#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 4.37 -0.08 3.17 1.02 -1.26 -1.55 119.74 125.41 1hi9 s LYS 2 Ca 0.00 0.72 0.05 0.00 0.02 0.00 0.00 55.97 56.75 1hi9 s LYS 2 Cb 0.00 -3.41 -0.01 0.00 -0.52 0.00 0.00 37.83 33.89 1hi9 s LYS 2 CO 0.00 0.19 -0.23 -1.17 -0.92 0.00 0.00 175.35 173.22 1hi9 s LEU 3 N 0.43 2.20 -0.14 3.17 1.98 -0.02 -0.66 118.68 125.64 1hi9 s LEU 3 Ca 0.32 -0.48 -0.07 0.00 -2.89 0.00 0.00 54.13 51.01 1hi9 s LEU 3 Cb -0.17 -1.42 -0.04 0.00 0.66 0.00 0.00 46.19 45.21 1hi9 s LEU 3 CO 0.16 0.22 0.11 -0.47 -1.89 0.00 0.00 176.35 174.48 1hi9 s TYR 4 N 0.01 3.46 -0.09 5.38 5.04 -0.44 -1.50 117.35 129.22 1hi9 s TYR 4 Ca -0.08 0.39 0.02 0.00 -2.44 0.00 0.00 57.07 54.96 1hi9 s TYR 4 Cb -0.15 -1.99 0.01 0.00 0.35 0.00 0.00 41.96 40.18 1hi9 s TYR 4 CO 0.05 0.53 -0.15 -1.64 -1.34 0.00 0.00 175.55 173.01 1hi9 s MET 5 N -0.52 2.11 -0.23 4.97 -1.94 0.92 -0.08 119.30 124.53 1hi9 s MET 5 Ca 0.12 -0.54 -0.03 0.00 -1.71 0.00 0.00 55.69 53.53 1hi9 s MET 5 Cb -0.12 -1.75 0.01 0.00 2.01 0.00 0.00 34.83 34.98 1hi9 s MET 5 CO 0.02 -0.00 -0.06 0.45 -0.01 0.00 0.00 175.02 175.41 1hi9 s SER 6 N 0.81 4.20 -0.22 3.03 0.15 -0.54 -0.44 113.70 120.69 1hi9 s SER 6 Ca -0.11 -0.61 -0.03 0.00 0.70 0.00 0.00 55.95 55.90 1hi9 s SER 6 Cb -0.16 -1.69 0.01 0.00 -1.71 0.00 0.00 66.02 62.47 1hi9 s SER 6 CO 0.02 -0.07 -0.07 -0.69 1.20 0.00 0.00 173.24 173.63 1hi9 s VAL 7 N 1.40 3.04 0.57 4.45 1.01 -0.72 -0.54 120.40 129.61 1hi9 s VAL 7 Ca 0.04 -0.70 0.08 0.00 0.00 0.00 0.00 61.98 61.40 1hi9 s VAL 7 Cb -0.15 -2.41 0.07 0.00 0.00 0.00 0.00 36.38 33.89 1hi9 s VAL 7 CO -0.05 0.38 0.68 -0.62 0.00 0.00 0.00 175.10 175.50 1hi9 s ASP 8 N 1.41 4.95 -0.13 3.32 -1.08 0.66 -0.25 116.67 125.56 1hi9 s ASP 8 Ca 0.04 -0.98 -0.01 0.00 -0.52 0.00 0.00 52.55 51.08 1hi9 s ASP 8 Cb -0.15 0.36 -0.08 0.00 -1.46 0.00 0.00 42.92 41.60 1hi9 s ASP 8 CO -0.05 -1.28 -0.13 0.23 0.52 0.00 0.00 175.17 174.45 1hi9 n MET 9 N -2.11 0.31 -0.25 4.34 2.81 -1.23 -4.34 117.12 116.65 1hi9 n MET 9 Ca 0.11 0.09 0.23 0.00 -1.81 0.00 0.00 57.70 56.31 1hi9 n MET 9 Cb 0.62 -1.17 0.58 0.00 -0.71 0.00 0.00 33.22 32.54 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 -0.14 0.27 -0.01 0.03 3.07 -1.92 0.81 114.58 116.70 1hi9 h GLU 10 Ca -0.30 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.55 1hi9 h GLU 10 Cb 1.40 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 29.24 1hi9 h GLU 10 CO -0.09 0.18 -0.02 0.41 -1.40 0.00 0.00 179.01 178.09 1hi9 n GLY 11 N -1.57 -0.24 3.74 -3.84 0.00 0.21 -4.90 105.19 98.59 1hi9 n GLY 11 Ca 0.21 -0.40 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.05 2.12 0.48 -0.61 -1.09 0.28 -4.12 121.20 116.21 1hi9 s ILE 12 Ca 0.38 0.08 -0.22 0.00 -2.23 0.00 0.00 60.65 58.66 1hi9 s ILE 12 Cb 0.21 -3.03 -0.07 0.00 -1.58 0.00 0.00 42.46 37.99 1hi9 s ILE 12 CO 0.36 -0.01 1.20 -0.94 -1.23 0.00 0.00 174.94 174.31 1hi9 s SER 13 N -1.30 5.96 0.00 3.58 1.04 -1.26 -3.25 113.70 118.47 1hi9 s SER 13 Ca 0.79 2.37 0.00 0.00 0.48 0.00 0.00 55.95 59.59 1hi9 s SER 13 Cb -0.37 -2.61 0.00 0.00 0.10 0.00 0.00 66.02 63.14 1hi9 s SER 13 CO 0.41 -1.06 0.00 0.61 0.98 0.00 0.00 173.24 174.17 1hi9 n GLY 14 N 0.47 3.02 3.60 7.32 0.00 -1.26 -4.96 105.19 113.37 1hi9 n GLY 14 Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 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 3.99 -0.08 0.99 1.43 -1.20 -4.93 118.68 118.88 1hi9 s LEU 15 Ca 0.00 0.48 0.03 0.00 -1.03 0.00 0.00 54.13 53.62 1hi9 s LEU 15 Cb 0.00 -3.25 -0.25 0.00 0.03 0.00 0.00 46.19 42.72 1hi9 s LEU 15 CO 0.00 -0.90 0.53 -0.81 0.23 0.00 0.00 176.35 175.40 1hi9 n PRO 16 N 6.87 0.69 -3.56 1.29 -0.04 -1.26 -4.90 135.00 134.10 1hi9 n PRO 16 Ca 0.07 0.28 -0.13 0.00 -0.04 0.00 0.00 63.50 63.68 1hi9 n PRO 16 Cb 0.48 -1.76 -0.05 0.00 -0.04 0.00 0.00 33.50 32.13 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 -3.26 -0.63 0.00 3.54 3.85 -1.26 -3.49 116.55 115.30 1hi9 n ASP 17 Ca -0.24 -2.55 0.09 0.00 -0.71 0.00 0.00 54.79 51.39 1hi9 n ASP 17 Cb 1.05 1.36 0.42 0.00 -1.35 0.00 0.00 41.12 42.60 1hi9 n ASP 17 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 1hi9 n ASP 18 N -1.98 0.00 0.23 -1.12 5.75 -1.26 -2.49 116.55 115.68 1hi9 n ASP 18 Ca 0.04 0.26 0.16 0.00 -0.01 0.00 0.00 54.79 55.24 1hi9 n ASP 18 Cb 0.44 -0.39 0.71 0.00 -1.03 0.00 0.00 41.12 40.84 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 -0.19 112.91 114.24 1hi9 h THR 19 Ca 0.00 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.58 1hi9 h THR 19 Cb 0.24 1.13 0.00 0.00 -1.73 0.00 0.00 68.15 67.78 1hi9 h THR 19 CO 0.00 0.00 -1.25 0.49 -0.25 0.00 0.00 175.52 174.51 1hi9 n PHE 20 N -2.72 0.21 0.16 4.73 3.01 -1.04 -1.35 117.46 120.46 1hi9 n PHE 20 Ca 0.00 0.06 0.03 0.00 1.01 0.00 0.00 57.45 58.55 1hi9 n PHE 20 Cb 0.21 -0.41 -0.03 0.00 -0.01 0.00 0.00 39.48 39.23 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 -2.00 0.00 -3.08 -4.37 0.24 -0.80 -4.27 118.33 104.04 1hi9 n VAL 21 Ca 0.01 -0.29 -0.42 0.00 -2.04 0.00 0.00 64.34 61.59 1hi9 n VAL 21 Cb 0.46 0.79 -0.06 0.00 -1.47 0.00 0.00 33.84 33.55 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 -1.88 6.39 0.62 -1.34 -1.08 -0.15 -4.92 116.67 114.30 1hi9 s ASP 22 Ca 0.01 -0.07 0.26 0.00 -0.52 0.00 0.00 52.55 52.23 1hi9 s ASP 22 Cb 0.04 -2.34 1.29 0.00 -1.46 0.00 0.00 42.92 40.46 1hi9 s ASP 22 CO 0.22 -0.72 1.72 0.77 0.52 0.00 0.00 175.17 177.69 1hi9 h SER 23 N 8.69 0.00 -0.40 -0.34 4.64 -1.92 0.44 113.55 124.67 1hi9 h SER 23 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 1hi9 h SER 23 Cb 1.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1hi9 h SER 23 CO 0.88 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.45 1hi9 n GLY 24 N -1.47 0.87 3.58 -0.77 0.00 -1.26 -4.92 105.19 101.22 1hi9 n GLY 24 Ca 0.08 -0.44 -0.25 0.00 0.00 0.00 0.00 46.02 45.41 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 -1.47 2.09 0.34 1.61 1.02 0.15 -5.05 119.74 118.44 1hi9 s LYS 25 Ca 0.27 -1.36 0.15 0.00 0.02 0.00 0.00 55.97 55.04 1hi9 s LYS 25 Cb 0.14 -2.12 1.12 0.00 -0.52 0.00 0.00 37.83 36.45 1hi9 s LYS 25 CO 0.19 0.40 1.63 -0.09 -0.92 0.00 0.00 175.35 176.56 1hi9 h ARG 26 N 2.54 0.18 -0.69 1.68 2.43 -1.86 -1.89 114.38 116.77 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 1.22 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 1hi9 h ARG 26 CO 0.57 0.12 0.00 0.09 -1.51 0.00 0.00 179.97 179.23 1hi9 n ASN 27 N -5.17 4.37 -0.06 -3.80 3.02 -0.45 -4.57 115.26 108.59 1hi9 n ASN 27 Ca 0.32 -2.23 -0.10 0.00 -0.03 0.00 0.00 54.58 52.55 1hi9 n ASN 27 Cb 1.04 -0.53 -0.03 0.00 -0.61 0.00 0.00 39.78 39.65 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 4.17 0.31 -0.87 3.10 3.20 -0.40 -1.43 116.97 125.05 1hi9 h TYR 28 Ca 0.00 0.00 0.06 0.00 3.14 0.00 0.00 58.73 61.94 1hi9 h TYR 28 Cb 1.22 -0.10 -0.06 0.00 1.54 0.00 0.00 36.73 39.33 1hi9 h TYR 28 CO 0.63 0.22 0.57 0.93 -1.64 0.00 0.00 178.16 178.86 1hi9 h GLU 29 N 0.31 0.95 -0.36 1.82 5.08 -1.81 -0.25 114.58 120.33 1hi9 h GLU 29 Ca 0.09 -0.06 -0.13 0.00 -1.00 0.00 0.00 59.36 58.26 1hi9 h GLU 29 Cb -0.01 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.02 1hi9 h GLU 29 CO -0.02 0.63 -0.29 0.00 -1.00 0.00 0.00 179.01 178.33 1hi9 h ARG 30 N 0.98 0.83 -0.34 2.33 3.08 -1.84 -2.96 114.38 116.46 1hi9 h ARG 30 Ca 0.37 -0.41 0.05 0.00 0.07 0.00 0.00 59.98 60.06 1hi9 h ARG 30 Cb 0.20 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.21 1hi9 h ARG 30 CO -0.13 1.05 0.08 0.78 -1.07 0.00 0.00 179.97 180.68 1hi9 h GLY 31 N 0.62 0.41 2.00 0.04 0.00 0.01 -1.04 103.07 105.10 1hi9 h GLY 31 Ca 0.06 -0.03 -0.02 0.00 0.00 0.00 0.00 47.33 47.34 1hi9 h GLY 31 CO 0.08 -0.01 -0.08 0.07 0.00 0.00 0.00 176.54 176.60 1hi9 h ARG 32 N 0.21 0.00 0.08 4.80 0.11 -1.15 0.66 114.38 119.09 1hi9 h ARG 32 Ca 0.16 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.24 1hi9 h ARG 32 Cb 0.17 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.25 1hi9 h ARG 32 CO -0.20 0.08 -0.04 1.25 0.10 0.00 0.00 179.97 181.16 1hi9 h LEU 33 N 0.00 -0.09 -0.99 0.08 6.46 -1.19 -1.10 115.31 118.49 1hi9 h LEU 33 Ca -0.00 -0.48 0.02 0.00 -0.12 0.00 0.00 57.88 57.29 1hi9 h LEU 33 Cb 0.58 0.02 -0.05 0.00 -0.73 0.00 0.00 40.66 40.48 1hi9 h LEU 33 CO 0.01 0.48 0.65 0.40 -0.62 0.00 0.00 178.44 179.36 1hi9 h ILE 34 N -0.70 1.23 -0.20 4.05 2.04 -0.93 -1.44 117.51 121.57 1hi9 h ILE 34 Ca -0.01 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.40 1hi9 h ILE 34 Cb 0.56 -0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.44 1hi9 h ILE 34 CO 0.02 0.24 0.12 -0.03 0.00 0.00 0.00 178.15 178.50 1hi9 h MET 35 N 1.31 0.26 -0.68 2.37 4.05 -0.83 0.85 114.93 122.26 1hi9 h MET 35 Ca 0.37 -0.02 -0.03 0.00 -0.28 0.00 0.00 59.70 59.74 1hi9 h MET 35 Cb -0.11 -0.06 -0.03 0.00 -0.80 0.00 0.00 31.60 30.60 1hi9 h MET 35 CO -0.09 0.20 0.32 1.15 0.23 0.00 0.00 176.91 178.72 1hi9 h THR 36 N 0.25 1.23 -0.31 -0.77 2.02 -0.79 -1.87 112.91 112.66 1hi9 h THR 36 Ca 0.07 -0.67 -0.11 0.00 