#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hqm n LYS 7 N 0.00 0.00 -3.60 1.96 5.02 -1.26 -4.73 118.16 115.54 1hqm n LYS 7 Ca 0.00 0.00 -0.05 0.00 -2.02 0.00 0.00 58.31 56.24 1hqm n LYS 7 Cb 0.00 -2.81 -0.03 0.00 -0.02 0.00 0.00 35.03 32.17 1hqm n LYS 7 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1hqm s ALA 8 N -0.71 -2.05 0.33 7.82 0.00 -1.26 -5.20 121.76 120.70 1hqm s ALA 8 Ca 0.00 1.66 0.00 0.00 0.00 0.00 0.00 51.96 53.62 1hqm s ALA 8 Cb 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 23.12 22.55 1hqm s ALA 8 CO 0.00 -0.45 0.00 -0.35 0.00 0.00 0.00 175.76 174.96 1hqm n PRO 9 N 0.21 3.57 -3.25 0.00 -0.04 -1.26 -4.89 135.00 129.34 1hqm n PRO 9 Ca -0.02 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.21 1hqm n PRO 9 Cb 0.58 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.97 1hqm n PRO 9 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1hqm n VAL 10 N 0.00 -0.93 -1.62 0.52 0.31 -1.26 -4.94 118.33 110.41 1hqm n VAL 10 Ca 0.00 -3.18 -0.15 0.00 -0.01 0.00 0.00 64.34 61.00 1hqm n VAL 10 Cb 0.00 -1.28 -0.09 0.00 -0.91 0.00 0.00 33.84 31.56 1hqm n VAL 10 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 1hqm s PHE 11 N -0.07 1.22 0.49 3.52 5.36 -1.26 -4.34 117.98 122.90 1hqm s PHE 11 Ca 0.33 2.06 -0.08 0.00 -0.96 0.00 0.00 56.93 58.28 1hqm s PHE 11 Cb 0.07 -3.42 0.12 0.00 -0.34 0.00 0.00 43.02 39.45 1hqm s PHE 11 CO -0.17 -1.15 0.46 2.41 -1.46 0.00 0.00 175.22 175.32 1hqm n THR 12 N 8.86 0.00 -2.66 0.12 -1.04 0.35 -4.91 114.28 115.00 1hqm n THR 12 Ca 0.44 -0.23 -0.03 0.00 -2.04 0.00 0.00 64.05 62.19 1hqm n THR 12 Cb 0.45 -1.20 0.10 0.00 -1.82 0.00 0.00 70.33 67.86 1hqm n THR 12 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1hqm n ALA 13 N -3.71 -3.07 -1.53 2.41 0.00 -1.26 -3.52 120.51 109.83 1hqm n ALA 13 Ca -0.09 -0.39 -0.31 0.00 0.00 0.00 0.00 53.44 52.66 1hqm n ALA 13 Cb 0.24 -2.86 -0.10 0.00 0.00 0.00 0.00 19.45 16.74 1hqm n ALA 13 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1hqm n THR 14 N 0.35 -0.04 0.00 0.00 -1.04 -0.96 -4.84 114.28 107.75 1hqm n THR 14 Ca -0.09 -0.49 0.00 0.00 -2.04 0.00 0.00 64.05 61.42 1hqm n THR 14 Cb 0.74 -1.69 0.00 0.00 -1.82 0.00 0.00 70.33 67.57 1hqm n THR 14 CO 0.00 0.00 0.00 1.07 -0.64 0.00 0.00 175.07 175.50 1hqm n THR 15 N 7.72 0.00 -2.92 12.58 5.66 -1.26 -3.03 114.28 133.02 1hqm n THR 15 Ca 0.51 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.51 1hqm n THR 15 Cb 0.34 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.12 1hqm n THR 15 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1hqm n GLN 16 N 0.00 0.00 -3.79 1.09 1.13 -1.26 -4.71 117.38 109.84 1hqm n GLN 16 Ca 0.00 0.00 -0.32 0.00 -1.94 0.00 0.00 57.00 54.74 1hqm n GLN 16 Cb 0.00 0.00 -0.10 0.00 0.11 0.00 0.00 30.24 30.25 1hqm n GLN 16 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1hqm s GLY 17 N -0.92 2.93 -0.14 1.08 0.00 -1.26 -4.91 107.32 104.10 1hqm s GLY 17 Ca 0.00 -3.76 -0.10 0.00 0.00 0.00 0.00 44.72 40.86 1hqm s GLY 17 CO 0.00 1.12 0.19 1.22 0.00 0.00 0.00 173.10 175.63 1hqm n ASP 18 N 2.30 -2.52 0.00 1.64 8.00 -1.26 -4.98 116.55 119.73 1hqm n ASP 18 Ca 0.18 1.46 0.00 0.00 0.71 0.00 0.00 54.79 57.14 1hqm n ASP 18 Cb 0.36 -5.13 0.00 0.00 -0.02 0.00 0.00 41.12 36.33 1hqm n ASP 18 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1hqm n HIS 19 N 1.79 0.00 -2.20 1.24 1.44 -1.26 -4.85 115.22 111.38 1hqm n HIS 19 Ca -0.32 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.39 1hqm n HIS 19 Cb 0.50 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.61 1hqm n HIS 19 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 1hqm n TYR 20 N 1.70 -4.48 -2.75 -1.40 0.53 -1.26 -4.51 117.16 105.00 1hqm n TYR 20 Ca 0.00 2.68 -0.08 0.00 -1.02 0.00 0.00 57.90 59.49 1hqm n TYR 20 Cb 0.00 -3.48 0.05 0.00 -1.03 0.00 0.00 39.34 34.88 1hqm n TYR 20 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1hqm n GLY 21 N 1.91 -0.06 3.68 2.72 0.00 -0.78 -4.00 105.19 108.66 1hqm n GLY 21 Ca 0.00 0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1hqm n GLY 21 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1hqm s GLU 22 N 0.68 4.22 -0.32 1.61 2.02 -1.16 -4.13 118.70 121.61 1hqm s GLU 22 Ca 0.32 2.16 0.01 0.00 0.02 0.00 0.00 54.97 57.48 1hqm s GLU 22 Cb 0.23 -3.68 0.10 0.00 0.10 0.00 0.00 34.13 30.88 1hqm s GLU 22 CO -0.24 -0.70 0.09 -0.06 0.02 0.00 0.00 175.26 174.36 1hqm s PHE 23 N 2.87 2.43 -0.25 1.61 0.08 0.89 -2.27 117.98 123.35 1hqm s PHE 23 Ca 0.70 -2.20 -0.22 0.00 0.12 0.00 0.00 56.93 55.33 1hqm s PHE 23 Cb -0.35 -2.14 -0.01 0.00 -0.57 0.00 0.00 43.02 39.94 1hqm s PHE 23 CO 0.29 -0.90 0.72 0.08 -0.10 0.00 0.00 175.22 175.31 1hqm s VAL 24 N 1.33 4.92 0.00 -0.44 1.01 -1.23 -3.18 120.40 122.81 1hqm s VAL 24 Ca 0.10 1.33 0.00 0.00 0.00 0.00 0.00 61.98 63.41 1hqm s VAL 24 Cb -0.18 -4.02 0.00 0.00 0.00 0.00 0.00 36.38 32.18 1hqm s VAL 24 CO -0.19 -0.01 0.00 0.18 0.00 0.00 0.00 175.10 175.08 1hqm n LEU 25 N 5.81 0.00 0.00 3.92 4.77 -1.26 0.13 117.00 130.37 1hqm n LEU 25 Ca 0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 1hqm n LEU 25 Cb 0.48 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 1hqm n LEU 25 CO 0.45 0.00 0.00 -0.62 -1.33 0.00 0.00 177.39 175.89 1hqm n GLU 26 N 0.00 0.00 -2.23 3.23 -0.58 -1.26 -4.13 120.64 115.67 1hqm n GLU 26 Ca 0.00 0.00 -0.34 0.00 -0.42 0.00 0.00 57.16 56.40 1hqm n GLU 26 Cb 0.00 0.00 -0.04 0.00 -0.57 0.00 0.00 31.44 30.83 1hqm n GLU 26 CO 0.00 0.00 0.00 -0.35 -0.48 0.00 0.00 177.13 176.30 1hqm n PRO 27 N 0.00 2.19 -3.30 3.49 -0.04 -1.26 -4.19 135.00 131.89 1hqm n PRO 27 Ca 0.00 -2.75 -0.39 0.00 -0.04 0.00 0.00 63.50 60.32 1hqm n PRO 27 Cb 0.00 -3.63 -0.07 0.00 -0.04 0.00 0.00 33.50 29.76 1hqm n PRO 27 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1hqm s LEU 28 N 8.35 4.16 0.44 1.53 1.43 -1.06 -4.68 118.68 128.84 1hqm s LEU 28 Ca 0.63 0.63 -0.23 0.00 -1.03 0.00 0.00 54.13 54.13 1hqm s LEU 28 Cb 0.01 -2.64 -0.11 0.00 0.03 0.00 0.00 46.19 43.48 1hqm s LEU 28 CO 0.11 -0.14 