#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xu9 s PRO 22 N 0.00 4.00 0.20 -1.09 0.04 -1.25 -4.92 135.00 131.98 1xu9 s PRO 22 Ca 0.00 1.22 -0.30 0.00 0.04 0.00 0.00 61.00 61.95 1xu9 s PRO 22 Cb 0.00 -2.14 -0.09 0.00 0.04 0.00 0.00 34.50 32.31 1xu9 s PRO 22 CO 0.00 -0.24 1.38 -0.51 0.04 0.00 0.00 177.00 177.67 1xu9 s LEU 23 N -3.41 4.40 -0.37 -3.56 1.43 -0.42 -4.92 118.68 111.84 1xu9 s LEU 23 Ca 0.64 2.49 -0.02 0.00 -1.03 0.00 0.00 54.13 56.21 1xu9 s LEU 23 Cb -0.12 -3.61 0.17 0.00 0.03 0.00 0.00 46.19 42.65 1xu9 s LEU 23 CO 0.18 -0.62 2.29 0.59 0.23 0.00 0.00 176.35 179.02 1xu9 n ASN 24 N 2.84 6.50 -4.32 2.29 3.02 -1.26 -4.89 115.26 119.44 1xu9 n ASN 24 Ca 0.08 -3.13 -0.17 0.00 -0.03 0.00 0.00 54.58 51.32 1xu9 n ASN 24 Cb 0.42 -1.12 -0.10 0.00 -0.61 0.00 0.00 39.78 38.37 1xu9 n ASN 24 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1xu9 s GLU 25 N -1.82 1.27 0.41 3.52 2.02 -1.26 -5.14 118.70 117.71 1xu9 s GLU 25 Ca 0.42 -1.56 -0.24 0.00 0.02 0.00 0.00 54.97 53.61 1xu9 s GLU 25 Cb 0.30 -1.00 -0.08 0.00 0.10 0.00 0.00 34.13 33.44 1xu9 s GLU 25 CO -0.08 0.16 1.11 -2.00 0.02 0.00 0.00 175.26 174.47 1xu9 s GLU 26 N -3.67 4.03 0.35 1.61 2.12 -1.26 -5.00 118.70 116.87 1xu9 s GLU 26 Ca 0.21 1.67 -0.28 0.00 0.36 0.00 0.00 54.97 56.93 1xu9 s GLU 26 Cb 0.00 -2.55 -0.11 0.00 0.26 0.00 0.00 34.13 31.74 1xu9 s GLU 26 CO 0.05 -0.29 1.37 0.12 -0.54 0.00 0.00 175.26 175.97 1xu9 s PHE 27 N -1.56 2.90 -0.03 5.30 5.36 -1.26 -5.04 117.98 123.66 1xu9 s PHE 27 Ca 0.59 1.33 0.03 0.00 -0.96 0.00 0.00 56.93 57.92 1xu9 s PHE 27 Cb -0.26 -3.79 0.00 0.00 -0.34 0.00 0.00 43.02 38.63 1xu9 s PHE 27 CO 0.32 -2.23 -0.10 1.03 -1.46 0.00 0.00 175.22 172.78 1xu9 s ARG 28 N -1.88 1.04 0.58 10.12 0.52 -1.26 -5.04 118.95 123.03 1xu9 s ARG 28 Ca 0.50 -0.35 0.28 0.00 -0.52 0.00 0.00 55.73 55.64 1xu9 s ARG 28 Cb -0.42 -0.97 1.66 0.00 0.52 0.00 0.00 34.95 35.74 1xu9 s ARG 28 CO 0.56 0.14 2.14 -1.00 0.02 0.00 0.00 175.30 177.16 1xu9 h PRO 29 N 6.32 0.00 0.00 3.54 0.13 -1.98 -1.25 132.00 138.75 1xu9 h PRO 29 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 1xu9 h PRO 29 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1xu9 h PRO 29 CO 0.49 0.00 0.00 0.93 -0.23 0.00 0.00 178.00 179.19 1xu9 h GLU 30 N 0.00 0.00 0.00 0.86 3.07 -1.96 -2.25 114.58 114.30 1xu9 h GLU 30 Ca 0.06 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.92 1xu9 h GLU 30 Cb 0.35 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.26 1xu9 h GLU 30 CO -0.00 0.00 -0.01 0.52 -1.40 0.00 0.00 179.01 178.12 1xu9 h MET 31 N 0.00 0.00 -0.01 2.33 2.86 -1.61 -2.50 114.93 116.00 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 0.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.79 1xu9 h MET 31 CO 0.00 0.01 -0.50 1.28 1.06 0.00 0.00 176.91 178.76 1xu9 n LEU 32 N -3.26 1.47 -4.68 1.22 7.99 -0.84 -4.86 117.00 114.04 1xu9 n LEU 32 Ca -0.03 -0.69 -0.42 0.00 -0.01 0.00 0.00 56.01 54.86 1xu9 n LEU 32 Cb 0.11 0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 43.39 1xu9 n LEU 32 CO 0.23 0.29 1.52 1.67 -1.51 0.00 0.00 177.39 179.59 1xu9 n GLN 33 N -0.47 2.81 -0.89 3.23 7.27 -0.94 -1.59 117.38 126.79 1xu9 n GLN 33 Ca 0.06 1.02 0.00 0.00 0.07 0.00 0.00 57.00 58.16 1xu9 n GLN 33 Cb 0.34 -2.94 0.00 0.00 2.41 0.00 0.00 30.24 30.06 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 4.34 0.59 3.82 1.69 0.00 -0.47 -4.91 105.19 110.24 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 3.82 -0.31 1.61 -0.14 -0.62 -4.65 119.74 119.05 1xu9 s LYS 35 Ca 0.00 1.13 -0.08 0.00 -1.36 0.00 0.00 55.97 55.67 1xu9 s LYS 35 Cb 0.00 -2.11 0.01 0.00 -1.68 0.00 0.00 37.83 34.05 1xu9 s LYS 35 CO 0.00 -0.39 0.10 0.15 -0.76 0.00 0.00 175.35 174.45 1xu9 s LYS 36 N -3.72 3.06 -0.04 1.68 1.02 -1.26 -0.36 119.74 120.11 1xu9 s LYS 36 Ca 0.62 -0.89 0.02 0.00 0.02 0.00 0.00 55.97 55.75 1xu9 s LYS 36 Cb -0.13 -3.44 0.01 0.00 -0.52 0.00 0.00 37.83 33.76 1xu9 s LYS 36 CO 0.27 -0.48 -0.09 0.08 -0.92 0.00 0.00 175.35 174.21 1xu9 s VAL 37 N 1.51 0.82 -0.13 3.17 1.01 -0.16 -0.42 120.40 126.20 1xu9 s VAL 37 Ca 0.02 -0.32 -0.11 0.00 0.00 0.00 0.00 61.98 61.57 1xu9 s VAL 37 Cb -0.18 -0.76 -0.05 0.00 0.00 0.00 0.00 36.38 35.39 1xu9 s VAL 37 CO 0.03 0.27 0.24 -0.63 0.00 0.00 0.00 175.10 175.02 1xu9 s ILE 38 N 0.58 5.33 -0.13 2.22 1.01 -0.59 -1.45 121.20 128.17 1xu9 s ILE 38 Ca -0.10 0.44 0.01 0.00 0.00 0.00 0.00 60.65 61.00 1xu9 s ILE 38 Cb -0.13 -3.55 0.02 0.00 0.01 0.00 0.00 42.46 38.81 1xu9 s ILE 38 CO 0.01 0.50 -0.14 -0.69 0.00 0.00 0.00 174.94 174.63 1xu9 s VAL 39 N -0.28 1.47 0.39 2.92 1.01 -0.63 -0.96 120.40 124.33 1xu9 s VAL 39 Ca 0.16 -0.59 0.01 0.00 0.00 0.00 0.00 61.98 61.56 1xu9 s VAL 39 Cb -0.13 -1.38 -0.02 0.00 0.00 0.00 0.00 36.38 34.86 1xu9 s VAL 39 CO 0.05 0.44 0.60 0.42 0.00 0.00 0.00 175.10 176.60 1xu9 s THR 40 N 1.35 4.46 -1.39 3.92 -4.23 -0.71 -2.15 115.64 116.88 1xu9 s THR 40 Ca 0.01 -0.54 -0.05 0.00 -1.18 0.00 0.00 61.69 59.93 1xu9 s THR 40 Cb -0.13 -3.63 0.03 0.00 1.34 0.00 0.00 72.50 70.11 1xu9 s THR 40 CO -0.07 -0.41 0.78 0.61 -0.54 0.00 0.00 174.62 174.99 1xu9 n GLY 41 N -1.91 -0.35 0.81 3.99 0.00 -0.70 -3.84 105.19 103.19 1xu9 n GLY 41 Ca -0.01 0.15 0.07 0.00 0.00 0.00 0.00 46.02 46.23 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 -4.42 2.66 0.28 4.61 0.00 -0.55 -3.82 120.51 119.26 1xu9 n ALA 42 Ca -0.19 -1.79 0.12 0.00 0.00 0.00 0.00 53.44 51.58 1xu9 n ALA 42 Cb 0.63 -0.61 0.12 0.00 0.00 0.00 0.00 19.45 19.60 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 1.98 0.00 -2.89 0.00 4.64 -1.89 -3.22 113.55 112.17 1xu9 h SER 43 Ca 0.00 -0.04 -0.04 0.00 -0.47 0.00 0.00 61.79 61.24 1xu9 h SER 43 Cb 1.15 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.25 1xu9 h SER 43 CO 0.13 0.02 0.25 2.29 -0.87 0.00 0.00 176.83 178.65 1xu9 n LYS 44 N -2.68 1.05 0.00 4.77 2.85 -1.26 -4.79 118.16 118.11 1xu9 n LYS 44 Ca 0.02 -2.11 0.00 0.00 -1.05 0.00 0.00 58.31 55.18 1xu9 n LYS 44 Cb 0.51 2.61 0.00 0.00 -0.65 0.00 0.00 35.03 37.50 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 -0.50 1.21 0.31 2.58 0.00 -1.26 -2.08 105.19 105.45 1xu9 n GLY 45 Ca -0.08 -0.63 -0.04 0.00 0.00 0.00 0.00 46.02 45.27 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 -0.59 -0.61 2.04 -1.89 -2.64 117.51 115.06 1xu9 h ILE 46 Ca 0.00 -0.86 0.02 0.00 1.00 0.00 0.00 64.86 65.02 1xu9 h ILE 46 Cb 0.00 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 36.64 1xu9 h ILE 46 CO 0.00 0.33 0.37 1.23 0.00 0.00 0.00 178.15 180.08 1xu9 h GLY 47 N 1.03 0.84 0.99 5.37 0.00 -1.65 0.52 103.07 110.17 1xu9 h GLY 47 Ca 0.20 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.24 1xu9 h GLY 47 CO -0.00 0.26 0.29 -0.09 0.00 0.00 0.00 176.54 177.00 1xu9 h ARG 48 N 0.75 0.62 -0.52 4.80 2.43 -1.23 -1.50 114.38 119.73 1xu9 h ARG 48 Ca 0.23 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.33 1xu9 h ARG 48 Cb -0.02 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.37 1xu9 h ARG 48 CO -0.08 0.44 0.24 0.93 -1.51 0.00 0.00 179.97 179.98 1xu9 h GLU 49 N 0.62 0.74 -0.38 0.20 4.39 -1.07 -1.23 114.58 117.86 1xu9 h GLU 49 Ca 0.17 -0.09 -0.04 0.00 0.34 0.00 0.00 59.36 59.73 1xu9 h GLU 49 Cb -0.03 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.46 1xu9 h GLU 49 CO -0.03 0.59 0.08 0.52 -1.16 0.00 0.00 179.01 179.00 1xu9 h MET 50 N 0.74 0.61 -0.87 2.33 2.86 -0.44 -1.27 114.93 118.90 1xu9 h MET 50 Ca 0.18 -0.16 0.03 0.00 -2.06 0.00 0.00 59.70 57.70 1xu9 h MET 50 Cb 0.10 -0.08 -0.05 0.00 0.06 0.00 0.00 31.60 31.64 1xu9 h MET 50 CO -0.02 0.66 0.56 0.00 1.06 0.00 0.00 176.91 179.17 1xu9 h ALA 51 N 0.93 1.14 -0.40 6.32 0.00 -0.81 -1.06 119.26 125.37 1xu9 h ALA 51 Ca 0.12 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 1xu9 h ALA 51 Cb 0.33 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1xu9 h ALA 51 CO 0.00 0.41 0.03 1.88 0.00 0.00 0.00 179.25 181.58 1xu9 h TYR 52 N 1.09 0.74 -0.40 0.00 0.05 -1.00 -0.77 116.97 116.69 1xu9 h TYR 52 Ca 0.34 -0.12 -0.00 0.00 0.05 0.00 0.00 58.73 59.00 1xu9 h TYR 52 Cb -0.01 -0.20 -0.02 0.00 1.01 0.00 0.00 36.73 37.52 1xu9 h TYR 52 CO -0.02 0.74 0.24 0.45 -1.05 0.00 0.00 178.16 178.52 1xu9 h HIS 53 N 0.52 0.52 -0.80 4.88 3.86 -0.90 -1.23 115.15 122.00 1xu9 h HIS 53 Ca 0.12 -0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.32 1xu9 h HIS 53 Cb 0.43 -0.17 -0.04 0.00 1.06 0.00 0.00 27.41 28.69 1xu9 h HIS 53 CO 0.03 0.37 0.47 -0.07 0.86 0.00 0.00 177.93 179.59 1xu9 h LEU 54 N 0.52 0.97 -0.22 2.43 3.38 -1.01 -1.46 115.31 119.92 1xu9 h LEU 54 Ca 0.14 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 1xu9 h LEU 54 Cb -0.00 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1xu9 h LEU 54 CO -0.03 0.75 0.03 0.00 0.09 0.00 0.00 178.44 179.29 1xu9 h ALA 55 N 1.41 0.29 -0.32 1.53 0.00 -0.87 -1.15 119.26 120.15 1xu9 h ALA 55 Ca 0.29 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1xu9 h ALA 55 Cb -0.03 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1xu9 h ALA 55 CO -0.05 -0.03 0.22 0.87 0.00 0.00 0.00 179.25 