0.77 0.00 0.00 66.41 66.47 1hi9 h THR 36 Cb 0.00 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 66.81 1hi9 h THR 36 CO -0.01 0.27 -0.27 -0.33 0.37 0.00 0.00 175.52 175.55 1hi9 h GLU 37 N 0.95 0.64 -0.83 6.66 5.08 -1.02 -1.99 114.58 124.07 1hi9 h GLU 37 Ca 0.23 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1hi9 h GLU 37 Cb 0.14 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.32 1hi9 h GLU 37 CO -0.03 0.84 0.47 1.49 -1.00 0.00 0.00 179.01 180.79 1hi9 h GLU 38 N 0.55 1.14 -0.23 2.33 4.81 -0.44 -1.84 114.58 120.90 1hi9 h GLU 38 Ca 0.07 -0.12 -0.11 0.00 -0.13 0.00 0.00 59.36 59.08 1hi9 h GLU 38 Cb 0.75 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 1hi9 h GLU 38 CO 0.06 0.82 -0.31 0.00 -0.73 0.00 0.00 179.01 178.86 1hi9 h ALA 39 N 1.25 1.05 -0.61 2.92 0.00 -1.11 -2.96 119.26 119.81 1hi9 h ALA 39 Ca 0.29 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1hi9 h ALA 39 Cb 0.00 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1hi9 h ALA 39 CO -0.05 0.58 0.29 -0.91 0.00 0.00 0.00 179.25 179.16 1hi9 h ASN 40 N 0.40 0.77 -0.37 0.00 2.35 -0.59 -0.65 115.58 117.50 1hi9 h ASN 40 Ca 0.05 -0.08 0.03 0.00 -0.55 0.00 0.00 56.30 55.75 1hi9 h ASN 40 Cb 0.74 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.88 1hi9 h ASN 40 CO 0.06 0.66 0.18 1.88 -1.65 0.00 0.00 177.43 178.55 1hi9 h TYR 41 N 0.85 0.33 -0.42 1.19 -1.99 -1.26 0.98 116.97 116.65 1hi9 h TYR 41 Ca 0.21 0.02 -0.12 0.00 2.00 0.00 0.00 58.73 60.84 1hi9 h TYR 41 Cb 0.09 -0.10 -0.01 0.00 2.00 0.00 0.00 36.73 38.72 1hi9 h TYR 41 CO 0.01 0.17 -0.21 0.00 -0.00 0.00 0.00 178.16 178.13 1hi9 h ILE 43 N 0.70 1.11 -0.47 0.00 2.04 -0.88 0.17 117.51 120.19 1hi9 h ILE 43 Ca 0.09 -0.31 0.04 0.00 1.00 0.00 0.00 64.86 65.69 1hi9 h ILE 43 Cb 0.78 1.05 -0.04 0.00 -0.74 0.00 0.00 36.82 37.86 1hi9 h ILE 43 CO 0.06 0.10 0.22 0.00 0.00 0.00 0.00 178.15 178.53 1hi9 h ALA 44 N 0.96 0.58 0.00 1.87 0.00 -0.79 -1.09 119.26 120.79 1hi9 h ALA 44 Ca 0.05 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1hi9 h ALA 44 Cb 0.09 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1hi9 h ALA 44 CO -0.01 -0.14 -0.32 1.49 0.00 0.00 0.00 179.25 180.27 1hi9 h GLU 45 N 0.44 0.00 0.18 0.00 4.57 -1.21 -1.40 114.58 117.15 1hi9 h GLU 45 Ca 0.21 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.38 1hi9 h GLU 45 Cb 0.14 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.73 1hi9 h GLU 45 CO -0.16 0.32 -0.09 0.00 -1.18 0.00 0.00 179.01 177.91 1hi9 h ALA 46 N 1.68 -0.24 -0.42 2.92 0.00 0.54 -0.94 119.26 122.80 1hi9 h ALA 46 Ca -0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1hi9 h ALA 46 Cb 0.87 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 1hi9 h ALA 46 CO 0.04 -0.52 0.22 0.74 0.00 0.00 0.00 179.25 179.74 1hi9 h PHE 47 N -0.47 0.59 -0.00 0.00 0.05 -1.23 -1.68 116.94 114.20 1hi9 h PHE 47 Ca -0.02 -0.02 0.00 0.00 3.82 0.00 0.00 57.97 61.75 1hi9 h PHE 47 Cb 0.36 -0.19 -0.00 0.00 2.00 0.00 0.00 35.95 38.12 1hi9 h PHE 47 CO 0.00 0.46 0.02 -0.97 -0.18 0.00 0.00 178.31 177.64 1hi9 h ASN 48 N 0.55 0.00 -0.64 2.17 -1.24 -1.15 -1.01 115.58 114.26 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 0.07 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.12 1hi9 h ASN 48 CO -0.02 0.00 0.00 -1.20 -1.29 0.00 0.00 177.43 174.92 1hi9 n SER 49 N -3.22 4.06 0.00 1.15 7.64 -0.37 -4.94 113.62 117.95 1hi9 n SER 49 Ca -0.03 -2.22 0.00 0.00 1.01 0.00 0.00 58.87 57.63 1hi9 n SER 49 Cb 0.09 -0.51 0.00 0.00 -1.01 0.00 0.00 64.21 62.78 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 1.32 2.23 3.64 0.23 0.00 -0.38 -5.01 105.19 107.22 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 1.91 0.18 -3.82 0.00 -2.24 -0.60 -4.38 114.28 105.33 1hi9 n THR 52 Ca 0.13 -0.49 -0.12 0.00 -2.27 0.00 0.00 64.05 61.30 1hi9 n THR 52 Cb 0.29 -0.06 -0.13 0.00 -2.10 0.00 0.00 70.33 68.33 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 -3.45 0.15 -0.19 -0.78 2.02 -1.18 -4.96 118.70 110.32 1hi9 s GLU 53 Ca -0.05 0.20 -0.03 0.00 0.02 0.00 0.00 54.97 55.11 1hi9 s GLU 53 Cb 0.13 0.06 0.06 0.00 0.10 0.00 0.00 34.13 34.47 1hi9 s GLU 53 CO 0.87 -0.03 0.05 0.08 0.02 0.00 0.00 175.26 176.25 1hi9 s VAL 54 N 0.16 0.39 -0.23 2.63 1.01 -1.26 -0.84 120.40 122.25 1hi9 s VAL 54 Ca -0.01 -0.47 -0.16 0.00 0.00 0.00 0.00 61.98 61.35 1hi9 s VAL 54 Cb -0.02 -0.93 -0.04 0.00 0.00 0.00 0.00 36.38 35.40 1hi9 s VAL 54 CO -0.00 -0.22 0.41 -0.22 0.00 0.00 0.00 175.10 175.06 1hi9 s LEU 55 N 1.92 4.11 -0.24 3.92 0.20 -0.56 -2.02 118.68 126.01 1hi9 s LEU 55 Ca -0.00 0.46 -0.04 0.00 0.69 0.00 0.00 54.13 55.24 1hi9 s LEU 55 Cb -0.17 -2.51 0.00 0.00 -0.43 0.00 0.00 46.19 43.08 1hi9 s LEU 55 CO -0.08 -0.13 -0.02 -0.69 -0.29 0.00 0.00 176.35 175.14 1hi9 s VAL 56 N 1.63 3.38 -0.28 1.68 1.01 0.85 -0.05 120.40 128.62 1hi9 s VAL 56 Ca 0.18 -0.65 -0.06 0.00 0.00 0.00 0.00 61.98 61.45 1hi9 s VAL 56 Cb -0.15 -2.62 0.01 0.00 0.00 0.00 0.00 36.38 33.61 1hi9 s VAL 56 CO 0.09 0.30 0.06 0.21 0.00 0.00 0.00 175.10 175.76 1hi9 s ASN 57 N 1.45 5.00 -0.14 3.32 3.04 0.42 -0.07 114.94 127.95 1hi9 s ASN 57 Ca 0.04 -0.68 -0.29 0.00 0.04 0.00 0.00 52.86 51.97 1hi9 s ASN 57 Cb -0.15 -1.85 -0.04 0.00 -1.54 0.00 0.00 41.25 37.66 1hi9 s ASN 57 CO -0.02 -0.17 1.68 -0.62 -3.04 0.00 0.00 177.10 174.93 1hi9 s ASP 58 N 1.49 6.44 -0.23 -4.21 -1.08 -0.93 -1.75 116.67 116.41 1hi9 s ASP 58 Ca 0.03 1.93 0.13 0.00 -0.52 0.00 0.00 52.55 54.12 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 0.02 -1.16 1.41 -1.20 0.52 0.00 0.00 175.17 174.76 1hi9 n SER 59 N 8.08 3.01 -4.24 -0.34 7.64 0.66 -4.71 113.62 123.71 1hi9 n SER 59 Ca 0.19 -3.40 -0.32 0.00 1.01 0.00 0.00 58.87 56.34 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 -3.04 2.65 0.00 1.43 5.65 -1.25 -4.70 115.29 116.03 1hi9 s HIS 60 Ca 0.42 -1.03 0.00 0.00 0.25 0.00 0.00 55.06 54.70 1hi9 s HIS 60 Cb 0.37 -1.77 0.00 0.00 -1.18 0.00 0.00 32.58 30.00 1hi9 s HIS 60 CO 0.04 -0.42 0.00 0.45 -0.65 0.00 0.00 174.74 174.15 1hi9 n SER 61 N 3.67 0.00 -0.05 9.88 2.88 -1.26 0.15 113.62 128.89 1hi9 n SER 61 Ca -0.19 0.00 0.15 0.00 -1.33 0.00 0.00 58.87 57.50 1hi9 n SER 61 Cb 0.53 0.00 0.88 0.00 -0.75 0.00 0.00 64.21 64.87 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 4.75 1.07 -3.73 -1.46 4.76 -1.26 -4.90 118.16 117.38 1hi9 n LYS 62 Ca 0.00 -0.10 -0.29 0.00 -2.87 0.00 0.00 58.31 55.05 1hi9 n LYS 62 Cb 0.00 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.71 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 -0.87 -4.16 -1.98 1.97 2.81 0.40 -3.57 117.12 111.71 1hi9 n MET 63 Ca 0.23 0.52 -0.07 0.00 -1.81 0.00 0.00 57.70 56.57 1hi9 n MET 63 Cb 0.13 -5.30 0.06 0.00 -0.71 0.00 0.00 33.22 27.40 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 -2.57 2.70 -0.10 7.83 0.23 -1.26 -0.66 115.26 121.43 1hi9 n ASN 64 Ca 0.02 -2.94 -0.21 0.00 -0.53 0.00 0.00 54.58 50.93 1hi9 n ASN 64 Cb 0.53 -0.41 -0.10 0.00 -2.08 0.00 0.00 39.78 37.71 1hi9 n ASN 64 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1hi9 n ASN 65 N -0.56 1.86 -4.69 0.53 3.02 -1.26 -4.89 115.26 109.27 1hi9 n ASN 65 Ca 0.22 0.44 -0.44 0.00 -0.03 0.00 0.00 54.58 54.77 1hi9 n ASN 65 Cb 0.90 -0.94 -0.03 0.00 -0.61 0.00 0.00 39.78 39.09 1hi9 n ASN 65 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1hi9 n LEU 66 N -4.44 3.44 -4.52 3.41 4.77 -1.26 -4.84 117.00 113.57 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 0.65 -1.47 -0.06 0.00 -2.33 0.00 0.00 43.42 40.22 1hi9 n LEU 66 CO 0.17 -0.28 0.53 -0.04 -1.33 0.00 0.00 177.39 176.44 1hi9 s MET 67 N -0.19 3.33 0.52 3.23 -1.94 -1.26 -4.93 119.30 118.05 1hi9 s MET 67 Ca 0.69 -0.29 0.22 0.00 -1.71 0.00 0.00 55.69 54.61 1hi9 s MET 67 Cb -0.61 -3.98 1.33 0.00 2.01 0.00 0.00 34.83 33.58 1hi9 s MET 67 CO 0.47 -1.17 2.02 -0.24 -0.01 0.00 0.00 175.02 176.09 1hi9 h VAL 68 N 5.95 0.80 -0.00 -6.03 3.04 -1.96 -0.50 116.25 117.56 1hi9 h VAL 68 Ca -0.25 -0.02 0.00 0.00 -1.01 0.00 0.00 66.70 65.42 1hi9 h VAL 68 Cb 1.09 0.75 0.00 0.00 -2.01 0.00 0.00 31.29 31.11 1hi9 h VAL 68 CO 0.97 0.01 -0.02 -1.84 -1.01 0.00 0.00 177.57 175.68 1hi9 n GLU 69 N -4.42 0.38 0.00 4.17 0.00 -1.26 -3.73 120.64 115.78 1hi9 n GLU 69 Ca 0.08 -0.02 0.00 0.00 0.00 0.00 0.00 57.16 57.22 1hi9 n GLU 69 Cb 0.49 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.43 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 -1.29 2.89 -1.77 3.44 5.02 -0.31 -5.05 118.16 121.08 1hi9 n LYS 70 Ca 0.13 -0.17 -0.32 0.00 -2.02 0.00 0.00 58.31 55.93 1hi9 n LYS 70 Cb 0.26 -0.61 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 -0.92 3.32 -0.14 -0.35 2.96 -0.54 -4.89 118.68 118.11 1hi9 s LEU 71 Ca 0.00 1.79 -0.37 0.00 -0.22 0.00 0.00 54.13 55.33 1hi9 s LEU 71 Cb 0.00 -4.52 -0.14 0.00 0.50 0.00 0.00 46.19 42.03 1hi9 s LEU 71 CO 0.00 -1.42 1.79 1.57 -1.32 0.00 0.00 176.35 176.98 1hi9 n HIS 72 N -2.58 2.19 0.04 5.38 -0.00 -1.26 -4.83 115.22 114.16 1hi9 n HIS 72 Ca 0.09 0.24 0.20 0.00 -0.00 0.00 0.00 57.72 58.25 1hi9 n