0.71 -0.62 0.23 0.00 0.00 176.35 176.64 1hqm n GLU 29 N 4.63 0.81 -1.50 1.70 1.02 -1.26 -1.75 120.64 124.28 1hqm n GLU 29 Ca -0.06 0.30 -0.36 0.00 -0.02 0.00 0.00 57.16 57.02 1hqm n GLU 29 Cb 0.51 -1.71 -0.17 0.00 -0.02 0.00 0.00 31.44 30.05 1hqm n GLU 29 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1hqm n ARG 30 N 0.34 0.03 0.00 3.49 0.00 -1.26 -2.95 116.66 116.31 1hqm n ARG 30 Ca 0.11 -0.01 0.00 0.00 -0.00 0.00 0.00 57.85 57.95 1hqm n ARG 30 Cb 0.40 -1.44 0.00 0.00 -0.00 0.00 0.00 32.46 31.42 1hqm n ARG 30 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1hqm n GLY 31 N 6.23 2.32 0.00 2.89 0.00 -1.26 -4.92 105.19 110.46 1hqm n GLY 31 Ca 0.66 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 46.36 1hqm n GLY 31 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1hqm n PHE 32 N 0.00 0.00 0.27 1.61 3.01 -1.15 -3.41 117.46 117.79 1hqm n PHE 32 Ca 0.00 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.50 1hqm n PHE 32 Cb 0.00 -0.07 0.21 0.00 -0.01 0.00 0.00 39.48 39.60 1hqm n PHE 32 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1hqm h GLY 33 N 0.00 0.00 0.00 1.37 0.00 -1.89 -1.54 103.07 101.01 1hqm h GLY 33 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1hqm h GLY 33 CO 0.00 0.00 -0.43 3.33 0.00 0.00 0.00 176.54 179.44 1hqm n VAL 34 N -2.34 0.00 -0.45 4.60 0.24 -1.22 -3.92 118.33 115.23 1hqm n VAL 34 Ca -0.01 0.00 0.39 0.00 -2.04 0.00 0.00 64.34 62.69 1hqm n VAL 34 Cb 0.73 -0.20 0.73 0.00 -1.47 0.00 0.00 33.84 33.64 1hqm n VAL 34 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 1hqm h THR 35 N 0.00 0.26 0.00 3.34 2.02 -1.48 -0.33 112.91 116.72 1hqm h THR 35 Ca 0.00 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1hqm h THR 35 Cb 0.27 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 66.88 1hqm h THR 35 CO 0.00 0.01 -0.63 0.18 0.37 0.00 0.00 175.52 175.45 1hqm n LEU 36 N -4.24 1.32 -0.17 2.58 4.77 -1.11 -4.57 117.00 115.58 1hqm n LEU 36 Ca 0.33 0.22 0.12 0.00 -0.03 0.00 0.00 56.01 56.65 1hqm n LEU 36 Cb 1.46 -0.62 0.22 0.00 -2.33 0.00 0.00 43.42 42.15 1hqm n LEU 36 CO 0.37 -0.38 0.47 0.61 -1.33 0.00 0.00 177.39 177.13 1hqm n GLY 37 N 1.70 -0.53 0.00 -0.72 0.00 -0.76 -3.15 105.19 101.73 1hqm n GLY 37 Ca -0.09 0.45 -0.00 0.00 0.00 0.00 0.00 46.02 46.38 1hqm n GLY 37 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1hqm h ASN 38 N 0.00 0.00 -0.71 1.61 -0.73 -1.36 -3.26 115.58 111.12 1hqm h ASN 38 Ca 0.36 0.00 0.12 0.00 1.87 0.00 0.00 56.30 58.66 1hqm h ASN 38 Cb 0.87 0.00 -0.12 0.00 0.27 0.00 0.00 38.32 39.34 1hqm h ASN 38 CO -0.43 0.01 -0.24 -2.65 -0.37 0.00 0.00 177.43 173.75 1hqm n PRO 39 N -2.15 -0.13 -0.10 6.67 -0.02 -1.19 0.33 135.00 138.41 1hqm n PRO 39 Ca -0.00 1.11 -0.06 0.00 -2.02 0.00 0.00 63.50 62.53 1hqm n PRO 39 Cb 0.00 -1.64 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 1hqm n PRO 39 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1hqm h LEU 40 N 0.00 -0.57 -0.40 2.45 3.38 -1.76 1.64 115.31 120.06 1hqm h LEU 40 Ca 0.28 0.13 0.03 0.00 0.09 0.00 0.00 57.88 58.41 1hqm h LEU 40 Cb 0.46 0.31 -0.03 0.00 0.09 0.00 0.00 40.66 41.49 1hqm h LEU 40 CO -0.72 -0.20 0.21 -0.09 0.09 0.00 0.00 178.44 177.73 1hqm h ARG 41 N -0.11 0.41 0.21 1.13 1.12 0.53 1.68 114.38 119.35 1hqm h ARG 41 Ca 0.18 -0.02 -0.01 0.00 -1.11 0.00 0.00 59.98 59.01 1hqm h ARG 41 Cb 0.38 -0.09 -0.00 0.00 -0.01 0.00 0.00 29.97 30.24 1hqm h ARG 41 CO -0.42 0.27 -0.16 0.00 -3.11 0.00 0.00 179.97 176.56 1hqm h ARG 42 N 0.43 -0.34 -0.80 0.20 2.47 0.30 -2.73 114.38 113.91 1hqm h ARG 42 Ca 0.16 0.02 0.18 0.00 -1.26 0.00 0.00 59.98 59.09 1hqm h ARG 42 Cb 0.05 0.08 -0.12 0.00 -1.65 0.00 0.00 29.97 28.33 1hqm h ARG 42 CO -0.10 -0.22 0.25 0.82 0.56 0.00 0.00 179.97 181.28 1hqm h ILE 43 N -0.35 0.49 0.00 2.04 2.04 0.26 0.79 117.51 122.78 1hqm h ILE 43 Ca -0.03 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.72 1hqm h ILE 43 Cb 0.29 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.51 1hqm h ILE 43 CO 0.01 0.06 0.01 0.18 0.00 0.00 0.00 178.15 178.41 1hqm n LEU 44 N -5.12 0.36 -0.08 1.44 4.77 0.57 -0.35 117.00 118.59 1hqm n LEU 44 Ca 0.17 0.66 0.08 0.00 -0.03 0.00 0.00 56.01 56.89 1hqm n LEU 44 Cb 0.53 -0.70 -0.07 0.00 -2.33 0.00 0.00 43.42 40.85 1hqm n LEU 44 CO 0.12 -0.79 0.03 0.18 -1.33 0.00 0.00 177.39 175.61 1hqm n LEU 45 N -1.99 0.94 0.00 2.23 4.77 0.25 -4.73 117.00 118.48 1hqm n LEU 45 Ca -0.01 -0.56 0.00 0.00 -0.03 0.00 0.00 56.01 55.41 1hqm n LEU 45 Cb 0.04 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1hqm n LEU 45 CO 0.06 0.21 0.00 -1.20 -1.33 0.00 0.00 177.39 175.14 1hqm n SER 46 N -1.09 0.00 -4.55 -1.43 7.64 0.53 -4.98 113.62 109.74 1hqm n SER 46 Ca 0.04 0.00 -0.19 0.00 1.01 0.00 0.00 58.87 59.72 1hqm n SER 46 Cb 0.27 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.37 1hqm n SER 46 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1hqm n SER 47 N 0.00 1.31 -3.65 6.43 7.64 -1.20 -4.54 113.62 119.61 1hqm n SER 47 Ca 0.00 -1.12 -0.06 0.00 1.01 0.00 0.00 58.87 58.70 1hqm n SER 47 Cb 0.00 -1.44 -0.07 0.00 -1.01 0.00 0.00 64.21 61.69 1hqm n SER 47 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1hqm s ILE 48 N 11.86 -0.28 0.24 0.44 1.01 -1.26 -4.86 121.20 128.34 1hqm s ILE 48 Ca 1.02 0.02 -0.31 0.00 0.00 0.00 0.00 60.65 61.37 1hqm s ILE 48 Cb -0.30 -0.94 -0.13 0.00 0.01 0.00 0.00 42.46 41.10 1hqm s ILE 48 CO 0.21 0.01 1.51 -2.65 0.00 0.00 0.00 174.94 174.01 1hqm n PRO 49 N 4.65 2.28 -2.58 2.79 -0.02 -1.26 -4.26 135.00 136.60 1hqm n PRO 49 Ca -0.18 0.81 -0.06 0.00 -2.02 0.00 0.00 63.50 62.06 1hqm n PRO 49 Cb 0.56 -2.54 -0.00 0.00 -0.02 0.00 0.00 33.50 31.50 1hqm n PRO 49 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1hqm n GLY 50 N 2.48 2.10 3.58 -1.23 0.00 -0.38 -4.60 105.19 107.14 1hqm n GLY 50 Ca 0.12 -1.33 -0.32 0.00 0.00 0.00 0.00 46.02 44.50 1hqm n GLY 50 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1hqm s THR 51 N -2.59 3.54 -0.26 2.61 -4.23 -1.26 -2.31 115.64 111.14 1hqm s THR 51 Ca 0.11 -0.88 -0.26 0.00 -1.18 0.00 0.00 61.69 59.48 1hqm s THR 51 Cb -0.01 -2.56 0.14 0.00 1.34 0.00 0.00 72.50 71.41 1hqm s THR 51 CO 0.08 0.34 1.15 0.00 -0.54 0.00 0.00 174.62 175.65 1hqm s ALA 52 N -1.03 -2.03 0.72 3.99 0.00 -1.20 -4.54 121.76 117.67 1hqm s ALA 52 Ca 0.18 1.77 -0.16 0.00 0.00 0.00 0.00 51.96 53.75 1hqm s ALA 52 Cb -0.11 -1.37 0.03 0.00 0.00 0.00 0.00 23.12 21.67 1hqm s ALA 52 CO 0.08 -0.22 1.25 0.08 0.00 0.00 0.00 175.76 176.96 1hqm s VAL 53 N -0.20 2.03 0.00 0.00 1.01 -1.26 -2.26 120.40 119.72 1hqm s VAL 53 Ca 0.04 0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.03 1hqm s VAL 53 Cb -0.04 -2.73 0.00 0.00 0.00 0.00 0.00 36.38 33.61 1hqm s VAL 53 CO -0.07 -0.01 0.00 0.41 0.00 0.00 0.00 175.10 175.43 1hqm n THR 54 N -2.57 0.00 -3.61 3.92 -1.04 -1.26 -4.38 114.28 105.33 1hqm n THR 54 Ca 0.15 0.00 -0.08 0.00 -2.04 0.00 0.00 64.05 62.08 1hqm n THR 54 Cb 0.49 -0.49 -0.06 0.00 -1.82 0.00 0.00 70.33 68.46 1hqm n THR 54 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1hqm s SER 55 N -2.14 -0.29 0.04 8.00 0.15 -1.26 -1.14 113.70 117.05 1hqm s SER 55 Ca 0.00 0.42 0.04 0.00 0.70 0.00 0.00 55.95 57.11 1hqm s SER 55 Cb 0.00 0.38 -0.02 0.00 -1.71 0.00 0.00 66.02 64.67 1hqm s SER 55 CO 0.00 -0.19 -0.12 0.68 1.20 0.00 0.00 173.24 174.81 1hqm s VAL 56 N -0.58 0.94 -0.07 4.45 -7.23 -1.01 0.72 120.40 117.62 1hqm s VAL 56 Ca 0.03 -0.95 0.05 0.00 -1.81 0.00 0.00 61.98 59.30 1hqm s VAL 56 Cb -0.02 -0.87 -0.00 0.00 0.56 0.00 0.00 36.38 36.04 1hqm s VAL 56 CO -0.05 -0.06 -0.21 -0.47 -0.31 0.00 0.00 175.10 174.00 1hqm s TYR 57 N -0.89 2.20 0.10 2.82 6.04 -0.22 -4.06 117.35 123.34 1hqm s TYR 57 Ca -0.01 -0.76 0.09 0.00 0.04 0.00 0.00 57.07 56.44 1hqm s TYR 57 Cb -0.08 -1.47 -0.03 0.00 -1.04 0.00 0.00 41.96 39.33 1hqm s TYR 57 CO 0.01 -0.28 -0.24 0.42 -1.54 0.00 0.00 175.55 173.92 1hqm s ILE 58 N 0.14 2.02 0.00 3.14 1.01 -1.26 -0.87 121.20 125.37 1hqm s ILE 58 Ca -0.10 -1.56 0.00 0.00 0.00 0.00 0.00 60.65 58.99 1hqm s ILE 58 Cb -0.15 -1.78 0.00 0.00 0.01 0.00 0.00 42.46 40.54 1hqm s ILE 58 CO 0.05 0.11 0.00 1.21 0.00 0.00 0.00 174.94 176.31 1hqm n GLU 59 N 1.23 0.00 -2.35 2.79 4.07 -0.40 -2.50 120.64 123.48 1hqm n GLU 59 Ca -0.18 0.00 -0.40 0.00 -0.06 0.00 0.00 57.16 56.52 1hqm n GLU 59 Cb 0.53 0.00 0.02 0.00 -0.06 0.00 0.00 31.44 31.93 1hqm n GLU 59 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 1hqm n ASP 60 N 0.00 7.43 -3.91 4.31 8.00 -1.26 -4.90 116.55 126.23 1hqm n ASP 60 Ca 0.00 -3.70 -0.30 0.00 0.71 0.00 0.00 54.79 51.50 1hqm n ASP 60 Cb 0.00 -1.15 -0.15 0.00 -0.02 0.00 0.00 41.12 39.80 1hqm n ASP 60 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1hqm s VAL 61 N -4.35 1.84 0.50 2.53 1.01 -1.04 -4.98 120.40 115.91 1hqm s VAL 61 Ca 0.44 -2.19 0.20 0.00 0.00 0.00 0.00 61.98 60.43 1hqm s VAL 61 Cb 0.27 -2.35 0.34 0.00 0.00 0.00 0.00 36.38 34.64 1hqm s VAL 61 CO -0.22 -0.66 2.04 -0.07 0.00 0.00 0.00 175.10 176.18 1hqm h LEU 62 N 7.57 0.09 0.00 3.92 4.07 -1.90 -3.43 115.31 125.63 1hqm h LEU 62 Ca -0.07 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.89 1hqm h LEU 62 Cb 1.00 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 42.72 1hqm h LEU 62 CO 0.52 0.06 0.00 1.41 -1.08 0.00 0.00 178.44 179.35 1hqm n HIS 63 N -4.45 0.00 -0.75 1.13 8.25 -1.26 -4.47 115.22 113.67 1hqm n HIS 63 Ca 0.06 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.29 1hqm n HIS 63 Cb 0.40 0.00 0.08 0.00 1.12 0.00 0.00 29.99 31.59 1hqm n HIS 63 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 1hqm n GLU 64 N -0.12 -0.94 -2.16 -0.41 2.13 -1.26 -3.73 120.64 114.16 1hqm n GLU 64 Ca 0.00 -0.27 -0.12 0.00 0.66 0.00 0.00 57.16 57.43 1hqm n GLU 64 Cb 0.00 -1.26 -0.01 0.00 0.27 0.00 0.00 31.44 30.44 1hqm n GLU 64 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 1hqm n PHE 65 N -3.81 -0.53 -2.33 4.31 3.01 -1.26 -5.00 117.46 111.85 1hqm n PHE 65 Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.47 1hqm n PHE 65 Cb 0.44 -2.69 0.00 0.00 -0.01 0.00 0.00 39.48 37.22 1hqm n PHE 65 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 1hqm n SER 66 N -0.29 0.31 -3.06 4.37 7.64 -1.24 -5.08 113.62 116.26 1hqm n SER 66 Ca -0.14 -0.17 0.04 0.00 1.01 0.00 0.00 58.87 59.60 1hqm n SER 66 Cb 0.59 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.79 1hqm n SER 66 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1hqm s THR 67 N 1.65 -0.49 -0.25 0.44 -1.32 -1.26 -4.12 115.64 110.29 1hqm s THR 67 Ca 0.00 0.00 -0.29 0.00 -1.21 0.00 0.00 61.69 60.19 1hqm s THR 67 Cb 0.00 -0.30 -0.02 0.00 -1.51 0.00 0.00 72.50 70.67 1hqm s THR 67 CO 0.00 0.00 1.58 -0.63 -2.21 0.00 0.00 174.62 173.36 1hqm s ILE 68 N 2.53 3.75 0.51 5.08 1.01 -1.26 -4.98 121.20 127.84 1hqm s ILE 68 Ca 0.19 0.83 -0.20 0.00 0.00 0.00 0.00 60.65 61.47 1hqm s ILE 68 Cb -0.02 -3.79 -0.09 0.00 0.01 0.00 0.00 42.46 38.57 1hqm s ILE 68 CO -0.19 -0.35 0.68 -2.65 0.00 0.00 0.00 174.94 172.43 1hqm n PRO 69 N 7.69 0.74 0.00 2.79 -0.02 -1.26 -2.20 135.00 142.73 1hqm n PRO 69 Ca 0.18 0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 1hqm n PRO 69 Cb 0.46 -1.78 0.00 0.00 -0.02 0.00 0.00 33.50 32.15 1hqm n PRO 69 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1hqm n GLY 70 N 1.60 2.17 3.52 -1.23 0.00 -1.26 -4.71 105.19 105.28 1hqm n GLY 70 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 1hqm n GLY 70 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hqm s VAL 71 N -2.21 4.95 0.24 1.61 1.01 -0.94 0.07 120.40 125.14 1hqm s VAL 71 Ca 0.00 -0.06 -0.04 0.00 0.00 0.00 0.00 61.98 61.88 1hqm s VAL 71 Cb 0.00 -3.40 0.22 0.00 0.00 0.00 0.00 36.38 33.19 1hqm s VAL 71 CO 0.00 0.21 1.74 0.50 0.00 0.00 0.00 175.10 177.54 1hqm h LYS 72 N 8.35 0.45 0.00 2.72 3.64 -1.68 -3.43 116.57 126.63 1hqm h LYS 72 Ca -0.35 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.00 1hqm h LYS 72 Cb 1.17 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1hqm h LYS 72 CO 0.58 0.30 0.00 0.39 -2.27 0.00 0.00 179.45 178.45 1hqm n GLU 73 N -4.98 2.53 0.00 1.90 -0.58 -1.26 -5.04 