#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hf9 s ILE 3 N 0.00 3.01 0.02 12.58 -1.09 -0.14 -2.68 121.20 132.90 3hf9 s ILE 3 Ca 0.00 -1.12 0.03 0.00 -2.23 0.00 0.00 60.65 57.33 3hf9 s ILE 3 Cb 0.00 -2.29 -0.02 0.00 -1.58 0.00 0.00 42.46 38.57 3hf9 s ILE 3 CO 0.00 0.32 -0.09 -0.69 -1.23 0.00 0.00 174.94 173.25 3hf9 s VAL 4 N -0.97 0.69 -0.11 2.92 1.01 0.26 -1.84 120.40 122.37 3hf9 s VAL 4 Ca 0.16 -0.72 -0.09 0.00 0.00 0.00 0.00 61.98 61.33 3hf9 s VAL 4 Cb -0.11 -0.65 0.03 0.00 0.00 0.00 0.00 36.38 35.66 3hf9 s VAL 4 CO 0.06 -0.05 0.28 0.00 0.00 0.00 0.00 175.10 175.39 3hf9 s ALA 5 N -0.71 -0.68 0.01 5.51 0.00 -0.55 -0.93 121.76 124.42 3hf9 s ALA 5 Ca -0.01 0.87 -0.08 0.00 0.00 0.00 0.00 51.96 52.74 3hf9 s ALA 5 Cb -0.06 -0.52 0.00 0.00 0.00 0.00 0.00 23.12 22.54 3hf9 s ALA 5 CO 0.00 -0.15 0.15 -0.48 0.00 0.00 0.00 175.76 175.28 3hf9 s LEU 6 N 0.47 1.51 0.14 0.00 0.05 -0.02 -1.57 118.68 119.25 3hf9 s LEU 6 Ca -0.03 -0.23 -0.18 0.00 0.05 0.00 0.00 54.13 53.74 3hf9 s LEU 6 Cb -0.04 0.74 -0.07 0.00 -2.05 0.00 0.00 46.19 44.77 3hf9 s LEU 6 CO -0.02 -0.41 0.61 -0.54 -0.55 0.00 0.00 176.35 175.44 3hf9 s LYS 7 N -1.60 4.15 0.10 1.48 1.02 0.46 -1.12 119.74 124.24 3hf9 s LYS 7 Ca -0.13 0.70 0.03 0.00 0.02 0.00 0.00 55.97 56.59 3hf9 s LYS 7 Cb -0.06 -3.05 -0.04 0.00 -0.52 0.00 0.00 37.83 34.15 3hf9 s LYS 7 CO 0.01 0.53 -0.08 1.52 -0.92 0.00 0.00 175.35 176.41 3hf9 s TYR 8 N -1.33 0.97 -0.24 3.18 -0.85 -0.51 -4.94 117.35 113.64 3hf9 s TYR 8 Ca 0.35 -0.80 -0.30 0.00 -0.52 0.00 0.00 57.07 55.81 3hf9 s TYR 8 Cb -0.17 -0.54 -0.06 0.00 0.38 0.00 0.00 41.96 41.56 3hf9 s TYR 8 CO 0.20 -0.07 2.21 -2.30 -1.52 0.00 0.00 175.55 174.07 3hf9 n PRO 9 N 0.19 1.81 0.00 -3.49 -0.02 -1.26 -1.11 135.00 131.12 3hf9 n PRO 9 Ca -0.14 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 3hf9 n PRO 9 Cb 0.60 -3.09 0.00 0.00 -0.02 0.00 0.00 33.50 30.99 3hf9 n PRO 9 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hf9 n GLY 10 N 5.89 0.44 0.04 -1.23 0.00 0.49 -4.72 105.19 106.10 3hf9 n GLY 10 Ca 0.32 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.34 3hf9 n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hf9 n GLY 11 N -1.57 1.12 3.18 -0.02 0.00 -0.26 -3.99 105.19 103.65 3hf9 n GLY 11 Ca 0.00 -0.90 -0.15 0.00 0.00 0.00 0.00 46.02 44.97 3hf9 n GLY 11 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hf9 s VAL 12 N -2.46 1.02 -0.00 1.61 -7.23 -0.21 -1.43 120.40 111.70 3hf9 s VAL 12 Ca 0.00 -1.60 0.06 0.00 -1.81 0.00 0.00 61.98 58.64 3hf9 s VAL 12 Cb -0.00 -1.33 -0.02 0.00 0.56 0.00 0.00 36.38 35.59 3hf9 s VAL 12 CO 0.00 -0.49 -0.20 0.54 -0.31 0.00 0.00 175.10 174.64 3hf9 s VAL 13 N -2.22 1.59 -0.03 1.32 0.11 -0.27 -0.62 120.40 120.28 3hf9 s VAL 13 Ca 0.05 -0.93 0.02 0.00 -2.93 0.00 0.00 61.98 58.19 3hf9 s VAL 13 Cb -0.04 -1.34 0.00 0.00 -1.53 0.00 0.00 36.38 33.47 3hf9 s VAL 13 CO 0.01 0.39 -0.08 -0.32 -3.33 0.00 0.00 175.10 171.76 3hf9 s MET 14 N -0.64 0.90 0.03 1.54 1.75 -0.49 -0.84 119.30 121.55 3hf9 s MET 14 Ca 0.08 -0.27 0.01 0.00 -1.25 0.00 0.00 55.69 54.25 3hf9 s MET 14 Cb -0.08 -0.85 -0.02 0.00 2.84 0.00 0.00 34.83 36.72 3hf9 s MET 14 CO -0.00 0.09 -0.04 0.00 -0.65 0.00 0.00 175.02 174.42 3hf9 s ALA 15 N 0.24 0.27 -0.14 4.11 0.00 -0.11 -0.14 121.76 125.99 3hf9 s ALA 15 Ca -0.04 -0.66 -0.12 0.00 0.00 0.00 0.00 51.96 51.15 3hf9 s ALA 15 Cb -0.09 0.12 0.04 0.00 0.00 0.00 0.00 23.12 23.19 3hf9 s ALA 15 CO 0.00 -0.12 0.37 0.20 0.00 0.00 0.00 175.76 176.22 3hf9 s GLY 16 N -1.52 -0.28 1.35 0.00 0.00 -0.59 -0.58 107.32 105.71 3hf9 s GLY 16 Ca -0.14 1.14 -0.20 0.00 0.00 0.00 0.00 44.72 45.52 3hf9 s GLY 16 CO -0.01 1.08 0.96 0.51 0.00 0.00 0.00 173.10 175.64 3hf9 s ASP 17 N 0.49 -0.52 0.00 1.64 3.84 -1.09 -1.98 116.67 119.05 3hf9 s ASP 17 Ca -0.02 1.02 0.05 0.00 -0.00 0.00 0.00 52.55 53.60 3hf9 s ASP 17 Cb -0.04 -1.49 0.03 0.00 -1.38 0.00 0.00 42.92 40.03 3hf9 s ASP 17 CO -0.03 -5.05 0.60 0.54 -0.00 0.00 0.00 175.17 171.23 3hf9 n ARG 18 N -5.44 0.66 -2.07 2.11 5.12 -1.26 -4.55 116.66 111.22 3hf9 n ARG 18 Ca 0.10 -0.69 -0.31 0.00 -1.93 0.00 0.00 57.85 55.01 3hf9 n ARG 18 Cb 0.58 -1.04 -0.01 0.00 -1.16 0.00 0.00 32.46 30.83 3hf9 n ARG 18 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 3hf9 s ARG 19 N -0.61 3.73 -0.14 5.56 6.06 -1.26 -1.30 118.95 130.99 3hf9 s ARG 19 Ca 0.06 0.83 -0.12 0.00 -2.50 0.00 0.00 55.73 54.00 3hf9 s ARG 19 Cb 0.04 -2.10 0.04 0.00 0.06 0.00 0.00 34.95 32.99 3hf9 s ARG 19 CO 0.09 -0.46 0.36 -1.54 -2.50 0.00 0.00 175.30 171.25 3hf9 s SER 20 N -3.75 -0.39 0.17 -2.12 1.04 -0.77 -4.84 113.70 103.05 3hf9 s SER 20 Ca 0.57 0.74 0.11 0.00 0.48 0.00 0.00 55.95 57.84 3hf9 s SER 20 Cb -0.11 0.72 -0.04 0.00 0.10 0.00 0.00 66.02 66.69 3hf9 s SER 20 CO 0.45 -0.14 -0.25 0.42 0.98 0.00 0.00 173.24 174.71 3hf9 s THR 21 N 0.40 2.35 -0.65 2.02 -4.23 -1.26 -0.97 115.64 113.30 3hf9 s THR 21 Ca -0.02 -1.95 0.03 0.00 -1.18 0.00 0.00 61.69 58.58 3hf9 s THR 21 Cb -0.04 -2.10 0.16 0.00 1.34 0.00 0.00 72.50 71.86 3hf9 s THR 21 CO -0.02 -0.06 0.44 -1.58 -0.54 0.00 0.00 174.62 172.87 3hf9 s GLN 22 N -2.50 2.41 7.87 3.99 0.74 -0.18 -4.86 119.66 127.13 3hf9 s GLN 22 Ca 0.19 -2.99 0.00 0.00 0.05 0.00 0.00 55.36 52.61 3hf9 s GLN 22 Cb -0.09 -3.49 0.00 0.00 1.10 0.00 0.00 33.01 30.54 3hf9 s GLN 22 CO 0.09 -1.21 0.00 0.41 -0.55 0.00 0.00 175.29 174.03 3hf9 n GLY 23 N 2.59 2.37 0.09 2.59 0.00 -1.26 -2.78 105.19 108.79 3hf9 n GLY 23 Ca 0.13 -0.40 -0.02 0.00 0.00 0.00 0.00 46.02 45.73 3hf9 n GLY 23 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3hf9 h ASN 24 N 0.00 0.00 -3.51 1.61 2.35 -2.02 -3.47 115.58 110.54 3hf9 h ASN 24 Ca 0.00 0.00 -0.52 0.00 -0.55 0.00 0.00 56.30 55.23 3hf9 h ASN 24 Cb 0.00 0.00 0.04 0.00 0.05 0.00 0.00 38.32 38.41 3hf9 h ASN 24 CO 0.00 0.68 0.65 -0.04 -1.65 0.00 0.00 177.43 177.06 3hf9 s MET 25 N -2.85 4.39 -0.26 0.81 -1.94 -1.12 -4.98 119.30 113.35 3hf9 s MET 25 Ca -0.03 2.09 -0.28 0.00 -1.71 0.00 0.00 55.69 55.76 3hf9 s MET 25 Cb 0.08 -3.16 0.01 0.00 2.01 0.00 0.00 34.83 33.77 3hf9 s MET 25 CO 0.81 -0.22 1.03 0.42 -0.01 0.00 0.00 175.02 177.05 3hf9 s ILE 26 N -0.22 4.64 -0.64 2.53 1.01 -1.26 -1.01 121.20 126.24 3hf9 s ILE 26 Ca 0.55 1.86 0.15 0.00 0.00 0.00 0.00 60.65 63.21 3hf9 s ILE 26 Cb -0.37 -4.33 -0.17 0.00 0.01 0.00 0.00 42.46 37.60 3hf9 s ILE 26 CO 0.42 -0.28 0.61 -1.54 0.00 0.00 0.00 174.94 174.14 3hf9 n SER 27 N 6.48 0.78 -3.66 3.58 3.41 -0.14 -4.92 113.62 119.15 3hf9 n SER 27 Ca 0.11 -0.77 -0.14 0.00 -0.26 0.00 0.00 58.87 57.81 3hf9 n SER 27 Cb 0.47 1.07 -0.08 0.00 -0.26 0.00 0.00 64.21 65.40 3hf9 n SER 27 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3hf9 s GLY 28 N -2.54 -0.43 0.00 5.00 0.00 -0.85 -4.93 107.32 103.56 3hf9 s GLY 28 Ca 0.05 1.47 0.00 0.00 0.00 0.00 0.00 44.72 46.23 3hf9 s GLY 28 CO 0.62 1.23 0.18 0.54 0.00 0.00 0.00 173.10 175.67 3hf9 n ARG 29 N 2.39 3.11 0.00 2.90 1.74 -1.25 -1.85 116.66 123.69 3hf9 n ARG 29 Ca -0.15 -0.18 0.04 0.00 -0.77 0.00 0.00 57.85 56.79 3hf9 n ARG 29 Cb 0.56 -0.64 0.02 0.00 -1.02 0.00 0.00 32.46 31.38 3hf9 n ARG 29 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 3hf9 n ASP 30 N -0.50 1.41 -4.68 0.55 5.68 -1.15 -4.57 116.55 113.30 3hf9 n ASP 30 Ca 0.00 -1.21 -0.42 0.00 -0.50 0.00 0.00 54.79 52.66 3hf9 n ASP 30 Cb 0.01 0.21 -0.03 0.00 -1.14 0.00 0.00 41.12 40.18 3hf9 n ASP 30 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 