HIS 72 Cb 0.53 -2.57 0.72 0.00 -0.00 0.00 0.00 29.99 28.67 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 8.08 0.00 -0.09 1.57 0.13 -1.94 -1.42 132.00 138.33 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 -4.19 1.51 -3.99 0.86 -0.58 -1.26 -4.86 120.64 108.12 1hi9 n GLU 74 Ca 0.09 -0.75 -0.27 0.00 -0.42 0.00 0.00 57.16 55.80 1hi9 n GLU 74 Cb 0.58 -1.40 -0.04 0.00 -0.57 0.00 0.00 31.44 30.02 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 -1.89 3.84 -0.25 0.62 0.00 -0.54 -4.70 121.76 118.84 1hi9 s ALA 75 Ca 0.34 -1.05 -0.09 0.00 0.00 0.00 0.00 51.96 51.15 1hi9 s ALA 75 Cb 0.17 -1.65 -0.04 0.00 0.00 0.00 0.00 23.12 21.60 1hi9 s ALA 75 CO 0.28 0.59 0.13 -0.51 0.00 0.00 0.00 175.76 176.24 1hi9 s ASP 76 N -3.02 5.69 -0.15 0.00 1.01 -0.86 -4.95 116.67 114.39 1hi9 s ASP 76 Ca 0.33 -0.04 -0.07 0.00 0.71 0.00 0.00 52.55 53.48 1hi9 s ASP 76 Cb -0.11 -2.03 -0.04 0.00 1.01 0.00 0.00 42.92 41.75 1hi9 s ASP 76 CO 0.27 0.01 0.09 -0.22 0.21 0.00 0.00 175.17 175.52 1hi9 s LEU 77 N 1.39 4.04 -0.35 1.23 2.96 -1.26 -0.10 118.68 126.59 1hi9 s LEU 77 Ca 0.06 0.24 -0.09 0.00 -0.22 0.00 0.00 54.13 54.12 1hi9 s LEU 77 Cb -0.15 -2.00 0.02 0.00 0.50 0.00 0.00 46.19 44.56 1hi9 s LEU 77 CO 0.06 0.27 0.16 -0.63 -1.32 0.00 0.00 176.35 174.89 1hi9 s ILE 78 N -0.22 4.34 -0.00 6.68 1.01 0.89 -4.96 121.20 128.93 1hi9 s ILE 78 Ca 0.09 -0.83 0.08 0.00 0.00 0.00 0.00 60.65 60.00 1hi9 s ILE 78 Cb -0.12 -3.37 -0.02 0.00 0.01 0.00 0.00 42.46 38.96 1hi9 s ILE 78 CO 0.01 -0.14 -0.25 -0.55 0.00 0.00 0.00 174.94 174.01 1hi9 s SER 79 N 1.52 2.99 0.00 3.58 0.15 -1.26 -2.18 113.70 118.50 1hi9 s SER 79 Ca 0.02 -0.49 0.00 0.00 0.70 0.00 0.00 55.95 56.18 1hi9 s SER 79 Cb -0.19 -0.32 0.00 0.00 -1.71 0.00 0.00 66.02 63.81 1hi9 s SER 79 CO 0.05 0.29 0.00 0.61 1.20 0.00 0.00 173.24 175.40 1hi9 n GLY 80 N 2.29 2.76 0.17 9.45 0.00 0.17 -5.01 105.19 115.02 1hi9 n GLY 80 Ca -0.16 -2.02 -0.01 0.00 0.00 0.00 0.00 46.02 43.82 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 1.48 -3.10 1.61 5.75 -1.23 -4.69 116.55 116.37 1hi9 n ASP 81 Ca 0.00 -1.09 -0.21 0.00 -0.01 0.00 0.00 54.79 53.48 1hi9 n ASP 81 Cb 0.00 0.01 0.06 0.00 -1.03 0.00 0.00 41.12 40.15 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 -0.35 -2.40 -3.36 2.12 0.31 -1.26 -4.97 118.33 108.42 1hi9 n VAL 82 Ca -0.00 0.00 -0.38 0.00 -0.01 0.00 0.00 64.34 63.94 1hi9 n VAL 82 Cb 0.03 -3.58 -0.06 0.00 -0.91 0.00 0.00 33.84 29.32 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 -5.98 4.16 0.34 5.55 1.02 -1.26 -4.97 119.74 118.60 1hi9 s LYS 83 Ca 0.44 0.53 0.12 0.00 0.02 0.00 0.00 55.97 57.08 1hi9 s LYS 83 Cb -0.19 -3.31 1.07 0.00 -0.52 0.00 0.00 37.83 34.87 1hi9 s LYS 83 CO 0.55 0.47 1.54 -2.30 -0.92 0.00 0.00 175.35 174.69 1hi9 n PRO 84 N 2.50 -0.07 -0.78 -1.68 -0.02 -1.26 -1.26 135.00 132.43 1hi9 n PRO 84 Ca -0.10 1.40 0.01 0.00 -2.02 0.00 0.00 63.50 62.79 1hi9 n PRO 84 Cb 0.52 -2.38 0.19 0.00 -0.02 0.00 0.00 33.50 31.80 1hi9 n PRO 84 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1hi9 n PHE 85 N -5.32 0.45 0.00 6.00 3.01 -1.26 -4.84 117.46 115.50 1hi9 n PHE 85 Ca 0.31 -1.60 0.00 0.00 1.01 0.00 0.00 57.45 57.17 1hi9 n PHE 85 Cb 1.04 -0.30 0.00 0.00 -0.01 0.00 0.00 39.48 40.21 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 -1.08 0.00 0.32 4.37 2.88 -0.39 -0.28 113.62 119.44 1hi9 n SER 86 Ca 0.24 0.00 0.21 0.00 -1.33 0.00 0.00 58.87 57.99 1hi9 n SER 86 Cb 0.76 0.00 1.06 0.00 -0.75 0.00 0.00 64.21 65.28 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 -0.07 -1.46 2.86 -1.90 -2.69 114.93 111.67 1hi9 h MET 87 Ca 0.00 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1hi9 h MET 87 Cb 0.00 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.66 1hi9 h MET 87 CO 0.00 0.00 -0.03 1.33 1.06 0.00 0.00 176.91 179.27 1hi9 n VAL 88 N -3.05 2.01 -1.72 -2.22 0.24 0.62 -4.81 118.33 109.41 1hi9 n VAL 88 Ca -0.02 -2.25 -0.43 0.00 -2.04 0.00 0.00 64.34 59.60 1hi9 n VAL 88 Cb 0.13 -0.25 -0.02 0.00 -1.47 0.00 0.00 33.84 32.23 1hi9 n VAL 88 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 1hi9 n GLU 89 N -1.21 2.53 -0.27 7.34 4.07 -0.98 -2.05 120.64 130.07 1hi9 n GLU 89 Ca 0.18 0.90 0.00 0.00 -0.06 0.00 0.00 57.16 58.18 1hi9 n GLU 89 Cb 0.71 -2.67 0.00 0.00 -0.06 0.00 0.00 31.44 29.42 1hi9 n GLU 89 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1hi9 n GLY 90 N 2.67 1.04 3.63 8.31 0.00 -1.26 -4.89 105.19 114.70 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 4.08 0.00 0.99 0.20 -0.87 -5.04 118.68 118.04 1hi9 s LEU 91 Ca 0.00 0.78 0.02 0.00 0.69 0.00 0.00 54.13 55.62 1hi9 s LEU 91 Cb 0.00 -2.92 -0.01 0.00 -0.43 0.00 0.00 46.19 42.83 1hi9 s LEU 91 CO 0.00 -0.38 0.07 -0.90 -0.29 0.00 0.00 176.35 174.84 1hi9 n ASP 92 N 5.68 0.72 0.00 3.68 5.68 -1.26 -5.03 116.55 126.03 1hi9 n ASP 92 Ca 0.00 -1.80 0.07 0.00 -0.50 0.00 0.00 54.79 52.57 1hi9 n ASP 92 Cb 0.49 0.44 0.42 0.00 -1.14 0.00 0.00 41.12 41.33 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 -2.03 0.00 -0.76 -1.12 3.85 -1.26 -3.15 116.55 112.09 1hi9 n ASP 93 Ca -0.01 -1.15 0.11 0.00 -0.71 0.00 0.00 54.79 53.03 1hi9 n ASP 93 Cb 0.22 0.00 0.31 0.00 -1.35 0.00 0.00 41.12 40.31 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 -0.78 0.28 -3.83 2.12 -2.24 -1.26 -4.90 114.28 103.67 1hi9 n THR 94 Ca 0.11 -0.47 -0.37 0.00 -2.27 0.00 0.00 64.05 61.04 1hi9 n THR 94 Cb 0.05 0.62 -0.06 0.00 -2.10 0.00 0.00 70.33 68.84 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 -1.72 3.60 0.27 4.78 0.40 -1.19 -4.60 117.98 119.52 1hi9 s PHE 95 Ca 0.34 0.56 0.09 0.00 -0.60 0.00 0.00 56.93 57.33 1hi9 s PHE 95 Cb 0.19 -1.99 0.35 0.00 0.51 0.00 0.00 43.02 42.08 1hi9 s PHE 95 CO 0.28 0.70 1.61 -0.09 0.70 0.00 0.00 175.22 178.42 1hi9 h ARG 96 N 5.07 0.04 -1.73 0.44 9.65 -1.23 -3.45 114.38 123.16 1hi9 h ARG 96 Ca -0.54 -0.03 0.29 0.00 -1.10 0.00 0.00 59.98 58.60 1hi9 h ARG 96 Cb 1.22 0.00 -0.10 0.00 -1.39 0.00 0.00 29.97 29.70 1hi9 h ARG 96 CO 0.60 0.64 0.76 0.20 2.80 0.00 0.00 179.97 184.96 1hi9 s GLY 97 N -4.44 -0.33 0.11 2.80 0.00 -1.24 -4.49 107.32 99.73 1hi9 s GLY 97 Ca -0.02 0.47 0.09 0.00 0.00 0.00 0.00 44.72 45.27 1hi9 s GLY 97 CO 0.77 0.68 -0.23 0.00 0.00 0.00 0.00 173.10 174.31 1hi9 s ALA 98 N -2.55 2.04 -0.11 3.20 0.00 0.10 -1.33 121.76 123.11 1hi9 s ALA 98 Ca 0.15 -1.32 -0.01 0.00 0.00 0.00 0.00 51.96 50.79 1hi9 s ALA 98 Cb 0.03 -0.31 0.03 0.00 0.00 0.00 0.00 23.12 22.86 1hi9 s ALA 98 CO -0.02 0.44 -0.05 -1.17 0.00 0.00 0.00 175.76 174.96 1hi9 s LEU 99 N -1.89 1.09 -0.26 0.00 0.20 0.88 -1.04 118.68 117.66 1hi9 s LEU 99 Ca 0.10 -0.30 -0.13 0.00 0.69 0.00 0.00 54.13 54.49 1hi9 s LEU 99 Cb -0.10 -0.75 -0.04 0.00 -0.43 0.00 0.00 46.19 44.87 1hi9 s LEU 99 CO 0.05 -0.15 0.27 -0.36 -0.29 0.00 0.00 176.35 175.87 1hi9 s PHE 100 N 1.77 3.27 0.02 5.38 2.99 -0.40 -1.47 117.98 129.55 1hi9 s PHE 100 Ca 0.04 0.31 0.07 0.00 0.00 0.00 0.00 56.93 57.35 1hi9 s PHE 100 Cb -0.13 -2.44 -0.03 0.00 0.00 0.00 0.00 43.02 40.43 1hi9 s PHE 100 CO -0.07 -0.11 -0.20 -1.17 -0.00 0.00 0.00 175.22 173.67 1hi9 s LEU 101 N 1.63 2.48 -1.41 -0.37 0.20 0.30 -0.12 118.68 121.39 1hi9 s LEU 101 Ca 0.11 -0.43 -0.01 0.00 0.69 0.00 0.00 54.13 54.50 1hi9 s LEU 101 Cb -0.15 -1.46 0.00 0.00 -0.43 0.00 0.00 46.19 44.15 1hi9 s LEU 101 CO 0.09 0.28 0.08 0.61 -0.29 0.00 0.00 176.35 177.12 1hi9 n GLY 102 N 1.81 -0.32 3.89 7.98 0.00 -0.72 -0.24 105.19 117.58 1hi9 n GLY 102 Ca -0.16 -0.16 -0.30 0.00 0.00 0.00 0.00 46.02 45.40 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 -2.87 3.36 0.25 1.61 1.51 -0.12 -0.62 117.35 120.47 1hi9 s TYR 103 Ca 0.04 1.03 0.01 0.00 -1.01 0.00 0.00 57.07 57.14 1hi9 s TYR 103 Cb -0.02 -2.97 -0.05 0.00 -0.11 0.00 0.00 41.96 38.81 1hi9 s TYR 103 CO 0.05 -1.06 0.09 -3.38 -1.11 0.00 0.00 175.55 170.14 1hi9 s HIS 104 N -3.28 1.50 0.69 2.71 -3.43 -1.26 -3.63 115.29 108.59 1hi9 s HIS 104 Ca 0.57 -1.17 -0.15 0.00 -0.80 0.00 0.00 55.06 53.52 1hi9 s HIS 104 Cb -0.11 -0.88 0.01 0.00 -1.43 0.00 0.00 32.58 30.18 1hi9 s HIS 104 CO 0.51 -0.33 1.13 0.00 -2.00 0.00 0.00 174.74 174.05 1hi9 s ALA 105 N -3.75 2.36 0.77 -1.38 0.00 -1.26 -4.76 121.76 113.74 1hi9 s ALA 105 Ca 0.37 0.60 -0.11 0.00 0.00 0.00 0.00 51.96 52.81 1hi9 s ALA 105 Cb 0.08 -3.35 0.06 0.00 0.00 0.00 0.00 23.12 19.90 1hi9 s ALA 105 CO 0.13 -1.47 1.09 -0.98 0.00 0.00 0.00 175.76 174.53 1hi9 s ARG 106 N -4.11 2.28 0.62 0.00 1.70 -1.26 -2.65 118.95 115.53 1hi9 s ARG 106 Ca 0.68 0.78 -0.18 0.00 -0.47 0.00 0.00 55.73 56.53 1hi9 s ARG 106 Cb -0.22 -1.93 -0.04 0.00 -0.57 0.00 0.00 34.95 32.19 1hi9 s ARG 106 CO 0.43 -1.52 1.06 0.00 -1.08 0.00 0.00 175.30 174.20 1hi9 n ALA 107 N -3.38 0.47 -1.06 7.88 0.00 -1.22 -3.11 120.51 120.08 1hi9 n ALA 107 Ca 0.07 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.49 1hi9 n ALA 107 Cb 0.55 -2.17 -0.01 0.00 0.00 0.00 0.00 19.45 17.82 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 -1.10 -4.33 -4.33 0.00 7.64 -1.26 -4.78 113.62 105.45 