120.64 113.21 1hqm n GLU 73 Ca 0.14 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.88 1hqm n GLU 73 Cb 0.41 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.28 1hqm n GLU 73 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1hqm n ASP 74 N 0.00 0.00 0.00 1.62 -0.08 -1.26 -5.00 116.55 111.83 1hqm n ASP 74 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1hqm n ASP 74 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 1hqm n ASP 74 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 1hqm n VAL 75 N 0.00 0.00 0.03 5.18 0.31 -1.26 0.78 118.33 123.37 1hqm n VAL 75 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.21 1hqm n VAL 75 Cb 0.00 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 32.84 1hqm n VAL 75 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1hqm h VAL 76 N 0.00 1.08 -0.94 2.52 2.07 -1.97 -2.61 116.25 116.39 1hqm h VAL 76 Ca 0.00 -1.22 0.10 0.00 0.82 0.00 0.00 66.70 66.39 1hqm h VAL 76 Cb 0.00 1.79 -0.12 0.00 -1.52 0.00 0.00 31.29 31.44 1hqm h VAL 76 CO 0.00 0.27 -0.56 -0.33 0.02 0.00 0.00 177.57 176.98 1hqm h GLU 77 N -0.77 -0.03 0.00 1.57 5.08 -0.05 0.89 114.58 121.27 1hqm h GLU 77 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1hqm h GLU 77 Cb 0.56 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.82 1hqm h GLU 77 CO 0.02 -0.02 0.00 -0.89 -1.00 0.00 0.00 179.01 177.12 1hqm n ILE 78 N -5.29 0.00 -0.42 3.13 5.41 -1.21 0.21 119.36 121.19 1hqm n ILE 78 Ca 0.03 1.06 0.36 0.00 1.00 0.00 0.00 62.75 65.20 1hqm n ILE 78 Cb 0.29 -1.53 0.69 0.00 -0.71 0.00 0.00 39.64 38.38 1hqm n ILE 78 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 1hqm h ILE 79 N 0.00 0.30 -0.27 1.39 2.04 -0.67 1.63 117.51 121.93 1hqm h ILE 79 Ca 0.00 -0.03 -0.16 0.00 1.00 0.00 0.00 64.86 65.67 1hqm h ILE 79 Cb 0.00 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.26 1hqm h ILE 79 CO 0.00 0.02 -0.47 -0.07 0.00 0.00 0.00 178.15 177.63 1hqm h LEU 80 N 0.10 0.78 0.42 1.44 3.38 0.85 -0.66 115.31 121.62 1hqm h LEU 80 Ca 0.69 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 58.26 1hqm h LEU 80 Cb 2.44 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 42.97 1hqm h LEU 80 CO -0.16 1.12 -0.20 0.78 0.09 0.00 0.00 178.44 180.08 1hqm h ASN 81 N 0.57 -0.47 -0.28 -0.43 4.21 1.36 -3.01 115.58 117.52 1hqm h ASN 81 Ca 0.03 0.02 0.08 0.00 1.21 0.00 0.00 56.30 57.64 1hqm h ASN 81 Cb 1.03 0.12 -0.01 0.00 -1.12 0.00 0.00 38.32 38.34 1hqm h ASN 81 CO 0.10 -0.13 0.76 -0.07 -1.29 0.00 0.00 177.43 176.80 1hqm h LEU 82 N -0.97 0.00 -1.94 1.61 3.38 0.28 0.66 115.31 118.33 1hqm h LEU 82 Ca -0.06 0.00 0.06 0.00 0.09 0.00 0.00 57.88 57.97 1hqm h LEU 82 Cb 0.43 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 1hqm h LEU 82 CO 0.09 0.00 0.17 0.50 0.09 0.00 0.00 178.44 179.30 1hqm h LYS 83 N 0.00 0.07 0.00 1.13 3.64 -0.97 -3.24 116.57 117.20 1hqm h LYS 83 Ca 0.14 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1hqm h LYS 83 Cb 1.66 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.47 1hqm h LYS 83 CO -0.00 0.05 0.00 0.39 -2.27 0.00 0.00 179.45 177.62 1hqm n GLU 84 N -4.48 0.00 0.00 1.90 1.02 0.23 -4.70 120.64 114.62 1hqm n GLU 84 Ca 0.03 0.48 0.00 0.00 -0.02 0.00 0.00 57.16 57.64 1hqm n GLU 84 Cb 0.27 -1.00 0.00 0.00 -0.02 0.00 0.00 31.44 30.69 1hqm n GLU 84 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1hqm n LEU 85 N -1.94 0.00 -4.63 -4.62 0.00 -1.23 -4.82 117.00 99.77 1hqm n LEU 85 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 56.01 55.64 1hqm n LEU 85 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 43.42 43.32 1hqm n LEU 85 CO 0.00 0.00 -0.12 0.54 0.00 0.00 0.00 177.39 177.81 1hqm s VAL 86 N 0.00 5.31 0.41 1.96 0.11 -1.26 -4.66 120.40 122.26 1hqm s VAL 86 Ca 0.00 0.27 0.08 0.00 -2.93 0.00 0.00 61.98 59.39 1hqm s VAL 86 Cb 0.00 -3.55 0.00 0.00 -1.53 0.00 0.00 36.38 31.30 1hqm s VAL 86 CO 0.00 0.28 0.52 0.68 -3.33 0.00 0.00 175.10 173.25 1hqm s VAL 87 N 1.45 3.06 0.11 2.04 -7.23 -1.26 -2.99 120.40 115.58 1hqm s VAL 87 Ca 0.09 -1.07 0.07 0.00 -1.81 0.00 0.00 61.98 59.26 1hqm s VAL 87 Cb -0.15 -3.04 -0.04 0.00 0.56 0.00 0.00 36.38 33.71 1hqm s VAL 87 CO 0.08 -0.02 -0.17 -0.60 -0.31 0.00 0.00 175.10 174.08 1hqm s ARG 88 N -4.29 1.05 -0.01 4.82 3.52 -0.98 -4.37 118.95 118.70 1hqm s ARG 88 Ca 0.52 -1.18 0.08 0.00 -0.13 0.00 0.00 55.73 55.02 1hqm s ARG 88 Cb -0.09 -1.12 -0.12 0.00 -1.56 0.00 0.00 34.95 32.06 1hqm s ARG 88 CO 0.32 0.24 0.19 1.19 -0.81 0.00 0.00 175.30 176.42 1hqm n PHE 89 N 0.83 0.00 -3.12 5.12 3.01 -1.26 -2.96 117.46 119.09 1hqm n PHE 89 Ca -0.18 0.00 -0.15 0.00 1.01 0.00 0.00 57.45 58.14 1hqm n PHE 89 Cb 0.55 -0.17 -0.02 0.00 -0.01 0.00 0.00 39.48 39.84 1hqm n PHE 89 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1hqm n LEU 90 N -1.72 -0.49 -3.44 4.37 4.32 -1.26 -4.29 117.00 114.49 1hqm n LEU 90 Ca -0.01 -0.07 -0.13 0.00 -0.02 0.00 0.00 56.01 55.77 1hqm n LEU 90 Cb 0.20 -1.38 -0.03 0.00 -1.62 0.00 0.00 43.42 40.60 1hqm n LEU 90 CO 0.17 0.04 0.40 -0.62 -1.22 0.00 0.00 177.39 176.16 1hqm s ASP 91 N -2.41 -0.58 -0.53 -1.43 -1.08 -1.26 -4.91 116.67 104.47 1hqm s ASP 91 Ca 0.26 0.12 -0.24 0.00 -0.52 0.00 0.00 52.55 52.17 1hqm s ASP 91 Cb -0.15 0.59 0.04 0.00 -1.46 0.00 0.00 42.92 41.94 1hqm s ASP 91 CO 0.32 -0.91 0.92 -2.16 0.52 0.00 0.00 175.17 173.86 1hqm s PRO 92 N -3.31 3.36 0.12 4.34 0.04 -1.26 -4.83 135.00 133.46 1hqm s PRO 92 Ca -0.01 -0.21 0.00 0.00 0.04 0.00 0.00 61.00 60.82 1hqm s PRO 92 Cb -0.01 -4.03 0.00 0.00 0.04 0.00 0.00 34.50 30.50 1hqm s PRO 92 CO -0.09 -1.41 0.00 2.89 0.04 0.00 0.00 177.00 178.43 1hqm n ARG 93 N 7.32 -4.80 0.00 4.56 0.00 -1.26 -5.11 116.66 117.37 1hqm n ARG 93 Ca 0.02 3.49 0.00 0.00 -0.00 0.00 0.00 57.85 61.36 1hqm n ARG 93 Cb 0.48 -3.93 0.00 0.00 -0.00 0.00 0.00 32.46 29.01 1hqm n ARG 93 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.63 174.96 1hqm n TRP 94 N 1.65 0.00 -4.62 2.89 4.27 -1.26 -5.17 117.44 115.20 1hqm n TRP 94 Ca 0.00 0.00 -0.29 0.00 -3.89 0.00 0.00 57.50 53.32 1hqm