3hf9 s VAL 31 N -0.92 2.75 -0.22 2.12 1.01 -0.42 -4.98 120.40 119.75 3hf9 s VAL 31 Ca 0.08 0.06 -0.18 0.00 0.00 0.00 0.00 61.98 61.94 3hf9 s VAL 31 Cb 0.07 -3.04 -0.03 0.00 0.00 0.00 0.00 36.38 33.38 3hf9 s VAL 31 CO 0.15 -0.00 0.50 -0.13 0.00 0.00 0.00 175.10 175.62 3hf9 s ARG 32 N 3.44 4.15 -0.01 2.72 0.52 -1.26 -4.29 118.95 124.22 3hf9 s ARG 32 Ca 0.84 0.36 0.07 0.00 -0.52 0.00 0.00 55.73 56.48 3hf9 s ARG 32 Cb -0.44 -3.58 -0.10 0.00 0.52 0.00 0.00 34.95 31.34 3hf9 s ARG 32 CO 0.38 -0.19 0.21 1.63 0.02 0.00 0.00 175.30 177.35 3hf9 n LYS 33 N 4.96 1.81 -4.27 3.54 5.02 -1.26 -4.74 118.16 123.22 3hf9 n LYS 33 Ca -0.05 -0.04 -0.34 0.00 -2.02 0.00 0.00 58.31 55.86 3hf9 n LYS 33 Cb 0.50 -1.05 -0.12 0.00 -0.02 0.00 0.00 35.03 34.34 3hf9 n LYS 33 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3hf9 s VAL 34 N -2.21 3.91 0.09 -0.18 1.01 -1.26 -2.89 120.40 118.87 3hf9 s VAL 34 Ca -0.01 -0.34 0.04 0.00 0.00 0.00 0.00 61.98 61.66 3hf9 s VAL 34 Cb 0.05 -2.73 -0.04 0.00 0.00 0.00 0.00 36.38 33.66 3hf9 s VAL 34 CO 0.30 0.47 -0.10 -0.31 0.00 0.00 0.00 175.10 175.46 3hf9 s TYR 35 N 0.62 1.04 -0.51 5.22 1.51 -0.20 -4.98 117.35 120.04 3hf9 s TYR 35 Ca -0.02 -0.65 -0.20 0.00 -1.01 0.00 0.00 57.07 55.19 3hf9 s TYR 35 Cb -0.14 -0.57 0.05 0.00 -0.11 0.00 0.00 41.96 41.19 3hf9 s TYR 35 CO 0.02 -0.01 0.69 0.42 -1.11 0.00 0.00 175.55 175.56 3hf9 s ILE 36 N -2.39 4.77 0.20 2.71 1.01 -1.26 -0.65 121.20 125.59 3hf9 s ILE 36 Ca 0.04 -0.28 -0.07 0.00 0.00 0.00 0.00 60.65 60.35 3hf9 s ILE 36 Cb -0.03 -4.34 0.06 0.00 0.01 0.00 0.00 42.46 38.16 3hf9 s ILE 36 CO -0.00 -0.84 1.64 0.71 0.00 0.00 0.00 174.94 176.45 3hf9 h THR 37 N 5.89 1.26 -3.09 2.92 1.35 -1.55 -3.48 112.91 116.21 3hf9 h THR 37 Ca -0.27 -1.20 -0.10 0.00 -0.55 0.00 0.00 66.41 64.29 3hf9 h THR 37 Cb 1.09 0.92 -0.02 0.00 -1.73 0.00 0.00 68.15 68.41 3hf9 h THR 37 CO 0.98 0.43 0.08 -0.90 -0.25 0.00 0.00 175.52 175.85 3hf9 n ASP 38 N -4.16 -1.48 -0.33 5.36 5.75 -0.78 -4.45 116.55 116.46 3hf9 n ASP 38 Ca 0.02 -2.33 -0.01 0.00 -0.01 0.00 0.00 54.79 52.47 3hf9 n ASP 38 Cb 0.37 2.56 0.16 0.00 -1.03 0.00 0.00 41.12 43.18 3hf9 n ASP 38 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 3hf9 h ASP 39 N 1.53 1.05 -0.36 -1.12 3.32 -1.94 -3.00 116.42 115.90 3hf9 h ASP 39 Ca -0.24 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.79 3hf9 h ASP 39 Cb 0.94 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 40.23 3hf9 h ASP 39 CO 0.31 0.75 0.00 -1.22 -1.72 0.00 0.00 179.24 177.36 3hf9 n TYR 40 N -4.41 0.57 -3.96 4.55 4.02 -1.26 -0.81 117.16 115.86 3hf9 n TYR 40 Ca 0.11 -0.55 -0.09 0.00 -0.01 0.00 0.00 57.90 57.36 3hf9 n TYR 40 Cb 0.04 -0.07 -0.10 0.00 -0.02 0.00 0.00 39.34 39.19 3hf9 n TYR 40 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 3hf9 s THR 41 N -1.25 0.12 0.02 -0.72 -4.23 -1.13 -0.39 115.64 108.06 3hf9 s THR 41 Ca 0.27 -1.00 -0.06 0.00 -1.18 0.00 0.00 61.69 59.72 3hf9 s THR 41 Cb 0.16 -0.55 -0.01 0.00 1.34 0.00 0.00 72.50 73.45 3hf9 s THR 41 CO 0.16 -0.55 0.10 0.00 -0.54 0.00 0.00 174.62 173.79 3hf9 s ALA 42 N -1.92 -0.18 0.01 3.99 0.00 0.29 -1.37 121.76 122.58 3hf9 s ALA 42 Ca -0.11 -0.33 0.07 0.00 0.00 0.00 0.00 51.96 51.59 3hf9 s ALA 42 Cb -0.06 0.16 -0.02 0.00 0.00 0.00 0.00 23.12 23.20 3hf9 s ALA 42 CO -0.02 -0.24 -0.22 0.95 0.00 0.00 0.00 175.76 176.23 3hf9 s THR 43 N -1.80 1.78 -0.00 0.00 -4.23 0.17 -1.28 115.64 110.29 3hf9 s THR 43 Ca -0.12 -1.09 0.08 0.00 -1.18 0.00 0.00 61.69 59.38 3hf9 s THR 43 Cb -0.06 -1.51 -0.02 0.00 1.34 0.00 0.00 72.50 72.25 3hf9 s THR 43 CO -0.01 0.38 -0.24 -0.83 -0.54 0.00 0.00 174.62 173.38 3hf9 s GLY 44 N -0.84 1.21 -0.05 3.99 0.00 -0.66 -1.03 107.32 109.95 3hf9 s GLY 44 Ca 0.09 -1.08 0.03 0.00 0.00 0.00 0.00 44.72 43.76 3hf9 s GLY 44 CO 0.00 -0.93 -0.14 -0.42 0.00 0.00 0.00 173.10 171.62 3hf9 s ILE 45 N -0.63 1.23 -1.35 0.90 1.09 -1.14 -1.09 121.20 120.21 3hf9 s ILE 45 Ca 0.10 -0.57 -0.09 0.00 -1.10 0.00 0.00 60.65 58.98 3hf9 s ILE 45 Cb -0.09 -1.08 0.11 0.00 -1.06 0.00 0.00 42.46 40.33 3hf9 s ILE 45 CO -0.00 0.37 2.20 0.00 -0.10 0.00 0.00 174.94 177.41 3hf9 n ALA 46 N 3.44 6.10 -3.00 9.38 0.00 -1.26 -4.80 120.51 130.36 3hf9 n ALA 46 Ca -0.20 -4.11 0.00 0.00 0.00 0.00 0.00 53.44 49.13 3hf9 n ALA 46 Cb 0.53 -3.02 0.00 0.00 0.00 0.00 0.00 19.45 16.95 3hf9 n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hf9 n GLY 47 N 2.69 5.15 3.71 0.00 0.00 -1.26 -4.92 105.19 110.56 3hf9 n GLY 47 Ca 0.53 -1.34 -0.30 0.00 0.00 0.00 0.00 46.02 44.91 3hf9 n GLY 47 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hf9 s THR 48 N -0.67 2.73 0.22 2.61 -4.23 -1.26 -4.81 115.64 110.22 3hf9 s THR 48 Ca 0.00 0.24 -0.08 0.00 -1.18 0.00 0.00 61.69 60.67 3hf9 s THR 48 Cb 0.00 -2.64 0.16 0.00 1.34 0.00 0.00 72.50 71.36 3hf9 s THR 48 CO 0.00 -0.31 1.81 0.00 -0.54 0.00 0.00 174.62 175.58 3hf9 h ALA 49 N -1.54 0.96 -0.23 3.99 0.00 -1.96 -2.70 119.26 117.77 3hf9 h ALA 49 Ca -0.48 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.43 3hf9 h ALA 49 Cb 1.27 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 3hf9 h ALA 49 CO 0.52 0.06 0.05 0.00 0.00 0.00 0.00 179.25 179.88 3hf9 h ALA 50 N 1.38 0.31 -0.46 0.00 0.00 -1.93 -2.95 119.26 115.61 3hf9 h ALA 50 Ca 0.32 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.10 3hf9 h ALA 50 Cb 0.23 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 3hf9 h ALA 50 CO -0.20 -0.03 0.26 0.28 0.00 0.00 0.00 179.25 179.56 3hf9 h VAL 51 N 0.20 1.03 -0.56 0.00 2.07 -1.89 0.19 116.25 117.28 3hf9 h VAL 51 Ca 0.07 -0.18 0.05 0.00 0.82 0.00 0.00 66.70 67.46 3hf9 h VAL 51 Cb 0.29 0.46 -0.05 0.00 -1.52 0.00 0.00 31.29 30.47 3hf9 h VAL 51 CO 0.00 0.10 0.30 0.00 0.02 0.00 0.00 177.57 177.99 3hf9 h ALA 52 N 1.22 0.73 0.14 1.67 0.00 -1.48 -2.07 119.26 119.46 3hf9 h ALA 52 Ca 0.19 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 3hf9 h ALA 52 Cb 0.04 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3hf9 h ALA 52 CO -0.10 -0.03 -0.07 0.28 0.00 0.00 0.00 179.25 179.33 3hf9 h VAL 53 N 0.58 0.89 -0.34 0.00 2.07 -1.29 -2.61 116.25 115.54 3hf9 h VAL 53 Ca 0.25 -1.20 0.07 0.00 0.82 0.00 0.00 66.70 66.64 3hf9 h VAL 53 Cb 0.14 1.51 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 3hf9 h VAL 53 CO -0.16 0.24 0.24 -0.33 0.02 0.00 0.00 177.57 177.57 3hf9 h GLU 54 N -0.86 0.14 0.03 1.57 4.39 -0.61 0.63 114.58 119.86 3hf9 h GLU 54 Ca -0.02 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.67 3hf9 h GLU 54 Cb 0.53 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 3hf9 h GLU 54 CO 0.03 0.09 -0.01 0.35 -1.16 0.00 0.00 179.01 178.31 3hf9 h PHE 55 N 0.15 -0.04 -0.72 4.33 3.04 -1.46 -2.53 116.94 119.72 3hf9 h PHE 55 Ca 0.15 -0.00 0.09 0.00 3.98 0.00 0.00 57.97 62.20 3hf9 h PHE 55 Cb 0.43 0.01 -0.07 0.00 2.56 0.00 0.00 35.95 38.88 3hf9 h PHE 55 CO -0.00 0.67 0.36 0.00 -2.02 0.00 0.00 178.31 177.32 3hf9 h ALA 56 N 0.02 0.99 -0.14 2.41 0.00 -0.87 -1.56 119.26 120.11 3hf9 h ALA 56 Ca -0.00 0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.99 3hf9 h ALA 56 Cb 0.72 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 3hf9 h ALA 56 CO 0.01 -0.04 -0.07 -0.09 0.00 0.00 0.00 179.25 179.06 3hf9 h ARG 57 N 0.61 -0.06 -0.41 0.00 2.43 0.18 0.13 114.38 117.27 3hf9 h ARG 57 Ca 0.35 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.55 3hf9 h ARG 57 Cb 0.37 