1hi9 n SER 108 Ca 0.14 0.05 -0.17 0.00 1.01 0.00 0.00 58.87 59.90 1hi9 n SER 108 Cb 0.48 -2.03 -0.10 0.00 -1.01 0.00 0.00 64.21 61.55 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 -1.73 1.31 0.70 0.44 -4.23 -1.18 -5.13 115.64 105.82 1hi9 s THR 109 Ca 0.00 -2.09 -0.16 0.00 -1.18 0.00 0.00 61.69 58.26 1hi9 s THR 109 Cb 0.00 -2.20 0.02 0.00 1.34 0.00 0.00 72.50 71.66 1hi9 s THR 109 CO 0.00 -0.46 1.21 -2.65 -0.54 0.00 0.00 174.62 172.18 1hi9 n PRO 110 N -0.39 0.76 0.00 3.99 -0.02 -1.26 -4.80 135.00 133.27 1hi9 n PRO 110 Ca -0.07 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 1hi9 n PRO 110 Cb 0.62 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.66 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 4.65 3.73 -1.23 0.00 -1.26 -4.78 105.19 107.15 1hi9 n GLY 111 Ca 0.15 -1.02 -0.42 0.00 0.00 0.00 0.00 46.02 44.73 1hi9 n GLY 111 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hi9 s VAL 112 N -0.86 2.09 -1.49 1.61 0.11 -1.25 -2.51 120.40 118.10 1hi9 s VAL 112 Ca 0.00 0.07 -0.13 0.00 -2.93 0.00 0.00 61.98 58.99 1hi9 s VAL 112 Cb 0.00 -3.04 0.09 0.00 -1.53 0.00 0.00 36.38 31.90 1hi9 s VAL 112 CO 0.00 0.01 0.78 0.23 -3.33 0.00 0.00 175.10 172.78 1hi9 n MET 113 N 3.45 -4.44 -1.86 1.54 2.81 0.13 -4.59 117.12 114.17 1hi9 n MET 113 Ca 0.13 0.54 -0.41 0.00 -1.81 0.00 0.00 57.70 56.16 1hi9 n MET 113 Cb 0.36 -5.36 -0.00 0.00 -0.71 0.00 0.00 33.22 27.51 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 -3.07 6.36 0.00 7.83 1.04 -1.05 -4.84 113.70 119.97 1hi9 s SER 114 Ca 0.58 2.97 0.00 0.00 0.48 0.00 0.00 55.95 59.98 1hi9 s SER 114 Cb -0.30 -2.66 0.00 0.00 0.10 0.00 0.00 66.02 63.16 1hi9 s SER 114 CO 0.71 -0.85 0.00 0.00 0.98 0.00 0.00 173.24 174.07 1hi9 n HIS 115 N 0.43 0.00 -3.64 5.02 1.44 -1.08 -4.75 115.22 112.64 1hi9 n HIS 115 Ca 0.01 0.00 -0.29 0.00 -2.01 0.00 0.00 57.72 55.43 1hi9 n HIS 115 Cb 0.40 0.00 -0.15 0.00 0.12 0.00 0.00 29.99 30.36 1hi9 n HIS 115 CO 0.00 0.00 0.00 -1.12 -2.81 0.00 0.00 176.34 172.41 1hi9 s SER 116 N 0.00 3.79 0.00 4.39 0.01 -1.26 -3.37 113.70 117.26 1hi9 s SER 116 Ca 0.00 -1.49 0.00 0.00 1.31 0.00 0.00 55.95 55.77 1hi9 s SER 116 Cb 0.00 -0.62 0.00 0.00 0.21 0.00 0.00 66.02 65.61 1hi9 s SER 116 CO 0.00 -0.42 0.00 0.23 0.41 0.00 0.00 173.24 173.46 1hi9 n MET 117 N 5.01 0.00 -4.23 12.44 2.81 -1.26 -4.57 117.12 127.32 1hi9 n MET 117 Ca -0.04 0.00 -0.14 0.00 -1.81 0.00 0.00 57.70 55.71 1hi9 n MET 117 Cb 0.42 0.00 -0.10 0.00 -0.71 0.00 0.00 33.22 32.83 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 1.08 0.52 2.02 -4.36 -1.26 -5.03 121.20 114.17 1hi9 s ILE 118 Ca 0.00 -1.95 0.19 0.00 -0.26 0.00 0.00 60.65 58.63 1hi9 s ILE 118 Cb 0.00 -1.72 0.27 0.00 1.25 0.00 0.00 42.46 42.26 1hi9 s ILE 118 CO 0.00 -0.71 2.14 -0.26 0.24 0.00 0.00 174.94 176.35 1hi9 h PHE 119 N 2.98 0.00 0.00 1.37 0.05 -1.99 -2.91 116.94 116.44 1hi9 h PHE 119 Ca -0.37 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.42 1hi9 h PHE 119 Cb 1.19 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.14 1hi9 h PHE 119 CO 0.64 0.04 0.00 0.78 -0.18 0.00 0.00 178.31 179.59 1hi9 h GLY 120 N 0.16 0.00 -4.58 -1.45 0.00 -1.94 -3.45 103.07 91.82 1hi9 h GLY 120 Ca -0.00 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.75 1hi9 h GLY 120 CO 0.01 0.00 -0.11 -1.34 0.00 0.00 0.00 176.54 175.10 1hi9 s VAL 121 N -3.51 4.88 -0.22 4.60 -7.23 -1.10 -0.26 120.40 117.55 1hi9 s VAL 121 Ca 0.02 0.95 0.03 0.00 -1.81 0.00 0.00 61.98 61.17 1hi9 s VAL 121 Cb 0.09 -3.78 -0.16 0.00 0.56 0.00 0.00 36.38 33.09 1hi9 s VAL 121 CO 0.45 0.45 -0.18 0.54 -0.31 0.00 0.00 175.10 176.05 1hi9 n ARG 122 N 1.42 0.61 -3.72 4.82 1.74 0.11 -4.60 116.66 117.04 1hi9 n ARG 122 Ca -0.10 0.12 -0.14 0.00 -0.77 0.00 0.00 57.85 56.96 1hi9 n ARG 122 Cb 0.52 -1.46 -0.09 0.00 -1.02 0.00 0.00 32.46 30.41 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 -2.45 -0.34 -0.01 -1.55 3.76 -1.09 -4.16 115.29 109.44 1hi9 s HIS 123 Ca -0.29 0.69 0.03 0.00 -0.15 0.00 0.00 55.06 55.34 1hi9 s HIS 123 Cb 0.08 0.16 -0.03 0.00 1.11 0.00 0.00 32.58 33.90 1hi9 s HIS 123 CO 0.54 -0.36 -0.09 -0.06 -0.85 0.00 0.00 174.74 173.92 1hi9 s PHE 124 N -0.76 2.84 -0.03 1.40 2.99 -1.15 -1.16 117.98 122.10 1hi9 s PHE 124 Ca -0.08 -0.07 0.01 0.00 0.00 0.00 0.00 56.93 56.79 1hi9 s PHE 124 Cb -0.04 -1.62 0.02 0.00 0.00 0.00 0.00 43.02 41.39 1hi9 s PHE 124 CO 0.04 0.33 -0.03 0.71 -0.00 0.00 0.00 175.22 176.26 1hi9 s TYR 125 N -0.91 0.55 -0.38 0.36 1.51 0.14 -1.53 117.35 117.09 1hi9 s TYR 125 Ca 0.15 -0.12 0.04 0.00 -1.01 0.00 0.00 57.07 56.13 1hi9 s TYR 125 Cb -0.11 -0.52 0.11 0.00 -0.11 0.00 0.00 41.96 41.33 1hi9 s TYR 125 CO 0.05 -0.14 0.10 0.42 -1.11 0.00 0.00 175.55 174.87 1hi9 s ILE 126 N 0.77 2.39 -1.15 2.71 -1.09 -1.02 -0.81 121.20 122.99 1hi9 s ILE 126 Ca -0.09 -2.55 -0.02 0.00 -2.23 0.00 0.00 60.65 55.76 1hi9 s ILE 126 Cb -0.12 -2.74 -0.02 0.00 -1.58 0.00 0.00 42.46 38.00 1hi9 s ILE 126 CO -0.00 -0.65 0.97 0.59 -1.23 0.00 0.00 174.94 174.62 1hi9 n ASN 127 N 4.01 -3.36 0.00 3.58 4.13 -0.67 -2.51 115.26 120.43 1hi9 n ASN 127 Ca 0.04 -0.64 0.00 0.00 1.68 0.00 0.00 54.58 55.66 1hi9 n ASN 127 Cb 0.40 -5.14 0.00 0.00 -1.54 0.00 0.00 39.78 33.50 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 -3.15 0.00 -4.64 6.41 8.00 -1.26 -4.98 116.55 116.93 1hi9 n ASP 128 Ca -0.23 0.00 -0.39 0.00 0.71 0.00 0.00 54.79 54.89 1hi9 n ASP 128 Cb 0.66 -1.20 -0.08 0.00 -0.02 0.00 0.00 41.12 40.47 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 -0.46 4.10 0.11 -1.24 3.52 -1.04 -5.03 118.95 118.90 1hi9 s ARG 129 Ca 0.00 0.13 -0.31 0.00 -0.13 0.00 0.00 55.73 55.43 1hi9 s ARG 129 Cb 0.00 -3.59 -0.10 0.00 -1.56 0.00 0.00 34.95 29.70 1hi9 s ARG 129 CO 0.00 -0.16 1.81 -2.14 -0.81 0.00 0.00 175.30 174.00 1hi9 s PRO 130 N 1.70 4.15 0.10 5.12 0.02 -1.26 -2.44 135.00 142.37 1hi9 s PRO 130 Ca 0.17 2.56 -0.12 0.00 0.02 0.00 0.00 61.00 63.63 1hi9 s PRO 130 Cb -0.15 -3.61 0.01 0.00 0.02 0.00 0.00 34.50 30.77 1hi9 s PRO 130 CO 0.09 -0.83 0.28 0.14 -0.33 0.00 0.00 177.00 176.35 1hi9 s VAL 131 N 2.79 0.11 0.00 3.83 -7.23 -0.58 -4.99 120.40 114.32 1hi9 s VAL 131 Ca 0.80 -0.89 0.00 0.00 -1.81 0.00 0.00 61.98 60.09 1hi9 s VAL 131 Cb -0.45 -1.22 0.00 0.00 0.56 0.00 0.00 36.38 35.27 1hi9 s VAL 131 CO 0.36 -0.49 0.00 0.61 -0.31 0.00 0.00 175.10 175.27 1hi9 n GLY 132 N -0.04 5.95 0.25 2.32 0.00 -1.26 -2.91 105.19 109.50 1hi9 n GLY 132 Ca -0.16 -1.84 -0.03 0.00 0.00 0.00 0.00 46.02 43.98 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 0.71 -0.08 1.61 5.08 -1.91 -0.65 114.58 119.34 1hi9 h GLU 133 Ca 0.00 -0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.35 1hi9 h GLU 133 Cb 0.00 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.05 1hi9 h GLU 133 CO 0.00 0.47 -0.17 1.25 -1.00 0.00 0.00 179.01 179.56 1hi9 h LEU 134 N 0.73 -0.51 0.20 1.33 6.46 -1.95 0.70 115.31 122.27 1hi9 h LEU 134 Ca 0.27 0.09 -0.01 0.00 -0.12 0.00 0.00 57.88 58.10 1hi9 h LEU 134 Cb 0.07 0.23 0.00 0.00 -0.73 0.00 0.00 40.66 40.24 1hi9 h LEU 134 CO -0.13 -0.22 -0.10 1.23 -0.62 0.00 0.00 178.44 178.60 1hi9 h GLY 135 N -0.24 -0.28 0.73 3.75 0.00 -1.83 -1.00 103.07 104.20 1hi9 h GLY 135 Ca 0.08 0.11 0.05 0.00 0.00 0.00 0.00 47.33 47.57 1hi9 h GLY 135 CO -0.22 -0.10 0.35 1.41 0.00 0.00 0.00 176.54 177.97 1hi9 h LEU 136 N -0.37 0.52 -0.92 3.11 3.38 -0.95 0.08 115.31 120.16 1hi9 h LEU 136 Ca -0.03 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 1hi9 h LEU 136 Cb 0.29 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 1hi9 h LEU 136 CO 0.05 0.35 0.01 0.78 0.09 0.00 0.00 178.44 179.71 1hi9 h ASN 137 N 0.66 0.77 -0.61 -0.43 2.35 -0.79 -1.75 115.58 115.78 1hi9 h ASN 137 Ca 0.27 -0.18 -0.06 0.00 -0.55 0.00 0.00 56.30 55.78 1hi9 h ASN 137 Cb 0.14 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.28 1hi9 h ASN 137 CO -0.16 0.83 0.16 0.00 -1.65 0.00 0.00 177.43 176.61 1hi9 h ALA 138 N 1.26 0.80 -0.77 -0.83 0.00 -0.38 -0.71 119.26 118.63 1hi9 h ALA 138 Ca 0.15 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1hi9 h ALA 138 Cb 0.44 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 1hi9 h ALA 138 CO 0.02 0.50 0.36 1.88 0.00 0.00 0.00 179.25 182.01 1hi9 h TYR 139 N 0.88 1.11 -0.26 0.00 0.99 -0.55 0.16 116.97 119.30 1hi9 h TYR 139 Ca 0.19 -0.05 -0.11 0.00 2.00 0.00 0.00 58.73 60.76 1hi9 h TYR 139 Cb 0.33 -0.34 -0.01 0.00 1.00 0.00 0.00 36.73 37.70 1hi9 h TYR 139 CO 0.02 0.81 -0.31 0.28 -0.00 0.00 0.00 178.16 178.96 1hi9 h VAL 140 N 1.10 1.28 -0.82 -2.88 2.07 -0.94 -1.23 116.25 114.83 1hi9 h VAL 140 Ca 0.27 -1.41 -0.04 0.00 0.82 0.00 0.00 66.70 66.34 1hi9 h VAL 140 Cb 0.12 1.42 -0.04 0.00 -1.52 0.00 0.00 31.29 31.28 1hi9 h VAL 140 CO -0.03 0.45 0.36 0.00 0.02 0.00 0.00 177.57 178.36 1hi9 h ALA 141 N 1.19 1.06 -0.41 1.67 0.00 -0.27 -2.53 119.26 119.97 1hi9 h ALA 141 Ca 0.06 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 1hi9 h ALA 141 Cb 0.78 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1hi9 h ALA 