180.25 1xu9 h LYS 56 N 0.16 0.31 -0.00 0.00 1.57 -0.86 -1.16 116.57 116.58 1xu9 h LYS 56 Ca 0.07 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1xu9 h LYS 56 Cb 0.33 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.57 1xu9 h LYS 56 CO 0.00 0.20 -0.03 -1.33 -0.57 0.00 0.00 179.45 177.73 1xu9 n MET 57 N -4.49 0.74 -1.83 3.15 2.81 -0.58 -4.91 117.12 112.01 1xu9 n MET 57 Ca 0.03 -0.11 -0.02 0.00 -1.81 0.00 0.00 57.70 55.79 1xu9 n MET 57 Cb 0.16 -1.50 -0.00 0.00 -0.71 0.00 0.00 33.22 31.17 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 1.19 0.34 3.83 3.03 0.00 -0.48 -3.43 105.19 109.67 1xu9 n GLY 58 Ca 0.18 -0.85 -0.31 0.00 0.00 0.00 0.00 46.02 45.04 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 -2.09 2.76 -0.08 4.61 0.00 -0.48 -1.37 121.76 125.11 1xu9 s ALA 59 Ca 0.00 -0.01 -0.24 0.00 0.00 0.00 0.00 51.96 51.71 1xu9 s ALA 59 Cb 0.00 -3.14 -0.03 0.00 0.00 0.00 0.00 23.12 19.95 1xu9 s ALA 59 CO 0.00 -1.13 0.73 -1.01 0.00 0.00 0.00 175.76 174.35 1xu9 s HIS 60 N -3.11 3.56 -0.03 0.00 3.76 0.51 -1.13 115.29 118.86 1xu9 s HIS 60 Ca 0.58 1.27 0.05 0.00 -0.15 0.00 0.00 55.06 56.81 1xu9 s HIS 60 Cb -0.13 -2.85 -0.01 0.00 1.11 0.00 0.00 32.58 30.70 1xu9 s HIS 60 CO 0.55 0.04 -0.17 0.14 -0.85 0.00 0.00 174.74 174.45 1xu9 s VAL 61 N 1.00 1.34 -0.16 -0.90 -7.23 -0.62 -0.99 120.40 112.84 1xu9 s VAL 61 Ca 0.38 -0.70 0.02 0.00 -1.81 0.00 0.00 61.98 59.87 1xu9 s VAL 61 Cb -0.18 -1.13 0.01 0.00 0.56 0.00 0.00 36.38 35.64 1xu9 s VAL 61 CO 0.18 0.38 -0.21 -0.69 -0.31 0.00 0.00 175.10 174.46 1xu9 s VAL 62 N -0.19 2.02 0.15 1.32 1.01 -0.53 -1.90 120.40 122.28 1xu9 s VAL 62 Ca 0.02 -0.94 0.05 0.00 0.00 0.00 0.00 61.98 61.11 1xu9 s VAL 62 Cb -0.09 -1.81 -0.04 0.00 0.00 0.00 0.00 36.38 34.45 1xu9 s VAL 62 CO 0.01 0.54 0.07 0.68 0.00 0.00 0.00 175.10 176.39 1xu9 s VAL 63 N 1.04 4.20 0.08 2.92 -7.23 -0.28 -1.60 120.40 119.53 1xu9 s VAL 63 Ca -0.02 -1.13 -0.07 0.00 -1.81 0.00 0.00 61.98 58.95 1xu9 s VAL 63 Cb -0.14 -3.10 -0.01 0.00 0.56 0.00 0.00 36.38 33.69 1xu9 s VAL 63 CO -0.07 -0.05 0.14 0.28 -0.31 0.00 0.00 175.10 175.09 1xu9 s THR 64 N -1.64 0.16 0.00 5.32 -1.32 -0.91 -1.96 115.64 115.28 1xu9 s THR 64 Ca 0.29 -1.33 0.00 0.00 -1.21 0.00 0.00 61.69 59.44 1xu9 s THR 64 Cb -0.10 -1.40 0.00 0.00 -1.51 0.00 0.00 72.50 69.49 1xu9 s THR 64 CO 0.21 -0.72 0.00 0.00 -2.21 0.00 0.00 174.62 171.90 1xu9 n ALA 65 N -0.03 0.00 0.07 11.08 0.00 -1.26 -1.48 120.51 128.90 1xu9 n ALA 65 Ca -0.15 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.19 1xu9 n ALA 65 Cb 0.62 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.07 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 0.31 -5.30 0.00 3.08 -1.92 -1.61 114.38 108.94 1xu9 h ARG 66 Ca 0.00 -0.31 -0.66 0.00 0.07 0.00 0.00 59.98 59.08 1xu9 h ARG 66 Cb 0.00 0.08 -0.16 0.00 0.08 0.00 0.00 29.97 29.98 1xu9 h ARG 66 CO 0.00 1.00 0.04 -1.12 -1.07 0.00 0.00 179.97 178.82 1xu9 s SER 67 N -6.99 6.31 0.38 7.04 0.01 -1.26 -4.26 113.70 114.93 1xu9 s SER 67 Ca -0.04 -0.28 0.06 0.00 1.31 0.00 0.00 55.95 57.00 1xu9 s SER 67 Cb 0.10 -2.30 0.74 0.00 0.21 0.00 0.00 66.02 64.78 1xu9 s SER 67 CO 0.84 -0.67 1.97 0.07 0.41 0.00 0.00 173.24 175.85 1xu9 h LYS 68 N 8.73 0.50 -0.31 12.44 2.10 -1.97 -2.31 116.57 135.74 1xu9 h LYS 68 Ca -0.26 -0.07 -0.05 0.00 -2.00 0.00 0.00 60.65 58.27 1xu9 h LYS 68 Cb 1.10 -0.09 -0.01 0.00 -0.90 0.00 0.00 32.23 32.33 1xu9 h LYS 68 CO 0.85 0.44 0.00 0.93 -2.00 0.00 0.00 179.45 179.67 1xu9 h GLU 69 N 0.49 0.55 -0.09 0.07 3.07 -2.00 -0.25 114.58 116.43 1xu9 h GLU 69 Ca 0.12 -0.18 -0.19 0.00 -0.50 0.00 0.00 59.36 58.62 1xu9 h GLU 69 Cb 0.15 -0.05 -0.00 0.00 -0.84 0.00 0.00 28.75 28.01 1xu9 h GLU 69 CO -0.01 0.69 -0.73 1.79 -1.40 0.00 0.00 179.01 179.35 1xu9 h THR 70 N 0.35 1.37 -0.47 1.13 1.35 -1.92 -3.13 112.91 111.59 1xu9 h THR 70 Ca 0.09 -2.11 -0.05 0.00 -0.55 0.00 0.00 66.41 63.79 1xu9 h THR 70 Cb 0.44 2.09 -0.02 0.00 -1.73 0.00 0.00 68.15 68.93 1xu9 h THR 70 CO 0.02 0.64 0.09 -0.07 -0.25 0.00 0.00 175.52 175.94 1xu9 h LEU 71 N 0.30 0.68 -0.88 3.87 3.38 -1.26 -2.51 115.31 118.89 1xu9 h LEU 71 Ca -0.03 -0.12 0.06 0.00 0.09 0.00 0.00 57.88 57.88 1xu9 h LEU 71 Cb 1.31 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 41.82 1xu9 h LEU 71 CO 0.13 0.69 0.55 1.56 0.09 0.00 0.00 178.44 181.46 1xu9 h GLN 72 N 0.70 0.97 -0.42 1.13 4.20 -0.99 -0.78 115.11 119.92 1xu9 h GLN 72 Ca 0.15 -0.06 -0.12 0.00 0.06 0.00 0.00 58.65 58.68 1xu9 h GLN 72 Cb 0.30 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 1xu9 h GLN 72 CO 0.00 0.64 -0.22 0.87 -0.67 0.00 0.00 178.83 179.45 1xu9 h LYS 73 N 1.00 0.84 -0.35 1.46 1.57 -1.45 -1.50 116.57 118.15 1xu9 h LYS 73 Ca 0.38 -0.35 -0.04 0.00 -1.87 0.00 0.00 60.65 58.77 1xu9 h LYS 73 Cb 0.17 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1xu9 h LYS 73 CO -0.17 0.98 0.06 0.28 -0.57 0.00 0.00 179.45 180.03 1xu9 h VAL 74 N 0.73 1.24 -0.35 0.50 2.07 -1.06 -2.00 116.25 117.38 1xu9 h VAL 74 Ca 0.10 -0.84 -0.01 0.00 0.82 0.00 0.00 66.70 66.76 1xu9 h VAL 74 Cb 0.76 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.62 1xu9 h VAL 74 CO 0.06 0.28 0.16 0.58 0.02 0.00 0.00 177.57 178.67 1xu9 h VAL 75 N 0.42 1.17 -0.63 2.57 2.07 -0.99 0.18 116.25 121.04 1xu9 h VAL 75 Ca 0.11 -0.49 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 1xu9 h VAL 75 Cb 0.36 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 1xu9 h VAL 75 CO 0.01 0.18 0.37 0.77 0.02 0.00 0.00 177.57 178.92 1xu9 h SER 76 N 0.42 0.77 -0.14 0.57 4.64 -1.19 -1.61 113.55 117.02 1xu9 h SER 76 Ca 0.12 -0.07 -0.11 0.00 -0.47 0.00 0.00 61.79 61.26 1xu9 h SER 76 Cb 0.13 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.02 1xu9 h SER 76 CO -0.01 0.61 -0.26 -0.74 -0.87 0.00 0.00 176.83 175.56 1xu9 h HIS 77 N 0.86 0.67 -0.75 4.77 6.17 -1.15 -2.33 115.15 123.39 1xu9 h HIS 77 Ca 0.23 -0.15 0.02 0.00 0.71 0.00 0.00 60.37 61.17 1xu9 h HIS 77 Cb -0.00 -0.16 -0.04 0.00 2.52 0.00 0.00 27.41 29.72 1xu9 h HIS 77 CO -0.02 0.80 0.49 0.00 0.71 0.00 0.00 177.93 179.91 1xu9 h LEU 79 N 0.98 0.76 -1.36 0.00 3.38 -1.09 -2.33 115.31 115.65 1xu9 h LEU 79 Ca 0.29 -0.22 0.01 0.00 0.09 0.00 0.00 57.88 58.04 1xu9 h LEU 79 Cb -0.06 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.45 1xu9 h LEU 79 CO -0.08 0.78 0.43 -0.33 0.09 0.00 0.00 178.44 179.33 1xu9 h GLU 80 N 0.70 0.85 0.00 1.13 5.08 -0.98 -2.24 114.58 119.13 1xu9 h GLU 80 Ca 0.16 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1xu9 h GLU 80 Cb 0.31 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1xu9 h GLU 80 CO -0.00 0.56 0.00 1.28 -1.00 0.00 0.00 179.01 179.85 1xu9 n LEU 81 N -4.44 0.58 0.00 1.33 4.77 -0.49 -4.91 117.00 113.85 1xu9 n LEU 81 Ca 0.07 0.58 0.00 0.00 -0.03 0.00 0.00 56.01 56.63 1xu9 n LEU 81 Cb 0.05 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 1xu9 n LEU 81 CO 0.36 -0.26 0.00 0.61 -1.33 0.00 0.00 177.39 176.77 1xu9 n GLY 82 N 0.88 1.58 3.71 -0.72 0.00 -0.84 -4.03 105.19 105.77 1xu9 n GLY 82 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.98 1.37 -0.32 4.61 0.00 -0.91 -4.17 120.51 120.10 1xu9 n ALA 83 Ca 0.00 0.31 -0.02 0.00 0.00 0.00 0.00 53.44 53.73 1xu9 n ALA 83 Cb 0.00 -2.27 0.10 0.00 0.00 0.00 0.00 19.45 17.28 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 2.34 1.14 -2.89 0.00 0.00 -1.23 -3.45 119.26 115.17 1xu9 h ALA 84 Ca -0.47 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.36 1xu9 h ALA 84 Cb 1.29 -0.33 -0.12 0.00 0.00 0.00 0.00 17.79 18.63 1xu9 h ALA 84 CO 0.61 0.47 0.07 -1.54 0.00 0.00 0.00 179.25 178.87 1xu9 s SER 85 N -5.96 -0.37 -0.17 0.00 1.04 -1.24 -4.95 113.70 102.06 1xu9 s SER 85 Ca -0.13 -0.25 -0.11 0.00 0.48 0.00 0.00 55.95 55.94 1xu9 s SER 85 Cb 0.17 0.56 0.06 0.00 0.10 0.00 0.00 66.02 66.90 1xu9 s SER 85 CO 0.80 -0.97 0.43 0.00 0.98 0.00 0.00 173.24 174.48 1xu9 s ALA 86 N -3.81 -1.09 0.06 5.32 0.00 -1.26 -1.59 121.76 119.39 1xu9 s ALA 86 Ca 0.04 1.49 -0.11 0.00 0.00 0.00 0.00 51.96 53.38 1xu9 s ALA 86 Cb -0.00 -0.89 0.01 0.00 0.00 0.00 0.00 23.12 22.23 1xu9 s ALA 86 CO -0.09 -0.25 0.23 -1.01 0.00 0.00 0.00 175.76 174.64 1xu9 s HIS 87 N 1.08 0.03 0.20 0.00 3.76 -0.80 -4.99 115.29 114.57 1xu9 s HIS 87 Ca -0.07 -0.29 0.11 0.00 -0.15 0.00 0.00 55.06 54.66 1xu9 s HIS 87 Cb -0.07 0.01 -0.04 0.00 1.11 0.00 0.00 32.58 33.59 1xu9 s HIS 87 CO -0.09 -0.50 -0.23 1.52 -0.85 0.00 0.00 174.74 174.58 1xu9 s TYR 88 N -3.02 2.28 -0.07 1.40 -0.85 -1.26 -1.12 117.35 114.70 1xu9 s TYR 88 Ca -0.02 -0.36 -0.01 0.00 -0.52 0.00 0.00 57.07 56.17 1xu9 s TYR 88 Cb 0.01 -1.11 0.03 0.00 0.38 0.00 0.00 41.96 41.27 1xu9 s TYR 88 CO -0.06 0.52 -0.01 0.42 -1.52 0.00 0.00 175.55 174.90 1xu9 s ILE 89 N -1.80 0.46 -0.01 -3.49 1.01 -0.83 -4.95 121.20 111.60 1xu9 s ILE 89 Ca 0.22 0.05 -0.10 0.00 0.00 0.00 0.00 60.65 60.82 1xu9 s ILE 89 Cb -0.07 -0.59 -0.05 0.00 0.01 0.00 0.00 42.46 41.76 1xu9 s ILE 89 CO 0.10 0.27 0.31 0.00 0.00 0.00 0.00 174.94 175.62 1xu9 s ALA 90 N 1.80 3.78 0.00 9.38 0.00 -1.26 -4.11 121.76 131.35 1xu9 s ALA 90 Ca 0.03 -0.44 0.00 0.00 0.00 0.00 0.00 51.96 51.55 1xu9 s ALA 90 Cb -0.13 -2.19 0.00 0.00 0.00 0.00 0.00 23.12 20.81 1xu9 s ALA 90 CO -0.05 0.57 0.00 0.41 0.00 0.00 0.00 175.76 176.70 1xu9 n GLY 91 N 1.47 0.70 3.76 0.00 0.00 -0.60 -4.99 105.19 105.53 1xu9 n GLY 91 Ca -0.13 -0.91 -0.36 0.00 0.00 0.00 0.00 46.02 44.62 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 5.26 -2.01 2.61 -1.32 -1.26 -3.27 115.64 113.65 1xu9 s THR 92 Ca 0.00 0.13 0.11 0.00 -1.21 0.00 0.00 61.69 60.71 1xu9 s THR 92 Cb 0.00 -3.35 0.30 0.00 -1.51 0.00 0.00 72.50 67.94 1xu9 s THR 92 CO 0.00 0.52 1.39 0.23 -2.21 0.00 0.00 174.62 174.55 1xu9 n MET 93 N 2.89 1.05 0.23 7.08 0.00 -1.26 -1.95 117.12 125.16 1xu9 n MET 93 Ca -0.18 -0.08 0.11 0.00 0.00 0.00 0.00 57.70 57.55 1xu9 n MET 93 Cb 0.53 -1.17 0.54 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 0.15 0.00 -4.32 0.03 5.08 -1.93 -3.41 114.58 110.18 1xu9 h GLU 94 Ca 0.00 0.00 -0.74 0.00 -1.00 0.00 0.00 59.36 57.62 1xu9 h GLU 94 Cb 0.03 0.00 -0.23 0.00 0.50 0.00 0.00 28.75 29.05 1xu9 h GLU 94 CO 0.00 0.20 -0.35 0.34 -1.00 0.00 0.00 179.01 178.20 1xu9 s ASP 95 N -6.18 6.09 0.45 1.42 -1.08 -0.82 -4.95 116.67 111.60 1xu9 s ASP 95 Ca -0.01 -1.35 0.20 0.00 -0.52 0.00 0.00 52.55 50.88 1xu9 s ASP 95 Cb 0.11 -2.16 1.05 0.00 -1.46 0.00 0.00 42.92 40.46 1xu9 s ASP 95 CO 0.62 -0.63 1.94 0.24 0.52 0.00 0.00 175.17 177.85 1xu9 h MET 96 N 8.72 0.00 -0.40 4.34 2.86 -1.85 -2.07 114.93 126.52 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 1.11 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.75 1xu9 h MET 96 CO 0.86 0.24 -0.05 1.15 1.06 0.00 0.00 176.91 180.17 1xu9 h THR 97 N 0.00 1.27 -0.38 2.22 2.02 -1.95 -1.96 112.91 114.13 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 0.52 1.17 -0.04 0.00 -1.74 0.00 0.00 68.15 68.06 1xu9 h THR 97 CO 0.03 0.37 0.17 0.15 0.37 0.00 0.00 175.52 176.62 1xu9 h PHE 98 N 0.56 0.32 -0.33 3.16 3.57 -1.73 -1.28 116.94 121.22 1xu9 h PHE 98 Ca 0.11 0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.69 1xu9 h PHE 98 Cb 0.55 -0.09 -0.06 0.00 2.79 0.00 0.00 35.95 39.15 1xu9 h PHE 98 CO 0.04 0.15 -0.04 0.00 -2.23 0.00 0.00 178.31 176.24 1xu9 h ALA 99 N 1.22 0.26 -0.35 2.41 0.00 -1.20 0.26 119.26 121.85 1xu9 h ALA 99 Ca 0.17 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 1xu9 h ALA 99 Cb 0.10 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1xu9 h ALA 99 CO -0.14 -0.44 0.17 1.49 0.00 0.00 0.00 179.25 180.34 1xu9 h GLU 100 N 0.04 0.51 -0.11 0.00 4.81 -1.21 -2.87 114.58 115.75 1xu9 h GLU 100 Ca 0.16 -0.08 -0.15 0.00 -0.13 0.00 0.00 59.36 59.16 1xu9 h GLU 100 Cb 0.23 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 1xu9 h GLU 100 CO -0.30 0.46 -0.58 1.96 -0.73 0.00 0.00 179.01 179.82 1xu9 h GLN 101 N 0.43 0.34 -0.03 1.92 4.20 -0.79 -2.96 115.11 118.21 1xu9 h GLN 101 Ca 0.12 -0.22 0.01 0.00 0.06 0.00 0.00 58.65 58.62 1xu9 h GLN 101 Cb 0.12 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 1xu9 h GLN 101 CO -0.02 0.82 -0.03 0.35 -0.67 0.00 0.00 178.83 179.29 1xu9 h PHE 102 N 0.26 -0.06 -0.68 2.96 3.57 -0.40 -0.74 116.94 121.84 1xu9 h PHE 102 Ca -0.00 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 1xu9 h PHE 102 Cb 1.09 0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.83 1xu9 h PHE 102 CO 0.03 -0.04 0.33 0.28 -2.23 0.00 0.00 178.31 176.68 1xu9 h VAL 103 N -0.03 1.23 -0.43 1.41 2.07 -1.44 0.02 116.25 119.08 1xu9 h VAL 103 Ca 0.02 -0.63 -0.00 0.00 0.82 0.00 0.00 66.70 66.92 1xu9 h VAL 103 Cb 0.07 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.20 1xu9 h VAL 103 CO -0.05 0.26 0.27 0.00 0.02 0.00 0.00 177.57 178.07 1xu9 h ALA 104 N 1.16 0.55 -0.18 1.67 0.00 -1.36 -0.86 119.26 120.24 1xu9 h ALA 104 Ca 0.23 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1xu9 h ALA 104 Cb 0.11 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1xu9 h ALA 104 CO -0.03 0.03 0.04 0.37 0.00 0.00 0.00 179.25 179.65 1xu9 h GLN 105 N 0.57 0.29 -0.57 0.00 4.15 -0.84 -0.87 115.11 117.84 1xu9 h GLN 105 Ca 0.16 -0.07 -0.01 0.00 0.77 0.00 0.00 58.65 59.49 1xu9 h GLN 105 Cb -0.02 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 27.60 1xu9 h GLN 105 CO -0.03 0.44 0.32 0.00 -1.93 0.00 0.00 178.83 177.63 1xu9 h ALA 106 N 0.83 0.72 -0.50 3.38 0.00 -0.85 -1.11 119.26 121.73 1xu9 h ALA 106 Ca 0.05 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 1xu9 h ALA 106 Cb 0.29 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1xu9 h ALA 106 CO 0.00 0.24 -0.16 0.78 0.00 0.00 0.00 179.25 180.10 1xu9 h GLY 107 N 0.76 1.07 1.06 0.00 0.00 -1.11 -1.81 103.07 103.04 1xu9 h GLY 107 Ca 0.20 -0.90 -0.07 0.00 0.00 0.00 0.00 47.33 46.56 1xu9 h GLY 107 CO -0.03 0.82 0.12 1.70 0.00 0.00 0.00 176.54 179.15 1xu9 h LYS 108 N 0.86 1.07 -0.30 4.80 3.64 -0.93 0.11 116.57 125.82 1xu9 h LYS 108 Ca 0.12 -0.28 -0.01 0.00 -1.27 0.00 0.00 60.65 59.22 1xu9 h LYS 108 Cb 0.73 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.41 1xu9 h LYS 108 CO 0.06 0.98 0.16 1.25 -2.27 0.00 0.00 179.45 179.63 1xu9 h LEU 109 N 0.99 0.38 0.00 5.20 5.85 -1.04 -2.95 115.31 123.75 1xu9 h LEU 109 Ca 0.20 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.83 1xu9 h LEU 109 Cb 0.42 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.35 1xu9 h LEU 109 CO 0.01 0.36 -0.11 0.23 -0.34 0.00 0.00 178.44 178.59 1xu9 n MET 110 N -4.81 0.20 -2.09 1.25 2.81 -0.69 -4.93 117.12 108.86 1xu9 n MET 110 Ca -0.02 0.14 -0.05 0.00 -1.81 0.00 0.00 57.70 55.97 1xu9 n MET 110 Cb 0.08 -1.71 -0.00 0.00 -0.71 0.00 0.00 33.22 30.87 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 1.36 0.19 0.00 3.03 0.00 0.20 -4.93 105.19 105.03 1xu9 n GLY 111 Ca 0.06 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.38 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 -1.00 0.62 3.58 -0.02 0.00 -0.13 -5.02 105.19 103.22 1xu9 n GLY 112 Ca -0.05 -1.81 -0.05 0.00 0.00 0.00 0.00 46.02 44.11 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 -0.94 -0.17 0.99 2.96 -1.26 -4.55 118.68 115.71 1xu9 s LEU 113 Ca 0.00 1.44 0.14 0.00 -0.22 0.00 0.00 54.13 55.49 1xu9 s LEU 113 Cb 0.00 2.16 -0.20 0.00 0.50 0.00 0.00 46.19 48.65 1xu9 s LEU 113 CO 0.00 -0.23 0.04 0.47 -1.32 0.00 0.00 176.35 175.31 1xu9 n ASP 114 N 4.95 1.03 -3.72 3.68 8.00 0.44 -4.06 116.55 126.87 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 0.80 -0.11 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 -2.40 0.35 -0.30 -1.24 1.75 -0.91 -1.48 119.30 115.07 1xu9 s MET 115 Ca -0.10 0.63 -0.02 0.00 -1.25 0.00 0.00 55.69 54.95 1xu9 s MET 115 Cb 0.05 0.02 0.05 0.00 2.84 0.00 0.00 34.83 37.79 1xu9 s MET 115 CO 0.66 -0.13 -0.00 -1.17 -0.65 0.00 0.00 175.02 173.73 1xu9 s LEU 116 N 0.99 3.85 -0.35 4.11 2.96 -0.36 -1.54 118.68 128.34 1xu9 s LEU 116 Ca -0.07 -1.25 -0.11 0.00 -0.22 0.00 0.00 54.13 52.49 1xu9 s LEU 116 Cb -0.07 -1.71 0.01 0.00 0.50 0.00 0.00 46.19 44.92 1xu9 s LEU 116 CO -0.08 -0.25 0.19 -0.63 -1.32 0.00 0.00 176.35 174.26 1xu9 s ILE 117 N 1.26 4.64 -0.39 6.68 1.01 -0.13 -0.65 121.20 133.62 1xu9 s ILE 117 Ca -0.05 -0.64 -0.13 0.00 0.00 0.00 0.00 60.65 59.83 1xu9 s ILE 117 Cb -0.20 -3.49 0.02 0.00 0.01 0.00 0.00 42.46 38.80 1xu9 s ILE 117 CO -0.01 -0.10 0.26 -0.76 0.00 0.00 0.00 174.94 174.32 1xu9 s LEU 118 N 1.59 4.88 0.00 2.97 1.43 0.54 -1.73 118.68 128.35 1xu9 s LEU 118 Ca 0.03 -0.88 0.00 0.00 -1.03 0.00 0.00 54.13 52.25 1xu9 s LEU 118 Cb -0.18 -2.10 0.00 0.00 0.03 0.00 0.00 46.19 43.94 1xu9 s LEU 118 CO 0.07 -0.40 0.00 -3.20 0.23 0.00 0.00 176.35 173.05 1xu9 n ASN 119 N 5.09 1.27 -4.73 2.29 2.85 -1.26 -1.24 115.26 119.53 1xu9 n ASN 119 Ca -0.12 0.00 -0.35 0.00 -0.11 0.00 0.00 54.58 54.00 1xu9 n ASN 119 Cb 0.47 0.20 0.08 0.00 1.24 0.00 0.00 39.78 41.76 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 -0.83 2.11 0.05 1.20 -3.43 -1.25 -4.82 115.29 108.32 1xu9 s HIS 120 Ca 0.00 1.55 -0.02 0.00 -0.80 0.00 0.00 55.06 55.80 1xu9 s HIS 120 Cb 0.00 -3.54 -0.03 0.00 -1.43 0.00 0.00 32.58 27.58 1xu9 s HIS 120 CO 0.00 -2.64 -0.01 0.96 -2.00 0.00 0.00 174.74 171.05 1xu9 s ILE 121 N -1.76 0.19 0.57 -5.38 -4.36 -1.26 -4.77 121.20 104.43 1xu9 s ILE 121 Ca 0.77 -1.56 -0.17 0.00 -0.26 0.00 0.00 60.65 59.44 1xu9 s ILE 121 Cb -0.32 -1.23 -0.05 0.00 1.25 0.00 0.00 42.46 42.12 1xu9 s ILE 121 CO 0.42 -0.86 1.06 0.28 0.24 0.00 0.00 174.94 176.08 1xu9 s THR 122 N -3.37 3.72 0.09 8.37 -1.32 -1.26 -4.94 115.64 116.93 1xu9 s THR 122 Ca 0.02 0.88 -0.32 0.00 -1.21 0.00 0.00 61.69 61.06 1xu9 s THR 122 Cb 0.04 -3.37 -0.12 0.00 -1.51 0.00 0.00 72.50 67.54 1xu9 s THR 122 CO -0.08 -0.42 1.79 0.59 -2.21 0.00 0.00 174.62 174.29 1xu9 n ASN 123 N -1.79 3.72 -3.93 8.08 3.02 -1.26 -4.96 115.26 118.14 1xu9 n ASN 123 Ca 0.09 1.01 -0.22 0.00 -0.03 0.00 0.00 54.58 55.43 1xu9 n ASN 123 Cb 0.53 -1.49 -0.16 0.00 -0.61 0.00 0.00 39.78 38.04 1xu9 n ASN 123 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1xu9 s THR 124 N 2.53 0.75 0.32 3.41 -4.23 -1.26 -5.08 115.64 112.08 1xu9 s THR 124 Ca 0.83 -0.23 0.10 0.00 -1.18 0.00 0.00 61.69 61.20 