n TRP 94 Cb 0.00 0.00 -0.07 0.00 -1.36 0.00 0.00 31.31 29.88 1hqm n TRP 94 CO 0.00 0.00 0.00 2.89 -2.29 0.00 0.00 177.69 178.29 1hqm n ARG 95 N -1.12 0.69 -3.17 -2.67 0.00 -1.26 -4.10 116.66 105.02 1hqm n ARG 95 Ca 0.00 -3.54 -0.01 0.00 -0.00 0.00 0.00 57.85 54.30 1hqm n ARG 95 Cb 0.00 1.41 0.01 0.00 -0.00 0.00 0.00 32.46 33.88 1hqm n ARG 95 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.63 175.26 1hqm n THR 96 N -1.08 0.00 -3.55 8.89 5.66 -1.12 -5.01 114.28 118.07 1hqm n THR 96 Ca -0.13 -0.30 -0.27 0.00 -3.05 0.00 0.00 64.05 60.30 1hqm n THR 96 Cb 0.62 0.49 -0.15 0.00 -1.55 0.00 0.00 70.33 69.74 1hqm n THR 96 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 1hqm s THR 97 N -2.17 -0.11 1.42 1.09 2.01 -1.26 -2.46 115.64 114.16 1hqm s THR 97 Ca 0.17 -0.54 -0.23 0.00 0.31 0.00 0.00 61.69 61.41 1hqm s THR 97 Cb -0.01 -0.85 0.36 0.00 0.01 0.00 0.00 72.50 72.01 1hqm s THR 97 CO 0.02 -0.56 0.94 -0.76 -0.69 0.00 0.00 174.62 173.58 1hqm s LEU 98 N 2.14 -1.05 -0.29 4.42 2.01 -1.07 -4.87 118.68 119.98 1hqm s LEU 98 Ca 0.07 0.81 -0.16 0.00 0.01 0.00 0.00 54.13 54.87 1hqm s LEU 98 Cb -0.16 -2.24 0.11 0.00 0.01 0.00 0.00 46.19 43.91 1hqm s LEU 98 CO -0.27 -5.34 0.81 -0.63 1.01 0.00 0.00 176.35 171.93 1hqm s ILE 99 N -2.32 -0.05 -0.12 -0.59 1.01 -1.26 -3.70 121.20 114.17 1hqm s ILE 99 Ca 0.69 0.00 -0.09 0.00 0.00 0.00 0.00 60.65 61.24 1hqm s ILE 99 Cb -0.12 -1.00 0.04 0.00 0.01 0.00 0.00 42.46 41.38 1hqm s ILE 99 CO 0.57 0.00 0.31 -1.48 0.00 0.00 0.00 174.94 174.34 1hqm s LEU 100 N 1.58 0.63 -0.10 2.97 0.05 -1.19 -3.24 118.68 119.38 1hqm s LEU 100 Ca -0.09 0.64 0.03 0.00 0.05 0.00 0.00 54.13 54.75 1hqm s LEU 100 Cb -0.05 1.03 -0.01 0.00 -2.05 0.00 0.00 46.19 45.12 1hqm s LEU 100 CO -0.18 -0.13 -0.21 -0.60 -0.55 0.00 0.00 176.35 174.69 1hqm s ARG 101 N 0.52 3.04 0.02 1.48 3.52 -1.26 -0.01 118.95 126.26 1hqm s ARG 101 Ca -0.03 -0.82 0.04 0.00 -0.13 0.00 0.00 55.73 54.79 1hqm s ARG 101 Cb -0.04 -2.37 -0.03 0.00 -1.56 0.00 0.00 34.95 30.94 1hqm s ARG 101 CO -0.03 0.24 -0.08 0.00 -0.81 0.00 0.00 175.30 174.62 1hqm s ALA 102 N 0.21 2.96 0.20 6.12 0.00 -1.26 -4.85 121.76 125.14 1hqm s ALA 102 Ca -0.13 -1.06 0.07 0.00 0.00 0.00 0.00 51.96 50.84 1hqm s ALA 102 Cb -0.16 -1.06 -0.04 0.00 0.00 0.00 0.00 23.12 21.85 1hqm s ALA 102 CO 0.07 0.61 0.05 -1.21 0.00 0.00 0.00 175.76 175.28 1hqm s GLU 103 N -1.49 2.53 0.00 0.00 0.41 -1.20 -3.06 118.70 115.90 1hqm s GLU 103 Ca 0.17 -1.13 0.00 0.00 -0.41 0.00 0.00 54.97 53.61 1hqm s GLU 103 Cb -0.11 -2.39 0.00 0.00 -1.78 0.00 0.00 34.13 29.85 1hqm s GLU 103 CO 0.08 0.43 0.00 0.41 -0.49 0.00 0.00 175.26 175.69 1hqm n GLY 104 N -0.46 0.00 3.62 -1.39 0.00 -0.97 -4.03 105.19 101.96 1hqm n GLY 104 Ca -0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 1hqm n GLY 104 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1hqm s PRO 105 N 0.00 3.94 0.00 1.61 0.04 -1.26 -2.88 135.00 136.45 1hqm s PRO 105 Ca 0.00 0.80 0.00 0.00 0.04 0.00 0.00 61.00 61.84 1hqm s PRO 105 Cb 0.00 -3.78 0.00 0.00 0.04 0.00 0.00 34.50 30.76 1hqm s PRO 105 CO 0.00 -0.95 0.00 0.36 0.04 0.00 0.00 177.00 176.45 1hqm n LYS 106 N 6.88 0.00 -3.18 4.56 2.85 -1.13 -5.00 118.16 123.13 1hqm n LYS 106 Ca 0.10 0.00 -0.22 0.00 -1.05 0.00 0.00 58.31 57.13 1hqm n LYS 106 Cb 0.48 0.00 -0.06 0.00 -0.65 0.00 0.00 35.03 34.80 1hqm n LYS 106 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 1hqm n GLU 107 N 0.00 0.78 -1.05 -1.58 2.13 -1.26 -3.85 120.64 115.81 1hqm n GLU 107 Ca 0.00 -3.24 -0.03 0.00 0.66 0.00 0.00 57.16 54.54 1hqm n GLU 107 Cb 0.00 -1.34 -0.04 0.00 0.27 0.00 0.00 31.44 30.34 1hqm n GLU 107 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1hqm n VAL 108 N 1.13 0.00 -3.00 6.31 0.31 -0.95 -4.73 118.33 117.39 1hqm n VAL 108 Ca 0.22 -0.49 -0.33 0.00 -0.01 0.00 0.00 64.34 63.73 1hqm n VAL 108 Cb 0.56 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 33.43 1hqm n VAL 108 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1hqm s ARG 109 N 5.17 4.11 0.39 5.55 3.03 -1.26 -2.14 118.95 133.80 1hqm s ARG 109 Ca 0.21 0.87 0.21 0.00 2.03 0.00 0.00 55.73 59.05 1hqm s ARG 109 Cb -0.13 -2.34 0.74 0.00 -1.03 0.00 0.00 34.95 32.18 1hqm s ARG 109 CO 0.09 0.09 0.90 0.00 -1.13 0.00 0.00 175.30 175.24 1hqm n ALA 110 N -0.44 0.81 0.19 7.88 0.00 0.16 -1.46 120.51 127.65 1hqm n ALA 110 Ca 0.05 0.28 -0.16 0.00 0.00 0.00 0.00 53.44 53.61 1hqm n ALA 110 Cb 0.53 -0.48 -0.08 0.00 0.00 0.00 0.00 19.45 19.42 1hqm n ALA 110 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1hqm h VAL 111 N 0.00 0.16 0.00 0.00 2.07 -1.83 -2.30 116.25 114.36 1hqm h VAL 111 Ca 0.40 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.92 1hqm h VAL 111 Cb 2.08 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 32.02 1hqm h VAL 111 CO -0.00 0.00 0.00 0.47 0.02 0.00 0.00 177.57 178.06 1hqm n ASP 112 N -5.49 0.00 -4.56 0.57 10.43 -0.54 -4.40 116.55 112.57 1hqm n ASP 112 Ca -0.09 0.00 -0.33 0.00 2.57 0.00 0.00 54.79 56.94 1hqm n ASP 112 Cb 0.39 0.00 -0.04 0.00 1.84 0.00 0.00 41.12 43.31 1hqm n ASP 112 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 1hqm s PHE 113 N -1.30 2.15 0.00 1.24 0.40 -0.87 -4.80 117.98 114.80 1hqm s PHE 113 Ca 0.00 -0.07 0.00 0.00 -0.60 0.00 0.00 56.93 56.26 1hqm s PHE 113 Cb 0.00 -4.31 0.00 0.00 0.51 0.00 0.00 43.02 39.22 1hqm s PHE 113 CO 0.00 -1.74 0.00 -2.37 0.70 0.00 0.00 175.22 171.81 1hqm n THR 114 N 7.42 0.00 -1.71 0.64 5.66 -1.20 -4.77 114.28 120.31 1hqm n THR 114 Ca 0.39 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 61.01 1hqm n THR 114 Cb 0.48 0.00 0.05 0.00 -1.55 0.00 0.00 70.33 69.31 1hqm n THR 114 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1hqm n PRO 115 N 0.00 1.36 -3.55 1.09 -0.04 -1.26 -4.76 135.00 127.83 1hqm n PRO 115 Ca 0.00 0.51 0.00 0.00 -0.04 0.00 0.00 63.50 63.98 1hqm n PRO 115 Cb 0.00 -2.48 -0.06 0.00 -0.04 0.00 0.00 33.50 30.92 1hqm n PRO 115 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1hqm s SER 116 N -1.12 -0.35 0.00 3.54 1.04 -1.26 -5.08 