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.90 3hf9 h ARG 57 CO -0.27 -0.04 0.23 1.25 -1.51 0.00 0.00 179.97 179.63 3hf9 h LEU 58 N -0.06 0.36 -0.17 3.80 5.85 -1.06 -1.49 115.31 122.54 3hf9 h LEU 58 Ca 0.08 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 3hf9 h LEU 58 Cb 0.18 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 3hf9 h LEU 58 CO -0.18 0.26 0.07 0.22 -0.34 0.00 0.00 178.44 178.48 3hf9 h TYR 59 N 0.46 0.26 -0.76 1.25 3.20 -0.82 -1.58 116.97 118.98 3hf9 h TYR 59 Ca 0.16 -0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.05 3hf9 h TYR 59 Cb 0.03 -0.08 -0.05 0.00 1.54 0.00 0.00 36.73 38.17 3hf9 h TYR 59 CO -0.08 0.31 0.48 0.00 -1.64 0.00 0.00 178.16 177.22 3hf9 h ALA 60 N 0.92 1.00 -0.67 1.82 0.00 -0.53 -0.16 119.26 121.63 3hf9 h ALA 60 Ca 0.06 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.97 3hf9 h ALA 60 Cb 0.16 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 3hf9 h ALA 60 CO -0.01 0.27 0.42 0.28 0.00 0.00 0.00 179.25 180.21 3hf9 h VAL 61 N 0.93 1.08 -0.20 0.00 2.07 -1.03 -1.16 116.25 117.94 3hf9 h VAL 61 Ca 0.31 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.54 3hf9 h VAL 61 Cb 0.03 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 29.98 3hf9 h VAL 61 CO -0.12 0.15 0.12 -0.33 0.02 0.00 0.00 177.57 177.41 3hf9 h GLU 62 N 0.82 0.27 -0.86 1.57 5.08 -0.07 0.31 114.58 121.70 3hf9 h GLU 62 Ca 0.27 -0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.63 3hf9 h GLU 62 Cb 0.03 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.17 3hf9 h GLU 62 CO -0.11 0.23 0.56 -0.07 -1.00 0.00 0.00 179.01 178.62 3hf9 h LEU 63 N 0.24 0.93 0.01 1.33 3.38 -0.97 -1.54 115.31 118.70 3hf9 h LEU 63 Ca 0.07 -0.01 -0.19 0.00 0.09 0.00 0.00 57.88 57.84 3hf9 h LEU 63 Cb 0.03 -0.22 0.02 0.00 0.09 0.00 0.00 40.66 40.58 3hf9 h LEU 63 CO -0.01 0.65 -0.74 -0.08 0.09 0.00 0.00 178.44 178.35 3hf9 h GLU 64 N 1.10 0.47 -0.56 1.13 4.81 -0.99 -2.99 114.58 117.55 3hf9 h GLU 64 Ca 0.34 -0.53 0.11 0.00 -0.13 0.00 0.00 59.36 59.15 3hf9 h GLU 64 Cb -0.03 0.16 -0.11 0.00 0.63 0.00 0.00 28.75 29.40 3hf9 h GLU 64 CO -0.10 1.17 -0.16 1.25 -0.73 0.00 0.00 179.01 180.44 3hf9 h HIS 65 N -0.00 -0.34 -0.86 0.92 2.76 -0.18 0.22 115.15 117.66 3hf9 h HIS 65 Ca -0.10 0.05 -0.02 0.00 -2.20 0.00 0.00 60.37 58.11 3hf9 h HIS 65 Cb 1.44 0.24 -0.04 0.00 1.55 0.00 0.00 27.41 30.60 3hf9 h HIS 65 CO 0.14 -0.26 0.47 -0.92 -1.30 0.00 0.00 177.93 176.06 3hf9 h TYR 66 N -0.02 1.19 -0.67 5.26 3.20 -1.32 -1.97 116.97 122.64 3hf9 h TYR 66 Ca 0.27 -0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.09 3hf9 h TYR 66 Cb 0.43 -0.38 -0.03 0.00 1.54 0.00 0.00 36.73 38.29 3hf9 h TYR 66 CO -0.48 0.83 0.36 1.49 -1.64 0.00 0.00 178.16 178.71 3hf9 h GLU 67 N 1.21 0.94 -0.42 1.82 4.81 -0.98 -1.15 114.58 120.82 3hf9 h GLU 67 Ca 0.30 -0.12 -0.10 0.00 -0.13 0.00 0.00 59.36 59.32 3hf9 h GLU 67 Cb 0.03 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.21 3hf9 h GLU 67 CO -0.05 0.72 -0.13 0.87 -0.73 0.00 0.00 179.01 179.69 3hf9 h LYS 68 N 0.92 0.77 -0.20 1.92 1.57 -0.74 0.11 116.57 120.92 3hf9 h LYS 68 Ca 0.24 -0.26 -0.19 0.00 -1.87 0.00 0.00 60.65 58.57 3hf9 h LYS 68 Cb 0.06 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 3hf9 h LYS 68 CO -0.04 0.86 -0.62 -0.07 -0.57 0.00 0.00 179.45 179.01 3hf9 h LEU 69 N 0.69 0.78 -0.76 2.94 3.38 -1.09 -3.36 115.31 117.89 3hf9 h LEU 69 Ca 0.11 -0.45 0.00 0.00 0.09 0.00 0.00 57.88 57.64 3hf9 h LEU 69 Cb 0.61 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.13 3hf9 h LEU 69 CO 0.04 1.21 -0.22 -0.62 0.09 0.00 0.00 178.44 178.94 3hf9 n GLU 70 N -3.95 2.04 0.00 1.13 -0.58 -0.46 -5.00 120.64 113.83 3hf9 n GLU 70 Ca -0.05 -0.62 0.00 0.00 -0.42 0.00 0.00 57.16 56.07 3hf9 n GLU 70 Cb 0.66 -1.10 0.00 0.00 -0.57 0.00 0.00 31.44 30.42 3hf9 n GLU 70 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3hf9 n GLY 71 N 0.92 3.05 3.24 0.62 0.00 0.37 -4.98 105.19 108.41 3hf9 n GLY 71 Ca 0.04 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.93 3hf9 n GLY 71 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hf9 s VAL 72 N -1.60 1.08 0.59 1.61 -7.23 -1.24 -4.96 120.40 108.65 3hf9 s VAL 72 Ca 0.00 -2.04 -0.15 0.00 -1.81 0.00 0.00 61.98 57.98 3hf9 s VAL 72 Cb 0.00 -1.87 -0.04 0.00 0.56 0.00 0.00 36.38 35.03 3hf9 s VAL 72 CO 0.00 -0.72 1.04 -2.84 -0.31 0.00 0.00 175.10 172.26 3hf9 s PRO 73 N -3.77 3.44 0.72 4.82 0.02 -1.26 -4.07 135.00 134.89 3hf9 s PRO 73 Ca 0.17 1.05 -0.16 0.00 0.02 0.00 0.00 61.00 62.09 3hf9 s PRO 73 Cb 0.03 -2.06 0.03 0.00 0.02 0.00 0.00 34.50 32.53 3hf9 s PRO 73 CO 0.00 -0.70 1.25 -0.51 -0.33 0.00 0.00 177.00 176.71 3hf9 s LEU 74 N -4.64 3.38 0.88 -5.54 1.43 -1.26 -5.01 118.68 107.92 3hf9 s LEU 74 Ca 0.61 2.49 -0.11 0.00 -1.03 0.00 0.00 54.13 56.08 3hf9 s LEU 74 Cb -0.14 -4.60 0.12 0.00 0.03 0.00 0.00 46.19 41.60 3hf9 s LEU 74 CO 0.40 -2.29 1.09 0.42 0.23 0.00 0.00 176.35 176.21 3hf9 s THR 75 N -1.76 2.71 0.22 5.49 -4.23 -1.26 -4.72 115.64 112.10 3hf9 s THR 75 Ca 0.78 0.23 -0.08 0.00 -1.18 0.00 0.00 61.69 61.44 3hf9 s THR 75 Cb -0.33 -2.62 0.17 0.00 1.34 0.00 0.00 72.50 71.06 3hf9 s THR 75 CO 0.44 -0.30 1.82 0.15 -0.54 0.00 0.00 174.62 176.19 3hf9 h PHE 76 N -1.56 0.77 -0.93 3.99 3.57 -1.96 0.26 116.94 121.08 3hf9 h PHE 76 Ca -0.48 0.03 0.19 0.00 3.53 0.00 0.00 57.97 61.23 3hf9 h PHE 76 Cb 1.27 -0.24 -0.11 0.00 2.79 0.00 0.00 35.95 39.66 3hf9 h PHE 76 CO 0.47 0.37 0.50 0.00 -2.23 0.00 0.00 178.31 177.42 3hf9 h ALA 77 N 1.37 1.50 -0.33 2.41 0.00 -1.99 -0.99 119.26 121.22 3hf9 h ALA 77 Ca 0.33 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.30 3hf9 h ALA 77 Cb 0.20 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3hf9 h ALA 77 CO -0.19 -0.14 0.05 0.78 0.00 0.00 0.00 179.25 179.75 3hf9 h GLY 78 N 0.62 0.60 0.62 0.00 0.00 -0.88 0.07 103.07 104.10 3hf9 h GLY 78 Ca 0.54 -0.40 0.07 0.00 0.00 0.00 0.00 47.33 47.54 3hf9 h GLY 78 CO -0.41 0.37 0.41 0.50 0.00 0.00 0.00 176.54 177.41 3hf9 h LYS 79 N 0.38 0.71 -0.44 4.80 1.57 -0.16 -1.22 116.57 122.22 3hf9 h LYS 79 Ca 0.10 -0.04 -0.10 0.00 -1.87 0.00 0.00 60.65 58.74 3hf9 h LYS 79 Cb 0.36 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 3hf9 h LYS 79 CO 0.01 0.47 -0.10 0.82 -0.57 0.00 0.00 179.45 180.08 3hf9 h ILE 80 N 0.73 1.27 0.25 1.86 2.04 -0.89 -2.57 117.51 120.21 3hf9 h ILE 80 Ca 0.34 -1.20 0.01 0.00 1.00 0.00 0.00 64.86 65.00 3hf9 h ILE 80 Cb 0.25 1.15 -0.03 0.00 -0.74 0.00 0.00 36.82 37.45 3hf9 h ILE 80 CO -0.21 0.41 -0.34 -1.13 0.00 0.00 0.00 178.15 176.88 3hf9 h ASN 81 N 0.68 -0.95 -0.76 1.72 -1.24 0.04 0.29 115.58 115.36 3hf9 h ASN 81 Ca 0.11 0.09 0.10 0.00 0.71 0.00 0.00 56.30 57.32 3hf9 h ASN 81 Cb 0.63 0.34 -0.07 0.00 0.73 0.00 0.00 38.32 39.94 3hf9 h ASN 81 CO 0.04 -0.46 0.39 0.03 -1.29 0.00 0.00 177.43 176.15 3hf9 h ARG 82 N -0.65 0.63 0.03 6.67 2.47 -1.29 0.23 114.38 122.47 3hf9 h ARG 82 Ca -0.00 -0.04 0.02 0.00 -1.26 0.00 0.00 59.98 58.70 3hf9 h ARG 82 Cb 0.62 -0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.78 3hf9 h ARG 82 CO -0.12 0.42 -0.13 1.25 0.56 0.00 0.00 179.97 181.95 3hf9 h LEU 83 N 0.65 -0.38 -0.75 3.04 6.46 -1.00 0.40 115.31 123.73 3hf9 h LEU 83 Ca 0.38 0.05 -0.02 0.00 -0.12 0.00 0.00 57.88 58.17 3hf9 h LEU 83 Cb 0.40 0.16 -0.03 0.00 -0.73 0.00 0.00 40.66 40.45 3hf9 h LEU 83 CO -0.28 -0.19 0.37 0.00 -0.62 0.00 0.00 178.44 177.73 3hf9 h ALA 84 N 0.69 0.96 -0.52 1.25 0.00 0.21 0.20 