1xu9 s THR 124 Cb -0.57 -0.74 -0.05 0.00 1.34 0.00 0.00 72.50 72.48 1xu9 s THR 124 CO 0.40 0.28 -0.06 -0.94 -0.54 0.00 0.00 174.62 173.76 1xu9 s SER 125 N 0.93 4.02 -0.25 3.99 1.04 -1.26 -5.05 113.70 117.12 1xu9 s SER 125 Ca -0.10 -0.98 -0.28 0.00 0.48 0.00 0.00 55.95 55.06 1xu9 s SER 125 Cb -0.15 -0.49 0.01 0.00 0.10 0.00 0.00 66.02 65.49 1xu9 s SER 125 CO 0.00 -0.13 1.00 -0.76 0.98 0.00 0.00 173.24 174.34 1xu9 s LEU 126 N -3.64 4.07 -0.05 2.42 1.43 -1.26 -4.90 118.68 116.74 1xu9 s LEU 126 Ca 0.33 1.24 -0.29 0.00 -1.03 0.00 0.00 54.13 54.38 1xu9 s LEU 126 Cb -0.02 -3.47 0.10 0.00 0.03 0.00 0.00 46.19 42.84 1xu9 s LEU 126 CO 0.18 -0.68 0.86 0.20 0.23 0.00 0.00 176.35 177.14 1xu9 s ASN 127 N 1.32 -0.44 0.41 2.29 0.02 -0.98 -5.07 114.94 112.49 1xu9 s ASN 127 Ca 0.42 0.26 -0.26 0.00 -1.02 0.00 0.00 52.86 52.27 1xu9 s ASN 127 Cb -0.15 0.40 -0.10 0.00 0.02 0.00 0.00 41.25 41.43 1xu9 s ASN 127 CO 0.08 -0.55 1.29 0.18 0.02 0.00 0.00 177.10 178.12 1xu9 n LEU 128 N 0.28 4.08 -4.74 0.60 4.77 -1.26 -4.34 117.00 116.38 1xu9 n LEU 128 Ca -0.12 1.12 -0.42 0.00 -0.03 0.00 0.00 56.01 56.57 1xu9 n LEU 128 Cb 0.60 -1.51 -0.02 0.00 -2.33 0.00 0.00 43.42 40.16 1xu9 n LEU 128 CO 0.15 -0.57 1.27 0.12 -1.33 0.00 0.00 177.39 177.03 1xu9 s PHE 129 N -1.18 2.79 -0.33 -1.77 5.36 -1.26 -4.93 117.98 116.65 1xu9 s PHE 129 Ca 0.60 0.68 0.16 0.00 -0.96 0.00 0.00 56.93 57.42 1xu9 s PHE 129 Cb -0.51 -4.08 0.45 0.00 -0.34 0.00 0.00 43.02 38.54 1xu9 s PHE 129 CO 0.59 -3.74 0.95 -2.39 -1.46 0.00 0.00 175.22 169.16 1xu9 n HIS 130 N 2.60 1.27 -1.23 10.12 1.44 -1.26 -4.94 115.22 123.23 1xu9 n HIS 130 Ca 0.10 -2.90 -0.08 0.00 -2.01 0.00 0.00 57.72 52.83 1xu9 n HIS 130 Cb 0.37 -0.36 -0.03 0.00 0.12 0.00 0.00 29.99 30.09 1xu9 n HIS 130 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 1xu9 n ASP 131 N -0.07 -4.78 -3.75 4.39 8.00 -1.26 -4.90 116.55 114.19 1xu9 n ASP 131 Ca 0.13 0.19 -0.42 0.00 0.71 0.00 0.00 54.79 55.40 1xu9 n ASP 131 Cb 0.79 -2.97 0.00 0.00 -0.02 0.00 0.00 41.12 38.93 1xu9 n ASP 131 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1xu9 n ASP 132 N -0.39 4.84 -0.05 -2.24 5.75 -1.26 -4.71 116.55 118.49 1xu9 n ASP 132 Ca -0.08 -2.95 0.11 0.00 -0.01 0.00 0.00 54.79 51.86 1xu9 n ASP 132 Cb 0.40 -1.57 0.50 0.00 -1.03 0.00 0.00 41.12 39.42 1xu9 n ASP 132 CO 0.00 0.00 0.00 0.40 -0.11 0.00 0.00 177.20 177.49 1xu9 h ILE 133 N 3.77 0.93 -0.80 2.12 2.04 -2.00 -1.34 117.51 122.23 1xu9 h ILE 133 Ca 0.52 -0.14 0.08 0.00 1.00 0.00 0.00 64.86 66.32 1xu9 h ILE 133 Cb 0.60 0.50 -0.05 0.00 -0.74 0.00 0.00 36.82 37.12 1xu9 h ILE 133 CO 1.76 0.07 0.52 1.12 0.00 0.00 0.00 178.15 181.62 1xu9 h HIS 134 N 0.40 0.85 -0.05 1.37 2.07 -2.00 -0.68 115.15 117.11 1xu9 h HIS 134 Ca 0.24 0.02 -0.20 0.00 -2.85 0.00 0.00 60.37 57.58 1xu9 h HIS 134 Cb 0.42 -0.28 -0.00 0.00 2.57 0.00 0.00 27.41 30.12 1xu9 h HIS 134 CO -0.00 0.43 -0.80 1.25 -3.07 0.00 0.00 177.93 175.74 1xu9 h HIS 135 N 0.82 0.56 -0.31 6.12 -0.00 -1.65 -0.87 115.15 119.83 1xu9 h HIS 135 Ca 0.35 -0.27 -0.02 0.00 -0.00 0.00 0.00 60.37 60.43 1xu9 h HIS 135 Cb 0.31 -0.08 -0.01 0.00 -0.00 0.00 0.00 27.41 27.63 1xu9 h HIS 135 CO -0.00 1.05 0.11 0.28 -0.00 0.00 0.00 177.93 179.37 1xu9 h VAL 136 N 0.26 1.19 -0.33 5.26 2.07 -1.16 -0.55 116.25 122.99 1xu9 h VAL 136 Ca -0.05 -0.61 -0.03 0.00 0.82 0.00 0.00 66.70 66.83 1xu9 h VAL 136 Cb 1.40 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 32.16 1xu9 h VAL 136 CO 0.14 0.21 0.09 -0.09 0.02 0.00 0.00 177.57 177.93 1xu9 h ARG 137 N 0.35 0.53 -0.82 1.57 2.43 -1.11 -1.50 114.38 115.83 1xu9 h ARG 137 Ca 0.10 -0.12 -0.04 0.00 -0.81 0.00 0.00 59.98 59.11 1xu9 h ARG 137 Cb 0.22 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.66 1xu9 h ARG 137 CO -0.01 0.58 0.35 -0.22 -1.51 0.00 0.00 179.97 179.17 1xu9 h LYS 138 N 0.38 1.21 -0.56 0.20 3.64 -1.07 0.21 116.57 120.58 1xu9 h LYS 138 Ca 0.11 -0.20 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1xu9 h LYS 138 Cb 0.28 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 31.87 1xu9 h LYS 138 CO -0.00 0.96 0.37 0.77 -2.27 0.00 0.00 179.45 179.28 1xu9 h SER 139 N 1.18 0.65 -0.36 4.20 0.02 -0.96 -0.57 113.55 117.72 1xu9 h SER 139 Ca 0.28 -0.02 -0.11 0.00 -0.84 0.00 0.00 61.79 61.10 1xu9 h SER 139 Cb 0.18 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.54 1xu9 h SER 139 CO -0.03 0.47 -0.18 0.24 -1.14 0.00 0.00 176.83 176.20 1xu9 h MET 140 N 0.76 0.83 -0.06 3.45 2.86 -0.71 0.66 114.93 122.72 1xu9 h MET 140 Ca 0.21 -0.32 -0.03 0.00 -2.06 0.00 0.00 59.70 57.50 1xu9 h MET 140 Cb -0.08 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.53 1xu9 h MET 140 CO -0.04 0.95 -0.08 0.93 1.06 0.00 0.00 176.91 179.72 1xu9 h GLU 141 N 0.73 0.16 0.04 1.72 4.39 -0.60 -0.39 114.58 120.63 1xu9 h GLU 141 Ca 0.11 -0.09 -0.07 0.00 0.34 0.00 0.00 59.36 59.65 1xu9 h GLU 141 Cb 0.70 0.01 0.01 0.00 -0.10 0.00 0.00 28.75 29.36 1xu9 h GLU 141 CO 0.05 0.64 -0.30 0.28 -1.16 0.00 0.00 179.01 178.53 1xu9 h VAL 142 N -0.32 1.63 0.00 3.13 2.07 -1.12 -0.34 116.25 121.30 1xu9 h VAL 142 Ca 0.01 -2.24 -0.06 0.00 0.82 0.00 0.00 66.70 65.23 1xu9 h VAL 142 Cb 0.63 3.10 -0.01 0.00 -1.52 0.00 0.00 31.29 33.49 1xu9 h VAL 142 CO 0.02 0.61 -0.27 0.78 0.02 0.00 0.00 177.57 178.72 1xu9 h ASN 143 N -0.65 0.00 0.00 0.57 2.35 -1.01 -3.38 115.58 113.46 1xu9 h ASN 143 Ca -0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 1xu9 h ASN 143 Cb 1.16 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.53 1xu9 h ASN 143 CO 0.06 0.27 0.00 0.33 -1.65 0.00 0.00 177.43 176.44 1xu9 n PHE 144 N -3.17 -0.21 -0.27 1.19 7.35 -1.04 -4.71 117.46 116.59 1xu9 n PHE 144 Ca 0.03 0.04 -0.05 0.00 -0.76 0.00 0.00 57.45 56.71 1xu9 n PHE 144 Cb 0.63 0.07 0.10 0.00 0.35 0.00 0.00 39.48 40.64 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 1.05 -1.69 -2.13 3.38 -0.92 -1.17 115.31 113.83 1xu9 h LEU 145 Ca 0.00 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 1xu9 h LEU 145 Cb 0.00 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 1xu9 h LEU 145 CO 0.00 0.91 0.02 0.77 0.09 0.00 0.00 178.44 180.24 1xu9 h SER 146 N 1.13 0.19 -0.47 -0.43 4.64 -1.23 -1.46 113.55 115.91 1xu9 h SER 146 Ca 0.26 -0.02 -0.07 0.00 -0.47 0.00 0.00 61.79 61.49 1xu9 h SER 146 Cb 0.18 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.19 1xu9 h SER 146 CO -0.03 0.22 0.04 1.88 -0.87 0.00 0.00 176.83 178.07 1xu9 h TYR 147 N 0.22 0.92 -0.27 4.77 -1.99 -1.44 -0.14 116.97 119.04 1xu9 h TYR 147 Ca 0.05 -0.12 -0.07 0.00 2.00 0.00 0.00 58.73 60.59 1xu9 h TYR 147 Cb 0.11 -0.25 -0.01 0.00 2.00 0.00 0.00 36.73 38.58 1xu9 h TYR 147 CO 0.00 0.82 -0.12 0.28 -0.00 0.00 0.00 178.16 179.15 1xu9 h VAL 148 N 0.82 1.30 -0.52 -2.88 2.07 -1.06 -1.69 116.25 114.28 1xu9 h VAL 148 Ca 0.16 -1.19 -0.01 0.00 0.82 0.00 0.00 66.70 66.48 1xu9 h VAL 148 Cb 0.43 1.51 -0.02 0.00 -1.52 0.00 0.00 31.29 31.69 1xu9 h VAL 148 CO 0.02 0.37 0.30 0.58 0.02 0.00 0.00 177.57 178.86 1xu9 h VAL 149 N 0.29 1.17 -0.85 2.57 2.07 -1.08 -0.87 116.25 119.53 1xu9 h VAL 149 Ca 0.06 -0.39 -0.01 0.00 0.82 0.00 0.00 66.70 67.18 1xu9 h VAL 149 Cb 0.62 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 30.83 1xu9 h VAL 149 CO 0.04 0.17 0.49 -0.07 0.02 0.00 0.00 177.57 178.22 1xu9 h LEU 150 N 0.70 1.05 -0.25 2.57 3.38 -1.00 -1.60 115.31 120.16 1xu9 h LEU 150 Ca 0.19 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1xu9 h LEU 150 Cb 0.01 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 1xu9 h LEU 150 CO -0.03 0.83 0.11 0.74 0.09 0.00 0.00 178.44 180.18 1xu9 h THR 151 N 1.18 1.16 -0.88 0.22 2.02 -0.88 -0.97 112.91 114.77 1xu9 h THR 151 Ca 0.30 -0.47 0.01 0.00 0.77 0.00 0.00 66.41 67.03 1xu9 h THR 151 Cb -0.00 1.01 -0.04 0.00 -1.74 0.00 0.00 68.15 67.38 1xu9 h THR 151 CO -0.05 0.16 0.58 0.58 0.37 0.00 0.00 175.52 177.16 1xu9 h VAL 152 N 0.26 1.22 -0.06 3.16 2.07 -0.93 -0.98 116.25 120.98 1xu9 h VAL 152 Ca 0.08 -0.41 -0.11 0.00 0.82 0.00 0.00 66.70 67.08 1xu9 h VAL 152 Cb 0.15 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 29.84 1xu9 h VAL 152 CO -0.01 0.22 -0.49 0.00 0.02 0.00 0.00 177.57 177.31 1xu9 h ALA 153 N 1.33 1.08 0.00 1.67 0.00 -1.02 -3.21 119.26 119.10 1xu9 h ALA 153 Ca 0.33 -0.46 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1xu9 h ALA 153 Cb -0.12 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 1xu9 h ALA 153 CO -0.08 0.64 -0.74 0.00 0.00 0.00 0.00 179.25 179.07 1xu9 h ALA 154 N 1.38 0.67 -0.66 0.00 0.00 -0.62 -3.41 119.26 116.62 1xu9 h ALA 154 Ca 0.00 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1xu9 h ALA 154 Cb 0.91 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 1xu9 h ALA 154 CO 0.07 0.15 0.26 1.25 0.00 0.00 0.00 179.25 180.97 1xu9 h LEU 155 N 0.00 0.92 -0.56 0.00 5.85 -1.20 -1.31 115.31 119.01 1xu9 h LEU 155 Ca -0.02 -0.18 0.09 0.00 0.84 0.00 0.00 57.88 58.62 1xu9 h LEU 155 Cb 1.09 -0.24 -0.07 0.00 0.37 0.00 0.00 40.66 41.81 1xu9 h LEU 155 CO 0.01 0.84 0.17 -0.65 -0.34 0.00 0.00 178.44 178.47 1xu9 h PRO 156 N 0.93 0.32 -0.65 