113.70 110.47 1hqm s SER 116 Ca 0.76 0.54 0.00 0.00 0.48 0.00 0.00 55.95 57.73 1hqm s SER 116 Cb -0.41 1.23 0.00 0.00 0.10 0.00 0.00 66.02 66.94 1hqm s SER 116 CO 0.46 -0.08 0.00 0.00 0.98 0.00 0.00 173.24 174.60 1hqm n ALA 117 N 3.87 0.00 -1.86 5.32 0.00 -1.26 -3.02 120.51 123.56 1hqm n ALA 117 Ca -0.15 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 52.89 1hqm n ALA 117 Cb 0.56 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.98 1hqm n ALA 117 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1hqm n ASP 118 N -2.01 3.63 -3.69 0.00 8.00 -1.26 -4.84 116.55 116.38 1hqm n ASP 118 Ca 0.00 -2.79 -0.14 0.00 0.71 0.00 0.00 54.79 52.57 1hqm n ASP 118 Cb 0.00 -1.56 -0.08 0.00 -0.02 0.00 0.00 41.12 39.46 1hqm n ASP 118 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1hqm s VAL 119 N 5.46 0.02 0.10 2.53 1.01 -1.17 -4.24 120.40 124.11 1hqm s VAL 119 Ca 0.56 -0.17 0.03 0.00 0.00 0.00 0.00 61.98 62.40 1hqm s VAL 119 Cb 0.09 -0.71 -0.04 0.00 0.00 0.00 0.00 36.38 35.72 1hqm s VAL 119 CO 0.05 -0.10 -0.09 -1.61 0.00 0.00 0.00 175.10 173.35 1hqm s GLU 120 N -0.61 0.84 -0.70 2.72 2.02 -1.15 -4.76 118.70 117.05 1hqm s GLU 120 Ca -0.07 -1.18 0.04 0.00 0.02 0.00 0.00 54.97 53.78 1hqm s GLU 120 Cb -0.03 -0.48 0.28 0.00 0.10 0.00 0.00 34.13 33.99 1hqm s GLU 120 CO 0.04 0.07 0.93 -0.89 0.02 0.00 0.00 175.26 175.42 1hqm n ILE 121 N 0.46 3.05 -0.06 -1.63 2.08 -1.26 -2.31 119.36 119.70 1hqm n ILE 121 Ca -0.15 -5.42 0.00 0.00 0.56 0.00 0.00 62.75 57.74 1hqm n ILE 121 Cb 0.58 -1.95 0.01 0.00 -0.75 0.00 0.00 39.64 37.53 1hqm n ILE 121 CO 0.00 0.00 0.00 0.23 0.56 0.00 0.00 176.55 177.34 1hqm n MET 122 N 0.68 -0.03 -3.23 0.38 2.81 -1.16 -1.39 117.12 115.18 1hqm n MET 122 Ca 0.30 0.24 -0.39 0.00 -1.81 0.00 0.00 57.70 56.04 1hqm n MET 122 Cb 0.39 -0.36 -0.02 0.00 -0.71 0.00 0.00 33.22 32.52 1hqm n MET 122 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 1hqm n ASN 123 N -4.24 5.47 -3.68 7.83 6.94 -1.25 -5.04 115.26 121.29 1hqm n ASN 123 Ca 0.02 -3.33 0.00 0.00 -0.02 0.00 0.00 54.58 51.25 1hqm n ASN 123 Cb 0.07 -1.14 0.00 0.00 -2.36 0.00 0.00 39.78 36.35 1hqm n ASN 123 CO 0.00 0.00 0.00 -0.81 -1.03 0.00 0.00 177.26 175.42 1hqm n PRO 124 N 1.56 2.08 0.00 -0.53 -0.04 -0.49 -4.31 135.00 133.27 1hqm n PRO 124 Ca 0.26 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.72 1hqm n PRO 124 Cb 0.36 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.82 1hqm n PRO 124 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1hqm n ASP 125 N 0.00 0.00 -3.46 3.54 8.00 -1.26 -4.66 116.55 118.70 1hqm n ASP 125 Ca 0.00 0.00 -0.20 0.00 0.71 0.00 0.00 54.79 55.30 1hqm n ASP 125 Cb 0.00 0.00 0.06 0.00 -0.02 0.00 0.00 41.12 41.16 1hqm n ASP 125 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1hqm n LEU 126 N 0.00 -4.26 -1.10 0.64 7.94 -1.26 0.39 117.00 119.35 1hqm n LEU 126 Ca 0.00 -0.78 -0.06 0.00 -1.11 0.00 0.00 56.01 54.06 1hqm n LEU 126 Cb 0.00 -2.92 -0.05 0.00 0.53 0.00 0.00 43.42 40.98 1hqm n LEU 126 CO 0.00 0.29 0.52 1.57 -1.11 0.00 0.00 177.39 178.66 1hqm n HIS 127 N -3.81 0.03 0.10 1.96 -0.00 -1.26 -2.89 115.22 109.34 1hqm n HIS 127 Ca -0.16 0.02 -0.14 0.00 -0.00 0.00 0.00 57.72 57.43 1hqm n HIS 127 Cb 0.64 -0.21 -0.12 0.00 -0.00 0.00 0.00 29.99 30.29 1hqm n HIS 127 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.34 177.16 1hqm h ILE 128 N 1.76 1.52 -1.10 3.57 2.04 -1.68 -3.47 117.51 120.15 1hqm h ILE 128 Ca 0.01 -3.04 0.19 0.00 1.00 0.00 0.00 64.86 63.01 1hqm h ILE 128 Cb 0.29 2.88 -0.31 0.00 -0.74 0.00 0.00 36.82 38.93 1hqm h ILE 128 CO 0.39 0.89 0.65 0.00 0.00 0.00 0.00 178.15 180.07 1hqm s ALA 129 N -2.73 -2.63 -1.26 1.87 0.00 -0.91 -4.71 121.76 111.40 1hqm s ALA 129 Ca -0.03 2.02 -0.09 0.00 0.00 0.00 0.00 51.96 53.85 1hqm s ALA 129 Cb 0.08 -1.95 0.18 0.00 0.00 0.00 0.00 23.12 21.42 1hqm s ALA 129 CO 0.87 -0.38 1.82 2.41 0.00 0.00 0.00 175.76 180.48 1hqm n THR 130 N 3.36 4.45 -2.82 0.00 -1.04 -1.26 -2.24 114.28 114.73 1hqm n THR 130 Ca -0.17 -4.57 -0.30 0.00 -2.04 0.00 0.00 64.05 56.97 1hqm n THR 130 Cb 0.56 -2.33 -0.03 0.00 -1.82 0.00 0.00 70.33 66.71 1hqm n THR 130 CO 0.00 0.00 0.00 -1.48 -0.64 0.00 0.00 175.07 172.95 1hqm s LEU 131 N -0.38 3.81 -0.12 -4.42 0.05 -1.25 -1.91 118.68 114.46 1hqm s LEU 131 Ca 0.39 1.13 -0.30 0.00 0.05 0.00 0.00 54.13 55.39 1hqm s LEU 131 Cb 0.09 -4.02 0.12 0.00 -2.05 0.00 0.00 46.19 40.33 1hqm s LEU 131 CO 0.01 -0.42 1.00 -1.83 -0.55 0.00 0.00 176.35 174.56 1hqm s GLU 132 N -3.93 0.61 0.00 1.48 -1.05 0.11 -2.84 118.70 113.08 1hqm s GLU 132 Ca 0.51 -0.03 0.00 0.00 -0.15 0.00 0.00 54.97 55.30 1hqm s GLU 132 Cb -0.10 0.29 0.00 0.00 -0.44 0.00 0.00 34.13 33.87 1hqm s GLU 132 CO 0.32 -0.23 0.00 -1.91 0.95 0.00 0.00 175.26 174.40 1hqm n GLU 133 N 0.31 0.00 -2.65 -4.83 2.13 -1.26 -4.32 120.64 110.02 1hqm n GLU 133 Ca -0.08 0.00 -0.09 0.00 0.66 0.00 0.00 57.16 57.64 1hqm n GLU 133 Cb 0.59 -0.15 0.03 0.00 0.27 0.00 0.00 31.44 32.19 1hqm n GLU 133 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1hqm n GLY 134 N 0.00 2.39 3.44 8.31 0.00 -1.26 -4.86 105.19 113.21 1hqm n GLY 134 Ca 0.00 -1.48 -0.14 0.00 0.00 0.00 0.00 46.02 44.41 1hqm n GLY 134 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hqm n GLY 135 N -0.30 -0.29 3.13 -0.02 0.00 -1.14 -4.66 105.19 101.91 1hqm n GLY 135 Ca 0.14 0.11 -0.29 0.00 0.00 0.00 0.00 46.02 45.98 1hqm n GLY 135 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1hqm s LYS 136 N 7.52 2.47 0.00 1.61 2.47 -1.17 -2.30 119.74 130.34 1hqm s LYS 136 Ca 0.86 -0.68 0.00 0.00 -1.56 0.00 0.00 55.97 54.59 1hqm s LYS 136 Cb -0.32 -1.93 0.00 0.00 -1.46 0.00 0.00 37.83 34.12 1hqm s LYS 136 CO 0.24 0.10 0.00 -0.11 0.16 0.00 0.00 175.35 175.74 1hqm n LEU 137 N 3.69 0.00 -1.86 5.43 7.94 -1.22 -4.82 117.00 126.16 1hqm n LEU 137 Ca -0.21 0.00 -0.26 0.00 -1.11 0.00 0.00 56.01 54.43 1hqm n LEU 137 Cb 0.52 0.00 -0.05 0.00 0.53 0.00 0.00 43.42 44.42 1hqm n LEU 137 CO 0.27 0.17 0.69 0.00 -1.11 0.00 0.00 177.39 177.40 1hqm n TYR 138 N 0.00 0.55 -4.58 