3.38 -1.35 -3.36 115.31 118.70 1xu9 h LEU 266 Ca 0.00 -0.92 -0.17 0.00 0.09 0.00 0.00 57.88 56.88 1xu9 h LEU 266 Cb 0.82 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.29 1xu9 h LEU 266 CO 0.06 1.64 -0.92 -0.07 0.09 0.00 0.00 178.44 179.25 1xu9 h LEU 267 N 0.03 0.00 -1.31 1.67 3.38 -1.38 -3.29 115.31 114.41 1xu9 h LEU 267 Ca -0.23 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.73 1xu9 h LEU 267 Cb 2.05 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.80 1xu9 h LEU 267 CO 0.25 0.74 -0.05 -0.29 0.09 0.00 0.00 178.44 179.18 1xu9 h ILE 268 N 0.00 0.12 -3.92 1.22 6.09 -1.47 -3.44 117.51 116.11 1xu9 h ILE 268 Ca -0.05 -0.67 -0.53 0.00 -1.37 0.00 0.00 64.86 62.24 1xu9 h ILE 268 Cb 1.61 1.59 0.09 0.00 0.47 0.00 0.00 36.82 40.57 1xu9 h ILE 268 CO 0.09 0.05 0.70 -0.13 -3.07 0.00 0.00 178.15 175.78 1xu9 s ARG 269 N -3.65 4.18 -0.65 2.19 0.52 -1.24 -4.97 118.95 115.33 1xu9 s ARG 269 Ca 0.01 2.37 0.06 0.00 -0.52 0.00 0.00 55.73 57.65 1xu9 s ARG 269 Cb 0.09 -2.97 0.22 0.00 0.52 0.00 0.00 34.95 32.81 1xu9 s ARG 269 CO 0.57 -0.40 0.65 -1.71 0.02 0.00 0.00 175.30 174.44 1xu9 n ASN 270 N 0.54 3.33 0.28 0.23 4.05 -1.26 -4.94 115.26 117.48 1xu9 n ASN 270 Ca 0.01 -3.33 0.12 0.00 0.45 0.00 0.00 54.58 51.83 1xu9 n ASN 270 Cb 0.41 -0.70 0.77 0.00 1.23 0.00 0.00 39.78 41.50 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 4.59 0.00 -0.59 1.20 0.13 -1.98 -2.39 132.00 132.96 1xu9 h PRO 271 Ca 0.18 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.30 1xu9 h PRO 271 Cb 0.70 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.80 1xu9 h PRO 271 CO 0.78 0.02 0.32 0.77 -0.23 0.00 0.00 178.00 179.66 1xu9 h SER 272 N 0.00 0.72 -0.28 1.44 0.02 -1.99 -1.96 113.55 111.50 1xu9 h SER 272 Ca -0.00 -0.05 0.03 0.00 -0.84 0.00 0.00 61.79 60.93 1xu9 h SER 272 Cb 0.04 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.37 1xu9 h SER 272 CO 0.00 0.58 0.08 -0.09 -1.14 0.00 0.00 176.83 176.27 1xu9 h ARG 273 N 0.82 0.19 -0.43 3.45 2.43 -1.86 -0.78 114.38 118.19 1xu9 h ARG 273 Ca 0.21 -0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 59.29 1xu9 h ARG 273 Cb 0.02 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.51 1xu9 h ARG 273 CO -0.03 0.13 -0.05 0.87 -1.51 0.00 0.00 179.97 179.38 1xu9 h LYS 274 N 0.20 0.72 -0.22 0.20 1.79 -1.55 -0.94 116.57 116.77 1xu9 h LYS 274 Ca 0.12 -0.21 -0.02 0.00 -2.18 0.00 0.00 60.65 58.37 1xu9 h LYS 274 Cb 0.11 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 30.67 1xu9 h LYS 274 CO -0.14 0.77 0.05 0.82 -1.08 0.00 0.00 179.45 179.87 1xu9 h ILE 275 N 0.67 1.21 -0.56 1.86 2.04 -1.13 -1.94 117.51 119.67 1xu9 h ILE 275 Ca 0.13 -0.70 -0.05 0.00 1.00 0.00 0.00 64.86 65.24 1xu9 h ILE 275 Cb 0.49 1.25 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 1xu9 h ILE 275 CO 0.03 0.22 0.17 -0.07 0.00 0.00 0.00 178.15 178.49 1xu9 h LEU 276 N 0.18 0.81 -0.66 1.44 3.38 -0.85 -0.38 115.31 119.23 1xu9 h LEU 276 Ca 0.07 -0.21 0.09 0.00 0.09 0.00 0.00 57.88 57.92 1xu9 h LEU 276 Cb 0.29 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 40.76 1xu9 h LEU 276 CO 0.00 0.81 0.30 -0.33 0.09 0.00 0.00 178.44 179.31 1xu9 h GLU 277 N 0.78 0.51 -0.16 1.13 5.08 -1.11 0.35 114.58 121.16 1xu9 h GLU 277 Ca 0.18 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 1xu9 h GLU 277 Cb 0.29 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 1xu9 h GLU 277 CO -0.00 0.34 0.02 0.35 -1.00 0.00 0.00 179.01 178.72 1xu9 h PHE 278 N 0.53 0.29 -0.47 4.33 3.57 -0.93 -2.54 116.94 121.72 1xu9 h PHE 278 Ca 0.32 -0.04 -0.07 0.00 3.53 0.00 0.00 57.97 61.72 1xu9 h PHE 278 Cb 0.35 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.99 1xu9 h PHE 278 CO -0.13 0.44 0.02 -0.07 -2.23 0.00 0.00 178.31 176.34 1xu9 h LEU 279 N 0.06 0.73 -0.81 0.59 3.38 -0.65 -2.42 115.31 116.19 1xu9 h LEU 279 Ca 0.05 -0.17 -0.12 0.00 0.09 0.00 0.00 57.88 57.73 1xu9 h LEU 279 Cb 0.31 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1xu9 h LEU 279 CO 0.00 0.79 -0.42 1.88 0.09 0.00 0.00 178.44 180.79 1xu9 h TYR 280 N 0.72 0.45 0.00 1.13 0.99 -0.92 -3.51 116.97 115.84 1xu9 h TYR 280 Ca 0.14 -0.13 0.00 0.00 2.00 0.00 0.00 58.73 60.75 1xu9 h TYR 280 Cb 0.42 -0.10 0.00 0.00 1.00 0.00 0.00 36.73 38.05 1xu9 h TYR 280 CO 0.02 0.74 0.00 -1.13 -0.00 0.00 0.00 178.16 177.79