5.25 0.11 -1.80 0.17 132.00 136.34 1xu9 h PRO 156 Ca 0.22 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 66.24 1xu9 h PRO 156 Cb 0.22 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 31.23 1xu9 h PRO 156 CO -0.02 0.21 0.12 0.52 -0.21 0.00 0.00 178.00 178.62 1xu9 h MET 157 N 0.33 1.07 -0.18 1.05 2.86 -1.72 -2.05 114.93 116.30 1xu9 h MET 157 Ca 0.28 -0.28 -0.09 0.00 -2.06 0.00 0.00 59.70 57.55 1xu9 h MET 157 Cb 0.36 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.88 1xu9 h MET 157 CO -0.32 0.98 -0.28 -0.07 1.06 0.00 0.00 176.91 178.28 1xu9 h LEU 158 N 0.99 0.35 -0.58 1.22 3.38 -0.61 -2.34 115.31 117.72 1xu9 h LEU 158 Ca 0.20 -0.12 -0.11 0.00 0.09 0.00 0.00 57.88 57.94 1xu9 h LEU 158 Cb 0.42 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1xu9 h LEU 158 CO 0.01 0.63 -0.11 0.11 0.09 0.00 0.00 178.44 179.16 1xu9 h LYS 159 N 0.31 1.01 -0.71 1.13 1.57 -0.48 0.13 116.57 119.53 1xu9 h LYS 159 Ca 0.04 -0.37 0.02 0.00 -1.87 0.00 0.00 60.65 58.47 1xu9 h LYS 159 Cb 0.66 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.87 1xu9 h LYS 159 CO 0.05 1.06 0.47 0.37 -0.57 0.00 0.00 179.45 180.82 1xu9 h GLN 160 N 0.90 0.87 -0.07 3.15 5.75 -0.98 -3.07 115.11 121.65 1xu9 h GLN 160 Ca 0.14 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.59 1xu9 h GLN 160 Cb 0.68 -0.20 0.00 0.00 1.07 0.00 0.00 27.48 29.03 1xu9 h GLN 160 CO 0.05 0.58 0.00 -1.13 -2.65 0.00 0.00 178.83 175.68 1xu9 n SER 161 N -4.45 2.89 -3.86 -0.69 3.41 -0.92 -4.96 113.62 105.04 1xu9 n SER 161 Ca 0.08 -1.92 -0.24 0.00 -0.26 0.00 0.00 58.87 56.53 1xu9 n SER 161 Cb 0.09 -0.03 -0.00 0.00 -0.26 0.00 0.00 64.21 64.01 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 1.25 -0.79 -2.16 4.04 3.02 -0.19 -4.97 115.26 115.46 1xu9 n ASN 162 Ca 0.13 -0.93 0.00 0.00 -0.03 0.00 0.00 54.58 53.75 1xu9 n ASN 162 Cb 0.55 -3.44 0.00 0.00 -0.61 0.00 0.00 39.78 36.28 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 -1.81 0.13 3.03 7.41 0.00 0.29 -4.80 105.19 109.44 1xu9 n GLY 163 Ca -0.29 -1.73 -0.12 0.00 0.00 0.00 0.00 46.02 43.88 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 -0.10 -0.15 1.61 0.01 -0.55 -2.01 113.70 111.51 1xu9 s SER 164 Ca 0.00 0.16 -0.03 0.00 1.31 0.00 0.00 55.95 57.40 1xu9 s SER 164 Cb 0.00 0.26 -0.02 0.00 0.21 0.00 0.00 66.02 66.47 1xu9 s SER 164 CO 0.00 -0.12 -0.07 -0.63 0.41 0.00 0.00 173.24 172.84 1xu9 s ILE 165 N -0.25 3.59 -0.16 1.44 1.01 0.21 -1.23 121.20 125.81 1xu9 s ILE 165 Ca -0.03 -0.47 0.01 0.00 0.00 0.00 0.00 60.65 60.16 1xu9 s ILE 165 Cb -0.03 -2.56 0.01 0.00 0.01 0.00 0.00 42.46 39.90 1xu9 s ILE 165 CO 0.00 0.50 -0.18 -0.69 0.00 0.00 0.00 174.94 174.57 1xu9 s VAL 166 N 0.41 2.33 -0.23 2.92 1.01 0.17 -0.85 120.40 126.17 1xu9 s VAL 166 Ca -0.06 -0.87 -0.03 0.00 0.00 0.00 0.00 61.98 61.02 1xu9 s VAL 166 Cb -0.15 -1.97 0.01 0.00 0.00 0.00 0.00 36.38 34.27 1xu9 s VAL 166 CO 0.04 0.53 -0.05 -0.69 0.00 0.00 0.00 175.10 174.93 1xu9 s VAL 167 N 1.00 3.20 -0.21 2.92 1.01 0.30 -0.34 120.40 128.28 1xu9 s VAL 167 Ca -0.02 -0.70 -0.20 0.00 0.00 0.00 0.00 61.98 61.06 1xu9 s VAL 167 Cb -0.15 -2.52 -0.02 0.00 0.00 0.00 0.00 36.38 33.69 1xu9 s VAL 167 CO -0.05 0.33 0.62 -0.69 0.00 0.00 0.00 175.10 175.31 1xu9 s VAL 168 N 1.42 5.02 0.00 2.92 1.01 -0.37 -0.95 120.40 129.45 1xu9 s VAL 168 Ca 0.04 1.15 0.00 0.00 0.00 0.00 0.00 61.98 63.17 1xu9 s VAL 168 Cb -0.15 -3.93 0.00 0.00 0.00 0.00 0.00 36.38 32.30 1xu9 s VAL 168 CO -0.04 0.11 0.00 -0.24 0.00 0.00 0.00 175.10 174.93 1xu9 n SER 169 N 5.11 0.25 -3.54 3.32 2.88 0.18 -4.86 113.62 116.96 1xu9 n SER 169 Ca -0.02 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.37 1xu9 n SER 169 Cb 0.50 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.90 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 -0.56 0.34 -3.46 0.01 -1.22 -2.47 113.70 107.34 1xu9 s SER 170 Ca 0.00 0.44 0.08 0.00 1.31 0.00 0.00 55.95 57.77 1xu9 s SER 170 Cb 0.00 0.52 0.78 0.00 0.21 0.00 0.00 66.02 67.53 1xu9 s SER 170 CO 0.00 -0.67 1.85 -0.07 0.41 0.00 0.00 173.24 174.75 1xu9 h LEU 171 N 2.87 0.70 0.00 2.44 3.38 -1.60 0.15 115.31 123.25 1xu9 h LEU 171 Ca -0.29 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1xu9 h LEU 171 Cb 1.18 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.85 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 -2.41 2.50 0.40 1.53 0.00 -1.26 -1.29 120.51 119.98 1xu9 n ALA 172 Ca 0.19 -0.08 0.10 0.00 0.00 0.00 0.00 53.44 53.65 1xu9 n ALA 172 Cb 0.48 -1.21 0.17 0.00 0.00 0.00 0.00 19.45 18.89 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 0.61 1.42 0.00 0.00 0.00 0.51 -4.44 105.19 103.29 1xu9 n GLY 173 Ca 0.10 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.47 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 1.27 2.27 -4.23 1.61 4.76 -0.41 -4.24 118.16 119.19 1xu9 n LYS 174 Ca 0.16 0.00 -0.13 0.00 -2.87 0.00 0.00 58.31 55.47 1xu9 n LYS 174 Cb 0.55 -0.78 -0.10 0.00 -1.84 0.00 0.00 35.03 32.85 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 -1.55 0.39 0.03 -0.18 -7.23 -0.65 -5.14 120.40 106.08 1xu9 s VAL 175 Ca 0.00 -1.97 -0.10 0.00 -1.81 0.00 0.00 61.98 58.10 1xu9 s VAL 175 Cb 0.00 -2.28 -0.05 0.00 0.56 0.00 0.00 36.38 34.60 1xu9 s VAL 175 CO 0.00 -0.28 0.35 0.00 -0.31 0.00 0.00 175.10 174.86 1xu9 s ALA 176 N -3.86 3.76 0.03 1.32 0.00 -1.26 -4.21 121.76 117.54 1xu9 s ALA 176 Ca 0.30 -0.41 0.02 0.00 0.00 0.00 0.00 51.96 51.87 1xu9 s ALA 176 Cb 0.07 -2.23 -0.02 0.00 0.00 0.00 0.00 23.12 20.94 1xu9 s ALA 176 CO 0.07 0.57 -0.07 0.71 0.00 0.00 0.00 175.76 177.04 1xu9 s TYR 177 N -1.28 0.59 0.80 0.00 1.51 -1.26 -5.06 117.35 112.65 1xu9 s TYR 177 Ca 0.28 -0.41 -0.11 0.00 -1.01 0.00 0.00 57.07 55.82 1xu9 s TYR 177 Cb -0.14 -0.36 0.07 0.00 -0.11 0.00 0.00 41.96 41.41 1xu9 s TYR 177 CO 0.16 -0.07 1.09 -1.25 -1.11 0.00 0.00 175.55 174.36 1xu9 s PRO 178 N -1.26 2.08 0.00 -1.71 0.04 -1.26 -4.08 135.00 128.81 1xu9 s PRO 178 Ca -0.08 0.88 0.00 0.00 0.04 0.00 0.00 61.00 61.85 1xu9 s PRO 178 Cb -0.08 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.56 1xu9 s PRO 178 CO 0.00 -1.69 0.00 -1.33 0.04 0.00 0.00 177.00 174.02 1xu9 n MET 179 N -3.52 0.00 -2.23 4.56 2.81 -1.26 -4.81 117.12 112.67 1xu9 n MET 179 Ca 0.08 0.00 -0.03 0.00 -1.81 0.00 0.00 57.70 55.94 1xu9 n MET 179 Cb 0.55 -2.32 0.05 0.00 -0.71 0.00 0.00 33.22 30.78 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 1.30 0.11 2.03 0.24 -1.26 -2.32 118.33 116.44 1xu9 n VAL 180 Ca 0.00 -2.77 -0.13 0.00 -2.04 0.00 0.00 64.34 59.41 1xu9 n VAL 180 Cb 0.00 0.68 -0.06 0.00 -1.47 0.00 0.00 33.84 32.99 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 2.06 -0.32 -0.55 2.33 0.00 -1.87 0.17 119.26 121.08 1xu9 h ALA 181 Ca -0.06 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1xu9 h ALA 181 Cb 1.44 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 19.46 1xu9 h ALA 181 CO 0.26 -0.71 0.33 0.00 0.00 0.00 0.00 179.25 179.13 1xu9 h ALA 182 N 0.46 0.71 -0.28 0.00 0.00 -1.94 -1.38 119.26 116.82 1xu9 h ALA 182 Ca 0.02 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1xu9 h ALA 182 Cb 0.36 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1xu9 h ALA 182 CO -0.07 0.19 0.07 -0.92 0.00 0.00 0.00 179.25 178.51 1xu9 h TYR 183 N 0.75 0.48 -0.78 0.00 3.20 -1.85 -2.64 116.97 116.12 1xu9 h TYR 183 Ca 0.20 -0.06 -0.01 0.00 3.14 0.00 0.00 58.73 62.00 1xu9 h TYR 183 Cb -0.02 -0.13 -0.04 0.00 1.54 0.00 0.00 36.73 38.08 1xu9 h TYR 183 CO -0.02 0.53 0.44 0.77 -1.64 0.00 0.00 178.16 178.23 1xu9 h SER 184 N 0.29 0.96 -0.56 -2.11 0.02 -0.54 -1.25 113.55 110.36 1xu9 h SER 184 Ca 0.09 -0.09 0.08 0.00 -0.84 0.00 0.00 61.79 61.03 1xu9 h SER 184 Cb 0.29 -0.24 -0.06 0.00 0.14 0.00 0.00 62.40 62.52 1xu9 h SER 184 CO 0.00 0.77 0.21 0.00 -1.14 0.00 0.00 176.83 176.68 1xu9 h ALA 185 N 1.23 0.71 -0.42 3.77 0.00 -1.12 0.16 119.26 123.58 1xu9 h ALA 185 Ca 0.27 0.07 -0.11 0.00 0.00 0.00 0.00 54.91 55.14 1xu9 h ALA 185 Cb 0.01 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1xu9 h ALA 185 CO -0.05 -0.19 -0.20 0.66 0.00 0.00 0.00 179.25 179.48 1xu9 h SER 186 N 0.40 0.84 0.17 0.00 4.64 -0.97 -1.33 113.55 117.30 1xu9 h SER 186 Ca 0.28 -0.30 -0.25 0.00 -0.47 0.00 0.00 61.79 61.05 1xu9 h SER 186 Cb 0.31 -0.23 0.01 0.00 -0.31 0.00 0.00 62.40 62.18 1xu9 h SER 186 CO -0.27 1.02 -1.02 0.11 -0.87 0.00 0.00 176.83 175.80 1xu9 h LYS 187 N 0.73 0.56 -0.71 4.77 1.79 -0.73 -2.34 116.57 120.63 1xu9 h LYS 187 Ca 0.10 -0.62 0.05 0.00 -2.18 0.00 0.00 60.65 58.01 1xu9 h LYS 187 Cb 0.72 0.18 -0.05 0.00 -1.58 0.00 0.00 32.23 31.50 1xu9 h LYS 187 CO 0.06 1.23 0.42 0.74 -1.08 0.00 0.00 179.45 180.82 1xu9 h PHE 188 N 0.31 0.77 -0.99 -1.35 0.04 -0.70 -2.51 116.94 112.52 1xu9 h PHE 188 Ca -0.11 0.03 0.02 0.00 2.80 0.00 0.00 57.97 60.70 1xu9 h PHE 188 Cb 1.67 -0.24 -0.05 0.00 2.20 0.00 0.00 35.95 39.52 1xu9 h PHE 188 CO 0.08 0.39 0.65 0.00 -0.60 0.00 0.00 178.31 178.83 1xu9 h ALA 189 N 1.35 1.32 -0.81 2.45 0.00 -1.09 -1.62 119.26 120.86 1xu9 h ALA 189 Ca 0.31 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.19 