1.96 9.36 -1.23 -4.56 117.16 118.65 1hqm n TYR 138 Ca 0.00 0.36 -0.26 0.00 3.32 0.00 0.00 57.90 61.32 1hqm n TYR 138 Cb 0.21 -0.97 -0.10 0.00 -0.63 0.00 0.00 39.34 37.85 1hqm n TYR 138 CO 0.00 0.00 0.00 -1.64 0.22 0.00 0.00 176.86 175.44 1hqm s MET 139 N 2.31 1.90 -0.29 2.98 -1.94 0.99 -1.27 119.30 123.97 1hqm s MET 139 Ca 0.50 -2.11 0.02 0.00 -1.71 0.00 0.00 55.69 52.39 1hqm s MET 139 Cb -0.64 -1.23 0.16 0.00 2.01 0.00 0.00 34.83 35.13 1hqm s MET 139 CO 0.30 -0.21 0.41 -1.21 -0.01 0.00 0.00 175.02 174.30 1hqm s GLU 140 N -3.80 0.43 -0.14 2.03 2.02 -0.05 -3.19 118.70 115.99 1hqm s GLU 140 Ca 0.29 0.10 -0.04 0.00 0.02 0.00 0.00 54.97 55.33 1hqm s GLU 140 Cb 0.07 -0.31 -0.03 0.00 0.10 0.00 0.00 34.13 33.96 1hqm s GLU 140 CO 0.14 -1.04 0.01 0.54 0.02 0.00 0.00 175.26 174.93 1hqm s VAL 141 N 2.50 4.35 0.00 2.63 0.11 -1.24 -1.06 120.40 127.69 1hqm s VAL 141 Ca 0.10 -0.21 0.00 0.00 -2.93 0.00 0.00 61.98 58.94 1hqm s VAL 141 Cb -0.12 -2.90 0.00 0.00 -1.53 0.00 0.00 36.38 31.83 1hqm s VAL 141 CO -0.29 0.52 0.00 -1.14 -3.33 0.00 0.00 175.10 170.86 1hqm n ARG 142 N 3.05 2.12 0.00 1.54 3.00 0.22 -2.61 116.66 123.99 1hqm n ARG 142 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.67 1hqm n ARG 142 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.99 1hqm n ARG 142 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.63 178.96 1hqm n VAL 143 N -0.11 0.00 -2.99 5.15 0.24 -1.03 -4.46 118.33 115.13 1hqm n VAL 143 Ca 0.00 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 62.01 1hqm n VAL 143 Cb 0.00 0.00 -0.03 0.00 -1.47 0.00 0.00 33.84 32.34 1hqm n VAL 143 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1hqm s ASP 144 N 0.00 6.44 0.73 -1.34 1.11 -0.96 -2.80 116.67 119.86 1hqm s ASP 144 Ca 0.00 0.94 -0.11 0.00 0.18 0.00 0.00 52.55 53.56 1hqm s ASP 144 Cb 0.00 -2.24 0.03 0.00 1.07 0.00 0.00 42.92 41.78 1hqm s ASP 144 CO 0.00 -0.36 1.08 -0.60 1.18 0.00 0.00 175.17 176.47 1hqm s ARG 145 N -3.93 2.67 0.00 8.23 3.52 -1.26 -3.27 118.95 124.91 1hqm s ARG 145 Ca 0.48 0.70 0.00 0.00 -0.13 0.00 0.00 55.73 56.77 1hqm s ARG 145 Cb -0.10 -1.98 0.00 0.00 -1.56 0.00 0.00 34.95 31.31 1hqm s ARG 145 CO 0.33 -1.23 0.00 0.41 -0.81 0.00 0.00 175.30 174.01 1hqm n GLY 146 N -2.35 -1.22 3.22 8.12 0.00 -0.98 -4.95 105.19 107.03 1hqm n GLY 146 Ca 0.07 -0.91 -0.10 0.00 0.00 0.00 0.00 46.02 45.07 1hqm n GLY 146 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hqm s VAL 147 N -2.57 -0.25 0.00 1.61 1.01 -1.26 -1.25 120.40 117.69 1hqm s VAL 147 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.12 1hqm s VAL 147 Cb 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 36.38 35.79 1hqm s VAL 147 CO 0.00 0.06 0.00 0.61 0.00 0.00 0.00 175.10 175.77 1hqm n GLY 148 N 4.71 -0.76 3.43 4.51 0.00 -1.26 -4.85 105.19 110.97 1hqm n GLY 148 Ca -0.17 -1.19 -0.33 0.00 0.00 0.00 0.00 46.02 44.33 1hqm n GLY 148 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1hqm s TYR 149 N 0.00 2.90 -0.15 1.61 5.04 -1.26 -2.01 117.35 123.47 1hqm s TYR 149 Ca 0.00 -0.49 -0.06 0.00 -2.44 0.00 0.00 57.07 54.08 1hqm s TYR 149 Cb 0.00 -1.88 0.07 0.00 0.35 0.00 0.00 41.96 40.49 1hqm s TYR 149 CO 0.00 -0.12 0.33 0.08 -1.34 0.00 0.00 175.55 174.49 1hqm s VAL 150 N 0.31 -0.33 0.00 3.14 1.01 -0.88 -5.05 120.40 118.61 1hqm s VAL 150 Ca -0.08 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.10 1hqm s VAL 150 Cb -0.15 -0.52 0.00 0.00 0.00 0.00 0.00 36.38 35.71 1hqm s VAL 150 CO 0.05 0.08 0.00 -0.81 0.00 0.00 0.00 175.10 174.42 1hqm n PRO 151 N 4.95 3.72 -1.21 2.72 -0.05 -1.26 -0.32 135.00 143.55 1hqm n PRO 151 Ca -0.13 0.00 -0.21 0.00 -0.05 0.00 0.00 63.50 63.10 1hqm n PRO 151 Cb 0.51 0.00 -0.17 0.00 -0.05 0.00 0.00 33.50 33.79 1hqm n PRO 151 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 1hqm n ALA 152 N -3.00 0.75 0.02 0.55 0.00 -1.26 -2.82 120.51 114.75 1hqm n ALA 152 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 52.89 1hqm n ALA 152 Cb 0.00 -1.91 0.00 0.00 0.00 0.00 0.00 19.45 17.54 1hqm n ALA 152 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1hqm n GLU 153 N 5.03 0.00 -1.62 0.00 2.13 -1.26 -4.99 120.64 119.93 1hqm n GLU 153 Ca 0.54 0.00 -0.36 0.00 0.66 0.00 0.00 57.16 58.00 1hqm n GLU 153 Cb 0.09 0.00 -0.06 0.00 0.27 0.00 0.00 31.44 31.74 1hqm n GLU 153 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 1hqm n ARG 154 N -2.69 1.58 -1.59 5.31 0.63 -1.13 -4.90 116.66 113.88 1hqm n ARG 154 Ca 0.00 -2.17 -0.47 0.00 -0.92 0.00 0.00 57.85 54.29 1hqm n ARG 154 Cb 0.00 -3.32 -0.03 0.00 0.45 0.00 0.00 32.46 29.56 1hqm n ARG 154 CO 0.00 0.00 0.00 1.58 -2.51 0.00 0.00 177.63 176.70 1hqm n HIS 155 N 10.83 1.36 -2.52 -0.14 -0.00 -1.26 -4.89 115.22 118.60 1hqm n HIS 155 Ca 0.47 0.66 -0.41 0.00 -0.00 0.00 0.00 57.72 58.45 1hqm n HIS 155 Cb 0.43 -2.29 0.01 0.00 -0.00 0.00 0.00 29.99 28.15 1hqm n HIS 155 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1hqm n GLY 156 N 1.77 5.90 0.00 1.57 0.00 -1.26 -4.88 105.19 108.30 1hqm n GLY 156 Ca 0.13 -2.47 0.00 0.00 0.00 0.00 0.00 46.02 43.68 1hqm n GLY 156 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1hqm n ILE 157 N 0.40 0.00 0.00 -0.61 3.06 -1.26 -4.60 119.36 116.35 1hqm n ILE 157 Ca 0.49 0.53 0.00 0.00 -2.50 0.00 0.00 62.75 61.27 1hqm n ILE 157 Cb 0.26 -1.32 0.00 0.00 0.54 0.00 0.00 39.64 39.12 1hqm n ILE 157 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34 1hqm n LYS 158 N -0.04 0.00 -0.95 9.51 4.76 -1.26 -3.30 118.16 126.88 1hqm n LYS 158 Ca 0.00 0.00 -0.35 0.00 -2.87 0.00 0.00 58.31 55.09 1hqm n LYS 158 Cb 0.00 0.00 -0.04 0.00 -1.84 0.00 0.00 35.03 33.15 1hqm n LYS 158 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1hqm n ASP 159 N 6.87 3.19 -3.19 4.39 -0.08 -1.26 -4.83 116.55 121.65 1hqm n ASP 159 Ca 0.00 -2.53 -0.13 0.00 -1.51 0.00 0.00 54.79 50.62 1hqm n ASP 159 Cb 0.00 -1.07 -0.13 0.00 2.34 0.00 0.00 41.12 42.26 1hqm n ASP 159 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1hqm n ARG 160 N 6.02 0.00 0.00 -0.67 1.74 -1.21 -3.29 116.66 