119.26 122.05 3hf9 h ALA 84 Ca 0.04 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.84 3hf9 h ALA 84 Cb 0.28 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 3hf9 h ALA 84 CO -0.11 0.51 0.29 0.82 0.00 0.00 0.00 179.25 180.76 3hf9 h ILE 85 N 1.04 1.02 -0.22 0.00 2.04 -0.68 0.23 117.51 120.93 3hf9 h ILE 85 Ca 0.26 -0.20 0.02 0.00 1.00 0.00 0.00 64.86 65.93 3hf9 h ILE 85 Cb 0.09 0.39 -0.02 0.00 -0.74 0.00 0.00 36.82 36.54 3hf9 h ILE 85 CO -0.04 0.11 0.10 -0.03 0.00 0.00 0.00 178.15 178.29 3hf9 h MET 86 N 0.58 0.22 -0.16 2.37 4.05 0.39 -0.19 114.93 122.19 3hf9 h MET 86 Ca 0.22 -0.01 -0.00 0.00 -0.28 0.00 0.00 59.70 59.62 3hf9 h MET 86 Cb 0.07 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 30.81 3hf9 h MET 86 CO -0.12 0.15 0.10 0.28 0.23 0.00 0.00 176.91 177.54 3hf9 h VAL 87 N 0.23 1.07 -0.00 -5.77 2.07 -0.32 -2.21 116.25 111.32 3hf9 h VAL 87 Ca 0.09 -0.16 -0.04 0.00 0.82 0.00 0.00 66.70 67.42 3hf9 h VAL 87 Cb 0.03 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 3hf9 h VAL 87 CO -0.07 0.06 -0.18 0.03 0.02 0.00 0.00 177.57 177.44 3hf9 h ARG 88 N 0.18 0.00 -0.74 1.57 3.08 -0.87 -2.32 114.38 115.29 3hf9 h ARG 88 Ca 0.06 -0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 3hf9 h ARG 88 Cb 0.02 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.03 3hf9 h ARG 88 CO -0.01 0.18 0.33 0.78 -1.07 0.00 0.00 179.97 180.18 3hf9 h GLY 89 N 0.53 1.14 1.81 0.04 0.00 -0.44 -2.06 103.07 104.10 3hf9 h GLY 89 Ca -0.00 -0.58 -0.04 0.00 0.00 0.00 0.00 47.33 46.71 3hf9 h GLY 89 CO 0.02 0.55 -0.36 3.43 0.00 0.00 0.00 176.54 180.18 3hf9 h ASN 90 N 1.05 0.00 1.36 0.19 2.35 -0.94 -3.23 115.58 116.36 3hf9 h ASN 90 Ca 0.25 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.98 3hf9 h ASN 90 Cb 0.15 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.51 3hf9 h ASN 90 CO -0.03 0.18 -0.65 -0.07 -1.65 0.00 0.00 177.43 175.21 3hf9 h LEU 91 N 0.00 0.00 -2.06 1.61 3.38 -1.34 -3.26 115.31 113.65 3hf9 h LEU 91 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3hf9 h LEU 91 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 3hf9 h LEU 91 CO 0.02 0.10 0.00 0.00 0.09 0.00 0.00 178.44 178.65 3hf9 n ALA 92 N -2.18 2.43 -1.09 1.53 0.00 -0.79 -5.10 120.51 115.31 3hf9 n ALA 92 Ca 0.01 -0.94 0.00 0.00 0.00 0.00 0.00 53.44 52.50 3hf9 n ALA 92 Cb 0.59 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 19.09 3hf9 n ALA 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hf9 n ALA 93 N 1.18 0.00 -2.69 0.00 0.00 -1.22 -5.07 120.51 112.71 3hf9 n ALA 93 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.34 3hf9 n ALA 93 Cb 0.51 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.94 3hf9 n ALA 93 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3hf9 n LEU 99 N 0.00 5.07 -4.40 0.00 4.77 -1.26 -5.08 117.00 116.11 3hf9 n LEU 99 Ca 0.00 -5.45 -0.45 0.00 -0.03 0.00 0.00 56.01 50.08 3hf9 n LEU 99 Cb 0.19 -0.63 -0.03 0.00 -2.33 0.00 0.00 43.42 40.62 3hf9 n LEU 99 CO 0.00 2.25 0.63 0.00 -1.33 0.00 0.00 177.39 178.94 3hf9 s ALA 100 N -3.63 3.52 -0.32 -1.18 0.00 -1.26 -5.01 121.76 113.88 3hf9 s ALA 100 Ca 0.48 -2.62 -0.14 0.00 0.00 0.00 0.00 51.96 49.67 3hf9 s ALA 100 Cb 0.32 -3.73 -0.02 0.00 0.00 0.00 0.00 23.12 19.69 3hf9 s ALA 100 CO -0.17 -2.58 0.32 -0.51 0.00 0.00 0.00 175.76 172.82 3hf9 s LEU 101 N 2.24 4.33 0.67 0.00 2.01 -1.26 -4.98 118.68 121.69 3hf9 s LEU 101 Ca 0.21 -0.15 -0.11 0.00 0.01 0.00 0.00 54.13 54.09 3hf9 s LEU 101 Cb -0.14 -2.29 -0.01 0.00 0.01 0.00 0.00 46.19 43.76 3hf9 s LEU 101 CO -0.02 -0.26 1.05 -2.84 1.01 0.00 0.00 176.35 175.29 3hf9 s PRO 102 N 1.95 3.14 -0.09 1.29 0.02 -1.26 -4.33 135.00 135.72 3hf9 s PRO 102 Ca 0.11 0.88 0.00 0.00 0.02 0.00 0.00 61.00 62.01 3hf9 s PRO 102 Cb -0.16 -2.02 0.02 0.00 0.02 0.00 0.00 34.50 32.36 3hf9 s PRO 102 CO 0.11 -0.93 -0.08 -1.17 -0.33 0.00 0.00 177.00 174.59 3hf9 s LEU 103 N -5.43 1.30 -0.16 -5.54 0.20 -0.25 -3.09 118.68 105.72 3hf9 s LEU 103 Ca 0.57 -0.28 -0.04 0.00 0.69 0.00 0.00 54.13 55.07 3hf9 s LEU 103 Cb -0.13 -0.80 -0.03 0.00 -0.43 0.00 0.00 46.19 44.80 3hf9 s LEU 103 CO 0.55 -0.08 -0.04 -0.22 -0.29 0.00 0.00 176.35 176.28 3hf9 s LEU 104 N 1.38 3.24 -0.07 -0.68 2.96 0.29 -1.65 118.68 124.14 3hf9 s LEU 104 Ca -0.01 -0.14 0.02 0.00 -0.22 0.00 0.00 54.13 53.78 3hf9 s LEU 104 Cb -0.14 -1.78 -0.02 0.00 0.50 0.00 0.00 46.19 44.75 3hf9 s LEU 104 CO -0.04 0.16 -0.14 0.00 -1.32 0.00 0.00 176.35 175.00 3hf9 s ALA 105 N 0.44 2.65 0.29 5.97 0.00 -0.40 -0.74 121.76 129.98 3hf9 s ALA 105 Ca -0.04 -0.95 -0.09 0.00 0.00 0.00 0.00 51.96 50.88 3hf9 s ALA 105 Cb -0.14 -1.04 0.00 0.00 0.00 0.00 0.00 23.12 21.94 3hf9 s ALA 105 CO 0.03 0.47 0.49 0.20 0.00 0.00 0.00 175.76 176.95 3hf9 s GLY 106 N -0.41 0.87 -0.08 0.00 0.00 -0.54 -0.55 107.32 106.62 3hf9 s GLY 106 Ca 0.05 -1.11 0.02 0.00 0.00 0.00 0.00 44.72 43.67 3hf9 s GLY 106 CO 0.02 -0.75 -0.12 -0.47 0.00 0.00 0.00 173.10 171.78 3hf9 s TYR 107 N -3.53 1.50 -0.45 1.90 5.04 0.47 0.00 117.35 122.28 3hf9 s TYR 107 Ca 0.25 -0.60 -0.15 0.00 -2.44 0.00 0.00 57.07 54.13 3hf9 s TYR 107 Cb -0.01 -1.12 0.06 0.00 0.35 0.00 0.00 41.96 41.24 3hf9 s TYR 107 CO 0.13 -0.33 0.36 0.34 -1.34 0.00 0.00 175.55 174.71 3hf9 s ASP 108 N 0.87 6.10 0.27 4.32 2.15 -0.41 -4.83 116.67 125.14 3hf9 s ASP 108 Ca -0.11 -1.20 0.06 0.00 0.43 0.00 0.00 52.55 51.73 3hf9 s ASP 108 Cb -0.15 -2.16 0.36 0.00 -0.30 0.00 0.00 42.92 40.67 3hf9 s ASP 108 CO 0.01 -0.58 1.63 0.16 -0.17 0.00 0.00 175.17 176.23 3hf9 h ILE 109 N 5.74 1.36 0.00 4.11 3.07 -1.97 -2.47 117.51 127.34 3hf9 h ILE 109 Ca -0.28 -1.77 0.00 0.00 1.55 0.00 0.00 64.86 64.36 3hf9 h ILE 109 Cb 1.11 1.87 0.00 0.00 -0.27 0.00 0.00 36.82 39.53 3hf9 h ILE 109 CO 0.82 0.52 0.00 1.41 -1.05 0.00 0.00 178.15 179.86 3hf9 n HIS 110 N -3.94 0.00 -2.35 0.16 8.25 -1.26 -4.81 115.22 111.27 3hf9 n HIS 110 Ca -0.02 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.03 3hf9 n HIS 110 Cb 0.55 -0.13 -0.03 0.00 1.12 0.00 0.00 29.99 31.50 3hf9 n HIS 110 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3hf9 s ALA 111 N -2.25 3.45 0.13 -1.41 0.00 -0.93 -4.95 121.76 115.79 3hf9 s ALA 111 Ca 0.19 0.99 -0.19 0.00 0.00 0.00 0.00 51.96 52.95 3hf9 s ALA 111 Cb 0.10 -3.41 -0.02 0.00 0.00 0.00 0.00 23.12 19.79 3hf9 s ALA 111 CO 0.20 -0.38 1.73 0.66 0.00 0.00 0.00 175.76 177.98 3hf9 h SER 112 N 4.74 -0.02 -3.59 0.00 4.64 -1.90 -3.39 113.55 114.04 3hf9 h SER 112 Ca -0.45 0.04 -0.70 0.00 -0.47 0.00 0.00 61.79 60.20 3hf9 h SER 112 Cb 1.21 0.06 -0.23 0.00 -0.31 0.00 0.00 62.40 63.13 3hf9 h SER 112 CO 0.72 0.02 -0.50 -0.62 -0.87 0.00 0.00 176.83 175.58 3hf9 s ASP 113 N -5.27 5.80 0.47 4.97 3.68 -1.26 -4.97 116.67 120.10 3hf9 s ASP 113 Ca -0.13 -0.87 0.32 0.00 2.13 0.00 0.00 52.55 53.99 3hf9 s ASP 113 Cb 0.10 -2.06 1.46 0.00 -1.45 0.00 0.00 42.92 40.97 3hf9 s ASP 113 CO 0.69 -0.36 1.95 -0.65 0.13 0.00 0.00 175.17 176.93 3hf9 h PRO 114 N 8.47 0.00 -0.38 4.34 0.11 -1.95 -2.91 132.00 139.68 3hf9 h PRO 114 Ca -0.27 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.75 3hf9 h PRO 114 Cb 1.12 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 3hf9 h PRO 114 CO 0.67 0.00 -0.10 1.96 -0.21 0.00 0.00 178.00 180.32 3hf9 h GLN 115 N 0.00 0.74 -1.08 1.05 1.08 -1.93 -3.28 115.11 111.70 3hf9 h GLN 115 Ca 0.00 -0.29 -0.61 0.00 -1.45 0.00 0.00 58.65 56.30 3hf9 h GLN 115 Cb 0.31 -0.04 -0.38 0.00 -0.05 0.00 0.00 