1xu9 h ALA 189 Cb 0.16 -0.38 -0.05 0.00 0.00 0.00 0.00 17.79 17.52 1xu9 h ALA 189 CO -0.17 0.61 0.53 -0.07 0.00 0.00 0.00 179.25 180.15 1xu9 h LEU 190 N 1.30 0.89 -0.04 0.00 3.38 -1.00 -0.13 115.31 119.71 1xu9 h LEU 190 Ca 0.37 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.33 1xu9 h LEU 190 Cb -0.09 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.45 1xu9 h LEU 190 CO -0.10 0.63 0.01 -0.78 0.09 0.00 0.00 178.44 178.29 1xu9 h ASP 191 N 1.05 0.05 -0.26 -0.43 3.58 -1.03 -0.22 116.42 119.16 1xu9 h ASP 191 Ca 0.31 -0.19 0.02 0.00 0.42 0.00 0.00 57.03 57.59 1xu9 h ASP 191 Cb -0.05 -0.01 -0.02 0.00 1.72 0.00 0.00 39.33 40.97 1xu9 h ASP 191 CO -0.09 0.23 0.13 1.23 -2.88 0.00 0.00 179.24 177.86 1xu9 h GLY 192 N -0.13 0.35 0.69 -0.78 0.00 -1.07 -0.76 103.07 101.36 1xu9 h GLY 192 Ca 0.01 -0.10 -0.02 0.00 0.00 0.00 0.00 47.33 47.23 1xu9 h GLY 192 CO -0.00 0.08 -0.19 -2.75 0.00 0.00 0.00 176.54 173.68 1xu9 h PHE 193 N 0.28 -0.48 -0.09 5.60 3.04 -0.96 -2.55 116.94 121.77 1xu9 h PHE 193 Ca 0.11 -0.01 -0.12 0.00 3.98 0.00 0.00 57.97 61.93 1xu9 h PHE 193 Cb 0.03 0.16 -0.01 0.00 2.56 0.00 0.00 35.95 38.68 1xu9 h PHE 193 CO -0.09 -0.16 -0.47 0.74 -2.02 0.00 0.00 178.31 176.31 1xu9 h PHE 194 N -0.84 0.27 -0.11 0.41 -1.00 -1.04 -1.48 116.94 113.15 1xu9 h PHE 194 Ca -0.05 -0.08 -0.11 0.00 2.81 0.00 0.00 57.97 60.54 1xu9 h PHE 194 Cb 0.54 -0.06 -0.01 0.00 3.61 0.00 0.00 35.95 40.03 1xu9 h PHE 194 CO 0.02 0.65 -0.40 0.77 -1.61 0.00 0.00 178.31 177.74 1xu9 h SER 195 N 0.18 0.26 -0.09 2.17 0.02 -1.22 -1.35 113.55 113.53 1xu9 h SER 195 Ca 0.01 -0.11 -0.05 0.00 -0.84 0.00 0.00 61.79 60.81 1xu9 h SER 195 Cb 0.89 -0.07 -0.00 0.00 0.14 0.00 0.00 62.40 63.36 1xu9 h SER 195 CO 0.07 0.64 -0.12 0.28 -1.14 0.00 0.00 176.83 176.56 1xu9 h SER 196 N 0.21 0.27 0.66 3.07 0.02 -0.99 -2.98 113.55 113.81 1xu9 h SER 196 Ca 0.02 -0.52 -0.05 0.00 -0.84 0.00 0.00 61.79 60.40 1xu9 h SER 196 Cb 0.80 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.26 1xu9 h SER 196 CO 0.06 0.73 -0.26 0.16 -1.14 0.00 0.00 176.83 176.38 1xu9 h ILE 197 N -0.19 0.76 -0.54 3.27 3.07 -1.23 -1.65 117.51 120.99 1xu9 h ILE 197 Ca 0.01 -1.09 0.03 0.00 1.55 0.00 0.00 64.86 65.36 1xu9 h ILE 197 Cb 0.67 1.68 -0.04 0.00 -0.27 0.00 0.00 36.82 38.86 1xu9 h ILE 197 CO 0.03 0.26 0.31 -0.09 -1.05 0.00 0.00 178.15 177.61 1xu9 h ARG 198 N 0.00 0.60 -0.66 0.16 2.43 -1.21 0.13 114.38 115.84 1xu9 h ARG 198 Ca -0.00 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.07 1xu9 h ARG 198 Cb 0.66 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 30.05 1xu9 h ARG 198 CO 0.03 0.40 0.16 0.87 -1.51 0.00 0.00 179.97 179.92 1xu9 h LYS 199 N 0.61 1.04 -0.67 0.20 1.57 -1.20 -1.94 116.57 116.18 1xu9 h LYS 199 Ca 0.22 -0.24 -0.04 0.00 -1.87 0.00 0.00 60.65 58.73 1xu9 h LYS 199 Cb 0.05 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.19 1xu9 h LYS 199 CO -0.11 0.92 0.28 0.93 -0.57 0.00 0.00 179.45 180.89 1xu9 h GLU 200 N 0.99 1.00 -0.11 3.15 5.08 -0.66 -2.58 114.58 121.44 1xu9 h GLU 200 Ca 0.21 -0.17 -0.08 0.00 -1.00 0.00 0.00 59.36 58.32 1xu9 h GLU 200 Cb 0.35 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 1xu9 h GLU 200 CO 0.00 0.82 -0.28 1.88 -1.00 0.00 0.00 179.01 180.44 1xu9 h TYR 201 N 0.95 0.22 -0.42 4.33 0.05 -0.44 -0.39 116.97 121.27 1xu9 h TYR 201 Ca 0.23 -0.04 -0.03 0.00 0.05 0.00 0.00 58.73 58.93 1xu9 h TYR 201 Cb 0.19 -0.06 -0.02 0.00 1.01 0.00 0.00 36.73 37.86 1xu9 h TYR 201 CO 0.01 0.47 0.14 1.03 -1.05 0.00 0.00 178.16 178.76 1xu9 h SER 202 N 0.18 0.61 1.38 3.88 0.87 -1.01 -0.65 113.55 118.81 1xu9 h SER 202 Ca 0.03 -0.20 -0.13 0.00 -1.23 0.00 0.00 61.79 60.26 1xu9 h SER 202 Cb 0.59 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.37 1xu9 h SER 202 CO 0.04 0.65 -0.63 -0.37 -0.53 0.00 0.00 176.83 176.00 1xu9 h VAL 203 N 0.54 1.07 -0.15 2.23 -1.51 -1.09 -3.19 116.25 114.15 1xu9 h VAL 203 Ca 0.14 -2.51 0.00 0.00 -1.23 0.00 0.00 66.70 63.10 1xu9 h VAL 203 Cb 0.25 2.53 0.00 0.00 -2.13 0.00 0.00 31.29 31.94 1xu9 h VAL 203 CO -0.01 0.61 0.00 -1.54 -1.23 0.00 0.00 177.57 175.40 1xu9 n SER 204 N -3.25 2.21 -3.82 4.19 3.41 -0.19 -4.95 113.62 111.21 1xu9 n SER 204 Ca 0.01 -1.76 -0.27 0.00 -0.26 0.00 0.00 58.87 56.59 1xu9 n SER 204 Cb 0.79 -0.09 0.03 0.00 -0.26 0.00 0.00 64.21 64.67 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 0.69 -5.38 -3.07 4.33 1.74 -0.38 -4.97 116.66 109.64 1xu9 n ARG 205 Ca 0.17 0.61 -0.41 0.00 -0.77 0.00 0.00 57.85 57.45 1xu9 n ARG 205 Cb 0.44 -5.38 -0.06 0.00 -1.02 0.00 0.00 32.46 26.44 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 -3.45 4.88 -1.02 1.55 1.01 -0.46 -4.98 120.40 117.93 1xu9 s VAL 206 Ca 0.41 0.88 -0.04 0.00 0.00 0.00 0.00 61.98 63.23 1xu9 s VAL 206 Cb -0.20 -4.06 0.16 0.00 0.00 0.00 0.00 36.38 32.28 1xu9 s VAL 206 CO 0.82 -0.21 2.36 -3.20 0.00 0.00 0.00 175.10 174.87 1xu9 n ASN 207 N 6.01 7.50 -4.10 3.32 4.05 -1.26 -4.64 115.26 126.14 1xu9 n ASN 207 Ca 0.00 -3.31 -0.32 0.00 0.45 0.00 0.00 54.58 51.41 1xu9 n ASN 207 Cb 0.49 -1.27 -0.16 0.00 1.23 0.00 0.00 39.78 40.06 1xu9 n ASN 207 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1xu9 s VAL 208 N -2.28 1.87 0.48 3.44 1.01 -1.26 -3.86 120.40 119.79 1xu9 s VAL 208 Ca 0.53 -0.84 -0.14 0.00 0.00 0.00 0.00 61.98 61.53 1xu9 s VAL 208 Cb 0.25 -1.69 -0.07 0.00 0.00 0.00 0.00 36.38 34.88 1xu9 s VAL 208 CO -0.16 0.51 0.90 -0.94 0.00 0.00 0.00 175.10 175.41 1xu9 s SER 209 N 1.14 6.55 -0.09 3.32 1.04 -0.85 -4.92 113.70 119.88 1xu9 s SER 209 Ca -0.01 1.38 0.00 0.00 0.48 0.00 0.00 55.95 57.80 1xu9 s SER 209 Cb -0.14 -2.43 0.02 0.00 0.10 0.00 0.00 66.02 63.57 1xu9 s SER 209 CO -0.07 -0.53 -0.07 -0.63 0.98 0.00 0.00 173.24 172.92 1xu9 s ILE 210 N -2.56 0.89 -0.18 -1.02 1.01 -1.26 -0.62 121.20 117.46 1xu9 s ILE 210 Ca 0.55 -0.24 -0.01 0.00 0.00 0.00 0.00 60.65 60.96 1xu9 s ILE 210 Cb -0.10 -0.92 0.01 0.00 0.01 0.00 0.00 42.46 41.46 1xu9 s ILE 210 CO 0.33 0.34 -0.14 -0.89 0.00 0.00 0.00 174.94 174.57 1xu9 s THR 211 N 1.50 2.61 -0.23 2.92 2.01 -0.03 -4.39 115.64 120.03 1xu9 s THR 211 Ca 0.00 -0.77 -0.08 0.00 0.31 0.00 0.00 61.69 61.15 1xu9 s THR 211 Cb -0.13 -2.13 -0.04 0.00 0.01 0.00 0.00 72.50 70.21 1xu9 s THR 211 CO -0.05 0.50 0.10 -0.22 -0.69 0.00 0.00 174.62 174.26 1xu9 s LEU 212 N 1.18 3.72 -0.18 4.42 2.96 -0.01 -0.54 118.68 130.23 1xu9 s LEU 212 Ca 0.02 -0.05 -0.07 0.00 -0.22 0.00 0.00 54.13 53.81 1xu9 s LEU 212 Cb -0.14 -1.99 -0.04 0.00 0.50 0.00 0.00 46.19 44.53 1xu9 s LEU 212 CO -0.06 0.04 0.04 0.00 -1.32 0.00 0.00 176.35 175.05 1xu9 s VAL 214 N 0.51 3.59 -0.14 0.00 1.01 0.12 0.49 120.40 125.98 1xu9 s VAL 214 Ca 0.02 -1.30 -0.04 0.00 0.00 0.00 0.00 61.98 60.66 1xu9 s VAL 214 Cb -0.13 -3.09 -0.03 0.00 0.00 0.00 0.00 36.38 33.13 1xu9 s VAL 214 CO 0.01 -0.24 -0.01 -0.76 0.00 0.00 0.00 175.10 174.10 1xu9 s LEU 215 N 1.34 3.42 0.00 3.92 1.43 -1.03 -1.80 118.68 125.96 1xu9 s LEU 215 Ca -0.01 -0.02 0.00 0.00 -1.03 0.00 0.00 54.13 53.07 1xu9 s LEU 215 Cb -0.20 -1.82 0.00 0.00 0.03 0.00 0.00 46.19 44.20 1xu9 s LEU 215 CO 0.01 0.23 0.00 0.61 0.23 0.00 0.00 176.35 177.43 1xu9 n GLY 216 N 3.13 -0.43 3.68 -3.19 0.00 -0.16 -1.62 105.19 106.59 1xu9 n GLY 216 Ca -0.18 -1.59 -0.42 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 4.28 -0.02 0.99 2.96 -1.26 -4.91 118.68 120.72 1xu9 s LEU 217 Ca 0.00 2.01 0.08 0.00 -0.22 0.00 0.00 54.13 56.00 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 -0.74 -0.25 -0.63 -1.32 0.00 0.00 176.35 173.40 1xu9 s ILE 218 N 2.86 2.10 0.00 6.68 -1.09 -1.26 -0.95 121.20 129.54 1xu9 s ILE 218 Ca 0.62 -1.10 -0.01 0.00 -2.23 0.00 0.00 60.65 57.94 1xu9 s ILE 218 Cb -0.29 -1.72 -0.02 0.00 -1.58 0.00 0.00 42.46 38.84 1xu9 s ILE 218 CO 0.24 0.58 2.07 -0.90 -1.23 0.00 0.00 174.94 175.70 1xu9 n ASP 219 N 2.43 5.13 -4.76 3.58 3.85 -0.31 -4.63 116.55 121.84 1xu9 n ASP 219 Ca -0.16 -2.36 -0.33 0.00 -0.71 0.00 0.00 54.79 51.23 1xu9 n ASP 219 Cb 0.51 -1.11 0.06 0.00 -1.35 0.00 0.00 41.12 39.23 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 0.17 3.10 0.26 2.12 -4.23 -1.26 -4.81 115.64 110.98 1xu9 s THR 220 Ca 0.06 0.50 -0.02 0.00 -1.18 0.00 0.00 61.69 61.04 1xu9 s THR 220 Cb 0.03 -3.01 0.23 0.00 1.34 0.00 0.00 72.50 71.09 1xu9 s THR 220 CO 0.00 -0.33 1.80 -0.08 -0.54 0.00 0.00 174.62 175.47 1xu9 h GLU 221 N -0.15 0.73 -0.17 3.99 4.81 -1.98 -0.50 114.58 121.31 1xu9 h GLU 221 Ca -0.47 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 58.76 1xu9 h GLU 221 Cb 1.25 -0.16 -0.04 0.00 0.63 0.00 0.00 28.75 30.43 1xu9 h GLU 221 CO 0.53 0.48 -0.08 1.15 -0.73 0.00 0.00 179.01 180.36 1xu9 h THR 222 N 0.75 0.74 -0.65 0.32 2.02 -1.95 -1.03 112.91 113.12 1xu9 h THR 222 Ca 0.43 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.54 1xu9 h THR 222 Cb 0.49 0.74 -0.03 0.00 -1.74 0.00 0.00 68.15 67.61 1xu9 h THR 222 CO -0.29 0.00 0.12 0.00 0.37 0.00 0.00 175.52 175.72 1xu9 h ALA 223 N 1.09 1.00 0.00 6.16 0.00 -1.63 -1.97 119.26 123.91 1xu9 h ALA 223 Ca 0.09 