#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hi9 s LYS 2 N 0.00 4.39 -0.09 3.17 1.02 -1.26 -1.58 119.74 125.38 1hi9 s LYS 2 Ca 0.00 0.68 0.04 0.00 0.02 0.00 0.00 55.97 56.71 1hi9 s LYS 2 Cb 0.00 -3.44 -0.01 0.00 -0.52 0.00 0.00 37.83 33.86 1hi9 s LYS 2 CO 0.00 0.13 -0.20 -1.17 -0.92 0.00 0.00 175.35 173.18 1hi9 s LEU 3 N 0.66 2.33 -0.15 3.17 1.98 0.02 -0.56 118.68 126.12 1hi9 s LEU 3 Ca 0.32 -0.44 -0.07 0.00 -2.89 0.00 0.00 54.13 51.05 1hi9 s LEU 3 Cb -0.17 -1.47 -0.04 0.00 0.66 0.00 0.00 46.19 45.17 1hi9 s LEU 3 CO 0.15 0.21 0.10 -0.47 -1.89 0.00 0.00 176.35 174.45 1hi9 s TYR 4 N 0.05 3.41 -0.09 5.38 5.04 -0.47 -1.47 117.35 129.19 1hi9 s TYR 4 Ca -0.08 0.32 0.03 0.00 -2.44 0.00 0.00 57.07 54.90 1hi9 s TYR 4 Cb -0.15 -2.02 0.01 0.00 0.35 0.00 0.00 41.96 40.15 1hi9 s TYR 4 CO 0.05 0.44 -0.17 -1.64 -1.34 0.00 0.00 175.55 172.89 1hi9 s MET 5 N -0.28 2.26 -0.22 4.97 -1.94 0.86 0.03 119.30 124.98 1hi9 s MET 5 Ca 0.10 -0.60 -0.02 0.00 -1.71 0.00 0.00 55.69 53.46 1hi9 s MET 5 Cb -0.12 -1.81 0.01 0.00 2.01 0.00 0.00 34.83 34.92 1hi9 s MET 5 CO 0.01 0.05 -0.08 0.45 -0.01 0.00 0.00 175.02 175.44 1hi9 s SER 6 N 0.65 4.06 -0.23 3.03 0.15 -0.57 -0.46 113.70 120.32 1hi9 s SER 6 Ca -0.14 -0.61 -0.02 0.00 0.70 0.00 0.00 55.95 55.88 1hi9 s SER 6 Cb -0.16 -1.66 0.01 0.00 -1.71 0.00 0.00 66.02 62.50 1hi9 s SER 6 CO 0.04 -0.05 -0.07 -0.69 1.20 0.00 0.00 173.24 173.67 1hi9 s VAL 7 N 1.39 2.94 0.59 4.45 1.01 -0.66 -0.66 120.40 129.46 1hi9 s VAL 7 Ca 0.04 -0.85 0.09 0.00 0.00 0.00 0.00 61.98 61.26 1hi9 s VAL 7 Cb -0.15 -2.42 0.09 0.00 0.00 0.00 0.00 36.38 33.91 1hi9 s VAL 7 CO -0.06 0.31 0.77 -0.62 0.00 0.00 0.00 175.10 175.50 1hi9 s ASP 8 N 1.37 4.98 -0.10 3.32 -1.08 0.46 -0.38 116.67 125.24 1hi9 s ASP 8 Ca 0.03 -0.95 0.00 0.00 -0.52 0.00 0.00 52.55 51.11 1hi9 s ASP 8 Cb -0.15 0.43 -0.06 0.00 -1.46 0.00 0.00 42.92 41.68 1hi9 s ASP 8 CO -0.05 -1.39 -0.09 0.23 0.52 0.00 0.00 175.17 174.39 1hi9 n MET 9 N -2.24 0.25 -0.18 4.34 2.81 -1.23 -4.35 117.12 116.53 1hi9 n MET 9 Ca 0.14 0.06 0.22 0.00 -1.81 0.00 0.00 57.70 56.32 1hi9 n MET 9 Cb 0.62 -1.18 0.61 0.00 -0.71 0.00 0.00 33.22 32.57 1hi9 n MET 9 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1hi9 h GLU 10 N -0.03 0.20 -0.01 0.03 3.07 -1.92 0.59 114.58 116.51 1hi9 h GLU 10 Ca -0.23 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.62 1hi9 h GLU 10 Cb 1.34 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 29.20 1hi9 h GLU 10 CO -0.05 0.13 -0.08 0.41 -1.40 0.00 0.00 179.01 178.03 1hi9 n GLY 11 N -1.60 -0.22 3.73 -3.84 0.00 -0.09 -4.91 105.19 98.26 1hi9 n GLY 11 Ca 0.17 -0.42 -0.37 0.00 0.00 0.00 0.00 46.02 45.40 1hi9 n GLY 11 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hi9 s ILE 12 N -2.17 2.03 0.51 -0.61 -1.09 0.20 -4.14 121.20 115.92 1hi9 s ILE 12 Ca 0.34 0.02 -0.21 0.00 -2.23 0.00 0.00 60.65 58.56 1hi9 s ILE 12 Cb 0.20 -3.01 -0.06 0.00 -1.58 0.00 0.00 42.46 38.02 1hi9 s ILE 12 CO 0.40 -0.00 1.18 -0.94 -1.23 0.00 0.00 174.94 174.34 1hi9 s SER 13 N -1.31 5.83 0.00 3.58 1.04 -1.26 -3.24 113.70 118.35 1hi9 s SER 13 Ca 0.81 2.33 0.00 0.00 0.48 0.00 0.00 55.95 59.57 1hi9 s SER 13 Cb -0.38 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.14 1hi9 s SER 13 CO 0.41 -1.15 0.00 0.61 0.98 0.00 0.00 173.24 174.09 1hi9 n GLY 14 N 0.41 2.99 3.60 7.32 0.00 -1.26 -4.96 105.19 113.28 1hi9 n GLY 14 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 1hi9 n GLY 14 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hi9 s LEU 15 N 0.00 4.01 -0.08 0.99 1.43 -1.20 -4.93 118.68 118.90 1hi9 s LEU 15 Ca 0.00 0.49 0.07 0.00 -1.03 0.00 0.00 54.13 53.66 1hi9 s LEU 15 Cb 0.00 -3.22 -0.24 0.00 0.03 0.00 0.00 46.19 42.76 1hi9 s LEU 15 CO 0.00 -0.87 0.52 -0.81 0.23 0.00 0.00 176.35 175.42 1hi9 n PRO 16 N 6.79 0.67 -3.79 1.29 -0.04 -1.26 -4.91 135.00 133.75 1hi9 n PRO 16 Ca 0.06 0.26 -0.15 0.00 -0.04 0.00 0.00 63.50 63.64 1hi9 n PRO 16 Cb 0.48 -1.75 -0.05 0.00 -0.04 0.00 0.00 33.50 32.14 1hi9 n PRO 16 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1hi9 n ASP 17 N -3.16 -0.80 0.00 3.54 5.75 -1.26 -3.51 116.55 117.12 1hi9 n ASP 17 Ca -0.23 -2.77 0.08 0.00 -0.01 0.00 0.00 54.79 51.86 1hi9 n ASP 17 Cb 1.06 1.68 0.37 0.00 -1.03 0.00 0.00 41.12 43.20 1hi9 n ASP 17 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 1hi9 n ASP 18 N -1.82 0.00 0.20 -1.12 5.75 -1.26 -2.40 116.55 115.90 1hi9 n ASP 18 Ca 0.04 0.35 0.14 0.00 -0.01 0.00 0.00 54.79 55.32 1hi9 n ASP 18 Cb 0.51 -0.43 0.65 0.00 -1.03 0.00 0.00 41.12 40.82 1hi9 n ASP 18 CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 1hi9 h THR 19 N 0.00 0.00 0.00 2.12 1.35 -1.95 -0.14 112.91 114.29 1hi9 h THR 19 Ca 0.00 -0.23 0.00 0.00 -0.55 0.00 0.00 66.41 65.63 1hi9 h THR 19 Cb 0.24 1.02 0.00 0.00 -1.73 0.00 0.00 68.15 67.68 1hi9 h THR 19 CO 0.00 0.00 -1.09 0.49 -0.25 0.00 0.00 175.52 174.67 1hi9 n PHE 20 N -2.56 0.08 0.02 4.73 3.01 -1.01 -1.15 117.46 120.59 1hi9 n PHE 20 Ca 0.00 0.02 0.00 0.00 1.01 0.00 0.00 57.45 58.49 1hi9 n PHE 20 Cb 0.19 -0.23 -0.00 0.00 -0.01 0.00 0.00 39.48 39.43 1hi9 n PHE 20 CO 0.00 0.00 0.00 1.33 1.01 0.00 0.00 176.76 179.10 1hi9 n VAL 21 N -1.75 0.00 -3.17 -4.37 0.24 -0.75 -4.30 118.33 104.24 1hi9 n VAL 21 Ca 0.02 -0.49 -0.42 0.00 -2.04 0.00 0.00 64.34 61.42 1hi9 n VAL 21 Cb 0.40 1.00 -0.07 0.00 -1.47 0.00 0.00 33.84 33.69 1hi9 n VAL 21 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1hi9 s ASP 22 N -1.05 6.35 0.62 -1.34 -1.08 -0.14 -4.92 116.67 115.11 1hi9 s ASP 22 Ca 0.00 -0.06 0.27 0.00 -0.52 0.00 0.00 52.55 52.24 1hi9 s ASP 22 Cb 0.00 -2.30 1.39 0.00 -1.46 0.00 0.00 42.92 40.56 1hi9 s ASP 22 CO 0.02 -0.59 1.80 0.77 0.52 0.00 0.00 175.17 177.69 1hi9 h SER 23 N 8.57 0.00 -0.37 -0.34 4.64 -1.93 0.25 113.55 124.37 1hi9 h SER 23 Ca -0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 1hi9 h SER 23 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1hi9 h SER 23 CO 0.82 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.39 1hi9 n GLY 24 N -1.42 0.85 3.58 -0.77 0.00 -1.26 -4.92 105.19 101.24 1hi9 n GLY 24 Ca 0.05 -0.45 -0.25 0.00 0.00 0.00 0.00 46.02 45.37 1hi9 n GLY 24 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hi9 s LYS 25 N -1.51 2.09 0.38 1.61 1.02 0.88 -5.05 119.74 119.16 1hi9 s LYS 25 Ca 0.29 -1.39 0.21 0.00 0.02 0.00 0.00 55.97 55.09 1hi9 s LYS 25 Cb 0.15 -2.11 1.24 0.00 -0.52 0.00 0.00 37.83 36.59 1hi9 s LYS 25 CO 0.20 0.40 1.64 -0.09 -0.92 0.00 0.00 175.35 176.58 1hi9 h ARG 26 N 2.46 0.19 -0.64 1.68 2.43 -1.86 -1.88 114.38 116.75 1hi9 h ARG 26 Ca -0.45 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.71 1hi9 h ARG 26 Cb 1.23 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 1hi9 h ARG 26 CO 0.57 0.12 0.00 0.09 -1.51 0.00 0.00 179.97 179.24 1hi9 n ASN 27 N -4.97 3.98 -0.04 -3.80 3.02 -0.30 -4.59 115.26 108.55 1hi9 n ASN 27 Ca 0.34 -2.13 -0.09 0.00 -0.03 0.00 0.00 54.58 52.67 1hi9 n ASN 27 Cb 1.17 -0.47 -0.03 0.00 -0.61 0.00 0.00 39.78 39.84 1hi9 n ASN 27 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 1hi9 h TYR 28 N 3.81 0.18 -0.82 3.10 3.20 -0.39 -1.49 116.97 124.57 1hi9 h TYR 28 Ca 0.00 0.01 0.06 0.00 3.14 0.00 0.00 58.73 61.94 1hi9 h TYR 28 Cb 1.07 -0.05 -0.05 0.00 1.54 0.00 0.00 36.73 39.23 1hi9 h TYR 28 CO 0.51 0.10 0.53 0.93 -1.64 0.00 0.00 178.16 178.60 1hi9 h GLU 29 N 0.21 0.89 -0.29 1.82 5.08 -1.81 0.01 114.58 120.50 1hi9 h GLU 29 Ca 0.08 -0.05 -0.16 0.00 -1.00 0.00 0.00 59.36 58.23 1hi9 h GLU 29 Cb 0.02 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.07 1hi9 h GLU 29 CO -0.06 0.59 -0.48 0.00 -1.00 0.00 0.00 179.01 178.06 1hi9 h ARG 30 N 0.92 0.78 -0.13 2.33 3.08 -1.83 -2.96 114.38 116.57 1hi9 h ARG 30 Ca 0.35 -0.45 0.01 0.00 0.07 0.00 0.00 59.98 59.96 1hi9 h ARG 30 Cb 0.19 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 1hi9 h ARG 30 CO -0.12 1.08 0.03 0.78 -1.07 0.00 0.00 179.97 180.68 1hi9 h GLY 31 N 0.86 0.15 2.00 0.04 0.00 0.01 -1.42 103.07 104.70 1hi9 h GLY 31 Ca 0.03 -0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.33 1hi9 h GLY 31 CO 0.10 0.01 -0.08 0.07 0.00 0.00 0.00 176.54 176.65 1hi9 h ARG 32 N 0.09 0.00 0.01 4.80 0.11 -1.12 0.43 114.38 118.71 1hi9 h ARG 32 Ca 0.05 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.13 1hi9 h ARG 32 Cb 0.04 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.12 1hi9 h ARG 32 CO -0.06 0.08 -0.00 1.25 0.10 0.00 0.00 179.97 181.33 1hi9 h LEU 33 N 0.00 -0.01 -0.83 0.08 6.46 -1.27 -1.23 115.31 118.51 1hi9 h LEU 33 Ca -0.00 -0.58 -0.01 0.00 -0.12 0.00 0.00 57.88 57.17 1hi9 h LEU 33 Cb 0.52 0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 40.41 1hi9 h LEU 33 CO 0.01 0.58 0.49 0.40 -0.62 0.00 0.00 178.44 179.31 1hi9 h ILE 34 N -0.61 1.24 -0.38 4.05 2.04 -0.91 -1.62 117.51 121.32 1hi9 h ILE 34 Ca -0.00 -0.53 0.01 0.00 1.00 0.00 0.00 64.86 65.34 1hi9 h ILE 34 Cb 0.60 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.73 1hi9 h ILE 34 CO 0.00 0.25 0.24 -0.03 0.00 0.00 0.00 178.15 178.61 1hi9 h MET 35 N 1.15 0.47 -0.49 2.37 4.05 -0.89 0.14 114.93 121.72 1hi9 h MET 35 Ca 0.30 -0.03 -0.03 0.00 -0.28 0.00 0.00 59.70 59.66 1hi9 h MET 35 Cb -0.03 -0.11 -0.02 0.00 -0.80 0.00 0.00 31.60 30.64 1hi9 h MET 35 CO -0.05 0.31 0.20 1.15 0.23 0.00 0.00 176.91 178.74 1hi9 h THR 36 N 0.48 1.21 -0.41 -0.77 2.02 -0.91 -2.03 112.91 112.49 1hi9 h THR 36 