27.48 27.32 3hf9 h GLN 115 CO 0.00 0.89 -0.17 -1.13 -0.95 0.00 0.00 178.83 177.48 3hf9 n SER 116 N -4.35 5.89 -0.41 1.46 3.41 -1.11 -0.38 113.62 118.14 3hf9 n SER 116 Ca -0.02 -3.76 0.13 0.00 -0.26 0.00 0.00 58.87 54.96 3hf9 n SER 116 Cb 0.36 -0.60 0.34 0.00 -0.26 0.00 0.00 64.21 64.05 3hf9 n SER 116 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hf9 n ALA 117 N -0.71 2.95 -1.76 7.33 0.00 -1.17 -4.88 120.51 122.27 3hf9 n ALA 117 Ca 0.49 -0.47 -0.38 0.00 0.00 0.00 0.00 53.44 53.08 3hf9 n ALA 117 Cb 0.76 -1.07 0.01 0.00 0.00 0.00 0.00 19.45 19.16 3hf9 n ALA 117 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3hf9 s GLY 118 N -2.31 2.84 0.00 0.00 0.00 -1.26 -1.29 107.32 105.30 3hf9 s GLY 118 Ca 0.28 1.14 0.01 0.00 0.00 0.00 0.00 44.72 46.16 3hf9 s GLY 118 CO 0.46 1.64 -0.05 0.50 0.00 0.00 0.00 173.10 175.65 3hf9 s ARG 119 N -2.74 0.39 -0.05 2.90 1.81 0.10 -4.89 118.95 116.47 3hf9 s ARG 119 Ca 0.66 -0.24 0.01 0.00 -1.72 0.00 0.00 55.73 54.45 3hf9 s ARG 119 Cb -0.35 -0.35 0.02 0.00 -0.45 0.00 0.00 34.95 33.82 3hf9 s ARG 119 CO 0.42 0.09 -0.06 0.42 -0.68 0.00 0.00 175.30 175.49 3hf9 s ILE 120 N -0.27 0.69 -0.05 1.52 1.01 -1.26 -1.46 121.20 121.38 3hf9 s ILE 120 Ca 0.00 -0.20 0.02 0.00 0.00 0.00 0.00 60.65 60.47 3hf9 s ILE 120 Cb -0.03 -0.70 0.01 0.00 0.01 0.00 0.00 42.46 41.76 3hf9 s ILE 120 CO -0.00 0.26 -0.09 -0.69 0.00 0.00 0.00 174.94 174.42 3hf9 s VAL 121 N 0.95 0.89 0.34 2.92 1.01 0.09 -1.66 120.40 124.93 3hf9 s VAL 121 Ca -0.10 -0.36 0.05 0.00 0.00 0.00 0.00 61.98 61.57 3hf9 s VAL 121 Cb -0.14 -0.83 -0.07 0.00 0.00 0.00 0.00 36.38 35.34 3hf9 s VAL 121 CO 0.00 0.29 0.03 -0.94 0.00 0.00 0.00 175.10 174.48 3hf9 s SER 122 N 0.62 2.84 -0.00 3.32 1.04 -0.85 0.10 113.70 120.76 3hf9 s SER 122 Ca -0.11 -1.34 0.06 0.00 0.48 0.00 0.00 55.95 55.04 3hf9 s SER 122 Cb -0.14 -0.18 -0.02 0.00 0.10 0.00 0.00 66.02 65.78 3hf9 s SER 122 CO 0.02 -0.52 -0.20 -0.36 0.98 0.00 0.00 173.24 173.16 3hf9 s PHE 123 N -3.09 1.79 0.84 5.02 0.40 -1.18 -1.42 117.98 120.35 3hf9 s PHE 123 Ca 0.35 -0.34 -0.10 0.00 -0.60 0.00 0.00 56.93 56.24 3hf9 s PHE 123 Cb 0.08 -1.14 0.15 0.00 0.51 0.00 0.00 43.02 42.63 3hf9 s PHE 123 CO 0.16 -0.01 1.17 0.16 0.70 0.00 0.00 175.22 177.40 3hf9 s ASP 124 N -0.60 3.79 0.33 1.36 1.47 -0.31 -4.82 116.67 117.88 3hf9 s ASP 124 Ca 0.08 0.10 0.11 0.00 1.18 0.00 0.00 52.55 54.02 3hf9 s ASP 124 Cb -0.08 -0.34 0.97 0.00 -0.34 0.00 0.00 42.92 43.13 3hf9 s ASP 124 CO -0.00 -2.27 1.69 0.00 0.68 0.00 0.00 175.17 175.26 3hf9 h ALA 125 N -1.12 1.82 -0.55 2.11 0.00 -2.01 -1.48 119.26 118.03 3hf9 h ALA 125 Ca -0.42 0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3hf9 h ALA 125 Cb 1.26 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.16 3hf9 h ALA 125 CO 0.42 -0.44 0.00 0.00 0.00 0.00 0.00 179.25 179.24 3hf9 n ALA 126 N -2.33 2.70 -0.84 0.00 0.00 -1.26 -4.92 120.51 113.86 3hf9 n ALA 126 Ca 0.29 -1.14 0.00 0.00 0.00 0.00 0.00 53.44 52.59 3hf9 n ALA 126 Cb 0.86 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 19.32 3hf9 n ALA 126 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hf9 n GLY 127 N 1.20 0.48 3.77 0.00 0.00 -0.56 -4.98 105.19 105.10 3hf9 n GLY 127 Ca 0.20 -0.86 -0.38 0.00 0.00 0.00 0.00 46.02 44.98 3hf9 n GLY 127 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hf9 s GLY 128 N -2.78 2.46 0.69 -0.02 0.00 -1.26 -4.66 107.32 101.75 3hf9 s GLY 128 Ca 0.00 -0.17 -0.11 0.00 0.00 0.00 0.00 44.72 44.44 3hf9 s GLY 128 CO 0.00 0.53 1.08 0.66 0.00 0.00 0.00 173.10 175.37 3hf9 s TRP 129 N -0.15 3.35 -0.24 1.90 1.48 -1.26 -1.16 118.94 122.86 3hf9 s TRP 129 Ca 0.26 1.13 -0.12 0.00 -1.06 0.00 0.00 56.10 56.31 3hf9 s TRP 129 Cb -0.16 -2.98 0.08 0.00 -1.16 0.00 0.00 33.47 29.25 3hf9 s TRP 129 CO 0.12 -1.12 0.56 1.21 -4.06 0.00 0.00 176.95 173.67 3hf9 s ASN 130 N -4.25 -0.74 -0.05 -2.66 3.04 -0.51 -4.89 114.94 104.88 3hf9 s ASN 130 Ca 0.58 1.25 -0.17 0.00 0.04 0.00 0.00 52.86 54.56 3hf9 s ASN 130 Cb -0.11 1.31 -0.05 0.00 -1.54 0.00 0.00 41.25 40.85 3hf9 s ASN 130 CO 0.53 -0.22 0.45 -0.63 -3.04 0.00 0.00 177.10 174.19 3hf9 s ILE 131 N 1.86 5.07 -0.36 -5.21 1.01 -1.26 -2.01 121.20 120.30 3hf9 s ILE 131 Ca -0.08 0.93 -0.20 0.00 0.00 0.00 0.00 60.65 61.29 3hf9 s ILE 131 Cb -0.08 -3.78 0.00 0.00 0.01 0.00 0.00 42.46 38.61 3hf9 s ILE 131 CO -0.17 0.46 0.63 -1.61 0.00 0.00 0.00 174.94 174.25 3hf9 s GLU 132 N -0.29 3.67 0.00 2.79 0.41 -0.67 -4.90 118.70 119.71 3hf9 s GLU 132 Ca 0.25 0.03 0.16 0.00 -0.41 0.00 0.00 54.97 55.00 3hf9 s GLU 132 Cb -0.16 -3.81 0.19 0.00 -1.78 0.00 0.00 34.13 28.57 3hf9 s GLU 132 CO 0.12 -0.74 1.09 0.39 -0.49 0.00 0.00 175.26 175.63 3hf9 n GLU 133 N 6.03 1.56 0.00 1.61 1.02 -1.26 -4.25 120.64 125.36 3hf9 n GLU 133 Ca -0.01 -1.63 0.13 0.00 -0.02 0.00 0.00 57.16 55.62 3hf9 n GLU 133 Cb 0.49 -1.33 0.35 0.00 -0.02 0.00 0.00 31.44 30.92 3hf9 n GLU 133 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3hf9 n GLU 134 N 0.93 0.01 0.00 3.49 1.02 -1.26 -4.96 120.64 119.87 3hf9 n GLU 134 Ca 0.11 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.25 3hf9 n GLU 134 Cb 0.43 -1.51 0.00 0.00 -0.02 0.00 0.00 31.44 30.34 3hf9 n GLU 134 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hf9 n GLY 135 N 1.49 3.35 3.21 0.62 0.00 -1.26 -5.02 105.19 107.59 3hf9 n GLY 135 Ca 0.06 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.97 3hf9 n GLY 135 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3hf9 s TYR 136 N -2.99 1.04 -0.07 1.61 1.13 -1.26 -0.40 117.35 116.40 3hf9 s TYR 136 Ca 0.00 -1.30 -0.30 0.00 -1.41 0.00 0.00 57.07 54.06 3hf9 s TYR 136 Cb 0.00 -0.50 0.11 0.00 -1.10 0.00 0.00 41.96 40.48 3hf9 s TYR 136 CO 0.00 -0.63 0.94 -1.14 -2.51 0.00 0.00 175.55 172.20 3hf9 s GLN 137 N -4.12 0.72 -0.14 -3.49 2.00 -0.61 -4.93 119.66 109.09 3hf9 s GLN 137 Ca 0.34 -0.10 -0.20 0.00 -2.00 0.00 0.00 55.36 53.41 3hf9 s GLN 137 Cb 0.07 0.33 0.05 0.00 0.80 0.00 0.00 33.01 34.26 3hf9 s GLN 137 CO 0.09 -0.28 0.51 0.00 -0.50 0.00 0.00 175.29 175.11 3hf9 s ALA 138 N -2.24 -1.28 0.12 1.58 0.00 -1.26 -1.48 121.76 117.21 3hf9 s ALA 138 Ca 0.02 1.23 0.04 0.00 0.00 0.00 0.00 51.96 53.25 3hf9 s ALA 138 Cb -0.01 -0.53 -0.04 0.00 0.00 0.00 0.00 23.12 22.54 3hf9 s ALA 138 CO -0.04 -0.27 -0.11 0.14 0.00 0.00 0.00 175.76 175.48 3hf9 s VAL 139 N -0.28 1.10 0.00 0.00 -7.23 -0.76 -4.85 120.40 108.38 3hf9 s VAL 139 Ca -0.04 -1.86 0.00 0.00 -1.81 0.00 0.00 61.98 58.27 3hf9 s VAL 139 Cb -0.03 -1.62 0.00 0.00 0.56 0.00 0.00 36.38 35.28 3hf9 s VAL 139 CO 0.03 -0.64 0.00 0.61 -0.31 0.00 0.00 175.10 174.79 3hf9 n GLY 140 N 0.18 0.76 0.27 2.32 0.00 -1.26 -0.96 105.19 106.50 3hf9 n GLY 140 Ca -0.13 -2.20 0.01 0.00 0.00 0.00 0.00 46.02 43.69 3hf9 n GLY 140 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3hf9 h SER 141 N 0.00 0.43 -0.29 1.61 4.64 -1.96 -0.98 113.55 117.00 3hf9 h SER 141 Ca 0.00 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 3hf9 h SER 141 Cb 0.00 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 61.98 3hf9 h SER 141 CO 0.00 0.49 0.00 0.61 -0.87 0.00 0.00 176.83 177.06 3hf9 n GLY 142 N -0.98 0.44 0.35 -0.77 0.00 -1.26 -4.45 105.19 98.53 3hf9 n GLY 142 Ca 0.01 -0.35 0.07 0.00 0.00 0.00 0.00 46.02 45.75 3hf9 n GLY 142 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3hf9 h SER 143 N 1.88 0.66 -0.41 1.61 4.64 -1.41 -2.09 113.55 118.43 3hf9 h SER 143 Ca 0.00 