141 CO 0.06 0.65 0.06 0.78 0.00 0.00 0.00 179.25 180.80 1hi9 h GLY 142 N 1.17 0.68 1.17 0.00 0.00 0.09 -0.36 103.07 105.81 1hi9 h GLY 142 Ca 0.28 -0.39 0.10 0.00 0.00 0.00 0.00 47.33 47.32 1hi9 h GLY 142 CO -0.03 0.36 0.33 -1.82 0.00 0.00 0.00 176.54 175.39 1hi9 h TYR 143 N 0.61 0.24 -0.67 5.60 3.20 -0.80 0.21 116.97 125.36 1hi9 h TYR 143 Ca 0.13 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.01 1hi9 h TYR 143 Cb 0.30 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.49 1hi9 h TYR 143 CO 0.01 0.11 0.00 0.66 -1.64 0.00 0.00 178.16 177.31 1hi9 n TYR 144 N -4.45 1.01 -2.87 -3.82 4.02 -0.79 -4.93 117.16 105.33 1hi9 n TYR 144 Ca 0.08 -0.48 -0.22 0.00 -0.01 0.00 0.00 57.90 57.27 1hi9 n TYR 144 Cb 0.39 -0.04 0.03 0.00 -0.02 0.00 0.00 39.34 39.70 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 1.41 -6.12 -4.46 7.72 8.00 0.75 -4.29 116.55 119.57 1hi9 n ASP 145 Ca 0.23 -0.22 -0.34 0.00 0.71 0.00 0.00 54.79 55.16 1hi9 n ASP 145 Cb 0.63 -4.97 -0.12 0.00 -0.02 0.00 0.00 41.12 36.63 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 -3.15 3.90 0.29 2.53 1.01 -0.21 -4.83 120.40 119.93 1hi9 s VAL 146 Ca 0.23 -0.34 -0.19 0.00 0.00 0.00 0.00 61.98 61.68 1hi9 s VAL 146 Cb -0.10 -2.74 -0.09 0.00 0.00 0.00 0.00 36.38 33.45 1hi9 s VAL 146 CO 0.28 0.45 0.77 -2.16 0.00 0.00 0.00 175.10 174.45 1hi9 s PRO 147 N 0.76 4.19 -0.66 2.72 0.04 -1.26 -3.75 135.00 137.04 1hi9 s PRO 147 Ca -0.01 0.87 -0.22 0.00 0.04 0.00 0.00 61.00 61.68 1hi9 s PRO 147 Cb -0.14 -2.65 0.08 0.00 0.04 0.00 0.00 34.50 31.83 1hi9 s PRO 147 CO 0.02 0.26 0.94 0.08 0.04 0.00 0.00 177.00 178.34 1hi9 s VAL 148 N -1.76 4.39 0.15 -0.36 1.01 -1.26 -0.72 120.40 121.85 1hi9 s VAL 148 Ca 0.49 -0.47 -0.10 0.00 0.00 0.00 0.00 61.98 61.90 1hi9 s VAL 148 Cb -0.14 -4.66 -0.06 0.00 0.00 0.00 0.00 36.38 31.52 1hi9 s VAL 148 CO 0.19 -1.42 1.46 -0.07 0.00 0.00 0.00 175.10 175.26 1hi9 h LEU 149 N 11.16 0.94 -7.79 3.92 3.38 -1.45 -3.44 115.31 122.02 1hi9 h LEU 149 Ca -0.28 -0.47 -0.14 0.00 0.09 0.00 0.00 57.88 57.08 1hi9 h LEU 149 Cb 1.07 -0.27 -0.20 0.00 0.09 0.00 0.00 40.66 41.35 1hi9 h LEU 149 CO 1.17 1.25 -0.52 -0.32 0.09 0.00 0.00 178.44 180.12 1hi9 s MET 150 N -4.25 0.48 -0.03 1.13 0.00 -1.22 -2.01 119.30 113.40 1hi9 s MET 150 Ca -0.10 -0.47 -0.01 0.00 0.00 0.00 0.00 55.69 55.10 1hi9 s MET 150 Cb 0.11 0.19 0.03 0.00 0.00 0.00 0.00 34.83 35.16 1hi9 s MET 150 CO 0.88 -0.11 0.05 0.08 0.00 0.00 0.00 175.02 175.92 1hi9 s VAL 151 N -1.55 -0.09 0.06 10.11 1.01 -0.29 -1.27 120.40 128.38 1hi9 s VAL 151 Ca -0.14 0.36 0.09 0.00 0.00 0.00 0.00 61.98 62.29 1hi9 s VAL 151 Cb -0.07 -0.13 -0.03 0.00 0.00 0.00 0.00 36.38 36.15 1hi9 s VAL 151 CO 0.01 0.15 -0.26 0.00 0.00 0.00 0.00 175.10 175.00 1hi9 s ALA 152 N 1.80 2.30 0.00 5.51 0.00 0.83 -1.73 121.76 130.48 1hi9 s ALA 152 Ca 0.00 -1.30 0.00 0.00 0.00 0.00 0.00 51.96 50.66 1hi9 s ALA 152 Cb -0.12 -0.48 0.00 0.00 0.00 0.00 0.00 23.12 22.52 1hi9 s ALA 152 CO -0.03 0.54 0.00 0.41 0.00 0.00 0.00 175.76 176.68 1hi9 n GLY 153 N 1.60 -0.68 3.96 0.00 0.00 -0.73 -0.94 105.19 108.39 1hi9 n GLY 153 Ca -0.17 -0.37 -0.28 0.00 0.00 0.00 0.00 46.02 45.20 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 3.35 0.35 1.61 -4.77 -1.24 -1.06 116.67 110.91 1hi9 s ASP 154 Ca 0.00 -0.01 0.06 0.00 -3.30 0.00 0.00 52.55 49.30 1hi9 s ASP 154 Cb 0.00 -0.08 0.65 0.00 -1.09 0.00 0.00 42.92 42.40 1hi9 s ASP 154 CO 0.00 -2.56 1.86 -2.24 0.70 0.00 0.00 175.17 172.94 1hi9 h ASP 155 N -1.36 0.36 0.03 2.11 2.03 -1.67 -2.40 116.42 115.53 1hi9 h ASP 155 Ca -0.41 -0.08 -0.16 0.00 -0.73 0.00 0.00 57.03 55.65 1hi9 h ASP 155 Cb 1.23 -0.10 -0.01 0.00 -0.83 0.00 0.00 39.33 39.63 1hi9 h ASP 155 CO 0.35 0.51 -0.55 0.03 -1.03 0.00 0.00 179.24 178.56 1hi9 h ARG 156 N 0.36 0.55 -0.38 4.15 2.47 -1.90 -1.66 114.38 117.98 1hi9 h ARG 156 Ca 0.07 -0.35 -0.13 0.00 -1.26 0.00 0.00 59.98 58.31 1hi9 h ARG 156 Cb 0.41 0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 28.76 1hi9 h ARG 156 CO 0.02 0.96 -0.29 0.00 0.56 0.00 0.00 179.97 181.22 1hi9 h ALA 157 N 0.97 0.78 -0.23 0.04 0.00 -1.81 -0.72 119.26 118.29 1hi9 h ALA 157 Ca 0.01 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 1hi9 h ALA 157 Cb 1.09 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1hi9 h ALA 157 CO 0.10 0.65 0.12 0.00 0.00 0.00 0.00 179.25 180.12 1hi9 h ALA 158 N 0.98 0.30 -0.45 0.00 0.00 -1.28 0.79 119.26 119.60 1hi9 h ALA 158 Ca 0.08 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1hi9 h ALA 158 Cb 0.83 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1hi9 h ALA 158 CO 0.07 -0.15 0.29 -0.22 0.00 0.00 0.00 179.25 179.23 1hi9 h LYS 159 N 0.25 0.61 -0.93 0.00 1.63 -1.15 -1.26 116.57 115.72 1hi9 h LYS 159 Ca 0.08 -0.05 -0.01 0.00 -0.85 0.00 0.00 60.65 59.82 1hi9 h LYS 159 Cb 0.10 -0.13 -0.04 0.00 -0.60 0.00 0.00 32.23 31.55 1hi9 h LYS 159 CO -0.01 0.43 0.54 1.49 -3.45 0.00 0.00 179.45 178.45 1hi9 h GLU 160 N 0.61 1.27 0.32 1.90 4.81 -0.81 -1.98 114.58 120.69 1hi9 h GLU 160 Ca 0.16 -0.13 -0.02 0.00 -0.13 0.00 0.00 59.36 59.25 1hi9 h GLU 160 Cb -0.04 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 29.09 1hi9 h GLU 160 CO -0.03 0.90 -0.15 0.00 -0.73 0.00 0.00 179.01 179.00 1hi9 h ALA 161 N 1.30 -0.43 0.00 2.92 0.00 -0.24 -3.07 119.26 119.74 1hi9 h ALA 161 Ca 0.33 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1hi9 h ALA 161 Cb -0.02 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1hi9 h ALA 161 CO -0.06 -0.66 -0.04 1.05 0.00 0.00 0.00 179.25 179.54 1hi9 h GLU 162 N -0.60 0.00 -0.00 0.00 4.11 -1.12 0.16 114.58 117.13 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 0.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.68 1hi9 h GLU 162 CO 0.07 0.04 -0.04 0.39 0.07 0.00 0.00 179.01 179.54 1hi9 n GLU 163 N -3.28 0.05 -0.06 1.06 1.02 -0.76 -3.93 120.64 114.73 1hi9 n GLU 163 Ca -0.01 -0.00 -0.08 0.00 -0.02 0.00 0.00 57.16 57.04 1hi9 n GLU 163 Cb 0.20 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.06 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 -1.47 2.96 -4.16 -4.62 7.94 -0.41 -4.95 117.00 112.29 1hi9 n LEU 164 Ca 0.08 -0.07 -0.35 0.00 -1.11 0.00 0.00 56.01 54.56 1hi9 n LEU 164 Cb 0.33 -0.42 -0.13 0.00 0.53 0.00 0.00 43.42 43.72 1hi9 n LEU 164 CO 0.27 0.70 -0.33 -0.63 -1.11 0.00 0.00 177.39 176.30 1hi9 s ILE 165 N -2.25 3.01 0.27 1.96 1.01 0.43 -5.06 121.20 120.58 1hi9 s ILE 165 Ca -0.16 -1.50 -0.30 0.00 0.00 0.00 0.00 60.65 58.68 1hi9 s ILE 165 Cb 0.04 -2.79 -0.12 0.00 0.01 0.00 0.00 42.46 39.60 1hi9 s ILE 165 CO 0.28 -0.20 1.57 -2.65 0.00 0.00 0.00 174.94 173.95 1hi9 n PRO 166 N 4.61 2.58 -0.84 2.79 -0.02 -1.26 -2.47 135.00 140.38 1hi9 n PRO 166 Ca -0.11 0.92 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 1hi9 n PRO 166 Cb 0.43 -2.68 0.00 0.00 -0.02 0.00 0.00 33.50 31.23 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 -2.50 -4.76 2.55 3.02 -1.26 -4.57 115.26 110.08 1hi9 n ASN 167 Ca 0.10 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.26 1hi9 n ASN 167 Cb 0.35 -2.01 0.03 0.00 -0.61 0.00 0.00 39.78 37.54 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 -1.72 2.13 -0.08 2.41 0.11 -1.03 -4.82 120.40 117.40 1hi9 s VAL 168 Ca 0.00 0.11 -0.18 0.00 -2.93 0.00 0.00 61.98 58.98 1hi9 s VAL 168 Cb 0.00 -3.06 -0.05 0.00 -1.53 0.00 0.00 36.38 31.74 1hi9 s VAL 168 CO 0.00 0.01 0.48 -0.89 -3.33 0.00 0.00 175.10 171.36 1hi9 s THR 169 N -1.27 5.11 0.11 5.04 2.01 -0.85 -4.89 115.64 120.91 1hi9 s THR 169 Ca 0.67 0.96 0.09 0.00 0.31 0.00 0.00 61.69 63.72 1hi9 s THR 169 Cb -0.41 -3.81 -0.04 0.00 0.01 0.00 0.00 72.50 68.25 1hi9 s THR 169 CO 0.51 0.39 -0.22 0.42 -0.69 0.00 0.00 174.62 175.02 1hi9 s THR 170 N 0.16 1.87 -0.25 -0.82 -4.23 -1.26 -1.14 115.64 109.97 1hi9 s THR 170 Ca 0.26 -1.62 -0.01 0.00 -1.18 0.00 0.00 61.69 59.14 1hi9 s THR 170 Cb -0.16 -1.69 0.08 0.00 1.34 0.00 0.00 72.50 72.06 1hi9 s THR 170 CO 0.12 -0.03 0.04 0.00 -0.54 0.00 0.00 174.62 174.21 1hi9 s ALA 171 N -1.17 1.45 -0.84 3.99 0.00 -0.71 -4.96 121.76 119.52 1hi9 s ALA 171 Ca 0.09 -1.26 -0.19 0.00 0.00 0.00 0.00 51.96 50.60 1hi9 s ALA 171 Cb -0.10 -1.42 0.12 0.00 0.00 0.00 0.00 23.12 21.72 1hi9 s ALA 171 CO 0.05 -1.39 1.04 0.00 0.00 0.00 0.00 175.76 175.47 1hi9 s ALA 172 N 1.65 3.35 -0.89 0.00 0.00 -1.26 -1.77 121.76 122.83 1hi9 s ALA 172 Ca 0.03 -2.56 0.20 0.00 0.00 0.00 0.00 51.96 49.62 1hi9 s ALA 172 Cb -0.18 -3.95 0.82 0.00 0.00 0.00 0.00 23.12 19.82 1hi9 s ALA 172 CO -0.14 -2.86 1.62 1.33 0.00 0.00 0.00 175.76 175.70 1hi9 n VAL 173 N 5.53 0.75 -3.44 0.00 0.24 -0.22 -4.82 118.33 116.36 1hi9 n VAL 173 Ca 0.15 0.16 -0.13 0.00 -2.04 0.00 0.00 64.34 62.49 1hi9 n VAL 173 Cb 0.48 -0.91 -0.03 0.00 -1.47 0.00 0.00 33.84 31.91 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 -3.06 1.24 -0.15 7.34 -2.85 -1.25 -3.27 119.74 117.74 1hi9 s LYS 174 Ca 0.08 -0.39 -0.04 0.00 -1.00 0.00 0.00 55.97 54.62 1hi9 s LYS 174 Cb 0.11 0.57 -0.03 0.00 -2.06 0.00 0.00 37.83 36.43 