Ca 0.14 -0.64 -0.09 0.00 0.77 0.00 0.00 66.41 66.59 1hi9 h THR 36 Cb -0.03 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 1hi9 h THR 36 CO -0.05 0.24 -0.12 -0.33 0.37 0.00 0.00 175.52 175.64 1hi9 h GLU 37 N 0.65 0.74 -0.55 6.66 5.08 -0.98 -1.70 114.58 124.49 1hi9 h GLU 37 Ca 0.16 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1hi9 h GLU 37 Cb 0.19 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 1hi9 h GLU 37 CO -0.01 0.83 0.35 1.49 -1.00 0.00 0.00 179.01 180.67 1hi9 h GLU 38 N 0.67 0.73 -0.61 2.33 4.81 -0.47 -2.02 114.58 120.02 1hi9 h GLU 38 Ca 0.11 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.24 1hi9 h GLU 38 Cb 0.59 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.78 1hi9 h GLU 38 CO 0.04 0.50 0.17 0.00 -0.73 0.00 0.00 179.01 178.98 1hi9 h ALA 39 N 1.19 1.14 -0.82 2.92 0.00 -1.08 -2.70 119.26 119.91 1hi9 h ALA 39 Ca 0.20 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1hi9 h ALA 39 Cb -0.06 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.44 1hi9 h ALA 39 CO -0.04 0.59 0.54 -0.91 0.00 0.00 0.00 179.25 179.42 1hi9 h ASN 40 N 0.91 0.91 -0.44 0.00 2.35 -0.60 -0.40 115.58 118.30 1hi9 h ASN 40 Ca 0.20 -0.02 0.04 0.00 -0.55 0.00 0.00 56.30 55.97 1hi9 h ASN 40 Cb 0.30 -0.22 -0.04 0.00 0.05 0.00 0.00 38.32 38.41 1hi9 h ASN 40 CO -0.00 0.64 0.19 1.88 -1.65 0.00 0.00 177.43 178.49 1hi9 h TYR 41 N 1.06 0.35 -0.36 1.19 -1.99 -1.10 0.18 116.97 116.30 1hi9 h TYR 41 Ca 0.31 0.02 -0.10 0.00 2.00 0.00 0.00 58.73 60.96 1hi9 h TYR 41 Cb -0.05 -0.09 -0.01 0.00 2.00 0.00 0.00 36.73 38.57 1hi9 h TYR 41 CO -0.00 0.16 -0.16 0.00 -0.00 0.00 0.00 178.16 178.16 1hi9 h ILE 43 N 0.54 1.05 -0.44 0.00 2.04 -0.71 0.23 117.51 120.22 1hi9 h ILE 43 Ca 0.08 -0.11 0.05 0.00 1.00 0.00 0.00 64.86 65.88 1hi9 h ILE 43 Cb 0.70 0.85 -0.04 0.00 -0.74 0.00 0.00 36.82 37.59 1hi9 h ILE 43 CO 0.05 0.05 0.18 0.00 0.00 0.00 0.00 178.15 178.43 1hi9 h ALA 44 N 1.04 0.53 0.00 1.87 0.00 -0.61 -1.21 119.26 120.88 1hi9 h ALA 44 Ca 0.06 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 1hi9 h ALA 44 Cb -0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1hi9 h ALA 44 CO -0.01 -0.20 -0.37 1.49 0.00 0.00 0.00 179.25 180.16 1hi9 h GLU 45 N 0.37 0.00 0.06 0.00 4.57 -1.14 -1.36 114.58 117.07 1hi9 h GLU 45 Ca 0.20 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.37 1hi9 h GLU 45 Cb 0.16 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.75 1hi9 h GLU 45 CO -0.18 0.37 -0.03 0.00 -1.18 0.00 0.00 179.01 177.99 1hi9 h ALA 46 N 1.63 -0.08 -0.45 2.92 0.00 0.59 -0.95 119.26 122.92 1hi9 h ALA 46 Ca -0.00 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 1hi9 h ALA 46 Cb 0.85 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1hi9 h ALA 46 CO 0.05 -0.45 0.14 0.74 0.00 0.00 0.00 179.25 179.73 1hi9 h PHE 47 N -0.29 0.73 0.00 0.00 0.05 -1.25 -2.08 116.94 114.10 1hi9 h PHE 47 Ca -0.01 -0.07 -0.00 0.00 3.82 0.00 0.00 57.97 61.71 1hi9 h PHE 47 Cb 0.25 -0.21 -0.00 0.00 2.00 0.00 0.00 35.95 37.99 1hi9 h PHE 47 CO -0.01 0.66 -0.00 -0.97 -0.18 0.00 0.00 178.31 177.81 1hi9 h ASN 48 N 0.60 0.00 -0.61 2.17 -1.24 -1.11 -1.14 115.58 114.24 1hi9 h ASN 48 Ca 0.15 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.16 1hi9 h ASN 48 Cb 0.27 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.32 1hi9 h ASN 48 CO -0.00 0.00 0.00 -1.20 -1.29 0.00 0.00 177.43 174.94 1hi9 n SER 49 N -3.33 4.15 0.00 1.15 7.64 -0.37 -4.94 113.62 117.92 1hi9 n SER 49 Ca -0.03 -2.30 0.00 0.00 1.01 0.00 0.00 58.87 57.55 1hi9 n SER 49 Cb 0.08 -0.52 0.00 0.00 -1.01 0.00 0.00 64.21 62.75 1hi9 n SER 49 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1hi9 n GLY 50 N 1.18 2.09 3.63 0.23 0.00 -0.43 -5.00 105.19 106.89 1hi9 n GLY 50 Ca 0.23 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.79 1hi9 n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hi9 n THR 52 N 1.55 0.05 -3.81 0.00 -2.24 -0.62 -4.40 114.28 104.81 1hi9 n THR 52 Ca 0.12 -0.43 -0.13 0.00 -2.27 0.00 0.00 64.05 61.34 1hi9 n THR 52 Cb 0.29 0.10 -0.13 0.00 -2.10 0.00 0.00 70.33 68.50 1hi9 n THR 52 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1hi9 s GLU 53 N -3.44 0.16 -0.20 -0.78 2.02 -1.19 -4.96 118.70 110.32 1hi9 s GLU 53 Ca -0.05 0.23 -0.03 0.00 0.02 0.00 0.00 54.97 55.14 1hi9 s GLU 53 Cb 0.14 0.05 0.07 0.00 0.10 0.00 0.00 34.13 34.48 1hi9 s GLU 53 CO 0.89 -0.04 0.07 0.08 0.02 0.00 0.00 175.26 176.28 1hi9 s VAL 54 N 0.24 0.30 -0.24 2.63 1.01 -1.26 -0.80 120.40 122.27 1hi9 s VAL 54 Ca -0.01 -0.50 -0.17 0.00 0.00 0.00 0.00 61.98 61.30 1hi9 s VAL 54 Cb -0.03 -0.92 -0.03 0.00 0.00 0.00 0.00 36.38 35.40 1hi9 s VAL 54 CO -0.01 -0.31 0.45 -0.22 0.00 0.00 0.00 175.10 175.02 1hi9 s LEU 55 N 1.95 4.08 -0.27 3.92 0.20 -0.54 -2.14 118.68 125.89 1hi9 s LEU 55 Ca 0.02 0.48 -0.05 0.00 0.69 0.00 0.00 54.13 55.26 1hi9 s LEU 55 Cb -0.17 -2.58 0.01 0.00 -0.43 0.00 0.00 46.19 43.03 1hi9 s LEU 55 CO -0.12 -0.20 0.02 -0.69 -0.29 0.00 0.00 176.35 175.07 1hi9 s VAL 56 N 1.96 3.58 -0.30 1.68 1.01 0.73 -0.10 120.40 128.96 1hi9 s VAL 56 Ca 0.19 -0.73 -0.08 0.00 0.00 0.00 0.00 61.98 61.37 1hi9 s VAL 56 Cb -0.15 -2.80 0.00 0.00 0.00 0.00 0.00 36.38 33.43 1hi9 s VAL 56 CO 0.09 0.18 0.10 0.21 0.00 0.00 0.00 175.10 175.68 1hi9 s ASN 57 N 1.45 5.26 -0.14 3.32 3.04 0.40 -0.29 114.94 127.98 1hi9 s ASN 57 Ca 0.03 -0.61 -0.29 0.00 0.04 0.00 0.00 52.86 52.03 1hi9 s ASN 57 Cb -0.16 -1.92 -0.04 0.00 -1.54 0.00 0.00 41.25 37.58 1hi9 s ASN 57 CO -0.00 -0.18 1.61 -0.62 -3.04 0.00 0.00 177.10 174.87 1hi9 s ASP 58 N 1.55 6.55 -0.23 -4.21 -1.08 -0.96 -1.65 116.67 116.64 1hi9 s ASP 58 Ca 0.04 1.92 0.13 0.00 -0.52 0.00 0.00 52.55 54.11 1hi9 s ASP 58 Cb -0.17 -2.53 0.49 0.00 -1.46 0.00 0.00 42.92 39.25 1hi9 s ASP 58 CO 0.04 -1.07 1.41 -1.20 0.52 0.00 0.00 175.17 174.86 1hi9 n SER 59 N 7.73 2.99 -4.27 -0.34 7.64 0.49 -4.71 113.62 123.15 1hi9 n SER 59 Ca 0.18 -3.41 -0.32 0.00 1.01 0.00 0.00 58.87 56.33 1hi9 n SER 59 Cb 0.44 -0.58 -0.16 0.00 -1.01 0.00 0.00 64.21 62.90 1hi9 n SER 59 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 1hi9 s HIS 60 N -3.05 2.64 0.00 1.43 5.65 -1.25 -4.71 115.29 116.01 1hi9 s HIS 60 Ca 0.42 -0.93 0.00 0.00 0.25 0.00 0.00 55.06 54.80 1hi9 s HIS 60 Cb 0.37 -1.75 0.00 0.00 -1.18 0.00 0.00 32.58 30.01 1hi9 s HIS 60 CO 0.03 -0.36 0.00 0.45 -0.65 0.00 0.00 174.74 174.22 1hi9 n SER 61 N 3.53 0.00 0.00 9.88 2.88 -1.26 0.17 113.62 128.82 1hi9 n SER 61 Ca -0.19 0.00 0.15 0.00 -1.33 0.00 0.00 58.87 57.51 1hi9 n SER 61 Cb 0.53 0.00 0.89 0.00 -0.75 0.00 0.00 64.21 64.88 1hi9 n SER 61 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1hi9 n LYS 62 N 5.91 0.87 -3.49 -1.46 4.76 -1.26 -4.90 118.16 118.59 1hi9 n LYS 62 Ca 0.00 0.00 -0.25 0.00 -2.87 0.00 0.00 58.31 55.19 1hi9 n LYS 62 Cb 0.00 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.69 1hi9 n LYS 62 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 1hi9 n MET 63 N -1.05 -3.91 -1.66 1.97 2.81 0.44 -3.54 117.12 112.18 1hi9 n MET 63 Ca 0.22 0.54 -0.05 0.00 -1.81 0.00 0.00 57.70 56.59 1hi9 n MET 63 Cb 0.13 -5.30 0.08 0.00 -0.71 0.00 0.00 33.22 27.42 1hi9 n MET 63 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 1hi9 n ASN 64 N -2.44 2.59 -0.10 7.83 0.23 -1.26 -0.76 115.26 121.36 1hi9 n ASN 64 Ca -0.01 -3.14 -0.21 0.00 -0.53 0.00 0.00 54.58 50.69 1hi9 n ASN 64 Cb 0.54 -0.42 -0.11 0.00 -2.08 0.00 0.00 39.78 37.71 1hi9 n ASN 64 CO 0.00 0.00 0.00 0.78 -0.93 0.00 0.00 177.26 177.11 1hi9 h ASN 65 N 1.69 0.00 -2.83 0.53 2.35 -1.88 -3.46 115.58 111.99 1hi9 h ASN 65 Ca 0.05 -0.52 -0.56 0.00 -0.55 0.00 0.00 56.30 54.72 1hi9 h ASN 65 Cb 1.39 0.00 0.08 0.00 0.05 0.00 0.00 38.32 39.84 1hi9 h ASN 65 CO 0.30 1.45 0.78 0.18 -1.65 0.00 0.00 177.43 178.49 1hi9 n LEU 66 N -4.44 3.65 -4.54 1.61 4.77 -1.26 -4.83 117.00 111.95 1hi9 n LEU 66 Ca -0.31 1.13 -0.43 0.00 -0.03 0.00 0.00 56.01 56.37 1hi9 n LEU 66 Cb 0.66 -1.50 -0.05 0.00 -2.33 0.00 0.00 43.42 40.20 1hi9 n LEU 66 CO 0.19 -0.16 0.55 -0.04 -1.33 0.00 0.00 177.39 176.60 1hi9 s MET 67 N -0.07 3.43 0.50 3.23 -1.94 -1.26 -4.93 119.30 118.27 1hi9 s MET 67 Ca 0.69 -0.08 0.19 0.00 -1.71 0.00 0.00 55.69 54.78 1hi9 s MET 67 Cb -0.58 -3.93 1.25 0.00 2.01 0.00 0.00 34.83 33.59 1hi9 s MET 67 CO 0.46 -1.08 2.05 -0.24 -0.01 0.00 0.00 175.02 176.20 1hi9 h VAL 68 N 5.95 0.88 0.00 -6.03 3.04 -1.96 -0.56 116.25 117.57 1hi9 h VAL 68 Ca -0.25 -0.04 0.00 0.00 -1.01 0.00 0.00 66.70 65.41 1hi9 h VAL 68 Cb 1.09 0.76 0.00 0.00 -2.01 0.00 0.00 31.29 31.13 1hi9 h VAL 68 CO 0.95 0.02 0.00 -1.84 -1.01 0.00 0.00 177.57 175.69 1hi9 n GLU 69 N -4.46 0.19 0.00 4.17 0.00 -1.26 -3.70 120.64 115.58 1hi9 n GLU 69 Ca 0.05 0.02 0.00 0.00 0.00 0.00 0.00 57.16 57.22 1hi9 n GLU 69 Cb 0.35 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.29 1hi9 n GLU 69 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1hi9 n LYS 70 N -1.40 3.46 -1.71 3.44 5.02 -0.33 -5.05 118.16 121.58 1hi9 n LYS 70 Ca 0.10 -0.17 -0.32 0.00 -2.02 0.00 0.00 58.31 55.90 1hi9 n LYS 70 Cb 0.28 -0.63 0.04 0.00 -0.02 0.00 0.00 35.03 34.70 1hi9 n LYS 70 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1hi9 s LEU 71 N -1.09 3.29 -0.12 -0.35 2.96 -0.52 -4.89 118.68 117.97 1hi9 s LEU 71 Ca 0.00 1.81 -0.36 0.00 -0.22 0.00 0.00 54.13 55.35 1hi9 s LEU 71 Cb 0.00 -4.52 -0.13 0.00 0.50 0.00 0.00 46.19 42.03 1hi9 s LEU 71 CO 0.00 -1.50 