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.22 3hf9 h SER 143 Cb 0.43 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.37 3hf9 h SER 143 CO 0.00 0.43 -0.13 -0.07 -0.87 0.00 0.00 176.83 176.19 3hf9 h LEU 144 N 0.75 0.83 -0.53 5.97 3.38 -1.81 -1.17 115.31 122.72 3hf9 h LEU 144 Ca 0.31 -0.38 -0.15 0.00 0.09 0.00 0.00 57.88 57.75 3hf9 h LEU 144 Cb 0.26 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 3hf9 h LEU 144 CO -0.10 1.01 -0.49 -0.26 0.09 0.00 0.00 178.44 178.69 3hf9 h PHE 145 N 0.63 0.76 0.03 1.13 0.04 -1.77 -1.89 116.94 115.87 3hf9 h PHE 145 Ca 0.10 -0.25 -0.00 0.00 2.80 0.00 0.00 57.97 60.62 3hf9 h PHE 145 Cb 0.67 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 38.67 3hf9 h PHE 145 CO 0.05 0.99 -0.01 0.00 -0.60 0.00 0.00 178.31 178.73 3hf9 h ALA 146 N 0.97 -0.04 -0.74 2.45 0.00 -1.22 -1.29 119.26 119.38 3hf9 h ALA 146 Ca 0.02 -0.17 0.09 0.00 0.00 0.00 0.00 54.91 54.85 3hf9 h ALA 146 Cb 1.03 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.77 3hf9 h ALA 146 CO 0.10 -0.35 0.40 0.87 0.00 0.00 0.00 179.25 180.26 3hf9 h LYS 147 N -0.38 0.66 0.00 0.00 1.57 -1.23 -0.26 116.57 116.93 3hf9 h LYS 147 Ca -0.00 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.66 3hf9 h LYS 147 Cb 0.36 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 3hf9 h LYS 147 CO 0.01 0.44 -0.37 0.77 -0.57 0.00 0.00 179.45 179.72 3hf9 h SER 148 N 0.68 0.00 -0.08 0.86 0.02 -1.22 -1.10 113.55 112.71 3hf9 h SER 148 Ca 0.36 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 61.17 3hf9 h SER 148 Cb 0.33 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.88 3hf9 h SER 148 CO -0.25 0.37 -0.49 -1.28 -1.14 0.00 0.00 176.83 174.05 3hf9 h SER 149 N 0.00 0.57 -0.56 3.07 0.87 -0.73 -3.21 113.55 113.55 3hf9 h SER 149 Ca -0.00 -0.66 0.01 0.00 -1.23 0.00 0.00 61.79 59.91 3hf9 h SER 149 Cb 0.73 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 62.49 3hf9 h SER 149 CO 0.05 1.14 0.37 0.24 -0.53 0.00 0.00 176.83 178.10 3hf9 h MET 150 N 0.03 0.71 -0.98 2.24 2.07 -0.75 -2.29 114.93 115.95 3hf9 h MET 150 Ca -0.04 -0.04 0.16 0.00 -2.07 0.00 0.00 59.70 57.71 3hf9 h MET 150 Cb 1.14 -0.16 -0.10 0.00 -1.87 0.00 0.00 31.60 30.62 3hf9 h MET 150 CO 0.10 0.47 0.60 -0.22 1.07 0.00 0.00 176.91 178.93 3hf9 h LYS 151 N 0.73 0.81 0.07 1.72 3.64 -1.21 0.14 116.57 122.48 3hf9 h LYS 151 Ca 0.21 -0.05 -0.26 0.00 -1.27 0.00 0.00 60.65 59.28 3hf9 h LYS 151 Cb -0.04 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.58 3hf9 h LYS 151 CO -0.05 0.54 -1.29 0.87 -2.27 0.00 0.00 179.45 177.25 3hf9 h LYS 152 N 0.84 0.15 0.00 1.90 1.79 -1.51 -3.37 116.57 116.36 3hf9 h LYS 152 Ca 0.53 -0.26 0.00 0.00 -2.18 0.00 0.00 60.65 58.75 3hf9 h LYS 152 Cb 0.71 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.46 3hf9 h LYS 152 CO -0.34 1.05 -0.85 1.28 -1.08 0.00 0.00 179.45 179.51 3hf9 n LEU 153 N -3.40 0.82 -0.01 2.94 4.77 -0.80 -4.44 117.00 116.88 3hf9 n LEU 153 Ca -0.09 -0.32 -0.03 0.00 -0.03 0.00 0.00 56.01 55.54 3hf9 n LEU 153 Cb 1.01 -0.08 0.21 0.00 -2.33 0.00 0.00 43.42 42.22 3hf9 n LEU 153 CO 0.50 0.20 0.80 0.22 -1.33 0.00 0.00 177.39 177.78 3hf9 h TYR 154 N 0.00 0.60 -1.24 -1.77 3.20 -0.91 -1.55 116.97 115.31 3hf9 h TYR 154 Ca 0.00 -0.11 0.36 0.00 3.14 0.00 0.00 58.73 62.12 3hf9 h TYR 154 Cb 0.51 -0.16 -0.06 0.00 1.54 0.00 0.00 36.73 38.57 3hf9 h TYR 154 CO 0.00 0.68 0.88 0.66 -1.64 0.00 0.00 178.16 178.75 3hf9 h SER 155 N 0.50 0.04 -0.04 -2.11 4.64 -1.84 0.51 113.55 115.25 3hf9 h SER 155 Ca 0.09 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 3hf9 h SER 155 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 3hf9 h SER 155 CO 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.00 3hf9 n GLN 156 N -4.21 1.31 -3.01 4.77 6.02 -0.58 -4.82 117.38 116.86 3hf9 n GLN 156 Ca 0.27 -0.45 -0.41 0.00 -0.01 0.00 0.00 57.00 56.40 3hf9 n GLN 156 Cb 1.28 -1.41 -0.05 0.00 1.02 0.00 0.00 30.24 31.08 3hf9 n GLN 156 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3hf9 s VAL 157 N -1.95 4.88 0.00 5.09 1.01 0.17 -4.84 120.40 124.75 3hf9 s VAL 157 Ca 0.36 1.18 0.00 0.00 0.00 0.00 0.00 61.98 63.52 3hf9 s VAL 157 Cb 0.18 -4.06 0.00 0.00 0.00 0.00 0.00 36.38 32.50 3hf9 s VAL 157 CO 0.29 -0.12 0.00 0.35 0.00 0.00 0.00 175.10 175.62 3hf9 n THR 158 N 5.37 0.00 -4.18 3.92 -2.24 -1.26 -4.86 114.28 111.03 3hf9 n THR 158 Ca 0.02 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.67 3hf9 n THR 158 Cb 0.48 -0.41 -0.05 0.00 -2.10 0.00 0.00 70.33 68.25 3hf9 n THR 158 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3hf9 n ASP 159 N -1.26 -0.50 0.24 3.42 5.75 -1.26 -4.44 116.55 118.49 3hf9 n ASP 159 Ca 0.00 -2.47 0.10 0.00 -0.01 0.00 0.00 54.79 52.41 3hf9 n ASP 159 Cb 0.23 1.16 0.58 0.00 -1.03 0.00 0.00 41.12 42.06 3hf9 n ASP 159 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 3hf9 h GLY 160 N 1.38 0.00 0.84 6.12 0.00 -1.94 -2.01 103.07 107.45 3hf9 h GLY 160 Ca -0.16 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 46.97 3hf9 h GLY 160 CO 0.23 0.00 -0.85 -1.80 0.00 0.00 0.00 176.54 174.12 3hf9 h ASP 161 N 0.00 0.58 -0.31 0.19 -0.00 -1.99 -2.03 116.42 112.85 3hf9 h ASP 161 Ca -0.00 -0.87 -0.15 0.00 -0.00 0.00 0.00 57.03 56.01 3hf9 h ASP 161 Cb 0.54 -0.18 -0.01 0.00 -0.00 0.00 0.00 39.33 39.68 3hf9 h ASP 161 CO 0.03 1.39 -0.38 0.77 -0.00 0.00 0.00 179.24 181.04 3hf9 h SER 162 N -0.15 0.92 -0.65 2.28 4.64 -1.90 -2.28 113.55 116.42 3hf9 h SER 162 Ca -0.13 -0.42 0.13 0.00 -0.47 0.00 0.00 61.79 60.90 3hf9 h SER 162 Cb 1.61 -0.26 -0.10 0.00 -0.31 0.00 0.00 62.40 63.34 3hf9 h SER 162 CO 0.16 1.19 0.09 1.23 -0.87 0.00 0.00 176.83 178.63 3hf9 h GLY 163 N 0.84 0.79 1.00 -0.77 0.00 -1.40 0.44 103.07 103.98 3hf9 h GLY 163 Ca 0.06 0.02 0.01 0.00 0.00 0.00 0.00 47.33 47.42 3hf9 h GLY 163 CO 0.09 -0.18 0.61 -2.00 0.00 0.00 0.00 176.54 175.06 3hf9 h LEU 164 N 0.20 1.05 0.14 3.11 6.46 -1.06 -1.08 115.31 124.13 3hf9 h LEU 164 Ca 0.35 -0.03 -0.01 0.00 -0.12 0.00 0.00 57.88 58.08 3hf9 h LEU 164 Cb 0.56 -0.26 0.00 0.00 -0.73 0.00 0.00 40.66 40.23 3hf9 h LEU 164 CO -0.49 0.76 -0.06 -0.09 -0.62 0.00 0.00 178.44 177.93 3hf9 h ARG 165 N 1.24 -0.17 -0.63 1.25 2.43 -0.49 -1.35 114.38 116.65 3hf9 h ARG 165 Ca 0.34 0.01 0.13 0.00 -0.81 0.00 0.00 59.98 59.64 3hf9 h ARG 165 Cb -0.14 0.04 -0.09 0.00 -0.42 0.00 0.00 29.97 29.36 3hf9 h ARG 165 CO -0.08 0.15 0.11 0.28 -1.51 0.00 0.00 179.97 178.92 3hf9 h VAL 166 N -0.51 0.58 -0.40 0.20 2.07 -0.94 0.41 116.25 117.67 3hf9 h VAL 166 Ca -0.02 -0.08 0.05 0.00 0.82 0.00 0.00 66.70 67.48 3hf9 h VAL 166 Cb 0.40 0.33 -0.05 0.00 -1.52 0.00 0.00 31.29 30.46 3hf9 h VAL 166 CO 0.03 0.04 0.12 0.00 0.02 0.00 0.00 177.57 177.78 3hf9 h ALA 167 N 1.52 0.45 -0.52 1.67 0.00 -1.09 0.17 119.26 121.46 3hf9 h ALA 167 Ca 0.34 0.06 -0.09 0.00 0.00 0.00 0.00 54.91 55.21 3hf9 h ALA 167 Cb 0.53 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 3hf9 h ALA 167 CO -0.45 -0.28 -0.04 0.28 0.00 0.00 0.00 179.25 178.75 3hf9 h VAL 168 N 0.26 1.26 -0.59 0.00 2.07 -0.21 -1.72 116.25 117.32 3hf9 h VAL 168 Ca 0.19 -1.14 -0.07 0.00 0.82 0.00 0.00 66.70 66.49 3hf9 h VAL 168 Cb 0.19 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 3hf9 h VAL 168 CO -0.21 0.40 0.08 -0.08 0.02 0.00 0.00 177.57 177.78 3hf9 h GLU 169 N 0.84 0.98 -0.62 1.57 4.81 0.31 -1.30 114.58 121.17 3hf9 h GLU 169 Ca 0.15 -0.27 0.03 0.00 -0.13 0.00 0.00 59.36 59.14 3hf9 h GLU 169 