1hi9 s LYS 174 CO 0.36 -0.52 -0.02 -0.65 0.10 0.00 0.00 175.35 174.62 1hi9 s GLN 175 N -3.42 3.63 0.12 1.78 -1.52 0.16 -1.74 119.66 118.66 1hi9 s GLN 175 Ca -0.00 -0.48 -0.30 0.00 -1.95 0.00 0.00 55.36 52.62 1hi9 s GLN 175 Cb -0.01 -2.94 -0.06 0.00 -0.22 0.00 0.00 33.01 29.78 1hi9 s GLN 175 CO -0.10 0.31 1.04 0.99 -0.25 0.00 0.00 175.29 177.28 1hi9 s THR 176 N 0.20 4.23 -0.08 -0.19 2.01 -1.26 -0.23 115.64 120.33 1hi9 s THR 176 Ca -0.01 1.83 0.02 0.00 0.31 0.00 0.00 61.69 63.84 1hi9 s THR 176 Cb -0.13 -4.17 -0.06 0.00 0.01 0.00 0.00 72.50 68.14 1hi9 s THR 176 CO 0.02 0.27 -0.06 -0.38 -0.69 0.00 0.00 174.62 173.79 1hi9 n ILE 177 N 2.83 0.49 -3.90 1.82 5.41 -0.36 -4.89 119.36 120.75 1hi9 n ILE 177 Ca 0.03 -0.21 -0.11 0.00 1.00 0.00 0.00 62.75 63.46 1hi9 n ILE 177 Cb 0.48 -0.81 -0.01 0.00 -0.71 0.00 0.00 39.64 38.59 1hi9 n ILE 177 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1hi9 n SER 178 N -2.65 -1.49 0.06 4.38 3.41 -0.96 -4.97 113.62 111.40 1hi9 n SER 178 Ca -0.14 -2.60 0.09 0.00 -0.26 0.00 0.00 58.87 55.96 1hi9 n SER 178 Cb 0.67 2.65 0.38 0.00 -0.26 0.00 0.00 64.21 67.65 1hi9 n SER 178 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1hi9 n ARG 179 N -0.50 0.09 -2.52 4.33 0.63 -1.26 -3.10 116.66 114.33 1hi9 n ARG 179 Ca -0.02 0.34 -0.00 0.00 -0.92 0.00 0.00 57.85 57.25 1hi9 n ARG 179 Cb 0.52 -1.67 0.04 0.00 0.45 0.00 0.00 32.46 31.81 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 -1.83 1.62 -3.64 6.15 3.41 -1.26 0.17 113.62 118.24 1hi9 n SER 180 Ca 0.03 -2.12 -0.14 0.00 -0.26 0.00 0.00 58.87 56.38 1hi9 n SER 180 Cb 0.18 -0.44 -0.07 0.00 -0.26 0.00 0.00 64.21 63.62 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 -3.07 -1.69 0.15 7.33 0.00 -1.18 -4.61 121.76 118.70 1hi9 s ALA 181 Ca 0.30 1.94 -0.12 0.00 0.00 0.00 0.00 51.96 54.07 1hi9 s ALA 181 Cb 0.34 -1.13 0.01 0.00 0.00 0.00 0.00 23.12 22.34 1hi9 s ALA 181 CO -0.06 -0.32 0.35 0.14 0.00 0.00 0.00 175.76 175.87 1hi9 s VAL 182 N 0.40 0.07 -0.27 0.00 -7.23 -1.26 -1.22 120.40 110.88 1hi9 s VAL 182 Ca -0.00 -1.06 -0.05 0.00 -1.81 0.00 0.00 61.98 59.06 1hi9 s VAL 182 Cb -0.05 -1.58 0.01 0.00 0.56 0.00 0.00 36.38 35.32 1hi9 s VAL 182 CO 0.00 -0.31 0.02 -0.75 -0.31 0.00 0.00 175.10 173.76 1hi9 s LYS 183 N -3.90 3.03 0.36 4.82 2.20 0.68 -4.91 119.74 122.03 1hi9 s LYS 183 Ca 0.11 -0.88 0.09 0.00 -0.36 0.00 0.00 55.97 54.93 1hi9 s LYS 183 Cb 0.02 -3.21 -0.06 0.00 -1.51 0.00 0.00 37.83 33.07 1hi9 s LYS 183 CO -0.04 -0.41 0.02 0.00 -0.36 0.00 0.00 175.35 174.56 1hi9 s LEU 185 N -3.72 4.07 0.65 0.00 1.43 -1.20 -5.01 118.68 114.89 1hi9 s LEU 185 Ca 0.35 0.62 -0.17 0.00 -1.03 0.00 0.00 54.13 53.91 1hi9 s LEU 185 Cb 0.02 -3.44 -0.00 0.00 0.03 0.00 0.00 46.19 42.80 1hi9 s LEU 185 CO 0.19 -0.20 1.20 -0.94 0.23 0.00 0.00 176.35 176.84 1hi9 s SER 186 N -3.33 4.78 0.33 2.29 1.04 -1.26 -4.62 113.70 112.93 1hi9 s SER 186 Ca 0.42 2.34 0.11 0.00 0.48 0.00 0.00 55.95 59.30 1hi9 s SER 186 Cb -0.11 -2.59 0.92 0.00 0.10 0.00 0.00 66.02 64.34 1hi9 s SER 186 CO 0.31 -1.87 1.74 -0.65 0.98 0.00 0.00 173.24 173.75 1hi9 h PRO 187 N 0.32 0.54 -0.18 4.02 0.11 -1.97 0.67 132.00 135.51 1hi9 h PRO 187 Ca -0.49 -0.03 -0.18 0.00 0.11 0.00 0.00 66.00 65.41 1hi9 h PRO 187 Cb 1.29 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 1hi9 h PRO 187 CO 0.53 0.36 -0.62 0.00 -0.21 0.00 0.00 178.00 178.06 1hi9 h ALA 188 N 1.71 0.58 -0.49 -0.75 0.00 -2.00 -2.53 119.26 115.78 1hi9 h ALA 188 Ca 0.64 -0.54 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 1hi9 h ALA 188 Cb 1.27 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 1hi9 h ALA 188 CO -0.45 0.70 0.01 -0.22 0.00 0.00 0.00 179.25 179.30 1hi9 h LYS 189 N 0.46 0.85 -0.28 0.00 3.64 -1.27 -2.46 116.57 117.51 1hi9 h LYS 189 Ca -0.01 -0.27 -0.07 0.00 -1.27 0.00 0.00 60.65 59.04 1hi9 h LYS 189 Cb 1.19 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.91 1hi9 h LYS 189 CO 0.12 0.89 -0.12 0.07 -2.27 0.00 0.00 179.45 178.13 1hi9 h ARG 190 N 0.71 0.47 -0.68 1.90 0.11 -1.18 -2.37 114.38 113.34 1hi9 h ARG 190 Ca 0.14 -0.13 0.00 0.00 0.10 0.00 0.00 59.98 60.09 1hi9 h ARG 190 Cb 0.49 -0.05 -0.03 0.00 1.11 0.00 0.00 29.97 31.49 1hi9 h ARG 190 CO 0.02 0.59 0.43 0.78 0.10 0.00 0.00 179.97 181.90 1hi9 h GLY 191 N 0.91 0.98 0.80 0.08 0.00 -1.00 0.15 103.07 104.98 1hi9 h GLY 191 Ca 0.08 -0.39 -0.02 0.00 0.00 0.00 0.00 47.33 47.01 1hi9 h GLY 191 CO 0.03 0.38 0.02 3.21 0.00 0.00 0.00 176.54 180.17 1hi9 h ARG 192 N 0.93 0.21 -0.33 4.80 3.08 -1.14 0.92 114.38 122.84 1hi9 h ARG 192 Ca 0.25 -0.06 0.07 0.00 0.07 0.00 0.00 59.98 60.30 1hi9 h ARG 192 Cb -0.07 -0.02 -0.06 0.00 0.08 0.00 0.00 29.97 29.90 1hi9 h ARG 192 CO -0.05 0.42 -0.07 1.25 -1.07 0.00 0.00 179.97 180.44 1hi9 h LEU 193 N -0.02 -0.28 -0.66 3.04 5.85 -1.03 0.17 115.31 122.37 1hi9 h LEU 193 Ca 0.04 0.10 -0.04 0.00 0.84 0.00 0.00 57.88 58.82 1hi9 h LEU 193 Cb 0.31 0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.50 1hi9 h LEU 193 CO 0.00 -0.10 0.26 -0.07 -0.34 0.00 0.00 178.44 178.20 1hi9 h LEU 194 N 0.01 0.92 0.11 2.25 3.38 -0.57 0.10 115.31 121.51 1hi9 h LEU 194 Ca 0.16 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1hi9 h LEU 194 Cb 0.24 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1hi9 h LEU 194 CO -0.33 0.84 -0.07 0.74 0.09 0.00 0.00 178.44 179.71 1hi9 h THR 195 N 0.94 0.85 0.17 0.22 2.02 0.17 0.57 112.91 117.85 1hi9 h THR 195 Ca 0.22 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.39 1hi9 h THR 195 Cb 0.21 0.85 0.00 0.00 -1.74 0.00 0.00 68.15 67.47 1hi9 h THR 195 CO -0.02 0.00 -0.08 -0.33 0.37 0.00 0.00 175.52 175.46 1hi9 h GLU 196 N -0.18 -0.23 -0.97 6.66 5.08 -0.57 -1.97 114.58 122.41 1hi9 h GLU 196 Ca -0.01 0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.42 1hi9 h GLU 196 Cb 0.15 0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.39 1hi9 h GLU 196 CO 0.00 -0.05 0.63 0.87 -1.00 0.00 0.00 179.01 179.47 1hi9 h LYS 197 N -0.36 1.13 -0.50 2.33 1.79 -0.93 -0.40 116.57 119.63 1hi9 h LYS 197 Ca -0.02 -0.07 -0.08 0.00 -2.18 0.00 0.00 60.65 58.30 1hi9 h LYS 197 Cb 0.28 -0.25 -0.02 0.00 -1.58 0.00 0.00 32.23 30.66 1hi9 h LYS 197 CO 0.04 0.75 -0.01 1.15 -1.08 0.00 0.00 179.45 180.30 1hi9 h THR 198 N 1.16 1.26 -0.26 -0.16 2.02 -0.77 -0.39 112.91 115.77 1hi9 h THR 198 Ca 0.41 -1.09 -0.01 0.00 0.77 0.00 0.00 66.41 66.49 1hi9 h THR 198 Cb 0.12 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 67.50 1hi9 h THR 198 CO -0.15 0.38 0.12 0.00 0.37 0.00 0.00 175.52 176.24 1hi9 h ALA 199 N 0.93 0.34 -0.60 6.16 0.00 -0.60 -2.18 119.26 123.31 1hi9 h ALA 199 Ca 0.14 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1hi9 h ALA 199 Cb 0.53 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 1hi9 h ALA 199 CO 0.03 -0.09 0.19 0.35 0.00 0.00 0.00 179.25 179.73 1hi9 h PHE 200 N 0.28 0.97 -0.74 0.00 3.57 -0.99 -2.71 116.94 117.32 1hi9 h PHE 200 Ca 0.09 -0.10 0.03 0.00 3.53 0.00 0.00 57.97 61.52 1hi9 h PHE 200 Cb 0.14 -0.28 -0.04 0.00 2.79 0.00 0.00 35.95 38.56 1hi9 h PHE 200 CO -0.02 0.80 0.47 0.00 -2.23 0.00 0.00 178.31 177.34 1hi9 h ALA 201 N 1.06 0.97 -0.09 2.41 0.00 -0.90 0.23 119.26 122.93 1hi9 h ALA 201 Ca 0.19 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.96 1hi9 h ALA 201 Cb 0.29 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1hi9 h ALA 201 CO -0.01 0.28 -0.45 -0.07 0.00 0.00 0.00 179.25 179.01 1hi9 h LEU 202 N 0.93 0.23 0.00 0.00 3.38 -1.25 -2.30 115.31 116.30 1hi9 h LEU 202 Ca 0.29 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.15 1hi9 h LEU 202 Cb -0.00 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 1hi9 h LEU 202 CO -0.10 0.65 -0.81 0.06 0.09 0.00 0.00 178.44 178.32 1hi9 h GLN 203 N 0.18 0.00 -0.67 1.13 3.07 -1.16 -3.29 115.11 114.38 1hi9 h GLN 203 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.75 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 0.02 0.00 -1.71 0.09 0.00 0.00 178.83 177.29 1hi9 n ASN 204 N -2.78 4.10 -0.18 0.06 2.85 0.04 -4.61 115.26 114.75 1hi9 n ASN 204 Ca 0.00 -2.15 0.23 0.00 -0.11 0.00 0.00 54.58 52.55 1hi9 n ASN 204 Cb 0.56 -0.49 0.62 0.00 1.24 0.00 0.00 39.78 41.71 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 3.97 0.18 0.00 1.20 2.10 -1.48 -1.52 116.57 121.02 1hi9 h LYS 205 Ca 0.00 -0.01 -0.01 0.00 -2.00 0.00 0.00 60.65 58.63 1hi9 h LYS 205 Cb 1.11 -0.04 -0.00 0.00 -0.90 0.00 0.00 32.23 32.40 1hi9 h LYS 205 CO 0.07 0.12 -0.04 -0.44 -2.00 0.00 0.00 179.45 177.16 1hi9 h ASP 206 N 0.19 0.00 0.29 7.07 5.19 -1.88 -2.06 116.42 125.21 1hi9 h ASP 206 Ca 0.41 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.82 1hi9 h ASP 206 Cb 1.33 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.84 1hi9 h ASP 206 CO -0.08 0.04 -0.05 0.29 -3.12 0.00 0.00 179.24 176.32 1hi9 n LYS 207 N -3.72 0.79 -4.52 3.56 5.02 -0.57 -4.79 118.16 113.92 1hi9 n LYS 207 Ca -0.03 -0.18 -0.34 0.00 -2.02 0.00 0.00 58.31 55.75 1hi9 n LYS 207 Cb 0.14 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.53 