1.78 1.57 -1.32 0.00 0.00 176.35 176.88 1hi9 n HIS 72 N -2.68 2.19 0.05 5.38 -0.00 -1.26 -4.83 115.22 114.07 1hi9 n HIS 72 Ca 0.09 0.22 0.19 0.00 -0.00 0.00 0.00 57.72 58.22 1hi9 n HIS 72 Cb 0.53 -2.57 0.71 0.00 -0.00 0.00 0.00 29.99 28.65 1hi9 n HIS 72 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1hi9 h PRO 73 N 8.02 0.00 -0.14 1.57 0.13 -1.94 -1.34 132.00 138.31 1hi9 h PRO 73 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1hi9 h PRO 73 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1hi9 h PRO 73 CO 0.94 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 179.10 1hi9 n GLU 74 N -4.27 1.52 -4.03 0.86 -0.58 -1.26 -4.86 120.64 108.02 1hi9 n GLU 74 Ca 0.08 -0.79 -0.26 0.00 -0.42 0.00 0.00 57.16 55.77 1hi9 n GLU 74 Cb 0.54 -1.33 -0.04 0.00 -0.57 0.00 0.00 31.44 30.03 1hi9 n GLU 74 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1hi9 s ALA 75 N -1.82 3.72 -0.24 0.62 0.00 -0.51 -4.69 121.76 118.85 1hi9 s ALA 75 Ca 0.28 -1.17 -0.07 0.00 0.00 0.00 0.00 51.96 51.00 1hi9 s ALA 75 Cb 0.15 -1.52 -0.03 0.00 0.00 0.00 0.00 23.12 21.72 1hi9 s ALA 75 CO 0.22 0.49 0.07 -0.51 0.00 0.00 0.00 175.76 176.03 1hi9 s ASP 76 N -3.24 5.24 -0.17 0.00 1.01 -0.91 -4.95 116.67 113.66 1hi9 s ASP 76 Ca 0.32 -0.15 -0.07 0.00 0.71 0.00 0.00 52.55 53.36 1hi9 s ASP 76 Cb -0.10 -1.94 -0.04 0.00 1.01 0.00 0.00 42.92 41.85 1hi9 s ASP 76 CO 0.25 -0.00 0.08 -0.22 0.21 0.00 0.00 175.17 175.50 1hi9 s LEU 77 N 1.41 3.96 -0.35 1.23 2.96 -1.26 -0.19 118.68 126.44 1hi9 s LEU 77 Ca 0.05 0.18 -0.10 0.00 -0.22 0.00 0.00 54.13 54.05 1hi9 s LEU 77 Cb -0.15 -1.99 0.02 0.00 0.50 0.00 0.00 46.19 44.57 1hi9 s LEU 77 CO 0.04 0.23 0.17 -0.63 -1.32 0.00 0.00 176.35 174.85 1hi9 s ILE 78 N 0.01 4.46 0.04 6.68 1.01 0.60 -4.97 121.20 129.03 1hi9 s ILE 78 Ca 0.07 -0.76 0.09 0.00 0.00 0.00 0.00 60.65 60.05 1hi9 s ILE 78 Cb -0.12 -3.42 -0.03 0.00 0.01 0.00 0.00 42.46 38.90 1hi9 s ILE 78 CO 0.00 -0.13 -0.25 -0.55 0.00 0.00 0.00 174.94 174.02 1hi9 s SER 79 N 1.55 3.01 0.00 3.58 0.15 -1.26 -2.26 113.70 118.47 1hi9 s SER 79 Ca 0.02 -0.56 0.00 0.00 0.70 0.00 0.00 55.95 56.12 1hi9 s SER 79 Cb -0.18 -0.28 0.00 0.00 -1.71 0.00 0.00 66.02 63.85 1hi9 s SER 79 CO 0.06 0.25 0.00 0.61 1.20 0.00 0.00 173.24 175.36 1hi9 n GLY 80 N 1.89 2.65 0.00 9.45 0.00 0.06 -5.00 105.19 114.24 1hi9 n GLY 80 Ca -0.17 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 43.83 1hi9 n GLY 80 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1hi9 n ASP 81 N 0.00 1.51 -2.88 1.61 5.75 -1.23 -4.68 116.55 116.63 1hi9 n ASP 81 Ca 0.00 -0.95 -0.21 0.00 -0.01 0.00 0.00 54.79 53.62 1hi9 n ASP 81 Cb 0.00 0.00 0.04 0.00 -1.03 0.00 0.00 41.12 40.13 1hi9 n ASP 81 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 1hi9 n VAL 82 N -0.23 -2.05 -3.21 2.12 0.31 -1.26 -4.98 118.33 109.03 1hi9 n VAL 82 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 64.34 63.94 1hi9 n VAL 82 Cb 0.00 -3.39 -0.06 0.00 -0.91 0.00 0.00 33.84 29.49 1hi9 n VAL 82 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1hi9 s LYS 83 N -5.74 4.31 0.36 5.55 1.02 -1.26 -4.97 119.74 119.01 1hi9 s LYS 83 Ca 0.34 0.74 0.19 0.00 0.02 0.00 0.00 55.97 57.25 1hi9 s LYS 83 Cb -0.15 -3.34 1.28 0.00 -0.52 0.00 0.00 37.83 35.10 1hi9 s LYS 83 CO 0.42 0.38 1.59 -1.35 -0.92 0.00 0.00 175.35 175.47 1hi9 h PRO 84 N 5.60 0.03 -0.01 -1.68 0.11 -2.01 -1.22 132.00 132.83 1hi9 h PRO 84 Ca -0.45 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.65 1hi9 h PRO 84 Cb 1.20 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 1hi9 h PRO 84 CO 0.69 0.02 -0.39 1.19 -0.21 0.00 0.00 178.00 179.31 1hi9 n PHE 85 N -5.25 0.02 0.00 0.65 3.01 -1.26 -4.82 117.46 109.80 1hi9 n PHE 85 Ca 0.36 -1.39 0.00 0.00 1.01 0.00 0.00 57.45 57.43 1hi9 n PHE 85 Cb 1.22 -0.23 0.00 0.00 -0.01 0.00 0.00 39.48 40.46 1hi9 n PHE 85 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1hi9 n SER 86 N -1.19 0.00 0.33 4.37 2.88 -0.46 -0.54 113.62 119.01 1hi9 n SER 86 Ca 0.19 0.00 0.22 0.00 -1.33 0.00 0.00 58.87 57.94 1hi9 n SER 86 Cb 0.68 0.00 1.15 0.00 -0.75 0.00 0.00 64.21 65.29 1hi9 n SER 86 CO 0.00 0.00 0.00 0.24 -1.23 0.00 0.00 175.04 174.05 1hi9 h MET 87 N 0.00 0.00 -0.11 -1.46 2.86 -1.90 -2.66 114.93 111.66 1hi9 h MET 87 Ca 0.00 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 1hi9 h MET 87 Cb 0.00 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 1hi9 h MET 87 CO 0.00 0.00 -0.08 1.33 1.06 0.00 0.00 176.91 179.22 1hi9 n VAL 88 N -3.16 2.12 -1.74 -2.22 0.24 0.29 -4.81 118.33 109.06 1hi9 n VAL 88 Ca -0.03 -2.37 -0.42 0.00 -2.04 0.00 0.00 64.34 59.49 1hi9 n VAL 88 Cb 0.09 -0.25 -0.02 0.00 -1.47 0.00 0.00 33.84 32.19 1hi9 n VAL 88 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1hi9 s GLU 89 N -2.96 4.11 0.00 7.34 2.56 -1.01 -2.24 118.70 126.50 1hi9 s GLU 89 Ca 0.37 2.61 0.00 0.00 0.00 0.00 0.00 54.97 57.95 1hi9 s GLU 89 Cb 0.32 -3.04 0.00 0.00 2.00 0.00 0.00 34.13 33.41 1hi9 s GLU 89 CO 0.03 -0.71 0.00 0.41 -0.56 0.00 0.00 175.26 174.43 1hi9 n GLY 90 N 3.06 0.96 3.63 -1.50 0.00 -1.26 -4.88 105.19 105.19 1hi9 n GLY 90 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 1hi9 n GLY 90 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1hi9 s LEU 91 N 0.00 4.07 0.00 0.99 0.20 -0.95 -5.04 118.68 117.95 1hi9 s LEU 91 Ca 0.00 0.84 0.02 0.00 0.69 0.00 0.00 54.13 55.68 1hi9 s LEU 91 Cb 0.00 -3.00 -0.01 0.00 -0.43 0.00 0.00 46.19 42.76 1hi9 s LEU 91 CO 0.00 -0.44 0.06 -0.90 -0.29 0.00 0.00 176.35 174.79 1hi9 n ASP 92 N 5.84 0.81 0.00 3.68 5.68 -1.26 -5.03 116.55 126.27 1hi9 n ASP 92 Ca 0.02 -1.80 0.08 0.00 -0.50 0.00 0.00 54.79 52.59 1hi9 n ASP 92 Cb 0.48 0.42 0.50 0.00 -1.14 0.00 0.00 41.12 41.38 1hi9 n ASP 92 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 1hi9 n ASP 93 N -1.98 0.00 -0.65 -1.12 3.85 -1.26 -3.18 116.55 112.20 1hi9 n ASP 93 Ca -0.01 -1.06 0.11 0.00 -0.71 0.00 0.00 54.79 53.12 1hi9 n ASP 93 Cb 0.23 0.00 0.36 0.00 -1.35 0.00 0.00 41.12 40.36 1hi9 n ASP 93 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.20 176.54 1hi9 n THR 94 N -0.83 0.20 -3.76 2.12 -2.24 -1.26 -4.89 114.28 103.62 1hi9 n THR 94 Ca 0.13 -0.39 -0.37 0.00 -2.27 0.00 0.00 64.05 61.14 1hi9 n THR 94 Cb 0.06 0.56 -0.06 0.00 -2.10 0.00 0.00 70.33 68.79 1hi9 n THR 94 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1hi9 s PHE 95 N -1.80 3.64 0.24 4.78 0.40 -1.19 -4.61 117.98 119.43 1hi9 s PHE 95 Ca 0.34 0.67 0.06 0.00 -0.60 0.00 0.00 56.93 57.40 1hi9 s PHE 95 Cb 0.19 -2.05 0.25 0.00 0.51 0.00 0.00 43.02 41.92 1hi9 s PHE 95 CO 0.29 0.70 1.55 -0.09 0.70 0.00 0.00 175.22 178.37 1hi9 h ARG 96 N 4.82 0.15 -1.75 0.44 9.65 -1.17 -3.45 114.38 123.07 1hi9 h ARG 96 Ca -0.54 -0.11 0.28 0.00 -1.10 0.00 0.00 59.98 58.52 1hi9 h ARG 96 Cb 1.22 0.02 -0.10 0.00 -1.39 0.00 0.00 29.97 29.72 1hi9 h ARG 96 CO 0.60 0.74 0.74 0.20 2.80 0.00 0.00 179.97 185.04 1hi9 s GLY 97 N -4.40 -0.34 0.12 2.80 0.00 -1.24 -4.48 107.32 99.78 1hi9 s GLY 97 Ca -0.03 0.48 0.10 0.00 0.00 0.00 0.00 44.72 45.27 1hi9 s GLY 97 CO 0.79 0.44 -0.25 0.00 0.00 0.00 0.00 173.10 174.08 1hi9 s ALA 98 N -2.62 2.16 -0.12 3.20 0.00 -0.09 -1.37 121.76 122.92 1hi9 s ALA 98 Ca 0.15 -1.38 -0.01 0.00 0.00 0.00 0.00 51.96 50.72 1hi9 s ALA 98 Cb 0.03 -0.33 0.03 0.00 0.00 0.00 0.00 23.12 22.85 1hi9 s ALA 98 CO -0.02 0.47 -0.04 -1.17 0.00 0.00 0.00 175.76 175.00 1hi9 s LEU 99 N -1.98 1.11 -0.25 0.00 0.20 0.10 -1.09 118.68 116.78 1hi9 s LEU 99 Ca 0.11 -0.36 -0.13 0.00 0.69 0.00 0.00 54.13 54.44 1hi9 s LEU 99 Cb -0.10 -0.73 -0.04 0.00 -0.43 0.00 0.00 46.19 44.89 1hi9 s LEU 99 CO 0.05 -0.17 0.28 -0.36 -0.29 0.00 0.00 176.35 175.86 1hi9 s PHE 100 N 1.78 3.28 0.01 5.38 2.99 -0.37 -1.52 117.98 129.54 1hi9 s PHE 100 Ca 0.04 0.33 0.08 0.00 0.00 0.00 0.00 56.93 57.38 1hi9 s PHE 100 Cb -0.13 -2.44 -0.03 0.00 0.00 0.00 0.00 43.02 40.42 1hi9 s PHE 100 CO -0.07 -0.09 -0.23 -1.17 -0.00 0.00 0.00 175.22 173.65 1hi9 s LEU 101 N 1.59 2.27 -1.38 -0.37 0.20 0.16 -0.03 118.68 121.12 1hi9 s LEU 101 Ca 0.12 -0.48 0.00 0.00 0.69 0.00 0.00 54.13 54.46 1hi9 s LEU 101 Cb -0.15 -1.37 0.00 0.00 -0.43 0.00 0.00 46.19 44.24 1hi9 s LEU 101 CO 0.08 0.29 0.00 0.61 -0.29 0.00 0.00 176.35 177.04 1hi9 n GLY 102 N 2.01 -0.23 3.87 7.98 0.00 -0.82 -0.40 105.19 117.61 1hi9 n GLY 102 Ca -0.16 -0.22 -0.30 0.00 0.00 0.00 0.00 46.02 45.34 1hi9 n GLY 102 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1hi9 s TYR 103 N -2.79 3.33 0.27 1.61 1.51 -0.13 -0.91 117.35 120.23 1hi9 s TYR 103 Ca 0.00 1.12 0.01 0.00 -1.01 0.00 0.00 57.07 57.20 1hi9 s TYR 103 Cb 0.00 -3.00 -0.05 0.00 -0.11 0.00 0.00 41.96 38.80 1hi9 s TYR 103 CO 0.00 -1.15 0.11 -3.38 -1.11 0.00 0.00 175.55 170.02 1hi9 s HIS 104 N -3.29 1.55 0.61 2.71 -3.43 -1.26 -3.62 115.29 108.55 1hi9 s HIS 104 Ca 0.58 -1.21 -0.17 0.00 -0.80 0.00 0.00 55.06 53.46 1hi9 s HIS 104 Cb -0.11 -0.89 -0.03 0.00 -1.43 0.00 0.00 32.58 30.12 1hi9 s HIS 104 CO 0.53 -0.37 1.12 0.00 -2.00 0.00 0.00 174.74 174.02 1hi9 s ALA 105 N -3.73 2.56 0.79 -1.38 0.00 -1.26 -4.76 121.76 113.98 1hi9 s ALA 105 Ca 0.37 0.68 -0.11 0.00 0.00 0.00 0.00 51.96 52.90 1hi9 s ALA 105 Cb 0.07 -3.34 0.06 0.00 0.00 0.00 0.00 23.12 19.92 1hi9 s ALA 105 CO 0.14 -1.06 1.08 -0.98 0.00 0.00 0.00 175.76 174.94 1hi9 s ARG 106 N -3.73 2.16 0.67 0.00 1.70 -1.26 -2.49 118.95 116.00 1hi9 s ARG 106 Ca 0.70 0.94 -0.17 0.00 -0.47 0.00 