Cb 0.56 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.79 3hf9 h GLU 169 CO 0.03 0.93 0.38 0.00 -0.73 0.00 0.00 179.01 179.62 3hf9 h ALA 170 N 1.01 0.80 0.00 2.92 0.00 -0.42 0.26 119.26 123.83 3hf9 h ALA 170 Ca 0.18 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 3hf9 h ALA 170 Cb 0.44 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3hf9 h ALA 170 CO 0.01 0.11 -0.18 -0.07 0.00 0.00 0.00 179.25 179.13 3hf9 h LEU 171 N 0.74 0.00 -0.04 0.00 3.38 -1.06 -0.67 115.31 117.65 3hf9 h LEU 171 Ca 0.25 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 58.04 3hf9 h LEU 171 Cb 0.03 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.79 3hf9 h LEU 171 CO -0.11 0.18 -0.67 0.22 0.09 0.00 0.00 178.44 178.15 3hf9 h TYR 172 N 0.00 0.76 -0.18 1.13 3.20 0.13 -2.01 116.97 120.00 3hf9 h TYR 172 Ca -0.00 -0.38 -0.05 0.00 3.14 0.00 0.00 58.73 61.43 3hf9 h TYR 172 Cb 0.45 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 3hf9 h TYR 172 CO 0.00 1.20 -0.11 -0.44 -1.64 0.00 0.00 178.16 177.17 3hf9 h ASP 173 N 0.12 0.27 -0.29 -2.11 3.32 -0.18 -1.22 116.42 116.33 3hf9 h ASP 173 Ca -0.07 -0.05 -0.08 0.00 0.02 0.00 0.00 57.03 56.84 3hf9 h ASP 173 Cb 1.35 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.82 3hf9 h ASP 173 CO 0.14 0.41 -0.13 0.00 -1.72 0.00 0.00 179.24 177.94 3hf9 h ALA 174 N 1.62 0.40 0.00 3.45 0.00 -1.04 -2.86 119.26 120.84 3hf9 h ALA 174 Ca 0.06 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 3hf9 h ALA 174 Cb 0.36 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 3hf9 h ALA 174 CO 0.02 0.28 -0.02 0.00 0.00 0.00 0.00 179.25 179.53 3hf9 h ALA 175 N 0.75 1.01 -0.10 0.00 0.00 -0.92 -1.34 119.26 118.67 3hf9 h ALA 175 Ca 0.06 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.79 3hf9 h ALA 175 Cb 0.65 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 3hf9 h ALA 175 CO 0.04 0.03 -0.62 0.22 0.00 0.00 0.00 179.25 178.92 3hf9 h ASP 176 N 0.00 0.40 -0.00 0.00 3.58 -1.00 -3.33 116.42 116.06 3hf9 h ASP 176 Ca -0.00 -0.23 0.00 0.00 0.42 0.00 0.00 57.03 57.22 3hf9 h ASP 176 Cb 0.51 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 41.44 3hf9 h ASP 176 CO 0.00 0.92 -0.35 0.47 -2.88 0.00 0.00 179.24 177.40 3hf9 n ASP 177 N -3.88 0.46 -4.02 2.28 8.00 -1.12 -4.96 116.55 113.30 3hf9 n ASP 177 Ca -0.03 -0.73 -0.26 0.00 0.71 0.00 0.00 54.79 54.48 3hf9 n ASP 177 Cb 0.64 0.94 -0.17 0.00 -0.02 0.00 0.00 41.12 42.51 3hf9 n ASP 177 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3hf9 s ASP 178 N -1.69 2.06 0.05 -2.24 2.15 -0.52 -5.03 116.67 111.45 3hf9 s ASP 178 Ca 0.03 -0.34 0.27 0.00 0.43 0.00 0.00 52.55 52.94 3hf9 s ASP 178 Cb 0.06 -0.92 0.80 0.00 -0.30 0.00 0.00 42.92 42.56 3hf9 s ASP 178 CO 0.31 0.01 1.65 -1.54 -0.17 0.00 0.00 175.17 175.44 3hf9 n SER 179 N 4.07 0.40 -0.11 -0.34 3.41 -1.26 -3.12 113.62 116.67 3hf9 n SER 179 Ca -0.20 0.23 0.13 0.00 -0.26 0.00 0.00 58.87 58.76 3hf9 n SER 179 Cb 0.51 -0.22 0.34 0.00 -0.26 0.00 0.00 64.21 64.59 3hf9 n SER 179 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hf9 n ALA 180 N -1.60 3.26 -2.88 7.33 0.00 -1.26 -4.77 120.51 120.58 3hf9 n ALA 180 Ca 0.06 -0.36 -0.34 0.00 0.00 0.00 0.00 53.44 52.80 3hf9 n ALA 180 Cb 0.37 -1.15 -0.11 0.00 0.00 0.00 0.00 19.45 18.56 3hf9 n ALA 180 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3hf9 s THR 181 N -2.76 4.23 0.03 0.00 2.01 -1.18 -4.71 115.64 113.25 3hf9 s THR 181 Ca 0.18 -0.24 -0.18 0.00 0.31 0.00 0.00 61.69 61.75 3hf9 s THR 181 Cb 0.18 -2.86 -0.06 0.00 0.01 0.00 0.00 72.50 69.77 3hf9 s THR 181 CO 0.61 0.50 0.53 -0.83 -0.69 0.00 0.00 174.62 174.73 3hf9 s GLY 182 N 0.23 2.60 0.43 4.40 0.00 -1.26 -4.47 107.32 109.25 3hf9 s GLY 182 Ca -0.00 -0.04 -0.04 0.00 0.00 0.00 0.00 44.72 44.64 3hf9 s GLY 182 CO 0.02 0.48 0.59 0.61 0.00 0.00 0.00 173.10 174.80 3hf9 n GLY 183 N 2.02 -0.20 3.65 0.20 0.00 -1.26 -4.54 105.19 105.05 3hf9 n GLY 183 Ca -0.10 -1.86 -0.43 0.00 0.00 0.00 0.00 46.02 43.63 3hf9 n GLY 183 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3hf9 s PRO 184 N -4.11 4.03 -0.63 1.61 0.02 -1.26 -4.91 135.00 129.75 3hf9 s PRO 184 Ca 0.36 1.78 -0.24 0.00 0.02 0.00 0.00 61.00 62.93 3hf9 s PRO 184 Cb -0.02 -3.94 0.05 0.00 0.02 0.00 0.00 34.50 30.62 3hf9 s PRO 184 CO 0.25 -1.00 1.02 0.34 -0.33 0.00 0.00 177.00 177.28 3hf9 s ASP 185 N 3.27 6.24 0.20 2.53 3.68 -0.68 -4.89 116.67 127.02 3hf9 s ASP 185 Ca 0.66 -0.63 0.04 0.00 2.13 0.00 0.00 52.55 54.76 3hf9 s ASP 185 Cb -0.26 -2.45 0.10 0.00 -1.45 0.00 0.00 42.92 38.86 3hf9 s ASP 185 CO 0.25 -1.43 1.46 -0.07 0.13 0.00 0.00 175.17 175.50 3hf9 h LEU 186 N 11.52 0.23 -0.69 -1.34 3.38 -1.93 0.12 115.31 126.60 3hf9 h LEU 186 Ca -0.28 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.53 3hf9 h LEU 186 Cb 1.07 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.71 3hf9 h LEU 186 CO 1.17 0.91 0.43 0.58 0.09 0.00 0.00 178.44 181.61 3hf9 h VAL 187 N 0.12 1.19 0.00 1.22 2.07 -1.97 -2.97 116.25 115.90 3hf9 h VAL 187 Ca -0.03 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.10 3hf9 h VAL 187 Cb 1.34 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.33 3hf9 h VAL 187 CO 0.12 0.19 -0.99 0.54 0.02 0.00 0.00 177.57 177.45 3hf9 n ARG 188 N -4.57 0.06 -3.12 1.57 1.74 -1.20 -4.98 116.66 106.16 3hf9 n ARG 188 Ca 0.06 -0.01 -0.14 0.00 -0.77 0.00 0.00 57.85 56.98 3hf9 n ARG 188 Cb 0.04 -1.51 0.06 0.00 -1.02 0.00 0.00 32.46 30.03 3hf9 n ARG 188 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hf9 n GLY 189 N 1.48 -0.07 3.26 -0.13 0.00 0.35 -5.03 105.19 105.05 3hf9 n GLY 189 Ca 0.04 -0.07 -0.33 0.00 0.00 0.00 0.00 46.02 45.66 3hf9 n GLY 189 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hf9 s ILE 190 N -3.23 2.48 0.30 -0.61 1.01 -0.87 -5.02 121.20 115.27 3hf9 s ILE 190 Ca 0.22 -0.85 0.03 0.00 0.00 0.00 0.00 60.65 60.05 3hf9 s ILE 190 Cb -0.10 -2.01 -0.06 0.00 0.01 0.00 0.00 42.46 40.30 3hf9 s ILE 190 CO 0.49 0.54 0.05 -0.36 0.00 0.00 0.00 174.94 175.66 3hf9 s PHE 191 N 0.53 1.85 0.69 3.97 0.40 -1.26 -1.69 117.98 122.47 3hf9 s PHE 191 Ca -0.12 -0.98 -0.17 0.00 -0.60 0.00 0.00 56.93 55.07 3hf9 s PHE 191 Cb -0.16 -1.17 0.01 0.00 0.51 0.00 0.00 43.02 42.21 3hf9 s PHE 191 CO 0.04 -0.04 1.27 -2.14 0.70 0.00 0.00 175.22 175.05 3hf9 s PRO 192 N -3.90 2.33 0.12 0.24 0.02 -1.26 -4.81 135.00 127.74 3hf9 s PRO 192 Ca 0.36 1.97 -0.10 0.00 0.02 0.00 0.00 61.00 63.25 3hf9 s PRO 192 Cb 0.08 -1.83 -0.06 0.00 0.02 0.00 0.00 34.50 32.71 3hf9 s PRO 192 CO 0.14 -1.74 0.44 0.95 -0.33 0.00 0.00 177.00 176.47 3hf9 s THR 193 N -1.61 5.04 0.11 0.99 -4.23 -0.84 -4.91 115.64 110.20 3hf9 s THR 193 Ca 0.80 0.45 0.01 0.00 -1.18 0.00 0.00 61.69 61.76 3hf9 s THR 193 Cb -0.35 -3.65 -0.04 0.00 1.34 0.00 0.00 72.50 69.80 3hf9 s THR 193 CO 0.42 0.19 -0.02 0.00 -0.54 0.00 0.00 174.62 174.67 3hf9 s ALA 194 N -1.51 0.97 0.00 3.99 0.00 -1.26 -1.54 121.76 122.41 3hf9 s ALA 194 Ca 0.37 -1.40 -0.00 0.00 0.00 0.00 0.00 51.96 50.93 3hf9 s ALA 194 Cb -0.13 0.39 -0.00 0.00 0.00 0.00 0.00 23.12 23.38 3hf9 s ALA 194 CO 0.20 -0.32 -0.00 0.08 0.00 0.00 0.00 175.76 175.71 3hf9 s VAL 195 N -3.76 0.02 -0.07 0.00 1.01 0.80 -1.69 120.40 116.70 3hf9 s VAL 195 Ca 0.16 -0.13 0.04 0.00 0.00 0.00 0.00 61.98 62.06 3hf9 s VAL 195 Cb 0.06 -0.05 -0.00 0.00 0.00 0.00 0.00 36.38 36.40 3hf9 s VAL 195 CO -0.02 -0.07 -0.21 -0.63 0.00 0.00 0.00 175.10 174.17 3hf9 s ILE 196 N -0.20 1.77 -0.12 