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 -2.34 3.70 0.14 -0.18 1.01 -0.78 -4.71 120.40 117.25 1hi9 s VAL 208 Ca 0.34 -0.44 0.07 0.00 0.00 0.00 0.00 61.98 61.95 1hi9 s VAL 208 Cb 0.21 -2.59 -0.04 0.00 0.00 0.00 0.00 36.38 33.96 1hi9 s VAL 208 CO 0.43 0.52 -0.01 -0.54 0.00 0.00 0.00 175.10 175.50 1hi9 s LYS 209 N 0.10 2.40 0.38 2.72 1.02 -1.26 -4.87 119.74 120.23 1hi9 s LYS 209 Ca -0.02 -1.02 -0.28 0.00 0.02 0.00 0.00 55.97 54.67 1hi9 s LYS 209 Cb -0.14 -2.40 -0.10 0.00 -0.52 0.00 0.00 37.83 34.67 1hi9 s LYS 209 CO 0.03 0.48 1.41 -2.14 -0.92 0.00 0.00 175.35 174.22 1hi9 s PRO 210 N -2.67 4.09 -1.23 -1.68 0.02 -1.26 -4.63 135.00 127.63 1hi9 s PRO 210 Ca 0.26 2.41 -0.18 0.00 0.02 0.00 0.00 61.00 63.51 1hi9 s PRO 210 Cb -0.10 -2.92 0.08 0.00 0.02 0.00 0.00 34.50 31.58 1hi9 s PRO 210 CO 0.18 -0.49 1.64 -1.17 -0.33 0.00 0.00 177.00 176.83 1hi9 s LEU 211 N -2.16 3.95 0.11 -5.54 0.20 -1.26 -4.94 118.68 109.04 1hi9 s LEU 211 Ca 0.54 -2.32 -0.32 0.00 0.69 0.00 0.00 54.13 52.72 1hi9 s LEU 211 Cb -0.43 -2.55 -0.11 0.00 -0.43 0.00 0.00 46.19 42.66 1hi9 s LEU 211 CO 0.58 -1.18 1.83 0.41 -0.29 0.00 0.00 176.35 177.70 1hi9 n THR 212 N 6.26 0.37 -3.16 3.68 -1.04 -1.26 -3.97 114.28 115.16 1hi9 n THR 212 Ca 0.44 -0.07 -0.25 0.00 -2.04 0.00 0.00 64.05 62.14 1hi9 n THR 212 Cb 0.47 -2.08 -0.01 0.00 -1.82 0.00 0.00 70.33 66.89 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 2.76 3.50 0.86 -2.82 0.04 -1.26 -5.04 135.00 133.03 1hi9 s PRO 213 Ca 0.83 -0.18 -0.12 0.00 0.04 0.00 0.00 61.00 61.56 1hi9 s PRO 213 Cb -0.51 -2.58 0.10 0.00 0.04 0.00 0.00 34.50 31.55 1hi9 s PRO 213 CO 0.38 0.04 1.09 -2.30 0.04 0.00 0.00 177.00 176.25 1hi9 n PRO 214 N -1.93 -0.08 0.08 0.56 -0.02 -1.26 -4.94 135.00 127.41 1hi9 n PRO 214 Ca -0.03 0.05 -0.13 0.00 -2.02 0.00 0.00 63.50 61.37 1hi9 n PRO 214 Cb 0.56 -2.34 -0.08 0.00 -0.02 0.00 0.00 33.50 31.62 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 -1.29 -0.14 -2.40 2.55 3.45 -1.97 -3.34 116.42 113.27 1hi9 h ASP 215 Ca -0.45 -0.15 -0.60 0.00 0.43 0.00 0.00 57.03 56.26 1hi9 h ASP 215 Cb 1.29 0.04 -0.42 0.00 -0.56 0.00 0.00 39.33 39.68 1hi9 h ASP 215 CO 0.43 0.07 -0.64 0.54 -1.57 0.00 0.00 179.24 178.07 1hi9 n ARG 216 N -5.08 2.16 -1.76 3.56 1.74 -1.26 -3.91 116.66 112.11 1hi9 n ARG 216 Ca -0.09 -4.48 -0.39 0.00 -0.77 0.00 0.00 57.85 52.12 1hi9 n ARG 216 Cb 0.16 -2.17 0.03 0.00 -1.02 0.00 0.00 32.46 29.46 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 2.03 -3.66 5.56 -0.04 -1.25 -4.69 135.00 134.17 1hi9 n PRO 217 Ca 0.27 0.73 -0.39 0.00 -0.04 0.00 0.00 63.50 64.07 1hi9 n PRO 217 Cb 0.41 -2.61 -0.12 0.00 -0.04 0.00 0.00 33.50 31.14 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 -1.23 4.44 -0.06 0.52 1.01 -1.26 -1.48 120.40 122.34 1hi9 s VAL 218 Ca 0.65 -0.66 -0.23 0.00 0.00 0.00 0.00 61.98 61.74 1hi9 s VAL 218 Cb -0.44 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 1hi9 s VAL 218 CO 0.54 -0.05 0.68 -0.22 0.00 0.00 0.00 175.10 176.05 1hi9 s LEU 219 N 1.56 4.33 -0.06 3.92 2.96 -0.22 -1.68 118.68 129.48 1hi9 s LEU 219 Ca 0.03 1.18 0.03 0.00 -0.22 0.00 0.00 54.13 55.15 1hi9 s LEU 219 Cb -0.18 -3.06 0.01 0.00 0.50 0.00 0.00 46.19 43.46 1hi9 s LEU 219 CO 0.06 -0.09 -0.15 -0.44 -1.32 0.00 0.00 176.35 174.40 1hi9 s SER 220 N 0.68 2.09 -0.12 3.68 0.01 0.01 -0.69 113.70 119.35 1hi9 s SER 220 Ca 0.37 -0.35 0.00 0.00 1.31 0.00 0.00 55.95 57.27 1hi9 s SER 220 Cb -0.18 -0.85 0.02 0.00 0.21 0.00 0.00 66.02 65.22 1hi9 s SER 220 CO 0.18 0.09 -0.11 -0.63 0.41 0.00 0.00 173.24 173.18 1hi9 s ILE 221 N 0.43 1.25 -0.26 1.44 1.01 -0.41 0.28 121.20 124.94 1hi9 s ILE 221 Ca -0.12 -0.45 -0.10 0.00 0.00 0.00 0.00 60.65 59.98 1hi9 s ILE 221 Cb -0.15 -1.21 -0.04 0.00 0.01 0.00 0.00 42.46 41.07 1hi9 s ILE 221 CO 0.04 0.40 0.14 -0.70 0.00 0.00 0.00 174.94 174.83 1hi9 s GLU 222 N 1.44 3.86 0.38 2.79 2.12 -0.31 -0.80 118.70 128.17 1hi9 s GLU 222 Ca 0.01 -0.37 0.03 0.00 0.36 0.00 0.00 54.97 55.00 1hi9 s GLU 222 Cb -0.13 -3.52 -0.01 0.00 0.26 0.00 0.00 34.13 30.72 1hi9 s GLU 222 CO -0.07 -0.15 0.56 -0.06 -0.54 0.00 0.00 175.26 175.00 1hi9 s PHE 223 N 1.63 3.25 0.17 5.30 0.40 -0.55 0.06 117.98 128.24 1hi9 s PHE 223 Ca 0.07 0.08 -0.12 0.00 -0.60 0.00 0.00 56.93 56.36 1hi9 s PHE 223 Cb -0.15 -2.08 0.06 0.00 0.51 0.00 0.00 43.02 41.35 1hi9 s PHE 223 CO 0.08 -0.10 1.69 0.00 0.70 0.00 0.00 175.22 177.58 1hi9 h ALA 224 N 0.68 0.75 -2.21 5.36 0.00 -0.95 -3.44 119.26 119.46 1hi9 h ALA 224 Ca -0.47 -0.21 -0.37 0.00 0.00 0.00 0.00 54.91 53.86 1hi9 h ALA 224 Cb 1.25 -0.22 -0.14 0.00 0.00 0.00 0.00 17.79 18.67 1hi9 h ALA 224 CO 0.57 0.44 -0.64 0.54 0.00 0.00 0.00 179.25 180.15 1hi9 s ASN 225 N -6.21 1.71 0.37 0.00 4.22 -1.26 -5.05 114.94 108.71 1hi9 s ASN 225 Ca -0.13 -1.26 0.11 0.00 -2.14 0.00 0.00 52.86 49.44 1hi9 s ASN 225 Cb 0.13 0.04 0.70 0.00 1.28 0.00 0.00 41.25 43.40 1hi9 s ASN 225 CO 0.81 -0.57 1.83 0.22 -2.04 0.00 0.00 177.10 177.35 1hi9 h TYR 226 N 2.44 0.10 -0.92 1.54 3.20 -1.92 -2.89 116.97 118.52 1hi9 h TYR 226 Ca -0.38 -0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.47 1hi9 h TYR 226 Cb 1.23 -0.03 -0.05 0.00 1.54 0.00 0.00 36.73 39.43 1hi9 h TYR 226 CO 0.55 0.40 0.61 0.78 -1.64 0.00 0.00 178.16 178.86 1hi9 h GLY 227 N 1.02 1.30 1.66 1.82 0.00 -1.96 0.22 103.07 107.12 1hi9 h GLY 227 Ca 0.01 -0.49 -0.12 0.00 0.00 0.00 0.00 47.33 46.73 1hi9 h GLY 227 CO 0.04 0.48 -0.42 1.46 0.00 0.00 0.00 176.54 178.10 1hi9 h GLN 228 N 1.25 0.38 -0.39 4.80 4.20 -1.82 -2.12 115.11 121.42 1hi9 h GLN 228 Ca 0.34 -0.19 -0.07 0.00 0.06 0.00 0.00 58.65 58.79 1hi9 h GLN 228 Cb -0.14 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.63 1hi9 h GLN 228 CO -0.07 0.74 -0.03 0.00 -0.67 0.00 0.00 178.83 178.80 1hi9 h ALA 229 N 1.24 0.52 -0.72 3.87 0.00 -1.32 -2.35 119.26 120.51 1hi9 h ALA 229 Ca 0.03 -0.27 0.02 0.00 0.00 0.00 0.00 54.91 54.69 1hi9 h ALA 229 Cb 0.87 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 1hi9 h ALA 229 CO 0.07 0.33 0.46 0.93 0.00 0.00 0.00 179.25 181.04 1hi9 h GLU 230 N 0.52 0.88 -0.03 0.00 5.08 -0.65 0.83 114.58 121.21 1hi9 h GLU 230 Ca 0.11 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1hi9 h GLU 230 Cb 0.51 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 1hi9 h GLU 230 CO 0.02 0.58 0.01 -1.49 -1.00 0.00 0.00 179.01 177.14 1hi9 h TRP 231 N 0.91 0.02 -0.57 4.33 4.06 -1.25 -2.70 115.95 120.75 1hi9 h TRP 231 Ca 0.28 0.00 -0.05 0.00 2.06 0.00 0.00 58.89 61.19 1hi9 h TRP 231 Cb -0.02 -0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.11 1hi9 h TRP 231 CO -0.03 0.01 0.17 0.00 -3.56 0.00 0.00 178.44 175.03 1hi9 h ALA 232 N 1.02 1.23 0.00 1.49 0.00 -1.08 -2.14 119.26 119.78 1hi9 h ALA 232 Ca 0.01 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1hi9 h ALA 232 Cb 0.01 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1hi9 h ALA 232 CO -0.01 0.54 0.00 -1.71 0.00 0.00 0.00 179.25 178.07 1hi9 n ASN 233 N -4.29 0.00 0.08 0.00 5.15 0.25 -1.58 115.26 114.87 1hi9 n ASN 233 Ca 0.04 -0.38 -0.04 0.00 -0.60 0.00 0.00 54.58 53.61 1hi9 n ASN 233 Cb 0.21 0.00 -0.08 0.00 -0.53 0.00 0.00 39.78 39.38 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 -1.28 -3.46 115.31 106.24 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 0.84 0.76 -0.32 -1.08 0.00 0.00 178.44 178.63 1hi9 s MET 235 N -2.78 4.30 0.34 1.13 1.75 -0.62 -4.95 119.30 118.47 1hi9 s MET 235 Ca 0.01 2.17 -0.28 0.00 -1.25 0.00 0.00 55.69 56.34 1hi9 s MET 235 Cb 0.09 -3.20 -0.12 0.00 2.84 0.00 0.00 34.83 34.44 1hi9 s MET 235 CO 0.80 -0.45 1.31 -2.30 -0.65 0.00 0.00 175.02 173.72 1hi9 n PRO 236 N 3.60 2.18 -0.46 4.11 -0.02 -1.26 -2.58 135.00 140.57 1hi9 n PRO 236 Ca 0.11 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.35 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 0.75 0.75 3.83 -1.23 0.00 -1.26 -5.06 105.19 102.96 1hi9 n GLY 237 Ca 0.04 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.57 4.09 -0.19 2.61 -4.23 -1.06 -4.22 115.64 110.06 1hi9 s THR 238 Ca 0.00 -1.42 -0.21 0.00 -1.18 0.00 0.00 61.69 58.88 1hi9 s THR 238 Cb 0.00 -3.30 0.06 0.00 1.34 0.00 0.00 72.50 70.59 1hi9 s THR 238 CO 0.00 -0.29 0.58 -0.70 -0.54 0.00 0.00 174.62 173.67 1hi9 s GLU 239 N -3.89 0.73 -0.11 3.99 2.12 -0.92 -4.97 118.70 115.65 1hi9 s GLU 239 Ca 0.36 0.69 -0.15 0.00 0.36 0.00 0.00 54.97 56.22 1hi9 s GLU 239 Cb -0.07 0.35 -0.05 0.00 0.26 0.00 0.00 34.13 34.62 1hi9 s GLU 239 CO 0.25 -0.12 0.37 0.42 -0.54 0.00 0.00 175.26 175.65 1hi9 s ILE 240 N 0.04 5.21 -0.40 -3.70 1.01 -1.26 -0.62 121.20 121.48 1hi9 s ILE 240 Ca -0.02 0.74 -0.29 0.00 0.00 0.00 0.00 60.65 61.08 1hi9 s ILE 240 Cb -0.04 -3.70 0.01 0.00 0.01 0.00 0.00 42.46 38.74 1hi9 s ILE 240 CO 0.02 0.42 1.28 -0.75 0.00 0.00 0.00 174.94 175.91 1hi9 s LYS 241 N 0.08 3.74 0.22 2.79 2.47 -0.64 -4.95 119.74 123.44 1hi9 s LYS 241 Ca 0.21 0.91 -0.30 0.00 -1.56 0.00 0.00 55.97 55.24 1hi9 s LYS 241 Cb -0.15 -3.93 -0.16 0.00 -1.46 0.00 0.00 37.83 32.13 