0.00 55.73 56.73 1hi9 s ARG 106 Cb -0.22 -1.90 -0.02 0.00 -0.57 0.00 0.00 34.95 32.24 1hi9 s ARG 106 CO 0.35 -1.65 0.93 0.00 -1.08 0.00 0.00 175.30 173.85 1hi9 n ALA 107 N -3.50 -0.16 -1.04 7.88 0.00 -1.19 -3.20 120.51 119.30 1hi9 n ALA 107 Ca 0.08 -0.11 -0.01 0.00 0.00 0.00 0.00 53.44 53.39 1hi9 n ALA 107 Cb 0.54 -2.09 -0.01 0.00 0.00 0.00 0.00 19.45 17.89 1hi9 n ALA 107 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1hi9 n SER 108 N -1.20 -4.52 -4.36 0.00 7.64 -1.26 -4.80 113.62 105.12 1hi9 n SER 108 Ca 0.13 0.03 -0.19 0.00 1.01 0.00 0.00 58.87 59.86 1hi9 n SER 108 Cb 0.49 -2.14 -0.10 0.00 -1.01 0.00 0.00 64.21 61.45 1hi9 n SER 108 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1hi9 s THR 109 N -1.60 1.32 0.61 0.44 -4.23 -1.19 -5.13 115.64 105.86 1hi9 s THR 109 Ca 0.00 -2.08 -0.19 0.00 -1.18 0.00 0.00 61.69 58.24 1hi9 s THR 109 Cb 0.00 -2.34 -0.02 0.00 1.34 0.00 0.00 72.50 71.48 1hi9 s THR 109 CO 0.00 -0.36 1.32 -2.65 -0.54 0.00 0.00 174.62 172.40 1hi9 n PRO 110 N -0.47 1.34 0.00 3.99 -0.02 -1.26 -4.81 135.00 133.77 1hi9 n PRO 110 Ca -0.06 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 1hi9 n PRO 110 Cb 0.63 -2.56 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 1hi9 n PRO 110 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1hi9 n GLY 111 N 0.86 4.80 3.74 -1.23 0.00 -1.26 -4.80 105.19 107.29 1hi9 n GLY 111 Ca 0.14 -0.94 -0.42 0.00 0.00 0.00 0.00 46.02 44.80 1hi9 n GLY 111 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1hi9 n VAL 112 N -1.57 0.86 -4.02 1.61 3.14 -1.25 -2.58 118.33 114.52 1hi9 n VAL 112 Ca 0.00 -0.21 -0.33 0.00 -2.96 0.00 0.00 64.34 60.84 1hi9 n VAL 112 Cb 0.00 -1.95 -0.02 0.00 -1.06 0.00 0.00 33.84 30.82 1hi9 n VAL 112 CO 0.00 0.00 0.00 0.23 -6.46 0.00 0.00 176.83 170.60 1hi9 n MET 113 N 2.44 -3.40 -1.88 1.45 2.81 0.12 -4.56 117.12 114.10 1hi9 n MET 113 Ca 0.10 0.40 -0.41 0.00 -1.81 0.00 0.00 57.70 55.98 1hi9 n MET 113 Cb 0.36 -5.15 -0.02 0.00 -0.71 0.00 0.00 33.22 27.71 1hi9 n MET 113 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1hi9 s SER 114 N -3.15 6.49 -0.09 7.83 1.04 -1.07 -4.84 113.70 119.91 1hi9 s SER 114 Ca 0.67 2.85 -0.32 0.00 0.48 0.00 0.00 55.95 59.64 1hi9 s SER 114 Cb -0.36 -2.64 0.12 0.00 0.10 0.00 0.00 66.02 63.24 1hi9 s SER 114 CO 0.83 -0.81 1.40 -1.38 0.98 0.00 0.00 173.24 174.26 1hi9 s HIS 115 N -0.24 -0.00 -0.30 5.02 -3.43 -1.04 -4.71 115.29 110.59 1hi9 s HIS 115 Ca 0.59 -0.01 -0.03 0.00 -0.80 0.00 0.00 55.06 54.81 1hi9 s HIS 115 Cb -0.45 0.51 0.10 0.00 -1.43 0.00 0.00 32.58 31.31 1hi9 s HIS 115 CO 0.49 -0.03 0.13 -1.12 -2.00 0.00 0.00 174.74 172.20 1hi9 s SER 116 N -3.47 3.61 0.00 7.38 0.01 -1.26 -3.14 113.70 116.83 1hi9 s SER 116 Ca 0.23 -1.42 0.00 0.00 1.31 0.00 0.00 55.95 56.07 1hi9 s SER 116 Cb 0.04 -0.47 0.00 0.00 0.21 0.00 0.00 66.02 65.80 1hi9 s SER 116 CO -0.05 -0.43 0.00 0.23 0.41 0.00 0.00 173.24 173.41 1hi9 n MET 117 N 5.09 0.00 -4.29 12.44 2.81 -1.26 -4.58 117.12 127.32 1hi9 n MET 117 Ca -0.04 0.00 -0.17 0.00 -1.81 0.00 0.00 57.70 55.68 1hi9 n MET 117 Cb 0.42 0.00 -0.10 0.00 -0.71 0.00 0.00 33.22 32.82 1hi9 n MET 117 CO 0.00 0.00 0.00 0.96 1.51 0.00 0.00 175.97 178.44 1hi9 s ILE 118 N 0.00 1.45 0.53 2.02 -4.36 -1.26 -5.03 121.20 114.56 1hi9 s ILE 118 Ca 0.00 -2.05 0.19 0.00 -0.26 0.00 0.00 60.65 58.53 1hi9 s ILE 118 Cb 0.00 -1.87 0.29 0.00 1.25 0.00 0.00 42.46 42.13 1hi9 s ILE 118 CO 0.00 -0.61 2.17 -0.26 0.24 0.00 0.00 174.94 176.48 1hi9 h PHE 119 N 2.85 0.00 0.00 1.37 0.05 -1.99 -2.91 116.94 116.31 1hi9 h PHE 119 Ca -0.38 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.41 1hi9 h PHE 119 Cb 1.20 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.15 1hi9 h PHE 119 CO 0.68 0.00 0.00 0.41 -0.18 0.00 0.00 178.31 179.22 1hi9 n GLY 120 N -1.50 -1.26 3.84 -1.45 0.00 -1.26 -4.79 105.19 98.78 1hi9 n GLY 120 Ca -0.03 0.09 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 1hi9 n GLY 120 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1hi9 s VAL 121 N -3.32 5.06 -0.25 1.61 -7.23 -1.10 -0.33 120.40 114.84 1hi9 s VAL 121 Ca 0.04 0.74 0.03 0.00 -1.81 0.00 0.00 61.98 60.98 1hi9 s VAL 121 Cb 0.09 -3.69 -0.17 0.00 0.56 0.00 0.00 36.38 33.17 1hi9 s VAL 121 CO 0.38 0.52 -0.21 0.54 -0.31 0.00 0.00 175.10 176.03 1hi9 n ARG 122 N 1.64 0.65 -3.72 4.82 1.74 0.17 -4.61 116.66 117.35 1hi9 n ARG 122 Ca -0.13 0.14 -0.14 0.00 -0.77 0.00 0.00 57.85 56.95 1hi9 n ARG 122 Cb 0.52 -1.51 -0.08 0.00 -1.02 0.00 0.00 32.46 30.37 1hi9 n ARG 122 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1hi9 s HIS 123 N -2.51 -0.29 0.00 -1.55 3.76 -1.08 -4.17 115.29 109.45 1hi9 s HIS 123 Ca -0.33 0.52 0.05 0.00 -0.15 0.00 0.00 55.06 55.14 1hi9 s HIS 123 Cb 0.09 0.15 -0.03 0.00 1.11 0.00 0.00 32.58 33.90 1hi9 s HIS 123 CO 0.61 -0.40 -0.13 -0.06 -0.85 0.00 0.00 174.74 173.91 1hi9 s PHE 124 N -1.09 2.71 -0.02 1.40 2.99 -1.16 -1.22 117.98 121.59 1hi9 s PHE 124 Ca -0.11 -0.15 0.01 0.00 0.00 0.00 0.00 56.93 56.68 1hi9 s PHE 124 Cb -0.04 -1.56 0.01 0.00 0.00 0.00 0.00 43.02 41.43 1hi9 s PHE 124 CO 0.05 0.27 -0.03 0.71 -0.00 0.00 0.00 175.22 176.22 1hi9 s TYR 125 N -0.89 0.46 -0.36 0.36 1.51 0.11 -1.52 117.35 117.02 1hi9 s TYR 125 Ca 0.14 -0.08 0.04 0.00 -1.01 0.00 0.00 57.07 56.16 1hi9 s TYR 125 Cb -0.11 -0.42 0.10 0.00 -0.11 0.00 0.00 41.96 41.43 1hi9 s TYR 125 CO 0.05 -0.10 0.08 0.42 -1.11 0.00 0.00 175.55 174.89 1hi9 s ILE 126 N 0.57 2.18 -1.16 2.71 -1.09 -1.05 -1.05 121.20 122.32 1hi9 s ILE 126 Ca -0.06 -2.39 -0.03 0.00 -2.23 0.00 0.00 60.65 55.94 1hi9 s ILE 126 Cb -0.10 -2.60 -0.03 0.00 -1.58 0.00 0.00 42.46 38.16 1hi9 s ILE 126 CO -0.01 -0.64 0.93 0.59 -1.23 0.00 0.00 174.94 174.59 1hi9 n ASN 127 N 4.15 -3.70 0.00 3.58 4.13 -0.65 -2.51 115.26 120.25 1hi9 n ASN 127 Ca 0.04 -0.69 0.00 0.00 1.68 0.00 0.00 54.58 55.61 1hi9 n ASN 127 Cb 0.41 -4.98 0.00 0.00 -1.54 0.00 0.00 39.78 33.66 1hi9 n ASN 127 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 1hi9 n ASP 128 N -3.14 0.00 -4.63 6.41 8.00 -1.26 -4.98 116.55 116.95 1hi9 n ASP 128 Ca -0.21 0.00 -0.39 0.00 0.71 0.00 0.00 54.79 54.91 1hi9 n ASP 128 Cb 0.65 -1.34 -0.09 0.00 -0.02 0.00 0.00 41.12 40.32 1hi9 n ASP 128 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1hi9 s ARG 129 N -0.53 4.07 0.10 -1.24 3.52 -1.05 -5.04 118.95 118.78 1hi9 s ARG 129 Ca 0.00 0.06 -0.31 0.00 -0.13 0.00 0.00 55.73 55.35 1hi9 s ARG 129 Cb 0.00 -3.61 -0.10 0.00 -1.56 0.00 0.00 34.95 29.68 1hi9 s ARG 129 CO 0.00 -0.18 1.87 -2.14 -0.81 0.00 0.00 175.30 174.04 1hi9 s PRO 130 N 1.76 4.14 0.09 5.12 0.02 -1.26 -2.52 135.00 142.35 1hi9 s PRO 130 Ca 0.15 2.60 -0.09 0.00 0.02 0.00 0.00 61.00 63.68 1hi9 s PRO 130 Cb -0.15 -3.76 0.00 0.00 0.02 0.00 0.00 34.50 30.60 1hi9 s PRO 130 CO 0.09 -0.88 0.20 0.14 -0.33 0.00 0.00 177.00 176.22 1hi9 s VAL 131 N 3.26 0.14 0.00 3.83 -7.23 -0.58 -4.99 120.40 114.82 1hi9 s VAL 131 Ca 0.83 -1.14 0.00 0.00 -1.81 0.00 0.00 61.98 59.86 1hi9 s VAL 131 Cb -0.45 -1.32 0.00 0.00 0.56 0.00 0.00 36.38 35.17 1hi9 s VAL 131 CO 0.38 -0.63 0.00 0.61 -0.31 0.00 0.00 175.10 175.15 1hi9 n GLY 132 N -0.05 6.51 0.26 2.32 0.00 -1.26 -2.98 105.19 109.99 1hi9 n GLY 132 Ca -0.15 -1.91 -0.00 0.00 0.00 0.00 0.00 46.02 43.95 1hi9 n GLY 132 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1hi9 h GLU 133 N 0.00 0.62 -0.20 1.61 5.08 -1.91 -0.60 114.58 119.18 1hi9 h GLU 133 Ca 0.00 -0.04 0.05 0.00 -1.00 0.00 0.00 59.36 58.37 1hi9 h GLU 133 Cb 0.00 -0.14 -0.05 0.00 0.50 0.00 0.00 28.75 29.06 1hi9 h GLU 133 CO 0.00 0.41 -0.09 1.25 -1.00 0.00 0.00 179.01 179.58 1hi9 h LEU 134 N 0.64 -0.31 0.06 1.33 6.46 -1.95 0.14 115.31 121.68 1hi9 h LEU 134 Ca 0.32 0.08 -0.00 0.00 -0.12 0.00 0.00 57.88 58.15 1hi9 h LEU 134 Cb 0.27 0.17 0.00 0.00 -0.73 0.00 0.00 40.66 40.37 1hi9 h LEU 134 CO -0.22 -0.12 -0.03 1.23 -0.62 0.00 0.00 178.44 178.68 1hi9 h GLY 135 N -0.07 -0.09 0.73 3.75 0.00 -1.77 -1.12 103.07 104.50 1hi9 h GLY 135 Ca 0.11 0.03 0.05 0.00 0.00 0.00 0.00 47.33 47.52 1hi9 h GLY 135 CO -0.24 -0.03 0.36 1.41 0.00 0.00 0.00 176.54 178.03 1hi9 h LEU 136 N -0.35 0.54 -1.06 3.11 3.38 -0.99 0.06 115.31 120.00 1hi9 h LEU 136 Ca -0.01 0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.90 1hi9 h LEU 136 Cb 0.30 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1hi9 h LEU 136 CO 0.01 0.36 -0.22 0.78 0.09 0.00 0.00 178.44 179.47 1hi9 h ASN 137 N 0.67 0.40 -0.50 -0.43 2.35 -0.90 -1.56 115.58 115.61 1hi9 h ASN 137 Ca 0.28 -0.12 -0.10 0.00 -0.55 0.00 0.00 56.30 55.81 1hi9 h ASN 137 Cb 0.14 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.39 1hi9 h ASN 137 CO -0.16 0.63 -0.08 0.00 -1.65 0.00 0.00 177.43 176.17 1hi9 h ALA 138 N 1.41 0.69 -0.63 -0.83 0.00 -0.37 -1.14 119.26 118.39 1hi9 h ALA 138 Ca 0.06 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 1hi9 h ALA 138 Cb 0.59 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1hi9 h ALA 138 CO 0.04 0.57 0.18 1.88 0.00 0.00 0.00 179.25 181.92 1hi9 h TYR 139 N 0.80 1.00 -0.24 0.00 0.99 -0.59 0.15 116.97 119.08 1hi9 h TYR 139 Ca 0.13 -0.09 -0.12 0.00 2.00 0.00 0.00 58.73 60.65 1hi9 h TYR 139 Cb 0.63 -0.29 -0.01 0.00 1.00 0.00 0.00 36.73 38.05 1hi9 h TYR 139 CO 0.05 0.81 -0.34 0.28 -0.00 0.00 0.00 178.16 178.96 1hi9 h VAL 140 N 0.93 1.29 -0.66 -2.88 2.07 -1.04 -1.33 116.25 114.63 1hi9 h VAL 140 Ca 0.20 -1.45 -0.07 0.00 0.82 0.00 0.00 