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.67 1xu9 h ALA 223 Cb 0.20 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1xu9 h ALA 223 CO -0.21 0.64 -0.40 0.52 0.00 0.00 0.00 179.25 179.80 1xu9 h MET 224 N 0.98 0.00 -0.03 0.00 2.07 -0.76 -1.25 114.93 115.94 1xu9 h MET 224 Ca 0.20 0.00 -0.17 0.00 -2.07 0.00 0.00 59.70 57.67 1xu9 h MET 224 Cb 0.39 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 30.11 1xu9 h MET 224 CO 0.01 0.40 -0.72 0.87 1.07 0.00 0.00 176.91 178.53 1xu9 h LYS 225 N 0.00 0.19 0.21 1.72 1.57 -1.02 -3.36 116.57 115.88 1xu9 h LYS 225 Ca -0.00 -0.16 -0.32 0.00 -1.87 0.00 0.00 60.65 58.30 1xu9 h LYS 225 Cb 0.89 0.04 0.04 0.00 0.08 0.00 0.00 32.23 33.27 1xu9 h LYS 225 CO 0.05 0.83 -1.38 0.00 -0.57 0.00 0.00 179.45 178.38 1xu9 h ALA 226 N 1.12 -0.12 -2.03 3.86 0.00 -0.53 -3.47 119.26 118.10 1xu9 h ALA 226 Ca -0.02 -0.82 -0.46 0.00 0.00 0.00 0.00 54.91 53.61 1xu9 h ALA 226 Cb 1.28 0.16 0.10 0.00 0.00 0.00 0.00 17.79 19.32 1xu9 h ALA 226 CO 0.11 0.67 0.24 0.14 0.00 0.00 0.00 179.25 180.41 1xu9 s VAL 227 N -2.71 2.19 -0.02 0.00 -7.23 -0.56 -4.84 120.40 107.22 1xu9 s VAL 227 Ca -0.09 -0.29 0.05 0.00 -1.81 0.00 0.00 61.98 59.83 1xu9 s VAL 227 Cb 0.04 -2.90 -0.01 0.00 0.56 0.00 0.00 36.38 34.07 1xu9 s VAL 227 CO 0.94 0.00 -0.16 -0.55 -0.31 0.00 0.00 175.10 175.02 1xu9 s SER 228 N -4.64 1.92 0.80 4.85 0.15 -1.26 -4.93 113.70 110.58 1xu9 s SER 228 Ca 0.64 -0.30 0.00 0.00 0.70 0.00 0.00 55.95 56.99 1xu9 s SER 228 Cb -0.08 -0.30 0.00 0.00 -1.71 0.00 0.00 66.02 63.93 1xu9 s SER 228 CO 0.46 0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.69 1xu9 n GLY 229 N 2.82 2.30 0.10 9.45 0.00 -1.26 -2.66 105.19 115.94 1xu9 n GLY 229 Ca -0.16 -0.50 0.10 0.00 0.00 0.00 0.00 46.02 45.46 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 0.00 1.03 -0.15 -0.61 -5.35 -1.26 -1.92 119.36 111.10 1xu9 n ILE 230 Ca 0.00 0.39 0.13 0.00 -0.27 0.00 0.00 62.75 63.00 1xu9 n ILE 230 Cb 0.00 -1.31 0.48 0.00 -1.74 0.00 0.00 39.64 37.06 1xu9 n ILE 230 CO 0.00 0.00 0.00 0.58 -1.76 0.00 0.00 176.55 175.37 1xu9 h VAL 231 N 0.00 0.85 -0.92 7.28 2.07 -1.92 -0.39 116.25 123.21 1xu9 h VAL 231 Ca 0.00 -0.16 0.19 0.00 0.82 0.00 0.00 66.70 67.55 1xu9 h VAL 231 Cb 0.22 0.33 -0.07 0.00 -1.52 0.00 0.00 31.29 30.24 1xu9 h VAL 231 CO 0.00 0.09 0.60 0.45 0.02 0.00 0.00 177.57 178.73 1xu9 h HIS 232 N 0.48 0.68 -0.00 1.57 3.86 -1.57 -1.21 115.15 118.95 1xu9 h HIS 232 Ca 0.35 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.58 1xu9 h HIS 232 Cb 0.69 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 28.95 1xu9 h HIS 232 CO -0.00 0.18 -0.04 -1.33 0.86 0.00 0.00 177.93 177.60 1xu9 n MET 233 N -4.57 0.67 -0.64 2.45 2.00 -0.16 -3.24 117.12 113.64 1xu9 n MET 233 Ca 0.20 -0.11 0.08 0.00 0.00 0.00 0.00 57.70 57.87 1xu9 n MET 233 Cb 0.65 -1.50 0.34 0.00 0.00 0.00 0.00 33.22 32.70 1xu9 n MET 233 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 175.97 177.01 1xu9 n GLN 234 N -1.08 3.89 -3.30 0.03 6.02 -0.46 -4.97 117.38 117.51 1xu9 n GLN 234 Ca 0.16 -2.92 -0.35 0.00 -0.01 0.00 0.00 57.00 53.88 1xu9 n GLN 234 Cb 0.23 -1.97 -0.06 0.00 1.02 0.00 0.00 30.24 29.46 1xu9 n GLN 234 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1xu9 s ALA 235 N -2.37 3.54 0.37 -1.58 0.00 -1.20 -4.72 121.76 115.79 1xu9 s ALA 235 Ca 0.48 -0.07 -0.09 0.00 0.00 0.00 0.00 51.96 52.27 1xu9 s ALA 235 Cb 0.35 -2.58 -0.06 0.00 0.00 0.00 0.00 23.12 20.82 1xu9 s ALA 235 CO 0.17 0.43 0.71 0.00 0.00 0.00 0.00 175.76 177.06 1xu9 s ALA 236 N -1.50 3.42 0.11 0.00 0.00 -0.13 -4.78 121.76 118.88 1xu9 s ALA 236 Ca 0.39 -0.27 -0.31 0.00 0.00 0.00 0.00 51.96 51.77 1xu9 s ALA 236 Cb -0.15 -2.60 -0.08 0.00 0.00 0.00 0.00 23.12 20.29 1xu9 s ALA 236 CO 0.19 0.09 1.34 -1.25 0.00 0.00 0.00 175.76 176.14 1xu9 s PRO 237 N -3.68 4.35 0.45 0.00 0.05 -1.26 -1.17 135.00 133.74 1xu9 s PRO 237 Ca 0.50 2.01 0.11 0.00 0.05 0.00 0.00 61.00 63.67 1xu9 s PRO 237 Cb -0.10 -3.26 1.01 0.00 0.05 0.00 0.00 34.50 32.19 1xu9 s PRO 237 CO 0.30 -0.38 2.07 1.57 0.05 0.00 0.00 177.00 180.60 1xu9 h LYS 238 N 6.68 0.26 -0.38 4.56 2.10 -1.93 -1.54 116.57 126.32 1xu9 h LYS 238 Ca -0.42 -0.02 -0.05 0.00 -2.00 0.00 0.00 60.65 58.15 1xu9 h LYS 238 Cb 1.21 -0.06 -0.01 0.00 -0.90 0.00 0.00 32.23 32.47 1xu9 h LYS 238 CO 0.85 0.22 0.04 1.49 -2.00 0.00 0.00 179.45 180.05 1xu9 h GLU 239 N 0.27 0.65 -0.36 0.07 4.81 -1.95 -1.50 114.58 116.55 1xu9 h GLU 239 Ca 0.07 -0.19 -0.08 0.00 -0.13 0.00 0.00 59.36 59.03 1xu9 h GLU 239 Cb 0.05 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 1xu9 h GLU 239 CO -0.01 0.72 -0.10 1.49 -0.73 0.00 0.00 179.01 180.38 1xu9 h GLU 240 N 0.48 0.71 -0.23 1.92 4.81 -1.87 -2.63 114.58 117.78 1xu9 h GLU 240 Ca 0.11 -0.28 0.05 0.00 -0.13 0.00 0.00 59.36 59.12 1xu9 h GLU 240 Cb 0.40 -0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.69 1xu9 h GLU 240 CO 0.01 0.87 -0.13 0.00 -0.73 0.00 0.00 179.01 179.03 1xu9 h ALA 242 N 1.05 0.92 -0.53 0.00 0.00 -1.21 -1.76 119.26 117.74 1xu9 h ALA 242 Ca 0.13 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 1xu9 h ALA 242 Cb 0.30 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1xu9 h ALA 242 CO -0.30 -0.01 0.10 1.25 0.00 0.00 0.00 179.25 180.29 1xu9 h LEU 243 N 0.63 0.82 -1.33 0.00 5.85 -1.04 -2.12 115.31 118.13 1xu9 h LEU 243 Ca 0.32 -0.25 -0.04 0.00 0.84 0.00 0.00 57.88 58.75 1xu9 h LEU 243 Cb 0.27 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 1xu9 h LEU 243 CO -0.23 0.86 0.01 -0.33 -0.34 0.00 0.00 178.44 178.42 1xu9 h GLU 244 N 0.75 0.46 -0.13 1.25 4.39 -0.76 0.40 114.58 120.95 1xu9 h GLU 244 Ca 0.16 -0.09 -0.01 0.00 0.34 0.00 0.00 59.36 59.76 1xu9 h GLU 244 Cb 0.38 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.95 1xu9 h GLU 244 CO 0.01 0.48 0.03 0.82 -1.16 0.00 0.00 179.01 179.18 1xu9 h ILE 245 N 0.45 1.21 -0.62 3.13 2.04 -1.11 -1.37 117.51 121.24 1xu9 h ILE 245 Ca 0.10 -0.66 -0.00 0.00 1.00 0.00 0.00 64.86 65.30 1xu9 h ILE 245 Cb 0.28 1.41 -0.03 0.00 -0.74 0.00 0.00 36.82 37.74 1xu9 h ILE 245 CO 0.01 0.19 0.37 0.40 0.00 0.00 0.00 178.15 179.12 1xu9 h ILE 246 N -0.01 1.18 -0.48 -0.67 2.04 -0.87 -1.91 117.51 116.79 1xu9 h ILE 246 Ca 0.04 -0.40 -0.00 0.00 1.00 0.00 0.00 64.86 65.50 1xu9 h ILE 246 Cb 0.28 0.33 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 1xu9 h ILE 246 CO 0.00 0.19 0.29 0.11 0.00 0.00 0.00 178.15 178.73 1xu9 h LYS 247 N 0.83 0.66 -0.48 2.37 1.57 -0.84 -0.00 116.57 120.69 1xu9 h LYS 247 Ca 0.22 -0.06 0.02 0.00 -1.87 0.00 0.00 60.65 58.96 1xu9 h LYS 247 Cb -0.02 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.12 1xu9 h LYS 247 CO -0.04 0.49 0.29 0.78 -0.57 0.00 0.00 179.45 180.40 1xu9 h GLY 248 N 0.65 0.67 0.93 3.86 0.00 -1.00 -1.08 103.07 107.09 1xu9 h GLY 248 Ca 0.17 -0.22 -0.02 0.00 0.00 0.00 0.00 47.33 47.27 1xu9 h GLY 248 CO -0.03 0.19 0.13 -1.33 0.00 0.00 0.00 176.54 175.50 1xu9 h GLY 249 N 0.58 0.53 1.35 4.60 0.00 -1.03 -1.53 103.07 107.57 1xu9 h GLY 249 Ca 0.19 -0.29 -0.02 0.00 0.00 0.00 0.00 47.33 47.21 1xu9 h GLY 249 CO -0.08 0.27 0.31 0.00 0.00 0.00 0.00 176.54 177.04 1xu9 h ALA 250 N 0.98 1.40 -0.04 3.60 0.00 -0.74 -2.08 119.26 122.39 1xu9 h ALA 250 Ca 0.11 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1xu9 h ALA 250 Cb 0.18 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1xu9 h ALA 250 CO -0.01 0.48 0.00 1.28 0.00 0.00 0.00 179.25 181.00 1xu9 n LEU 251 N -4.37 1.13 -2.63 0.00 4.77 -0.43 -4.92 117.00 110.55 1xu9 n LEU 251 Ca 0.06 -0.40 -0.20 0.00 -0.03 0.00 0.00 56.01 55.43 1xu9 n LEU 251 Cb 0.12 -0.02 0.02 0.00 -2.33 0.00 0.00 43.42 41.21 1xu9 n LEU 251 CO 0.38 0.20 -0.08 0.54 -1.33 0.00 0.00 177.39 177.09 1xu9 n ARG 252 N -0.10 -3.61 -2.22 3.23 1.74 -0.78 -1.30 116.66 113.62 1xu9 n ARG 252 Ca 0.19 0.89 -0.38 0.00 -0.77 0.00 0.00 57.85 57.78 1xu9 n ARG 252 Cb 0.28 -5.58 -0.01 0.00 -1.02 0.00 0.00 32.46 26.14 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 -5.41 3.86 0.10 5.56 -0.21 -0.64 -3.80 119.66 119.11 1xu9 s GLN 253 Ca 0.19 1.87 -0.14 0.00 0.02 0.00 0.00 55.36 57.30 1xu9 s GLN 253 Cb -0.08 -2.54 -0.12 0.00 1.00 0.00 0.00 33.01 31.27 1xu9 s GLN 253 CO 0.24 -0.49 1.36 0.93 -2.12 0.00 0.00 175.29 175.20 1xu9 h GLU 254 N 2.31 0.75 -4.00 2.91 5.08 -1.89 -3.34 114.58 116.40 1xu9 h GLU 254 Ca -0.49 -0.50 -0.20 0.00 -1.00 0.00 0.00 59.36 57.16 1xu9 h GLU 254 Cb 1.25 0.07 -0.23 0.00 0.50 0.00 0.00 28.75 30.33 1xu9 h GLU 254 CO 0.61 1.12 -0.71 -1.21 -1.00 0.00 0.00 179.01 177.82 1xu9 s GLU 255 N -4.03 0.26 -0.09 2.33 2.02 -1.26 -0.83 118.70 117.10 1xu9 s GLU 255 Ca -0.11 -0.45 0.04 0.00 0.02 0.00 0.00 54.97 54.47 1xu9 s GLU 255 Cb 0.09 0.01 -0.00 0.00 0.10 0.00 0.00 34.13 34.32 1xu9 s GLU 255 CO 0.87 -0.02 -0.24 0.08 0.02 0.00 0.00 175.26 175.97 1xu9 s VAL 256 N -1.01 2.02 -0.15 2.63 1.01 -0.45 -4.92 120.40 119.54 1xu9 s VAL 256 Ca -0.10 -1.01 0.01 0.00 0.00 0.00 0.00 61.98 60.88 1xu9 s VAL 256 Cb -0.07 -1.74 0.00 0.00 0.00 0.00 0.00 36.38 34.57 1xu9 s VAL 256 CO -0.01 0.55 -0.18 -0.31 0.00 0.00 0.00 175.10 175.15 1xu9 s