1hi9 s LYS 241 CO 0.08 -1.35 0.90 0.25 0.16 0.00 0.00 175.35 175.39 1hi9 n THR 242 N 6.70 1.61 -1.00 3.43 -2.24 -1.26 -1.52 114.28 120.01 1hi9 n THR 242 Ca 0.14 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 1hi9 n THR 242 Cb 0.48 -0.59 0.00 0.00 -2.10 0.00 0.00 70.33 68.12 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 1.67 0.51 2.94 3.38 0.00 -1.26 -5.01 105.19 107.42 1hi9 n GLY 243 Ca 0.14 0.00 -0.17 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 -1.36 2.61 -2.24 -0.57 -5.04 114.28 104.70 1hi9 n THR 244 Ca 0.00 -2.18 0.06 0.00 -2.27 0.00 0.00 64.05 59.65 1hi9 n THR 244 Cb 0.00 1.11 0.19 0.00 -2.10 0.00 0.00 70.33 69.53 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 -0.58 2.17 -3.93 4.28 -2.24 -1.26 -4.79 114.28 107.94 1hi9 n THR 245 Ca 0.07 -2.75 -0.36 0.00 -2.27 0.00 0.00 64.05 58.74 1hi9 n THR 245 Cb 0.55 -0.25 -0.07 0.00 -2.10 0.00 0.00 70.33 68.45 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 -3.09 5.24 -0.06 4.28 2.01 -1.26 -1.48 115.64 121.28 1hi9 s THR 246 Ca 0.38 0.11 0.06 0.00 0.31 0.00 0.00 61.69 62.55 1hi9 s THR 246 Cb 0.35 -3.31 -0.01 0.00 0.01 0.00 0.00 72.50 69.54 1hi9 s THR 246 CO -0.01 0.56 -0.25 -0.69 -0.69 0.00 0.00 174.62 173.54 1hi9 s VAL 247 N -0.56 2.10 0.14 3.82 1.01 0.02 -1.63 120.40 125.29 1hi9 s VAL 247 Ca 0.12 -1.05 0.09 0.00 0.00 0.00 0.00 61.98 61.13 1hi9 s VAL 247 Cb -0.12 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.46 1hi9 s VAL 247 CO 0.02 0.57 -0.13 -1.10 0.00 0.00 0.00 175.10 174.46 1hi9 s GLN 248 N -0.16 1.97 -0.12 2.72 -0.21 0.21 -1.29 119.66 122.78 1hi9 s GLN 248 Ca -0.04 -1.18 -0.04 0.00 0.02 0.00 0.00 55.36 54.12 1hi9 s GLN 248 Cb -0.14 -2.17 0.06 0.00 1.00 0.00 0.00 33.01 31.76 1hi9 s GLN 248 CO 0.04 0.47 0.22 0.12 -2.12 0.00 0.00 175.29 174.02 1hi9 s PHE 249 N -1.39 -0.33 -0.36 0.91 5.36 0.13 -2.17 117.98 120.13 1hi9 s PHE 249 Ca 0.22 0.77 -0.27 0.00 -0.96 0.00 0.00 56.93 56.69 1hi9 s PHE 249 Cb -0.10 -0.15 0.02 0.00 -0.34 0.00 0.00 43.02 42.45 1hi9 s PHE 249 CO 0.13 -0.36 0.97 -1.14 -1.46 0.00 0.00 175.22 173.36 1hi9 s GLN 250 N 2.37 3.90 0.29 10.12 2.00 -1.26 -1.06 119.66 136.02 1hi9 s GLN 250 Ca 0.03 0.70 0.04 0.00 -2.00 0.00 0.00 55.36 54.13 1hi9 s GLN 250 Cb -0.12 -3.79 -0.02 0.00 0.80 0.00 0.00 33.01 29.87 1hi9 s GLN 250 CO -0.08 -0.95 0.43 0.00 -0.50 0.00 0.00 175.29 174.19 1hi9 s ALA 251 N 3.55 3.96 0.10 1.58 0.00 -0.55 -5.00 121.76 125.39 1hi9 s ALA 251 Ca 0.40 -1.23 0.06 0.00 0.00 0.00 0.00 51.96 51.20 1hi9 s ALA 251 Cb -0.12 -1.80 -0.22 0.00 0.00 0.00 0.00 23.12 20.99 1hi9 s ALA 251 CO 0.18 0.10 1.20 0.87 0.00 0.00 0.00 175.76 178.12 1hi9 h LYS 252 N 1.00 0.03 -2.89 0.00 1.57 -1.88 -3.35 116.57 111.04 1hi9 h LYS 252 Ca -0.50 -0.05 0.05 0.00 -1.87 0.00 0.00 60.65 58.28 1hi9 h LYS 252 Cb 1.24 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 33.54 1hi9 h LYS 252 CO 0.59 0.97 0.31 0.16 -0.57 0.00 0.00 179.45 180.91 1hi9 s ASP 253 N -6.69 -0.10 0.35 0.86 -4.77 -1.25 -4.33 116.67 100.74 1hi9 s ASP 253 Ca -0.00 -0.86 0.03 0.00 -3.30 0.00 0.00 52.55 48.42 1hi9 s ASP 253 Cb 0.10 0.75 0.65 0.00 -1.09 0.00 0.00 42.92 43.33 1hi9 s ASP 253 CO 0.83 -1.44 1.97 -0.03 0.70 0.00 0.00 175.17 177.19 1hi9 h MET 254 N 2.00 0.69 -0.72 2.11 1.85 -1.80 -1.52 114.93 117.55 1hi9 h MET 254 Ca -0.27 -0.07 -0.04 0.00 -0.61 0.00 0.00 59.70 58.71 1hi9 h MET 254 Cb 1.24 -0.14 -0.03 0.00 0.43 0.00 0.00 31.60 33.10 1hi9 h MET 254 CO 0.33 0.53 0.29 -0.07 -0.40 0.00 0.00 176.91 177.59 1hi9 h LEU 255 N 0.70 0.99 -0.75 3.39 3.38 -1.96 0.08 115.31 121.14 1hi9 h LEU 255 Ca 0.18 -0.17 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 1hi9 h LEU 255 Cb 0.05 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1hi9 h LEU 255 CO -0.03 0.88 -0.49 -0.08 0.09 0.00 0.00 178.44 178.82 1hi9 h GLU 256 N 1.02 0.32 -0.56 1.13 4.81 -1.85 -2.49 114.58 116.97 1hi9 h GLU 256 Ca 0.24 -0.18 -0.08 0.00 -0.13 0.00 0.00 59.36 59.21 1hi9 h GLU 256 Cb 0.20 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 1hi9 h GLU 256 CO -0.02 0.75 0.03 0.00 -0.73 0.00 0.00 179.01 179.04 1hi9 h ALA 257 N 1.22 1.00 -0.09 2.92 0.00 -0.77 -0.74 119.26 122.80 1hi9 h ALA 257 Ca 0.01 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 1hi9 h ALA 257 Cb 0.96 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 1hi9 h ALA 257 CO 0.08 0.62 0.00 -0.92 0.00 0.00 0.00 179.25 179.03 1hi9 h TYR 258 N 0.87 0.17 -0.18 0.00 3.20 -0.76 -2.06 116.97 118.20 1hi9 h TYR 258 Ca 0.17 -0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.96 1hi9 h TYR 258 Cb 0.47 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.68 1hi9 h TYR 258 CO 0.03 0.40 -0.12 1.96 -1.64 0.00 0.00 178.16 178.79 1hi9 h GLN 259 N -0.12 0.29 -0.28 1.82 4.20 -1.33 -0.58 115.11 119.11 1hi9 h GLN 259 Ca 0.03 -0.07 -0.07 0.00 0.06 0.00 0.00 58.65 58.60 1hi9 h GLN 259 Cb 0.33 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.06 1hi9 h GLN 259 CO 0.00 0.43 -0.12 0.00 -0.67 0.00 0.00 178.83 178.47 1hi9 h ALA 260 N 1.60 1.27 -0.52 3.87 0.00 -0.95 -1.36 119.26 123.19 1hi9 h ALA 260 Ca 0.06 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 1hi9 h ALA 260 Cb 0.39 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1hi9 h ALA 260 CO 0.02 0.48 0.05 1.98 0.00 0.00 0.00 179.25 181.78 1hi9 h MET 261 N 0.44 0.88 -0.18 0.00 1.85 -0.42 -0.28 114.93 117.22 1hi9 h MET 261 Ca 0.08 -0.25 0.00 0.00 -0.61 0.00 0.00 59.70 58.92 1hi9 h MET 261 Cb 0.48 -0.09 -0.01 0.00 0.43 0.00 0.00 31.60 32.41 1hi9 h MET 261 CO 0.03 0.88 0.11 -0.07 -0.40 0.00 0.00 176.91 177.46 1hi9 h LEU 262 N 0.75 0.21 -0.13 3.39 3.38 -0.51 -1.31 115.31 121.09 1hi9 h LEU 262 Ca 0.15 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 1hi9 h LEU 262 Cb 0.45 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 1hi9 h LEU 262 CO 0.02 0.17 -0.03 0.58 0.09 0.00 0.00 178.44 179.27 1hi9 h VAL 263 N 0.22 1.29 -0.74 1.22 2.07 -1.20 -1.05 116.25 118.07 1hi9 h VAL 263 Ca 0.06 -0.97 0.01 0.00 0.82 0.00 0.00 66.70 66.62 1hi9 h VAL 263 Cb -0.00 1.67 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 1hi9 h VAL 263 CO -0.01 0.28 0.49 0.24 0.02 0.00 0.00 177.57 178.58 1hi9 h MET 264 N -0.06 0.96 -0.15 1.57 2.86 -1.02 0.23 114.93 119.31 1hi9 h MET 264 Ca 0.03 -0.06 -0.17 0.00 -2.06 0.00 0.00 59.70 57.45 1hi9 h MET 264 Cb 0.45 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.89 1hi9 h MET 264 CO 0.01 0.63 -0.60 1.79 1.06 0.00 0.00 176.91 179.80 1hi9 h THR 265 N 0.99 1.33 -0.65 2.22 1.35 -1.26 -1.33 112.91 115.56 1hi9 h THR 265 Ca 0.28 -1.89 0.00 0.00 -0.55 0.00 0.00 66.41 64.25 1hi9 h THR 265 Cb -0.09 1.87 -0.03 0.00 -1.73 0.00 0.00 68.15 68.16 1hi9 h THR 265 CO -0.07 0.58 0.41 -0.08 -0.25 0.00 0.00 175.52 176.11 1hi9 h GLU 266 N 0.38 0.87 -0.39 4.72 4.57 -0.65 -0.56 114.58 123.52 1hi9 h GLU 266 Ca -0.00 -0.07 -0.05 0.00 -1.18 0.00 0.00 59.36 58.06 1hi9 h GLU 266 Cb 1.15 -0.19 -0.02 0.00 -0.16 0.00 0.00 28.75 29.54 1hi9 h GLU 266 CO 0.11 0.60 0.06 -0.07 -1.18 0.00 0.00 179.01 178.54 1hi9 h LEU 267 N 0.88 0.62 -1.87 1.64 3.38 -0.80 -2.75 115.31 116.41 1hi9 h LEU 267 Ca 0.24 -0.26 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1hi9 h LEU 267 Cb -0.06 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.52 1hi9 h LEU 267 CO -0.05 0.72 0.03 0.00 0.09 0.00 0.00 178.44 179.24 1hi9 h ALA 268 N 0.92 1.90 0.00 1.53 0.00 -0.81 -2.08 119.26 120.73 1hi9 h ALA 268 Ca 0.12 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1hi9 h ALA 268 Cb 0.37 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1hi9 h ALA 268 CO 0.01 0.08 -0.01 0.52 0.00 0.00 0.00 179.25 179.85 1hi9 h MET 269 N 0.11 0.00 0.00 0.00 2.86 -0.79 -2.06 114.93 115.06 1hi9 h MET 269 Ca 0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1hi9 h MET 269 Cb 0.03 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.69 1hi9 h MET 269 CO -0.00 0.01 0.00 0.54 1.06 0.00 0.00 176.91 178.52 1hi9 n ARG 270 N -3.76 0.17 -1.66 1.72 5.12 -0.78 -4.89 116.66 112.58 1hi9 n ARG 270 Ca -0.03 0.20 -0.47 0.00 -1.93 0.00 0.00 57.85 55.62 1hi9 n ARG 270 Cb 0.09 -1.72 -0.04 0.00 -1.16 0.00 0.00 32.46 29.63 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 -2.01 0.00 -3.15 0.55 -1.04 -0.78 -5.00 114.28 102.85 1hi9 n THR 271 Ca 0.05 -0.00 -0.18 0.00 -2.04 0.00 0.00 64.05 61.88 1hi9 n THR 271 Cb 0.35 -1.42 0.00 0.00 -1.82 0.00 0.00 70.33 67.45 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 0.83 5.48 -1.03 8.00 1.04 -1.26 -4.71 113.70 122.06 1hi9 s SER 272 Ca 0.80 -0.53 -0.03 0.00 0.48 0.00 0.00 55.95 56.66 1hi9 s SER 272 Cb -0.73 -0.57 -0.04 0.00 0.10 0.00 0.00 66.02 64.78 1hi9 s SER 272 CO 0.39 -0.77 0.88 0.33 0.98 0.00 0.00 173.24 175.05 1hi9 n PHE 273 N -1.80 -2.19 -1.02 5.02 7.35 -1.26 -5.03 117.46 118.52 1hi9 n PHE 273 Ca 0.07 0.83 0.00 0.00 -0.76 0.00 0.00 57.45 57.59 1hi9 n PHE 273 Cb 0.60 -4.34 0.00 0.00 0.35 0.00 0.00 39.48 36.09 1hi9 n PHE 273 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00