66.70 66.21 1hi9 h VAL 140 Cb 0.29 1.47 -0.03 0.00 -1.52 0.00 0.00 31.29 31.51 1hi9 h VAL 140 CO -0.01 0.46 0.14 0.00 0.02 0.00 0.00 177.57 178.19 1hi9 h ALA 141 N 1.20 1.01 -0.68 1.67 0.00 -0.43 -2.61 119.26 119.41 1hi9 h ALA 141 Ca 0.05 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 1hi9 h ALA 141 Cb 0.80 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 1hi9 h ALA 141 CO 0.07 0.64 0.32 0.78 0.00 0.00 0.00 179.25 181.06 1hi9 h GLY 142 N 1.06 1.04 0.84 0.00 0.00 -0.02 -0.42 103.07 105.58 1hi9 h GLY 142 Ca 0.21 -0.50 0.13 0.00 0.00 0.00 0.00 47.33 47.17 1hi9 h GLY 142 CO 0.00 0.47 0.45 -1.82 0.00 0.00 0.00 176.54 175.65 1hi9 h TYR 143 N 0.96 0.39 -0.63 5.60 3.20 -0.87 0.31 116.97 125.93 1hi9 h TYR 143 Ca 0.24 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.12 1hi9 h TYR 143 Cb 0.11 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.25 1hi9 h TYR 143 CO 0.01 0.16 0.00 0.66 -1.64 0.00 0.00 178.16 177.35 1hi9 n TYR 144 N -4.46 0.96 -2.73 -3.82 4.02 -0.75 -4.92 117.16 105.45 1hi9 n TYR 144 Ca 0.12 -0.45 -0.21 0.00 -0.01 0.00 0.00 57.90 57.35 1hi9 n TYR 144 Cb 0.49 -0.05 0.02 0.00 -0.02 0.00 0.00 39.34 39.78 1hi9 n TYR 144 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 1hi9 n ASP 145 N 1.29 -5.97 -4.50 7.72 8.00 0.11 -4.27 116.55 118.93 1hi9 n ASP 145 Ca 0.22 -0.16 -0.34 0.00 0.71 0.00 0.00 54.79 55.21 1hi9 n ASP 145 Cb 0.60 -4.87 -0.12 0.00 -0.02 0.00 0.00 41.12 36.71 1hi9 n ASP 145 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1hi9 s VAL 146 N -3.11 4.09 0.25 2.53 1.01 -0.24 -4.82 120.40 120.11 1hi9 s VAL 146 Ca 0.16 -0.28 -0.17 0.00 0.00 0.00 0.00 61.98 61.69 1hi9 s VAL 146 Cb -0.07 -2.83 -0.08 0.00 0.00 0.00 0.00 36.38 33.40 1hi9 s VAL 146 CO 0.20 0.45 0.71 -2.16 0.00 0.00 0.00 175.10 174.31 1hi9 s PRO 147 N 0.68 4.14 -0.69 2.72 0.04 -1.26 -3.75 135.00 136.87 1hi9 s PRO 147 Ca -0.00 0.76 -0.22 0.00 0.04 0.00 0.00 61.00 61.58 1hi9 s PRO 147 Cb -0.14 -2.72 0.08 0.00 0.04 0.00 0.00 34.50 31.76 1hi9 s PRO 147 CO 0.02 0.31 0.99 0.08 0.04 0.00 0.00 177.00 178.44 1hi9 s VAL 148 N -1.69 4.36 0.17 -0.36 1.01 -1.26 -0.92 120.40 121.71 1hi9 s VAL 148 Ca 0.47 -0.49 -0.06 0.00 0.00 0.00 0.00 61.98 61.90 1hi9 s VAL 148 Cb -0.14 -4.70 -0.05 0.00 0.00 0.00 0.00 36.38 31.49 1hi9 s VAL 148 CO 0.20 -1.47 1.50 -0.07 0.00 0.00 0.00 175.10 175.25 1hi9 h LEU 149 N 11.29 0.77 -7.71 3.92 3.38 -1.48 -3.44 115.31 122.04 1hi9 h LEU 149 Ca -0.23 -0.38 -0.13 0.00 0.09 0.00 0.00 57.88 57.22 1hi9 h LEU 149 Cb 1.06 -0.22 -0.20 0.00 0.09 0.00 0.00 40.66 41.40 1hi9 h LEU 149 CO 1.18 1.13 -0.44 -0.32 0.09 0.00 0.00 178.44 180.08 1hi9 s MET 150 N -4.16 0.56 -0.04 1.13 0.00 -1.22 -2.18 119.30 113.39 1hi9 s MET 150 Ca -0.09 -0.41 -0.02 0.00 0.00 0.00 0.00 55.69 55.18 1hi9 s MET 150 Cb 0.11 0.23 0.03 0.00 0.00 0.00 0.00 34.83 35.21 1hi9 s MET 150 CO 0.86 -0.14 0.06 0.08 0.00 0.00 0.00 175.02 175.87 1hi9 s VAL 151 N -1.60 -0.10 0.09 10.11 1.01 -0.31 -1.24 120.40 128.36 1hi9 s VAL 151 Ca -0.13 0.37 0.09 0.00 0.00 0.00 0.00 61.98 62.32 1hi9 s VAL 151 Cb -0.06 -0.14 -0.04 0.00 0.00 0.00 0.00 36.38 36.15 1hi9 s VAL 151 CO 0.01 0.16 -0.23 0.00 0.00 0.00 0.00 175.10 175.03 1hi9 s ALA 152 N 1.89 2.45 0.00 5.51 0.00 0.96 -1.63 121.76 130.94 1hi9 s ALA 152 Ca 0.01 -1.35 0.00 0.00 0.00 0.00 0.00 51.96 50.63 1hi9 s ALA 152 Cb -0.12 -0.52 0.00 0.00 0.00 0.00 0.00 23.12 22.47 1hi9 s ALA 152 CO -0.03 0.56 0.00 0.41 0.00 0.00 0.00 175.76 176.69 1hi9 n GLY 153 N 1.22 -0.61 3.94 0.00 0.00 -0.68 -0.95 105.19 108.10 1hi9 n GLY 153 Ca -0.17 -0.49 -0.28 0.00 0.00 0.00 0.00 46.02 45.08 1hi9 n GLY 153 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1hi9 s ASP 154 N -4.00 3.61 0.38 1.61 -4.77 -1.24 -0.94 116.67 111.32 1hi9 s ASP 154 Ca 0.00 0.25 0.06 0.00 -3.30 0.00 0.00 52.55 49.56 1hi9 s ASP 154 Cb 0.00 -0.45 0.74 0.00 -1.09 0.00 0.00 42.92 42.13 1hi9 s ASP 154 CO 0.00 -2.41 1.96 -2.24 0.70 0.00 0.00 175.17 173.18 1hi9 h ASP 155 N -1.32 0.44 0.15 2.11 2.03 -1.66 -2.29 116.42 115.89 1hi9 h ASP 155 Ca -0.43 -0.05 -0.14 0.00 -0.73 0.00 0.00 57.03 55.67 1hi9 h ASP 155 Cb 1.26 -0.11 -0.01 0.00 -0.83 0.00 0.00 39.33 39.63 1hi9 h ASP 155 CO 0.44 0.44 -0.53 0.03 -1.03 0.00 0.00 179.24 178.59 1hi9 h ARG 156 N 0.48 0.41 -0.23 4.15 2.47 -1.90 -1.84 114.38 117.92 1hi9 h ARG 156 Ca 0.12 -0.25 -0.15 0.00 -1.26 0.00 0.00 59.98 58.44 1hi9 h ARG 156 Cb 0.17 0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.50 1hi9 h ARG 156 CO -0.01 0.84 -0.46 0.00 0.56 0.00 0.00 179.97 180.90 1hi9 h ALA 157 N 1.12 0.77 -0.30 0.04 0.00 -1.79 -1.07 119.26 118.02 1hi9 h ALA 157 Ca 0.01 -0.47 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 1hi9 h ALA 157 Cb 1.03 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1hi9 h ALA 157 CO 0.09 0.66 0.08 0.00 0.00 0.00 0.00 179.25 180.08 1hi9 h ALA 158 N 1.02 0.40 -0.63 0.00 0.00 -1.26 0.03 119.26 118.81 1hi9 h ALA 158 Ca 0.03 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1hi9 h ALA 158 Cb 0.98 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 1hi9 h ALA 158 CO 0.09 0.05 0.34 -0.22 0.00 0.00 0.00 179.25 179.51 1hi9 h LYS 159 N 0.33 0.89 -0.79 0.00 1.63 -1.22 -1.33 116.57 116.07 1hi9 h LYS 159 Ca 0.10 -0.11 -0.03 0.00 -0.85 0.00 0.00 60.65 59.75 1hi9 h LYS 159 Cb 0.28 -0.17 -0.04 0.00 -0.60 0.00 0.00 32.23 31.70 1hi9 h LYS 159 CO 0.00 0.68 0.36 1.49 -3.45 0.00 0.00 179.45 178.53 1hi9 h GLU 160 N 0.86 1.15 0.29 1.90 4.81 -0.95 -2.28 114.58 120.36 1hi9 h GLU 160 Ca 0.22 -0.18 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 1hi9 h GLU 160 Cb 0.06 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.24 1hi9 h GLU 160 CO -0.03 0.90 -0.14 0.00 -0.73 0.00 0.00 179.01 179.01 1hi9 h ALA 161 N 1.19 -0.38 0.00 2.92 0.00 -0.43 -3.02 119.26 119.53 1hi9 h ALA 161 Ca 0.27 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1hi9 h ALA 161 Cb 0.15 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1hi9 h ALA 161 CO -0.03 -0.64 -0.02 1.05 0.00 0.00 0.00 179.25 179.61 1hi9 h GLU 162 N -0.54 0.00 -0.00 0.00 4.11 -1.20 0.15 114.58 117.11 1hi9 h GLU 162 Ca -0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.39 1hi9 h GLU 162 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1hi9 h GLU 162 CO 0.06 0.02 -0.09 0.39 0.07 0.00 0.00 179.01 179.47 1hi9 n GLU 163 N -3.18 0.25 -0.05 1.06 1.02 -0.86 -3.95 120.64 114.92 1hi9 n GLU 163 Ca -0.01 -0.05 -0.07 0.00 -0.02 0.00 0.00 57.16 57.01 1hi9 n GLU 163 Cb 0.21 -1.50 -0.04 0.00 -0.02 0.00 0.00 31.44 30.08 1hi9 n GLU 163 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1hi9 n LEU 164 N -1.33 2.85 -4.17 -4.62 7.94 -0.47 -4.96 117.00 112.24 1hi9 n LEU 164 Ca 0.10 -0.04 -0.35 0.00 -1.11 0.00 0.00 56.01 54.61 1hi9 n LEU 164 Cb 0.30 -0.34 -0.14 0.00 0.53 0.00 0.00 43.42 43.78 1hi9 n LEU 164 CO 0.26 0.64 -0.34 -0.63 -1.11 0.00 0.00 177.39 176.21 1hi9 s ILE 165 N -2.19 3.04 0.29 1.96 1.01 0.41 -5.06 121.20 120.66 1hi9 s ILE 165 Ca -0.13 -1.41 -0.30 0.00 0.00 0.00 0.00 60.65 58.81 1hi9 s ILE 165 Cb 0.03 -2.77 -0.12 0.00 0.01 0.00 0.00 42.46 39.62 1hi9 s ILE 165 CO 0.22 -0.14 1.61 -2.65 0.00 0.00 0.00 174.94 173.98 1hi9 n PRO 166 N 4.63 2.72 -0.92 2.79 -0.02 -1.26 -2.51 135.00 140.43 1hi9 n PRO 166 Ca -0.12 0.97 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 1hi9 n PRO 166 Cb 0.43 -2.76 0.00 0.00 -0.02 0.00 0.00 33.50 31.15 1hi9 n PRO 166 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1hi9 n ASN 167 N 2.34 -3.85 -4.76 2.55 3.02 -1.26 -4.58 115.26 108.72 1hi9 n ASN 167 Ca 0.09 0.00 -0.38 0.00 -0.03 0.00 0.00 54.58 54.26 1hi9 n ASN 167 Cb 0.37 -2.37 0.02 0.00 -0.61 0.00 0.00 39.78 37.19 1hi9 n ASN 167 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1hi9 s VAL 168 N -1.46 2.38 -0.10 2.41 0.11 -1.04 -4.81 120.40 117.89 1hi9 s VAL 168 Ca 0.00 0.29 -0.16 0.00 -2.93 0.00 0.00 61.98 59.18 1hi9 s VAL 168 Cb 0.00 -3.15 -0.05 0.00 -1.53 0.00 0.00 36.38 31.65 1hi9 s VAL 168 CO 0.00 -0.00 0.42 -0.89 -3.33 0.00 0.00 175.10 171.29 1hi9 s THR 169 N -1.37 5.18 0.11 5.04 2.01 -0.93 -4.89 115.64 120.80 1hi9 s THR 169 Ca 0.68 0.83 0.09 0.00 0.31 0.00 0.00 61.69 63.60 1hi9 s THR 169 Cb -0.37 -3.75 -0.04 0.00 0.01 0.00 0.00 72.50 68.35 1hi9 s THR 169 CO 0.44 0.40 -0.23 0.42 -0.69 0.00 0.00 174.62 174.96 1hi9 s THR 170 N 0.22 1.93 -0.24 -0.82 -4.23 -1.26 -1.16 115.64 110.08 1hi9 s THR 170 Ca 0.23 -1.64 -0.01 0.00 -1.18 0.00 0.00 61.69 59.09 1hi9 s THR 170 Cb -0.15 -1.74 0.07 0.00 1.34 0.00 0.00 72.50 72.03 1hi9 s THR 170 CO 0.09 -0.01 0.04 0.00 -0.54 0.00 0.00 174.62 174.20 1hi9 s ALA 171 N -1.14 1.42 -0.86 3.99 0.00 -0.65 -4.96 121.76 119.56 1hi9 s ALA 171 Ca 0.10 -1.18 -0.20 0.00 0.00 0.00 0.00 51.96 50.68 1hi9 s ALA 171 Cb -0.10 -1.39 0.12 0.00 0.00 0.00 0.00 23.12 21.75 1hi9 s ALA 171 CO 0.05 -1.34 1.08 0.00 0.00 0.00 0.00 175.76 175.55 1hi9 s ALA 172 N 1.66 3.31 -0.77 0.00 0.00 -1.26 -1.69 121.76 123.01 1hi9 s ALA 172 Ca 0.01 -2.55 0.22 0.00 0.00 0.00 0.00 51.96 49.64 1hi9 s ALA 172 Cb -0.18 -3.99 0.88 0.00 0.00 0.00 0.00 23.12 19.83 1hi9 s ALA 172 CO -0.13 -2.92 1.68 1.33 0.00 0.00 0.00 175.76 175.72 1hi9 n VAL 173 N 5.60 0.71 -3.53 0.00 0.24 -0.11 -4.81 118.33 116.43 1hi9 n VAL 173 Ca 0.17 0.11 -0.13 0.00 -2.04 0.00 0.00 64.34 62.45 1hi9 n VAL 173 Cb 0.48 -0.91 -0.04 0.00 -1.47 0.00 0.00 33.84 31.90 1hi9 n VAL 173 