2.22 1.01 -0.26 -1.39 121.20 124.23 3hf9 s ILE 196 Ca -0.02 -0.87 0.03 0.00 0.00 0.00 0.00 60.65 59.78 3hf9 s ILE 196 Cb -0.01 -1.53 -0.00 0.00 0.01 0.00 0.00 42.46 40.92 3hf9 s ILE 196 CO -0.00 0.50 -0.21 -0.63 0.00 0.00 0.00 174.94 174.60 3hf9 s ILE 197 N 0.24 2.28 0.32 2.92 1.01 0.21 -0.80 121.20 127.37 3hf9 s ILE 197 Ca -0.12 -0.93 0.06 0.00 0.00 0.00 0.00 60.65 59.66 3hf9 s ILE 197 Cb -0.16 -1.90 -0.03 0.00 0.01 0.00 0.00 42.46 40.38 3hf9 s ILE 197 CO 0.06 0.55 0.25 1.51 0.00 0.00 0.00 174.94 177.31 3hf9 s ASP 198 N 0.49 1.51 0.34 3.58 -4.77 -0.23 -1.04 116.67 116.54 3hf9 s ASP 198 Ca -0.14 -1.71 0.03 0.00 -3.30 0.00 0.00 52.55 47.44 3hf9 s ASP 198 Cb -0.17 0.53 0.64 0.00 -1.09 0.00 0.00 42.92 42.84 3hf9 s ASP 198 CO 0.05 -1.03 1.94 0.00 0.70 0.00 0.00 175.17 176.84 3hf9 h ALA 199 N 2.19 1.61 -0.70 2.11 0.00 -1.93 -1.45 119.26 121.09 3hf9 h ALA 199 Ca -0.27 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 3hf9 h ALA 199 Cb 1.24 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 3hf9 h ALA 199 CO 0.39 0.27 0.32 -0.44 0.00 0.00 0.00 179.25 179.80 3hf9 h ASP 200 N 0.88 0.93 0.00 0.00 3.45 -1.96 -3.49 116.42 116.23 3hf9 h ASP 200 Ca 0.34 -0.14 0.00 0.00 0.43 0.00 0.00 57.03 57.66 3hf9 h ASP 200 Cb 0.20 -0.24 0.00 0.00 -0.56 0.00 0.00 39.33 38.73 3hf9 h ASP 200 CO -0.12 0.81 0.00 0.61 -1.57 0.00 0.00 179.24 178.98 3hf9 n GLY 201 N -0.94 -1.27 3.49 2.75 0.00 -0.55 -5.08 105.19 103.59 3hf9 n GLY 201 Ca 0.06 -1.11 -0.34 0.00 0.00 0.00 0.00 46.02 44.62 3hf9 n GLY 201 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hf9 s ALA 202 N -1.00 3.04 0.01 4.61 0.00 0.01 -1.07 121.76 127.36 3hf9 s ALA 202 Ca 0.00 -0.88 0.02 0.00 0.00 0.00 0.00 51.96 51.10 3hf9 s ALA 202 Cb 0.00 -1.66 -0.01 0.00 0.00 0.00 0.00 23.12 21.44 3hf9 s ALA 202 CO 0.00 0.07 -0.07 0.08 0.00 0.00 0.00 175.76 175.85 3hf9 s VAL 203 N 0.60 0.50 0.08 0.00 1.01 0.02 -4.97 120.40 117.64 3hf9 s VAL 203 Ca -0.01 -0.55 -0.31 0.00 0.00 0.00 0.00 61.98 61.11 3hf9 s VAL 203 Cb -0.14 -0.48 -0.06 0.00 0.00 0.00 0.00 36.38 35.70 3hf9 s VAL 203 CO 0.02 -0.05 1.21 -1.81 0.00 0.00 0.00 175.10 174.48 3hf9 s ASP 204 N -0.65 7.06 0.03 3.32 1.01 -1.26 -1.10 116.67 125.08 3hf9 s ASP 204 Ca -0.02 2.07 -0.30 0.00 0.71 0.00 0.00 52.55 55.01 3hf9 s ASP 204 Cb -0.05 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.25 3hf9 s ASP 204 CO 0.00 -0.47 1.08 -0.69 0.21 0.00 0.00 175.17 175.31 3hf9 s VAL 205 N 0.89 4.47 0.33 -1.27 1.01 -0.68 -4.92 120.40 120.23 3hf9 s VAL 205 Ca 0.58 1.77 -0.29 0.00 0.00 0.00 0.00 61.98 64.05 3hf9 s VAL 205 Cb -0.30 -4.14 -0.11 0.00 0.00 0.00 0.00 36.38 31.83 3hf9 s VAL 205 CO 0.30 0.14 1.40 -2.84 0.00 0.00 0.00 175.10 174.10 3hf9 s PRO 206 N 1.03 4.25 0.22 2.72 0.02 -1.26 -4.52 135.00 137.47 3hf9 s PRO 206 Ca 0.55 2.36 -0.15 0.00 0.02 0.00 0.00 61.00 63.78 3hf9 s PRO 206 Cb -0.25 -3.04 0.25 0.00 0.02 0.00 0.00 34.50 31.48 3hf9 s PRO 206 CO 0.29 -0.35 1.59 1.49 -0.33 0.00 0.00 177.00 179.69 3hf9 h GLU 207 N 3.56 -0.05 -0.92 5.54 4.81 -1.94 -2.66 114.58 122.93 3hf9 h GLU 207 Ca -0.49 0.00 0.18 0.00 -0.13 0.00 0.00 59.36 58.92 3hf9 h GLU 207 Cb 1.23 0.01 -0.11 0.00 0.63 0.00 0.00 28.75 30.52 3hf9 h GLU 207 CO 0.67 -0.03 0.49 0.77 -0.73 0.00 0.00 179.01 180.18 3hf9 h SER 208 N -0.05 0.58 -0.53 1.04 0.02 -1.99 0.18 113.55 112.80 3hf9 h SER 208 Ca 0.32 0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 61.37 3hf9 h SER 208 Cb 0.57 0.02 -0.03 0.00 0.14 0.00 0.00 62.40 63.10 3hf9 h SER 208 CO -0.78 0.19 0.30 -0.09 -1.14 0.00 0.00 176.83 175.31 3hf9 h ARG 209 N 0.63 0.74 -0.64 3.45 9.65 -1.85 -0.84 114.38 125.51 3hf9 h ARG 209 Ca 0.53 -0.08 -0.04 0.00 -1.10 0.00 0.00 59.98 59.29 3hf9 h ARG 209 Cb 0.84 -0.15 -0.03 0.00 -1.39 0.00 0.00 29.97 29.24 3hf9 h ARG 209 CO -0.41 0.56 0.24 0.82 2.80 0.00 0.00 179.97 183.99 3hf9 h ILE 210 N 0.71 1.24 -0.76 1.20 2.04 -0.81 -1.20 117.51 119.93 3hf9 h ILE 210 Ca 0.19 -0.76 -0.03 0.00 1.00 0.00 0.00 64.86 65.25 3hf9 h ILE 210 Cb 0.03 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 36.61 3hf9 h ILE 210 CO -0.03 0.30 0.34 0.00 0.00 0.00 0.00 178.15 178.76 3hf9 h ALA 211 N 1.10 0.98 -0.35 1.87 0.00 -0.39 0.27 119.26 122.74 3hf9 h ALA 211 Ca 0.21 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 3hf9 h ALA 211 Cb 0.22 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3hf9 h ALA 211 CO -0.02 0.57 0.20 1.49 0.00 0.00 0.00 179.25 181.50 3hf9 h GLU 212 N 1.08 0.49 -0.81 0.00 4.81 -0.73 -0.63 114.58 118.79 3hf9 h GLU 212 Ca 0.26 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.41 3hf9 h GLU 212 Cb 0.16 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.40 3hf9 h GLU 212 CO -0.03 0.39 0.40 -0.07 -0.73 0.00 0.00 179.01 178.97 3hf9 h LEU 213 N 0.45 1.04 -0.50 1.64 3.38 -0.74 -0.91 115.31 119.68 3hf9 h LEU 213 Ca 0.13 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 3hf9 h LEU 213 Cb 0.04 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 3hf9 h LEU 213 CO -0.02 0.87 0.25 0.00 0.09 0.00 0.00 178.44 179.63 3hf9 h ALA 214 N 1.21 0.64 -0.69 1.53 0.00 -0.53 -0.48 119.26 120.94 3hf9 h ALA 214 Ca 0.28 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 3hf9 h ALA 214 Cb 0.10 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 3hf9 h ALA 214 CO -0.04 0.19 0.15 0.00 0.00 0.00 0.00 179.25 179.55 3hf9 h ARG 215 N 0.66 1.12 -0.62 0.00 3.08 -0.72 -0.37 114.38 117.53 3hf9 h ARG 215 Ca 0.17 -0.28 -0.01 0.00 0.07 0.00 0.00 59.98 59.94 3hf9 h ARG 215 Cb 0.10 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 29.97 3hf9 h ARG 215 CO -0.02 1.00 0.36 0.00 -1.07 0.00 0.00 179.97 180.23 3hf9 h ALA 216 N 1.10 0.80 -0.78 0.04 0.00 -0.75 -0.80 119.26 118.87 3hf9 h ALA 216 Ca 0.22 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 3hf9 h ALA 216 Cb 0.39 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 3hf9 h ALA 216 CO 0.01 0.29 0.35 0.82 0.00 0.00 0.00 179.25 180.72 3hf9 h ILE 217 N 0.85 1.25 -0.51 0.00 2.04 -0.61 0.87 117.51 121.40 3hf9 h ILE 217 Ca 0.22 -0.74 -0.04 0.00 1.00 0.00 0.00 64.86 65.29 3hf9 h ILE 217 Cb 0.01 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.37 3hf9 h ILE 217 CO -0.04 0.31 0.14 0.40 0.00 0.00 0.00 178.15 178.96 3hf9 h ILE 218 N 1.11 1.23 -0.40 -0.67 2.04 -0.63 -2.96 117.51 117.24 3hf9 h ILE 218 Ca 0.26 -0.80 -0.07 0.00 1.00 0.00 0.00 64.86 65.24 3hf9 h ILE 218 Cb 0.16 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 3hf9 h ILE 218 CO -0.03 0.29 -0.06 -0.33 0.00 0.00 0.00 178.15 178.02 3hf9 h GLU 219 N 0.69 0.67 -0.97 2.37 4.39 -0.76 -2.77 114.58 118.19 3hf9 h GLU 219 Ca 0.16 -0.19 0.02 0.00 0.34 0.00 0.00 59.36 59.69 3hf9 h GLU 219 Cb 0.30 -0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 28.82 3hf9 h GLU 219 CO -0.00 0.73 0.64 1.03 -1.16 0.00 0.00 179.01 180.25 3hf9 h SER 220 N 0.62 1.10 -0.22 1.42 0.87 -0.67 -2.40 113.55 114.27 3hf9 h SER 220 Ca 0.12 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.65 3hf9 h SER 220 Cb 0.48 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 62.17 3hf9 h SER 220 CO 0.03 0.79 0.00 0.54 -0.53 0.00 0.00 176.83 177.65 3hf9 n ARG 221 N -4.42 2.19 0.00 2.24 1.74 -1.12 -5.10 116.66 112.18 3hf9 n ARG 221 Ca 0.12 -1.78 0.14 0.00 -0.77 0.00 0.00 57.85 55.56 3hf9 n ARG 221 Cb 0.03 -1.47 0.53 0.00 -1.02 0.00 0.00 32.46 30.53 3hf9 n ARG 221 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54