TYR 257 N 0.22 2.72 -0.04 5.22 1.51 -1.26 0.15 117.35 125.88 1xu9 s TYR 257 Ca -0.15 -1.16 -0.00 0.00 -1.01 0.00 0.00 57.07 54.75 1xu9 s TYR 257 Cb -0.17 -1.85 0.03 0.00 -0.11 0.00 0.00 41.96 39.86 1xu9 s TYR 257 CO 0.07 -0.52 0.00 -0.47 -1.11 0.00 0.00 175.55 173.52 1xu9 s TYR 258 N 0.78 0.41 0.16 2.71 6.14 -0.74 -4.97 117.35 121.83 1xu9 s TYR 258 Ca -0.07 -0.03 -0.21 0.00 0.64 0.00 0.00 57.07 57.41 1xu9 s TYR 258 Cb -0.16 -0.54 0.06 0.00 0.42 0.00 0.00 41.96 41.74 1xu9 s TYR 258 CO -0.00 -0.19 0.54 0.34 0.64 0.00 0.00 175.55 176.88 1xu9 s ASP 259 N 1.38 -0.44 0.51 4.32 -1.08 -1.26 -0.99 116.67 119.10 1xu9 s ASP 259 Ca -0.05 -0.14 0.34 0.00 -0.52 0.00 0.00 52.55 52.18 1xu9 s ASP 259 Cb -0.13 0.56 1.57 0.00 -1.46 0.00 0.00 42.92 43.46 1xu9 s ASP 259 CO -0.02 -0.95 2.01 0.77 0.52 0.00 0.00 175.17 177.49 1xu9 h SER 260 N 2.12 0.00 -4.04 -0.34 4.64 -1.84 -3.44 113.55 110.65 1xu9 h SER 260 Ca -0.33 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.36 1xu9 h SER 260 Cb 1.29 0.00 -0.31 0.00 -0.31 0.00 0.00 62.40 63.07 1xu9 h SER 260 CO 0.40 0.00 -0.86 -0.55 -0.87 0.00 0.00 176.83 174.95 1xu9 s SER 261 N -5.11 2.60 0.49 4.97 0.15 -1.26 -5.01 113.70 110.54 1xu9 s SER 261 Ca -0.00 -0.43 0.25 0.00 0.70 0.00 0.00 55.95 56.47 1xu9 s SER 261 Cb 0.10 -0.65 1.30 0.00 -1.71 0.00 0.00 66.02 65.06 1xu9 s SER 261 CO 0.44 0.21 2.02 -0.07 1.20 0.00 0.00 173.24 177.04 1xu9 h LEU 262 N 6.07 0.00 -1.16 3.45 3.38 -1.99 -2.01 115.31 123.05 1xu9 h LEU 262 Ca -0.33 0.00 0.07 0.00 0.09 0.00 0.00 57.88 57.71 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 0.47 0.16 0.59 -0.50 0.09 0.00 0.00 178.44 179.25 1xu9 h TRP 263 N 0.00 1.03 0.24 1.13 4.06 -1.99 -1.04 115.95 119.37 1xu9 h TRP 263 Ca -0.00 0.03 -0.01 0.00 2.06 0.00 0.00 58.89 60.96 1xu9 h TRP 263 Cb 0.41 -0.34 0.00 0.00 -1.00 0.00 0.00 29.16 28.23 1xu9 h TRP 263 CO 0.00 0.52 -0.11 1.15 -3.56 0.00 0.00 178.44 176.44 1xu9 h THR 264 N 1.00 0.58 -0.04 1.49 2.02 -1.79 -2.65 112.91 113.51 1xu9 h THR 264 Ca 0.39 -0.95 -0.09 0.00 0.77 0.00 0.00 66.41 66.54 1xu9 h THR 264 Cb 0.24 0.96 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 1xu9 h THR 264 CO -0.15 0.15 -0.37 0.71 0.37 0.00 0.00 175.52 176.22 1xu9 h THR 265 N -0.94 1.28 0.13 3.16 1.35 -1.42 -1.38 112.91 115.09 1xu9 h THR 265 Ca -0.03 -1.34 -0.25 0.00 -0.55 0.00 0.00 66.41 64.24 1xu9 h THR 265 Cb 0.48 1.67 0.03 0.00 -1.73 0.00 0.00 68.15 68.60 1xu9 h THR 265 CO 0.05 0.39 -1.05 -0.07 -0.25 0.00 0.00 175.52 174.59 1xu9 h LEU 266 N 0.07 0.70 0.00 3.87 3.38 -1.32 -3.35 115.31 118.67 1xu9 h LEU 266 Ca 0.01 -0.86 -0.10 0.00 0.09 0.00 0.00 57.88 57.01 1xu9 h LEU 266 Cb 0.70 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1xu9 h LEU 266 CO 0.05 1.50 -0.54 -0.07 0.09 0.00 0.00 178.44 179.48 1xu9 h LEU 267 N 0.01 0.00 -0.31 1.67 3.38 -1.34 -3.27 115.31 115.45 1xu9 h LEU 267 Ca -0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1xu9 h LEU 267 Cb 1.77 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.52 1xu9 h LEU 267 CO 0.20 0.46 0.00 -0.29 0.09 0.00 0.00 178.44 178.90 1xu9 h ILE 268 N 0.00 0.00 -3.90 1.22 6.09 -1.41 -3.45 117.51 116.07 1xu9 h ILE 268 Ca -0.02 -0.88 -0.53 0.00 -1.37 0.00 0.00 64.86 62.06 1xu9 h ILE 268 Cb 1.36 1.88 0.10 0.00 0.47 0.00 0.00 36.82 40.63 1xu9 h ILE 268 CO 0.06 0.00 0.75 -0.13 -3.07 0.00 0.00 178.15 175.76 1xu9 s ARG 269 N -3.30 4.17 -0.68 2.19 0.52 -1.24 -4.97 118.95 115.63 1xu9 s ARG 269 Ca 0.06 2.48 0.05 0.00 -0.52 0.00 0.00 55.73 57.81 1xu9 s ARG 269 Cb 0.06 -3.00 0.22 0.00 0.52 0.00 0.00 34.95 32.75 1xu9 s ARG 269 CO 0.64 -0.45 0.65 -1.71 0.02 0.00 0.00 175.30 174.45 1xu9 n ASN 270 N 0.64 3.51 0.29 0.23 4.05 -1.26 -4.94 115.26 117.78 1xu9 n ASN 270 Ca 0.01 -3.35 0.14 0.00 0.45 0.00 0.00 54.58 51.83 1xu9 n ASN 270 Cb 0.40 -0.72 0.86 0.00 1.23 0.00 0.00 39.78 41.55 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 4.73 0.00 -0.58 1.20 0.13 -1.98 -2.35 132.00 133.15 1xu9 h PRO 271 Ca 0.18 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.32 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 0.80 0.01 0.38 0.77 -0.23 0.00 0.00 178.00 179.73 1xu9 h SER 272 N 0.00 0.64 -0.03 1.44 0.02 -1.99 -2.14 113.55 111.49 1xu9 h SER 272 Ca -0.00 -0.01 0.01 0.00 -0.84 0.00 0.00 61.79 60.94 1xu9 h SER 272 Cb 0.03 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 1xu9 h SER 272 CO 0.00 0.46 -0.02 -0.09 -1.14 0.00 0.00 176.83 176.04 1xu9 h ARG 273 N 0.75 -0.01 -0.23 3.45 2.43 -1.86 -1.15 114.38 117.77 1xu9 h ARG 273 Ca 0.22 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.30 1xu9 h ARG 273 Cb -0.04 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.50 1xu9 h ARG 273 CO -0.05 -0.01 -0.23 0.87 -1.51 0.00 0.00 179.97 179.04 1xu9 h LYS 274 N -0.01 0.43 -0.09 0.20 1.79 -1.59 -0.39 116.57 116.90 1xu9 h LYS 274 Ca 0.02 -0.15 -0.00 0.00 -2.18 0.00 0.00 60.65 58.34 1xu9 h LYS 274 Cb 0.04 -0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 30.66 1xu9 h LYS 274 CO -0.04 0.64 0.05 0.82 -1.08 0.00 0.00 179.45 179.84 1xu9 h ILE 275 N 0.38 1.07 -0.54 1.86 2.04 -1.23 -1.47 117.51 119.63 1xu9 h ILE 275 Ca 0.06 -0.20 -0.11 0.00 1.00 0.00 0.00 64.86 65.61 1xu9 h ILE 275 Cb 0.62 1.05 -0.02 0.00 -0.74 0.00 0.00 36.82 37.72 1xu9 h ILE 275 CO 0.04 0.07 -0.09 -0.07 0.00 0.00 0.00 178.15 178.10 1xu9 h LEU 276 N 0.07 0.98 -0.86 1.44 3.38 -0.89 -0.06 115.31 119.37 1xu9 h LEU 276 Ca 0.03 -0.31 0.05 0.00 0.09 0.00 0.00 57.88 57.74 1xu9 h LEU 276 Cb 0.06 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.49 1xu9 h LEU 276 CO -0.01 1.08 0.54 -0.33 0.09 0.00 0.00 178.44 179.82 1xu9 h GLU 277 N 0.89 0.99 -0.28 1.13 5.08 -0.94 0.11 114.58 121.55 1xu9 h GLU 277 Ca 0.14 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.40 1xu9 h GLU 277 Cb 0.63 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 1xu9 h GLU 277 CO 0.04 0.65 -0.02 0.35 -1.00 0.00 0.00 179.01 179.04 1xu9 h PHE 278 N 1.02 0.55 -0.22 4.33 3.57 -0.75 -2.48 116.94 122.96 1xu9 h PHE 278 Ca 0.36 -0.10 -0.07 0.00 3.53 0.00 0.00 57.97 61.68 1xu9 h PHE 278 Cb 0.09 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.68 1xu9 h PHE 278 CO -0.03 0.66 -0.18 -0.07 -2.23 0.00 0.00 178.31 176.46 1xu9 h LEU 279 N 0.28 0.38 -0.17 0.59 3.38 -0.63 -2.55 115.31 116.58 1xu9 h LEU 279 Ca 0.08 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1xu9 h LEU 279 Cb 0.45 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1xu9 h LEU 279 CO 0.02 0.58 0.00 1.88 0.09 0.00 0.00 178.44 181.01 1xu9 h TYR 280 N 0.35 0.00 0.00 1.13 0.99 -0.69 -3.35 116.97 115.40 1xu9 h TYR 280 Ca 0.06 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.78 1xu9 h TYR 280 Cb 0.53 0.00 -0.00 0.00 1.00 0.00 0.00 36.73 38.25 1xu9 h TYR 280 CO 0.01 0.00 -0.05 0.66 -0.00 0.00 0.00 178.16 178.79 1xu9 h SER 281 N 0.00 0.00 1.25 3.88 4.64 -1.00 -2.84 113.55 119.48 1xu9 h SER 281 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xu9 h SER 281 Cb 0.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 1xu9 h SER 281 CO 0.00 0.05 0.00 0.71 -0.87 0.00 0.00 176.83 176.72 1xu9 h THR 282 N 0.00 0.00 -0.14 2.95 1.35 -1.74 -3.32 112.91 112.00 1xu9 h THR 282 Ca -0.00 -0.43 0.00 0.00 -0.55 0.00 0.00 66.41 65.43 1xu9 h THR 282 Cb 0.58 1.35 0.00 0.00 -1.73 0.00 0.00 68.15 68.35 1xu9 h THR 282 CO 0.01 0.00 0.00 -1.20 -0.25 0.00 0.00 175.52 174.08 1xu9 n SER 283 N -2.34 1.85 -4.20 5.36 7.64 -1.07 -4.84 113.62 116.01 1xu9 n SER 283 Ca 0.04 -1.70 -0.22 0.00 1.01 0.00 0.00 58.87 58.01 1xu9 n SER 283 Cb 0.37 -0.09 -0.13 0.00 -1.01 0.00 0.00 64.21 63.35 1xu9 n SER 283 CO 0.00 0.00 0.00 -0.72 -3.01 0.00 0.00 175.04 171.31 1xu9 s TYR 284 N -1.83 1.46 -0.38 1.43 1.13 -1.25 -5.12 117.35 112.79 1xu9 s TYR 284 Ca 0.34 -0.39 -0.10 0.00 -1.41 0.00 0.00 57.07 55.51 1xu9 s TYR 284 Cb 0.19 -0.85 0.04 0.00 -1.10 0.00 0.00 41.96 40.24 1xu9 s TYR 284 CO 0.29 0.08 0.21 1.21 -2.51 0.00 0.00 175.55 174.83 1xu9 s ASN 285 N -1.40 5.68 0.00 -0.18 3.04 -1.26 -4.96 114.94 115.86 1xu9 s ASN 285 Ca 0.03 -1.12 0.22 0.00 0.04 0.00 0.00 52.86 52.03 1xu9 s ASN 285 Cb -0.09 -2.00 0.77 0.00 -1.54 0.00 0.00 41.25 38.38 1xu9 s ASN 285 CO 0.02 -0.42 1.57 0.23 -3.04 0.00 0.00 177.10 175.46 1xu9 n MET 286 N 4.97 1.80 0.03 0.43 2.81 -1.26 -4.44 117.12 121.46 1xu9 n MET 286 Ca -0.12 -1.19 0.03 0.00 -1.81 0.00 0.00 57.70 54.62 1xu9 n MET 286 Cb 0.45 -1.42 0.42 0.00 -0.71 0.00 0.00 33.22 31.96 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 2.49 0.41 -0.56 7.83 5.19 -2.01 0.55 116.42 130.33 1xu9 h ASP 287 Ca 0.00 -0.03 0.09 0.00 -0.62 0.00 0.00 57.03 56.47 1xu9 h ASP 287 Cb 0.54 -0.10 -0.03 0.00 0.18 0.00 0.00 39.33 39.92 1xu9 h ASP 287 CO 0.00 0.35 0.38 0.03 -3.12 0.00 0.00 179.24 176.88 1xu9 h ARG 288 N 0.47 0.39 -0.02 3.56 3.08 -2.04 -3.55 114.38 116.27 1xu9 h ARG 288 Ca 0.12 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.15 1xu9 h ARG 288 Cb 0.05 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.01 1xu9 h ARG 288 CO -0.02 0.26 0.00 1.19 -1.07 0.00 0.00 179.97 180.33