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 1hi9 s LYS 174 N -3.13 1.13 -0.17 7.34 -2.85 -1.25 -3.24 119.74 117.56 1hi9 s LYS 174 Ca 0.08 -0.39 -0.06 0.00 -1.00 0.00 0.00 55.97 54.59 1hi9 s LYS 174 Cb 0.11 0.51 -0.04 0.00 -2.06 0.00 0.00 37.83 36.36 1hi9 s LYS 174 CO 0.41 -0.45 0.02 -0.65 0.10 0.00 0.00 175.35 174.79 1hi9 s GLN 175 N -3.13 3.86 0.04 1.78 -1.52 0.15 -1.70 119.66 119.13 1hi9 s GLN 175 Ca -0.02 -0.41 -0.30 0.00 -1.95 0.00 0.00 55.36 52.68 1hi9 s GLN 175 Cb -0.00 -3.10 -0.04 0.00 -0.22 0.00 0.00 33.01 29.65 1hi9 s GLN 175 CO -0.07 0.27 1.06 0.99 -0.25 0.00 0.00 175.29 177.28 1hi9 s THR 176 N 0.35 4.48 -0.11 -0.19 2.01 -1.26 -0.31 115.64 120.61 1hi9 s THR 176 Ca 0.00 1.83 0.03 0.00 0.31 0.00 0.00 61.69 63.86 1hi9 s THR 176 Cb -0.13 -4.17 -0.09 0.00 0.01 0.00 0.00 72.50 68.12 1hi9 s THR 176 CO 0.01 0.17 -0.07 -0.38 -0.69 0.00 0.00 174.62 173.66 1hi9 n ILE 177 N 3.69 0.66 -3.95 1.82 5.41 -0.37 -4.91 119.36 121.71 1hi9 n ILE 177 Ca 0.06 -0.30 -0.12 0.00 1.00 0.00 0.00 62.75 63.40 1hi9 n ILE 177 Cb 0.49 -0.87 -0.01 0.00 -0.71 0.00 0.00 39.64 38.54 1hi9 n ILE 177 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1hi9 s SER 178 N -4.85 0.58 0.27 4.38 1.04 -0.93 -4.97 113.70 109.23 1hi9 s SER 178 Ca -0.13 -1.39 0.23 0.00 0.48 0.00 0.00 55.95 55.15 1hi9 s SER 178 Cb 0.04 0.77 1.02 0.00 0.10 0.00 0.00 66.02 67.95 1hi9 s SER 178 CO 0.30 -1.53 1.70 -1.14 0.98 0.00 0.00 173.24 173.55 1hi9 n ARG 179 N -0.57 0.18 -2.20 4.02 0.63 -1.26 -2.99 116.66 114.47 1hi9 n ARG 179 Ca -0.04 0.48 -0.01 0.00 -0.92 0.00 0.00 57.85 57.36 1hi9 n ARG 179 Cb 0.61 -1.89 0.05 0.00 0.45 0.00 0.00 32.46 31.67 1hi9 n ARG 179 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 1hi9 n SER 180 N -2.24 1.83 -3.66 6.15 3.41 -1.26 0.15 113.62 117.99 1hi9 n SER 180 Ca 0.01 -2.36 -0.13 0.00 -0.26 0.00 0.00 58.87 56.13 1hi9 n SER 180 Cb 0.18 -0.41 -0.08 0.00 -0.26 0.00 0.00 64.21 63.64 1hi9 n SER 180 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1hi9 s ALA 181 N -2.64 -1.58 0.12 7.33 0.00 -1.16 -4.60 121.76 119.23 1hi9 s ALA 181 Ca 0.33 1.83 -0.11 0.00 0.00 0.00 0.00 51.96 54.01 1hi9 s ALA 181 Cb 0.35 -1.07 0.01 0.00 0.00 0.00 0.00 23.12 22.42 1hi9 s ALA 181 CO -0.07 -0.30 0.29 0.14 0.00 0.00 0.00 175.76 175.81 1hi9 s VAL 182 N 0.45 0.10 -0.28 0.00 -7.23 -1.26 -1.23 120.40 110.94 1hi9 s VAL 182 Ca -0.01 -1.07 -0.06 0.00 -1.81 0.00 0.00 61.98 59.03 1hi9 s VAL 182 Cb -0.05 -1.45 0.01 0.00 0.56 0.00 0.00 36.38 35.46 1hi9 s VAL 182 CO -0.01 -0.44 0.05 -0.75 -0.31 0.00 0.00 175.10 173.64 1hi9 s LYS 183 N -3.88 3.07 0.33 4.82 2.20 0.58 -4.91 119.74 121.95 1hi9 s LYS 183 Ca 0.08 -0.86 0.09 0.00 -0.36 0.00 0.00 55.97 54.92 1hi9 s LYS 183 Cb 0.03 -3.28 -0.06 0.00 -1.51 0.00 0.00 37.83 33.01 1hi9 s LYS 183 CO -0.08 -0.42 -0.04 0.00 -0.36 0.00 0.00 175.35 174.46 1hi9 s LEU 185 N -3.67 3.97 0.66 0.00 1.43 -1.20 -5.01 118.68 114.86 1hi9 s LEU 185 Ca 0.33 0.76 -0.16 0.00 -1.03 0.00 0.00 54.13 54.03 1hi9 s LEU 185 Cb -0.00 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.61 1hi9 s LEU 185 CO 0.18 -0.28 1.18 -0.94 0.23 0.00 0.00 176.35 176.72 1hi9 s SER 186 N -3.40 4.80 0.34 2.29 1.04 -1.26 -4.61 113.70 112.89 1hi9 s SER 186 Ca 0.45 2.29 0.11 0.00 0.48 0.00 0.00 55.95 59.28 1hi9 s SER 186 Cb -0.10 -2.58 0.92 0.00 0.10 0.00 0.00 66.02 64.35 1hi9 s SER 186 CO 0.33 -1.85 1.75 -0.65 0.98 0.00 0.00 173.24 173.79 1hi9 h PRO 187 N 0.25 0.54 -0.14 4.02 0.11 -1.97 0.43 132.00 135.25 1hi9 h PRO 187 Ca -0.49 -0.03 -0.19 0.00 0.11 0.00 0.00 66.00 65.40 1hi9 h PRO 187 Cb 1.28 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 1hi9 h PRO 187 CO 0.53 0.36 -0.69 0.00 -0.21 0.00 0.00 178.00 177.99 1hi9 h ALA 188 N 1.69 0.53 -0.40 -0.75 0.00 -1.99 -2.52 119.26 115.81 1hi9 h ALA 188 Ca 0.62 -0.58 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1hi9 h ALA 188 Cb 1.25 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1hi9 h ALA 188 CO -0.42 0.72 -0.03 -0.22 0.00 0.00 0.00 179.25 179.30 1hi9 h LYS 189 N 0.41 0.73 -0.21 0.00 3.64 -1.34 -2.43 116.57 117.38 1hi9 h LYS 189 Ca -0.02 -0.25 -0.06 0.00 -1.27 0.00 0.00 60.65 59.05 1hi9 h LYS 189 Cb 1.27 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.02 1hi9 h LYS 189 CO 0.13 0.83 -0.13 0.07 -2.27 0.00 0.00 179.45 178.09 1hi9 h ARG 190 N 0.56 0.34 -0.44 1.90 0.11 -1.10 -2.46 114.38 113.28 1hi9 h ARG 190 Ca 0.11 -0.09 0.00 0.00 0.10 0.00 0.00 59.98 60.11 1hi9 h ARG 190 Cb 0.52 -0.04 -0.02 0.00 1.11 0.00 0.00 29.97 31.54 1hi9 h ARG 190 CO 0.03 0.47 0.29 0.78 0.10 0.00 0.00 179.97 181.64 1hi9 h GLY 191 N 0.83 0.62 0.85 0.08 0.00 -0.98 0.11 103.07 104.58 1hi9 h GLY 191 Ca 0.06 -0.24 -0.00 0.00 0.00 0.00 0.00 47.33 47.15 1hi9 h GLY 191 CO 0.02 0.23 -0.01 3.21 0.00 0.00 0.00 176.54 179.99 1hi9 h ARG 192 N 0.60 -0.04 -0.41 4.80 3.08 -1.17 0.77 114.38 122.00 1hi9 h ARG 192 Ca 0.16 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.30 1hi9 h ARG 192 Cb -0.06 0.01 -0.09 0.00 0.08 0.00 0.00 29.97 29.92 1hi9 h ARG 192 CO -0.03 0.13 -0.16 1.25 -1.07 0.00 0.00 179.97 180.08 1hi9 h LEU 193 N -0.19 -0.55 -0.72 3.04 5.85 -1.15 0.21 115.31 121.80 1hi9 h LEU 193 Ca -0.00 0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.83 1hi9 h LEU 193 Cb 0.18 0.32 -0.03 0.00 0.37 0.00 0.00 40.66 41.50 1hi9 h LEU 193 CO 0.01 -0.19 0.32 -0.07 -0.34 0.00 0.00 178.44 178.16 1hi9 h LEU 194 N -0.07 0.97 0.16 2.25 3.38 -0.61 0.18 115.31 121.57 1hi9 h LEU 194 Ca 0.20 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1hi9 h LEU 194 Cb 0.38 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1hi9 h LEU 194 CO -0.47 0.85 -0.08 0.74 0.09 0.00 0.00 178.44 179.58 1hi9 h THR 195 N 1.02 0.84 0.07 0.22 2.02 0.47 0.97 112.91 118.53 1hi9 h THR 195 Ca 0.24 -0.02 -0.00 0.00 0.77 0.00 0.00 66.41 67.40 1hi9 h THR 195 Cb 0.16 0.85 0.00 0.00 -1.74 0.00 0.00 68.15 67.43 1hi9 h THR 195 CO -0.03 0.00 -0.03 -0.33 0.37 0.00 0.00 175.52 175.51 1hi9 h GLU 196 N -0.23 -0.09 -0.96 6.66 5.08 -0.51 -1.90 114.58 122.63 1hi9 h GLU 196 Ca -0.02 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.37 1hi9 h GLU 196 Cb 0.17 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.39 1hi9 h GLU 196 CO 0.04 0.05 0.63 0.87 -1.00 0.00 0.00 179.01 179.61 1hi9 h LYS 197 N -0.22 1.21 -0.54 2.33 1.79 -0.90 -0.33 116.57 119.91 1hi9 h LYS 197 Ca -0.01 -0.07 -0.09 0.00 -2.18 0.00 0.00 60.65 58.30 1hi9 h LYS 197 Cb 0.18 -0.27 -0.02 0.00 -1.58 0.00 0.00 32.23 30.54 1hi9 h LYS 197 CO 0.02 0.80 -0.02 1.15 -1.08 0.00 0.00 179.45 180.31 1hi9 h THR 198 N 1.25 1.27 -0.00 -0.16 2.02 -0.69 -0.39 112.91 116.20 1hi9 h THR 198 Ca 0.37 -1.14 -0.00 0.00 0.77 0.00 0.00 66.41 66.41 1hi9 h THR 198 Cb -0.04 0.93 -0.00 0.00 -1.74 0.00 0.00 68.15 67.29 1hi9 h THR 198 CO -0.10 0.41 0.00 0.00 0.37 0.00 0.00 175.52 176.19 1hi9 h ALA 199 N 0.94 0.00 -0.76 6.16 0.00 -0.65 -2.05 119.26 122.90 1hi9 h ALA 199 Ca 0.15 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1hi9 h ALA 199 Cb 0.56 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 1hi9 h ALA 199 CO 0.03 -0.45 0.45 0.35 0.00 0.00 0.00 179.25 179.63 1hi9 h PHE 200 N -0.09 1.01 -0.75 0.00 3.57 -0.98 -2.50 116.94 117.21 1hi9 h PHE 200 Ca 0.00 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.50 1hi9 h PHE 200 Cb 0.09 -0.33 -0.04 0.00 2.79 0.00 0.00 35.95 38.46 1hi9 h PHE 200 CO -0.05 0.68 0.50 0.00 -2.23 0.00 0.00 178.31 177.21 1hi9 h ALA 201 N 1.24 0.95 -0.14 2.41 0.00 -0.90 0.43 119.26 123.24 1hi9 h ALA 201 Ca 0.27 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 55.02 1hi9 h ALA 201 Cb -0.03 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 1hi9 h ALA 201 CO -0.05 0.36 -0.42 -0.07 0.00 0.00 0.00 179.25 179.07 1hi9 h LEU 202 N 1.01 0.35 0.00 0.00 3.38 -1.11 -2.21 115.31 116.73 1hi9 h LEU 202 Ca 0.28 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1hi9 h LEU 202 Cb -0.11 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.55 1hi9 h LEU 202 CO -0.06 0.73 -0.65 0.06 0.09 0.00 0.00 178.44 178.61 1hi9 h GLN 203 N 0.27 0.00 -0.64 1.13 3.07 -1.15 -3.27 115.11 114.52 1hi9 h GLN 203 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.76 1hi9 h GLN 203 Cb 0.86 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.42 1hi9 h GLN 203 CO 0.07 0.00 0.00 -1.71 0.09 0.00 0.00 178.83 177.28 1hi9 n ASN 204 N -2.69 4.04 -0.23 0.06 2.85 0.11 -4.62 115.26 114.78 1hi9 n ASN 204 Ca 0.02 -2.16 0.21 0.00 -0.11 0.00 0.00 54.58 52.54 1hi9 n ASN 204 Cb 0.52 -0.48 0.55 0.00 1.24 0.00 0.00 39.78 41.61 1hi9 n ASN 204 CO 0.00 0.00 0.00 0.07 -2.11 0.00 0.00 177.26 175.22 1hi9 h LYS 205 N 3.82 0.32 0.00 1.20 2.10 -1.45 -1.68 116.57 120.88 1hi9 h LYS 205 Ca 0.00 -0.02 -0.00 0.00 -2.00 0.00 0.00 60.65 58.63 1hi9 h LYS 205 Cb 1.10 -0.07 -0.00 0.00 -0.90 0.00 0.00 32.23 32.35 1hi9 h LYS 205 CO 0.07 0.21 -0.01 -0.44 -2.00 0.00 0.00 179.45 177.29 1hi9 h ASP 206 N 0.33 0.00 0.21 7.07 5.19 -1.88 -1.78 116.42 125.56 1hi9 h ASP 206 Ca 0.46 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.87 1hi9 h ASP 206 Cb 1.26 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.77 1hi9 h ASP 206 CO -0.15 0.01 -0.03 0.29 -3.12 0.00 0.00 179.24 176.23 1hi9 n LYS 207 N -3.75 0.89 -4.57 3.56 5.02 -0.63 -4.79 118.16 113.89 1hi9 n LYS 207 Ca -0.03 -0.20 -0.33 0.00 -2.02 0.00 0.00 58.31 55.73 1hi9 n LYS 207 Cb 0.09 -1.50 -0.13 0.00 -0.02 0.00 0.00 35.03 33.48 1hi9 n LYS 207 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1hi9 s VAL 208 N -2.25 3.56 0.13 -0.18 1.01 -0.67 -4.70 120.40 117.30 1hi9 s VAL 208 Ca 0.37 -0.49 0.06 0.00 0.00 0.00 0.00 61.98 61.93 1hi9 s VAL 208 Cb 0.21 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.02 1hi9 s VAL 208 CO 0.41 0.52 -0.03 -0.54 0.00 0.00 0.00 175.10 175.46 1hi9 s LYS 209 N 0.22 2.38 0.43 2.72 1.02 -1.26 -4.86 119.74 120.38 1hi9 s LYS 209 Ca -0.05 -0.99 -0.26 0.00 0.02 0.00 0.00 55.97 54.69 1hi9 s LYS 209 Cb -0.14 -2.41 -0.09 0.00 -0.52 0.00 0.00 37.83 34.67 1hi9 s LYS 209 CO 0.04 0.50 1.42 -2.14 -0.92 0.00 0.00 175.35 174.24 1hi9 s PRO 210 N -2.52 3.82 -1.24 -1.68 0.02 -1.26 -4.65 135.00 127.49 1hi9 s PRO 210 Ca 0.25 2.40 -0.18 0.00 0.02 0.00 0.00 61.00 63.50 1hi9 s PRO 210 Cb -0.11 -2.74 0.09 0.00 0.02 0.00 0.00 34.50 31.77 1hi9 s PRO 210 CO 0.17 -0.70 1.62 -1.17 -0.33 0.00 0.00 177.00 176.59 1hi9 s LEU 211 N -2.54 4.12 0.12 -5.54 0.20 -1.26 -4.95 118.68 108.82 1hi9 s LEU 211 Ca 0.59 -2.45 -0.31 0.00 0.69 0.00 0.00 54.13 52.64 1hi9 s LEU 211 Cb -0.43 -2.53 -0.11 0.00 -0.43 0.00 0.00 46.19 42.69 1hi9 s LEU 211 CO 0.56 -1.11 1.84 0.41 -0.29 0.00 0.00 176.35 177.77 1hi9 n THR 212 N 6.02 0.38 -3.11 3.68 -1.04 -1.26 -4.04 114.28 114.91 1hi9 n THR 212 Ca 0.44 -0.07 -0.25 0.00 -2.04 0.00 0.00 64.05 62.13 1hi9 n THR 212 Cb 0.46 -2.12 -0.01 0.00 -1.82 0.00 0.00 70.33 66.84 1hi9 n THR 212 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1hi9 s PRO 213 N 2.81 3.50 0.86 -2.82 0.04 -1.26 -5.04 135.00 133.09 1hi9 s PRO 213 Ca 0.82 -0.15 -0.12 0.00 0.04 0.00 0.00 61.00 61.60 1hi9 s PRO 213 Cb -0.48 -2.56 0.11 0.00 0.04 0.00 0.00 34.50 31.61 1hi9 s PRO 213 CO 0.38 0.02 1.15 -2.30 0.04 0.00 0.00 177.00 176.28 1hi9 n PRO 214 N -1.96 -0.13 0.07 0.56 -0.02 -1.26 -4.94 135.00 127.32 1hi9 n PRO 214 Ca -0.03 0.04 -0.13 0.00 -2.02 0.00 0.00 63.50 61.36 1hi9 n PRO 214 Cb 0.56 -2.39 -0.08 0.00 -0.02 0.00 0.00 33.50 31.57 1hi9 n PRO 214 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1hi9 h ASP 215 N -1.37 -0.11 -2.37 2.55 3.45 -1.97 -3.34 116.42 113.25 1hi9 h ASP 215 Ca -0.45 -0.16 -0.60 0.00 0.43 0.00 0.00 57.03 56.26 1hi9 h ASP 215 Cb 1.29 0.03 -0.42 0.00 -0.56 0.00 0.00 39.33 39.67 1hi9 h ASP 215 CO 0.43 0.09 -0.66 0.54 -1.57 0.00 0.00 179.24 178.08 1hi9 n ARG 216 N -5.06 2.09 -1.74 3.56 1.74 -1.26 -3.92 116.66 112.07 1hi9 n ARG 216 Ca -0.08 -4.42 -0.39 0.00 -0.77 0.00 0.00 57.85 52.18 1hi9 n ARG 216 Cb 0.15 -2.13 0.03 0.00 -1.02 0.00 0.00 32.46 29.49 1hi9 n ARG 216 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1hi9 n PRO 217 N 1.22 1.94 -3.70 5.56 -0.04 -1.25 -4.68 135.00 134.05 1hi9 n PRO 217 Ca 0.27 0.70 -0.38 0.00 -0.04 0.00 0.00 63.50 64.05 1hi9 n PRO 217 Cb 0.41 -2.56 -0.12 0.00 -0.04 0.00 0.00 33.50 31.19 1hi9 n PRO 217 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1hi9 s VAL 218 N -1.24 4.33 -0.06 0.52 1.01 -1.26 -1.72 120.40 121.98 1hi9 s VAL 218 Ca 0.66 -0.55 -0.22 0.00 0.00 0.00 0.00 61.98 61.86 1hi9 s VAL 218 Cb -0.44 -3.23 -0.04 0.00 0.00 0.00 0.00 36.38 32.67 1hi9 s VAL 218 CO 0.54 0.06 0.66 -0.22 0.00 0.00 0.00 175.10 176.13 1hi9 s LEU 219 N 1.56 4.34 -0.05 3.92 2.96 -0.25 -1.64 118.68 129.51 1hi9 s LEU 219 Ca 0.04 1.15 0.03 0.00 -0.22 0.00 0.00 54.13 55.12 1hi9 s LEU 219 Cb -0.17 -3.01 0.00 0.00 0.50 0.00 0.00 46.19 43.51 1hi9 s LEU 219 CO 0.05 -0.06 -0.14 -0.44 -1.32 0.00 0.00 176.35 174.44 1hi9 s SER 220 N 0.56 1.83 -0.11 3.68 0.01 -0.21 -0.72 113.70 118.74 1hi9 s SER 220 Ca 0.35 -0.30 -0.00 0.00 1.31 0.00 0.00 55.95 57.31 1hi9 s SER 220 Cb -0.18 -0.66 0.02 0.00 0.21 0.00 0.00 66.02 65.42 1hi9 s SER 220 CO 0.17 0.09 -0.09 -0.63 0.41 0.00 0.00 173.24 173.19 1hi9 s ILE 221 N 0.33 1.09 -0.28 1.44 1.01 -0.53 0.09 121.20 124.36 1hi9 s ILE 221 Ca -0.08 -0.34 -0.11 0.00 0.00 0.00 0.00 60.65 60.12 1hi9 s ILE 221 Cb -0.13 -1.09 -0.05 0.00 0.01 0.00 0.00 42.46 41.21 1hi9 s ILE 221 CO 0.03 0.38 0.20 -0.70 0.00 0.00 0.00 174.94 174.85 1hi9 s GLU 222 N 1.61 3.96 0.37 2.79 2.12 -0.36 -1.03 118.70 128.17 1hi9 s GLU 222 Ca 0.04 -0.29 0.02 0.00 0.36 0.00 0.00 54.97 55.10 1hi9 s GLU 222 Cb -0.13 -3.65 -0.01 0.00 0.26 0.00 0.00 34.13 30.59 1hi9 s GLU 222 CO -0.08 -0.18 0.56 -0.06 -0.54 0.00 0.00 175.26 174.96 1hi9 s PHE 223 N 1.76 3.28 0.17 5.30 0.40 -0.57 0.43 117.98 128.75 1hi9 s PHE 223 Ca 0.08 0.12 -0.11 0.00 -0.60 0.00 0.00 56.93 56.41 1hi9 s PHE 223 Cb -0.16 -2.05 0.06 0.00 0.51 0.00 0.00 43.02 41.38 1hi9 s PHE 223 CO 0.11 -0.07 1.69 0.00 0.70 0.00 0.00 175.22 177.64 1hi9 h ALA 224 N 0.69 0.77 -2.18 5.36 0.00 -1.00 -3.43 119.26 119.47 1hi9 h ALA 224 Ca -0.48 -0.22 -0.40 0.00 0.00 0.00 0.00 54.91 53.82 1hi9 h ALA 224 Cb 1.24 -0.22 -0.14 0.00 0.00 0.00 0.00 17.79 18.67 1hi9 h ALA 224 CO 0.57 0.47 -0.64 0.54 0.00 0.00 0.00 179.25 180.19 1hi9 s ASN 225 N -6.25 1.85 0.36 0.00 4.22 -1.26 -5.06 114.94 108.80 1hi9 s ASN 225 Ca -0.13 -1.29 0.11 0.00 -2.14 0.00 0.00 52.86 49.41 1hi9 s ASN 225 Cb 0.13 0.01 0.67 0.00 1.28 0.00 0.00 41.25 43.34 1hi9 s ASN 225 CO 0.81 -0.57 1.82 0.22 -2.04 0.00 0.00 177.10 177.34 1hi9 h TYR 226 N 2.37 0.12 -0.80 1.54 3.20 -1.92 -2.98 116.97 118.49 1hi9 h TYR 226 Ca -0.39 -0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.50 1hi9 h TYR 226 Cb 1.23 -0.03 -0.05 0.00 1.54 0.00 0.00 36.73 39.42 1hi9 h TYR 226 CO 0.56 0.43 0.50 0.78 -1.64 0.00 0.00 178.16 178.79 1hi9 h GLY 227 N 1.06 1.18 1.72 1.82 0.00 -1.97 0.06 103.07 106.95 1hi9 h GLY 227 Ca 0.01 -0.37 -0.10 0.00 0.00 0.00 0.00 47.33 46.87 1hi9 h GLY 227 CO 0.05 0.29 -0.33 1.46 0.00 0.00 0.00 176.54 178.00 1hi9 h GLN 228 N 0.95 0.32 -0.35 4.80 4.20 -1.83 -2.04 115.11 121.16 1hi9 h GLN 228 Ca 0.33 -0.13 -0.07 0.00 0.06 0.00 0.00 58.65 58.84 1hi9 h GLN 228 Cb 0.08 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 1hi9 h GLN 228 CO -0.14 0.62 -0.07 0.00 -0.67 0.00 0.00 178.83 178.57 1hi9 h ALA 229 N 1.38 0.49 -0.67 3.87 0.00 -1.31 -2.45 119.26 120.57 1hi9 h ALA 229 Ca 0.03 -0.29 0.03 0.00 0.00 0.00 0.00 54.91 54.68 1hi9 h ALA 229 Cb 0.72 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 1hi9 h ALA 229 CO 0.06 0.32 0.42 0.93 0.00 0.00 0.00 179.25 180.97 1hi9 h GLU 230 N 0.47 0.81 0.12 0.00 5.08 -0.62 0.10 114.58 120.53 1hi9 h GLU 230 Ca 0.09 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.41 1hi9 h GLU 230 Cb 0.56 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 1hi9 h GLU 230 CO 0.03 0.53 -0.15 -1.49 -1.00 0.00 0.00 179.01 176.94 1hi9 h TRP 231 N 0.83 -0.38 -0.66 4.33 4.06 -1.28 -2.66 115.95 120.20 1hi9 h TRP 231 Ca 0.27 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 61.20 1hi9 h TRP 231 Cb 0.00 0.15 -0.03 0.00 -1.00 0.00 0.00 29.16 28.28 1hi9 h TRP 231 CO -0.04 -0.22 0.32 0.00 -3.56 0.00 0.00 178.44 174.93 1hi9 h ALA 232 N 0.54 1.32 0.00 1.49 0.00 -1.12 -1.88 119.26 119.60 1hi9 h ALA 232 Ca 0.01 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1hi9 h ALA 232 Cb 0.30 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1hi9 h ALA 232 CO -0.06 0.53 0.00 -1.71 0.00 0.00 0.00 179.25 178.01 1hi9 n ASN 233 N -4.34 0.00 0.08 0.00 5.15 0.32 -1.47 115.26 115.00 1hi9 n ASN 233 Ca 0.06 -0.37 -0.03 0.00 -0.60 0.00 0.00 54.58 53.64 1hi9 n ASN 233 Cb 0.13 0.00 -0.06 0.00 -0.53 0.00 0.00 39.78 39.32 1hi9 n ASN 233 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1hi9 h LEU 234 N 0.00 0.00 -9.60 1.20 4.07 -1.23 -3.46 115.31 106.29 1hi9 h LEU 234 Ca 0.00 0.00 -0.53 0.00 0.08 0.00 0.00 57.88 57.43 1hi9 h LEU 234 Cb 0.00 0.00 0.03 0.00 1.08 0.00 0.00 40.66 41.77 1hi9 h LEU 234 CO 0.00 0.77 0.76 -0.32 -1.08 0.00 0.00 178.44 178.57 1hi9 s MET 235 N -2.82 4.29 0.40 1.13 1.75 -0.54 -4.95 119.30 118.57 1hi9 s MET 235 Ca 0.01 2.17 -0.26 0.00 -1.25 0.00 0.00 55.69 56.37 1hi9 s MET 235 Cb 0.09 -3.20 -0.10 0.00 2.84 0.00 0.00 34.83 34.45 1hi9 s MET 235 CO 0.79 -0.46 1.27 -2.30 -0.65 0.00 0.00 175.02 173.67 1hi9 n PRO 236 N 3.58 1.96 -0.58 4.11 -0.02 -1.26 -2.49 135.00 140.30 1hi9 n PRO 236 Ca 0.11 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 1hi9 n PRO 236 Cb 0.41 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 1hi9 n PRO 236 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1hi9 n GLY 237 N 0.81 0.77 3.86 -1.23 0.00 -1.26 -5.06 105.19 103.08 1hi9 n GLY 237 Ca 0.06 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.87 1hi9 n GLY 237 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1hi9 s THR 238 N -2.81 3.93 -0.19 2.61 -4.23 -1.04 -4.21 115.64 109.70 1hi9 s THR 238 Ca 0.00 -1.33 -0.22 0.00 -1.18 0.00 0.00 61.69 58.96 1hi9 s THR 238 Cb 0.00 -3.30 0.06 0.00 1.34 0.00 0.00 72.50 70.60 1hi9 s THR 238 CO 0.00 -0.23 0.59 -0.70 -0.54 0.00 0.00 174.62 173.74 1hi9 s GLU 239 N -3.96 0.74 -0.13 3.99 2.12 -0.85 -4.97 118.70 115.64 1hi9 s GLU 239 Ca 0.39 0.68 -0.15 0.00 0.36 0.00 0.00 54.97 56.25 1hi9 s GLU 239 Cb -0.07 0.36 -0.05 0.00 0.26 0.00 0.00 34.13 34.63 1hi9 s GLU 239 CO 0.27 -0.12 0.36 0.42 -0.54 0.00 0.00 175.26 175.64 1hi9 s ILE 240 N 0.00 5.24 -0.39 -3.70 1.01 -1.26 -0.34 121.20 121.76 1hi9 s ILE 240 Ca -0.02 0.69 -0.29 0.00 0.00 0.00 0.00 60.65 61.03 1hi9 s ILE 240 Cb -0.04 -3.69 0.01 0.00 0.01 0.00 0.00 42.46 38.76 1hi9 s ILE 240 CO 0.02 0.40 1.34 -0.75 0.00 0.00 0.00 174.94 175.96 1hi9 s LYS 241 N 0.26 3.69 0.21 2.79 2.47 -0.58 -4.95 119.74 123.63 1hi9 s LYS 241 Ca 0.20 0.97 -0.30 0.00 -1.56 0.00 0.00 55.97 55.28 1hi9 s LYS 241 Cb -0.14 -3.97 -0.16 0.00 -1.46 0.00 0.00 37.83 32.10 1hi9 s LYS 241 CO 0.07 -1.41 0.87 0.25 0.16 0.00 0.00 175.35 175.28 1hi9 n THR 242 N 6.79 1.61 -0.99 3.43 -2.24 -1.26 -1.57 114.28 120.05 1hi9 n THR 242 Ca 0.15 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 1hi9 n THR 242 Cb 0.48 -0.52 0.00 0.00 -2.10 0.00 0.00 70.33 68.18 1hi9 n THR 242 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hi9 n GLY 243 N 1.70 0.51 3.07 3.38 0.00 -1.26 -5.01 105.19 107.58 1hi9 n GLY 243 Ca 0.15 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.99 1hi9 n GLY 243 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1hi9 n THR 244 N -2.98 0.00 -1.38 2.61 -2.24 -0.61 -5.04 114.28 104.64 1hi9 n THR 244 Ca 0.00 -2.20 0.06 0.00 -2.27 0.00 0.00 64.05 59.63 1hi9 n THR 244 Cb 0.00 1.14 0.19 0.00 -2.10 0.00 0.00 70.33 69.56 1hi9 n THR 244 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1hi9 n THR 245 N -0.59 2.19 -3.90 4.28 -2.24 -1.26 -4.78 114.28 107.97 1hi9 n THR 245 Ca 0.06 -2.79 -0.36 0.00 -2.27 0.00 0.00 64.05 58.70 1hi9 n THR 245 Cb 0.57 -0.26 -0.08 0.00 -2.10 0.00 0.00 70.33 68.47 1hi9 n THR 245 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1hi9 s THR 246 N -3.11 5.25 -0.07 4.28 2.01 -1.26 -1.51 115.64 121.23 1hi9 s THR 246 Ca 0.38 0.12 0.04 0.00 0.31 0.00 0.00 61.69 62.54 1hi9 s THR 246 Cb 0.35 -3.33 -0.01 0.00 0.01 0.00 0.00 72.50 69.52 1hi9 s THR 246 CO -0.02 0.54 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.54 1hi9 s VAL 247 N -0.34 2.38 0.15 3.82 1.01 -0.19 -1.52 120.40 125.70 1hi9 s VAL 247 Ca 0.11 -0.94 0.08 0.00 0.00 0.00 0.00 61.98 61.23 1hi9 s VAL 247 Cb -0.12 -1.91 -0.04 0.00 0.00 0.00 0.00 36.38 34.32 1hi9 s VAL 247 CO 0.01 0.57 -0.10 -1.10 0.00 0.00 0.00 175.10 174.47 1hi9 s GLN 248 N -0.12 2.05 -0.14 2.72 -0.21 0.53 -1.45 119.66 123.04 1hi9 s GLN 248 Ca -0.04 -1.20 -0.04 0.00 0.02 0.00 0.00 55.36 54.10 1hi9 s GLN 248 Cb -0.14 -2.19 0.07 0.00 1.00 0.00 0.00 33.01 31.75 1hi9 s GLN 248 CO 0.04 0.46 0.23 0.12 -2.12 0.00 0.00 175.29 174.01 1hi9 s PHE 249 N -1.52 -0.33 -0.31 0.91 5.36 0.10 -2.01 117.98 120.17 1hi9 s PHE 249 Ca 0.23 0.69 -0.27 0.00 -0.96 0.00 0.00 56.93 56.62 1hi9 s PHE 249 Cb -0.10 -0.18 0.01 0.00 -0.34 0.00 0.00 43.02 42.42 1hi9 s PHE 249 CO 0.14 -0.40 0.97 -1.14 -1.46 0.00 0.00 175.22 173.33 1hi9 s GLN 250 N 2.37 4.02 0.25 10.12 2.00 -1.26 -1.10 119.66 136.06 1hi9 s GLN 250 Ca 0.03 0.89 0.06 0.00 -2.00 0.00 0.00 55.36 54.34 1hi9 s GLN 250 Cb -0.13 -3.73 -0.03 0.00 0.80 0.00 0.00 33.01 29.91 1hi9 s GLN 250 CO -0.09 -0.82 0.31 0.00 -0.50 0.00 0.00 175.29 174.19 1hi9 s ALA 251 N 3.39 3.83 0.12 1.58 0.00 -0.70 -5.00 121.76 124.98 1hi9 s ALA 251 Ca 0.41 -1.31 0.05 0.00 0.00 0.00 0.00 51.96 51.10 1hi9 s ALA 251 Cb -0.13 -1.58 -0.20 0.00 0.00 0.00 0.00 23.12 21.21 1hi9 s ALA 251 CO 0.14 0.23 1.26 0.87 0.00 0.00 0.00 175.76 178.26 1hi9 h LYS 252 N 1.26 0.06 -2.93 0.00 1.57 -1.88 -3.35 116.57 111.29 1hi9 h LYS 252 Ca -0.50 -0.10 0.04 0.00 -1.87 0.00 0.00 60.65 58.22 1hi9 h LYS 252 Cb 1.23 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 33.55 1hi9 h LYS 252 CO 0.60 1.03 0.29 0.16 -0.57 0.00 0.00 179.45 180.96 1hi9 s ASP 253 N -6.80 -0.11 0.36 0.86 -4.77 -1.25 -4.33 116.67 100.62 1hi9 s ASP 253 Ca -0.00 -0.86 0.03 0.00 -3.30 0.00 0.00 52.55 48.41 1hi9 s ASP 253 Cb 0.10 0.76 0.67 0.00 -1.09 0.00 0.00 42.92 43.36 1hi9 s ASP 253 CO 0.83 -1.47 2.01 -0.03 0.70 0.00 0.00 175.17 177.21 1hi9 h MET 254 N 2.00 0.79 -0.70 2.11 1.85 -1.80 -1.48 114.93 117.71 1hi9 h MET 254 Ca -0.26 -0.05 -0.03 0.00 -0.61 0.00 0.00 59.70 58.75 1hi9 h MET 254 Cb 1.25 -0.18 -0.03 0.00 0.43 0.00 0.00 31.60 33.07 1hi9 h MET 254 CO 0.33 0.52 0.31 -0.07 -0.40 0.00 0.00 176.91 177.60 1hi9 h LEU 255 N 0.82 0.94 -0.68 3.39 3.38 -1.96 0.50 115.31 121.70 1hi9 h LEU 255 Ca 0.23 -0.15 -0.14 0.00 0.09 0.00 0.00 57.88 57.91 1hi9 h LEU 255 Cb -0.07 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 1hi9 h LEU 255 CO -0.05 0.83 -0.52 -0.08 0.09 0.00 0.00 178.44 178.71 1hi9 h GLU 256 N 0.99 0.37 -0.56 1.13 4.81 -1.84 -2.51 114.58 116.96 1hi9 h GLU 256 Ca 0.24 -0.22 -0.07 0.00 -0.13 0.00 0.00 59.36 59.17 1hi9 h GLU 256 Cb 0.16 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 1hi9 h GLU 256 CO -0.02 0.80 0.06 0.00 -0.73 0.00 0.00 179.01 179.12 1hi9 h ALA 257 N 1.15 1.05 -0.02 2.92 0.00 -0.76 -0.03 119.26 123.57 1hi9 h ALA 257 Ca 0.01 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 1hi9 h ALA 257 Cb 1.02 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1hi9 h ALA 257 CO 0.09 0.60 0.00 -0.92 0.00 0.00 0.00 179.25 179.02 1hi9 h TYR 258 N 0.86 0.04 -0.17 0.00 3.20 -0.69 -1.92 116.97 118.28 1hi9 h TYR 258 Ca 0.17 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.99 1hi9 h TYR 258 Cb 0.43 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.68 1hi9 h TYR 258 CO 0.03 0.30 -0.09 1.96 -1.64 0.00 0.00 178.16 178.72 1hi9 h GLN 259 N -0.24 0.26 -0.46 1.82 4.20 -1.30 -0.74 115.11 118.65 1hi9 h GLN 259 Ca 0.01 -0.05 -0.06 0.00 0.06 0.00 0.00 58.65 58.60 1hi9 h GLN 259 Cb 0.29 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.01 1hi9 h GLN 259 CO 0.00 0.37 0.04 0.00 -0.67 0.00 0.00 178.83 178.57 1hi9 h ALA 260 N 1.66 1.22 -0.38 3.87 0.00 -0.80 -1.59 119.26 123.23 1hi9 h ALA 260 Ca 0.05 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1hi9 h ALA 260 Cb 0.32 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1hi9 h ALA 260 CO 0.02 0.52 0.14 1.98 0.00 0.00 0.00 179.25 181.91 1hi9 h MET 261 N 0.69 0.58 -0.25 0.00 1.85 -0.36 -0.41 114.93 117.04 1hi9 h MET 261 Ca 0.14 -0.11 0.03 0.00 -0.61 0.00 0.00 59.70 59.15 1hi9 h MET 261 Cb 0.37 -0.09 -0.03 0.00 0.43 0.00 0.00 31.60 32.28 1hi9 h MET 261 CO 0.01 0.57 0.06 -0.07 -0.40 0.00 0.00 176.91 177.08 1hi9 h LEU 262 N 0.47 0.03 0.01 3.39 3.38 -0.73 -0.64 115.31 121.21 1hi9 h LEU 262 Ca 0.13 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 1hi9 h LEU 262 Cb 0.21 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1hi9 h LEU 262 CO -0.01 0.05 -0.00 0.58 0.09 0.00 0.00 178.44 179.15 1hi9 h VAL 263 N 0.15 1.24 -0.83 1.22 2.07 -1.19 -1.30 116.25 117.61 1hi9 h VAL 263 Ca 0.11 -0.73 0.03 0.00 0.82 0.00 0.00 66.70 66.93 1hi9 h VAL 263 Cb 0.11 1.74 -0.05 0.00 -1.52 0.00 0.00 31.29 31.57 1hi9 h VAL 263 CO -0.14 0.19 0.53 0.24 0.02 0.00 0.00 177.57 178.41 1hi9 h MET 264 N -0.32 1.01 -0.15 1.57 2.86 -0.98 0.20 114.93 119.12 1hi9 h MET 264 Ca -0.00 -0.06 -0.17 0.00 -2.06 0.00 0.00 59.70 57.41 1hi9 h MET 264 Cb 0.32 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 31.74 1hi9 h MET 264 CO 0.00 0.67 -0.61 1.79 1.06 0.00 0.00 176.91 179.82 1hi9 h THR 265 N 1.04 1.34 -0.90 2.22 1.35 -1.14 -1.50 112.91 115.32 1hi9 h THR 265 Ca 0.33 -1.90 -0.01 0.00 -0.55 0.00 0.00 66.41 64.28 1hi9 h THR 265 Cb 0.01 1.88 -0.04 0.00 -1.73 0.00 0.00 68.15 68.26 1hi9 h THR 265 CO -0.12 0.58 0.51 -0.08 -0.25 0.00 0.00 175.52 176.17 1hi9 h GLU 266 N 0.38 1.25 -0.36 4.72 4.57 -0.57 -0.29 114.58 124.28 1hi9 h GLU 266 Ca -0.01 -0.14 -0.11 0.00 -1.18 0.00 0.00 59.36 57.93 1hi9 h GLU 266 Cb 1.16 -0.25 -0.01 0.00 -0.16 0.00 0.00 28.75 29.49 1hi9 h GLU 266 CO 0.11 0.90 -0.19 -0.07 -1.18 0.00 0.00 179.01 178.58 1hi9 h LEU 267 N 1.26 0.79 -1.60 1.64 3.38 -0.84 -2.97 115.31 116.96 1hi9 h LEU 267 Ca 0.32 -0.41 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 1hi9 h LEU 267 Cb 0.00 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1hi9 h LEU 267 CO -0.05 1.03 -0.02 0.00 0.09 0.00 0.00 178.44 179.48 1hi9 h ALA 268 N 0.79 1.68 -0.03 1.53 0.00 -0.77 -2.25 119.26 120.20 1hi9 h ALA 268 Ca 0.08 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.88 1hi9 h ALA 268 Cb 0.74 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1hi9 h ALA 268 CO 0.06 0.24 0.04 0.52 0.00 0.00 0.00 179.25 180.11 1hi9 h MET 269 N 0.22 0.00 0.00 0.00 2.86 -0.89 -1.76 114.93 115.35 1hi9 h MET 269 Ca 0.05 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 1hi9 h MET 269 Cb 0.19 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.85 1hi9 h MET 269 CO 0.01 0.00 0.00 0.54 1.06 0.00 0.00 176.91 178.52 1hi9 n ARG 270 N -3.74 0.17 -1.65 1.72 5.12 -0.85 -4.89 116.66 112.55 1hi9 n ARG 270 Ca -0.02 0.19 -0.48 0.00 -1.93 0.00 0.00 57.85 55.62 1hi9 n ARG 270 Cb 0.13 -1.72 -0.05 0.00 -1.16 0.00 0.00 32.46 29.66 1hi9 n ARG 270 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 1hi9 n THR 271 N -2.03 0.01 -3.13 0.55 -1.04 -0.66 -4.99 114.28 102.98 1hi9 n THR 271 Ca 0.05 -0.00 -0.19 0.00 -2.04 0.00 0.00 64.05 61.87 1hi9 n THR 271 Cb 0.36 -1.34 0.02 0.00 -1.82 0.00 0.00 70.33 67.55 1hi9 n THR 271 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1hi9 s SER 272 N 0.84 5.38 -1.12 8.00 1.04 -1.26 -4.70 113.70 121.88 1hi9 s SER 272 Ca 0.81 -0.62 -0.03 0.00 0.48 0.00 0.00 55.95 56.58 1hi9 s SER 272 Cb -0.76 -0.33 -0.04 0.00 0.10 0.00 0.00 66.02 65.00 1hi9 s SER 272 CO 0.41 -0.93 0.96 0.33 0.98 0.00 0.00 173.24 174.99 1hi9 n PHE 273 N -1.92 -2.34 -1.21 5.02 7.35 -1.26 -5.03 117.46 118.07 1hi9 n PHE 273 Ca 0.09 0.90 0.00 0.00 -0.76 0.00 0.00 57.45 57.68 1hi9 n PHE 273 Cb 0.60 -4.57 0.00 0.00 0.35 0.00 0.00 39.48 35.86 1hi9 n PHE 273 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00