119.25 1hqm n ARG 160 Ca 0.46 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.54 1hqm n ARG 160 Cb 0.30 -0.72 0.00 0.00 -1.02 0.00 0.00 32.46 31.01 1hqm n ARG 160 CO 0.00 0.00 0.00 1.51 -1.52 0.00 0.00 177.63 177.62 1hqm n ILE 161 N 3.84 0.00 -2.45 0.55 3.06 -1.26 -4.99 119.36 118.10 1hqm n ILE 161 Ca 0.39 0.00 0.02 0.00 -2.50 0.00 0.00 62.75 60.66 1hqm n ILE 161 Cb 0.15 0.00 0.05 0.00 0.54 0.00 0.00 39.64 40.38 1hqm n ILE 161 CO 0.00 0.00 0.00 0.59 -2.50 0.00 0.00 176.55 174.64 1hqm n ASN 162 N 0.00 1.39 -0.29 9.51 3.02 -1.21 -4.89 115.26 122.79 1hqm n ASN 162 Ca 0.00 -2.31 0.25 0.00 -0.03 0.00 0.00 54.58 52.50 1hqm n ASN 162 Cb 0.00 -0.37 0.59 0.00 -0.61 0.00 0.00 39.78 39.38 1hqm n ASN 162 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1hqm h ALA 163 N 1.42 2.48 -7.00 5.41 0.00 -1.77 -3.41 119.26 116.39 1hqm h ALA 163 Ca -0.16 0.02 -0.52 0.00 0.00 0.00 0.00 54.91 54.26 1hqm h ALA 163 Cb 1.63 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 19.41 1hqm h ALA 163 CO 0.14 -0.83 -0.86 0.44 0.00 0.00 0.00 179.25 178.13 1hqm n ILE 164 N -4.47 -1.94 -1.35 0.00 -5.35 -1.26 -2.40 119.36 102.59 1hqm n ILE 164 Ca 0.23 -0.49 -0.46 0.00 -0.27 0.00 0.00 62.75 61.76 1hqm n ILE 164 Cb 0.93 -1.67 -0.03 0.00 -1.74 0.00 0.00 39.64 37.13 1hqm n ILE 164 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 1hqm n PRO 165 N -4.40 0.00 -3.42 6.28 -0.04 -1.26 -4.13 135.00 128.03 1hqm n PRO 165 Ca -0.13 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.13 1hqm n PRO 165 Cb 0.50 -0.97 -0.02 0.00 -0.04 0.00 0.00 33.50 32.97 1hqm n PRO 165 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1hqm s VAL 166 N -1.01 2.88 0.56 0.52 1.01 -0.29 -4.91 120.40 119.16 1hqm s VAL 166 Ca 0.62 -1.23 -0.17 0.00 0.00 0.00 0.00 61.98 61.19 1hqm s VAL 166 Cb -0.89 -3.03 -0.05 0.00 0.00 0.00 0.00 36.38 32.41 1hqm s VAL 166 CO 0.55 -0.02 1.06 -1.81 0.00 0.00 0.00 175.10 174.87 1hqm s ASP 167 N -4.19 5.95 -0.36 3.32 1.01 -1.26 -4.60 116.67 116.54 1hqm s ASP 167 Ca 0.49 1.88 -0.10 0.00 0.71 0.00 0.00 52.55 55.53 1hqm s ASP 167 Cb -0.06 -2.55 0.03 0.00 1.01 0.00 0.00 42.92 41.35 1hqm s ASP 167 CO 0.29 -1.05 0.18 0.00 0.21 0.00 0.00 175.17 174.81 1hqm s ALA 168 N -2.26 3.24 -0.58 5.23 0.00 0.56 -4.63 121.76 123.33 1hqm s ALA 168 Ca 0.65 -1.69 0.04 0.00 0.00 0.00 0.00 51.96 50.97 1hqm s ALA 168 Cb -0.17 -2.52 0.14 0.00 0.00 0.00 0.00 23.12 20.58 1hqm s ALA 168 CO 0.31 -1.32 0.34 0.42 0.00 0.00 0.00 175.76 175.50 1hqm s ILE 169 N 1.54 2.60 0.00 0.00 -1.09 -1.26 -2.06 121.20 120.92 1hqm s ILE 169 Ca 0.02 -3.60 0.00 0.00 -2.23 0.00 0.00 60.65 54.84 1hqm s ILE 169 Cb -0.19 -2.77 0.00 0.00 -1.58 0.00 0.00 42.46 37.92 1hqm s ILE 169 CO 0.06 -0.88 0.18 0.49 -1.23 0.00 0.00 174.94 173.56 1hqm n PHE 170 N 2.74 0.00 0.00 3.97 3.72 -0.85 -4.65 117.46 122.39 1hqm n PHE 170 Ca 0.10 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.50 1hqm n PHE 170 Cb 0.33 -0.22 0.00 0.00 -0.94 0.00 0.00 39.48 38.65 1hqm n PHE 170 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1hqm n SER 171 N -1.16 0.00 0.15 4.37 2.88 -1.25 -4.18 113.62 114.43 1hqm n SER 171 Ca 0.00 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.67 1hqm n SER 171 Cb 0.00 0.00 0.50 0.00 -0.75 0.00 0.00 64.21 63.96 1hqm n SER 171 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1hqm h PRO 172 N 0.00 0.00 -6.74 -1.46 0.13 -1.81 -3.44 132.00 118.67 1hqm h PRO 172 Ca 0.00 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.64 1hqm h PRO 172 Cb 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.11 1hqm h PRO 172 CO 0.00 0.00 0.35 0.08 -0.23 0.00 0.00 178.00 178.20 1hqm s VAL 173 N -3.34 4.09 -0.95 1.56 1.01 -1.26 -0.16 120.40 121.35 1hqm s VAL 173 Ca 0.05 2.09 0.08 0.00 0.00 0.00 0.00 61.98 64.19 1hqm s VAL 173 Cb 0.10 -4.33 0.07 0.00 0.00 0.00 0.00 36.38 32.22 1hqm s VAL 173 CO 0.46 0.49 0.77 0.54 0.00 0.00 0.00 175.10 177.36 1hqm n ARG 174 N 1.55 0.23 0.00 2.72 5.12 0.81 -4.91 116.66 122.18 1hqm n ARG 174 Ca -0.02 -1.01 0.00 0.00 -1.93 0.00 0.00 57.85 54.89 1hqm n ARG 174 Cb 0.47 -1.15 0.00 0.00 -1.16 0.00 0.00 32.46 30.62 1hqm n ARG 174 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57 1hqm n ARG 175 N 0.42 0.00 -3.66 5.56 0.63 -1.26 -4.88 116.66 113.48 1hqm n ARG 175 Ca 0.05 0.00 -0.06 0.00 -0.92 0.00 0.00 57.85 56.91 1hqm n ARG 175 Cb 0.20 0.00 -0.08 0.00 0.45 0.00 0.00 32.46 33.03 1hqm n ARG 175 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1hqm s VAL 176 N -1.67 -0.73 0.00 5.15 1.01 -1.26 -0.81 120.40 122.09 1hqm s VAL 176 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.09 1hqm s VAL 176 Cb 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 36.38 35.61 1hqm s VAL 176 CO 0.00 0.05 0.00 0.00 0.00 0.00 0.00 175.10 175.15 1hqm n ALA 177 N 5.37 0.00 0.00 5.51 0.00 -1.26 -4.96 120.51 125.17 1hqm n ALA 177 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1hqm n ALA 177 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1hqm n ALA 177 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 1hqm n PHE 178 N 0.00 0.00 -2.66 0.00 1.16 -1.26 -2.93 117.46 111.76 1hqm n PHE 178 Ca 0.00 0.00 -0.22 0.00 -1.87 0.00 0.00 57.45 55.36 1hqm n PHE 178 Cb 0.00 0.00 0.03 0.00 -1.61 0.00 0.00 39.48 37.90 1hqm n PHE 178 CO 0.00 0.00 0.00 -0.65 -1.87 0.00 0.00 176.76 174.24 1hqm s GLN 179 N 0.00 2.62 -0.01 3.97 -1.52 -1.26 -4.94 119.66 118.51 1hqm s GLN 179 Ca 0.00 -0.68 0.01 0.00 -1.95 0.00 0.00 55.36 52.74 1hqm s GLN 179 Cb 0.00 -2.47 0.01 0.00 -0.22 0.00 0.00 33.01 30.33 1hqm s GLN 179 CO 0.00 -0.67 0.86 0.28 -0.25 0.00 0.00 175.29 175.50 1hqm n VAL 180 N -2.34 0.72 -0.01 1.09 0.31 -1.26 -3.81 118.33 113.03 1hqm n VAL 180 Ca 0.07 -0.74 -0.00 0.00 -0.01 0.00 0.00 64.34 63.65 1hqm n VAL 180 Cb 0.59 0.61 -0.00 0.00 -0.91 0.00 0.00 33.84 34.14 1hqm n VAL 180 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1hqm n GLU 181 N -0.38 0.00 -3.66 5.55 1.02 -1.23 -2.72 120.64 119.22 1hqm n GLU 181 Ca 0.01 0.00 -0.39 0.00 -0.02 0.00 0.00 57.16 56.75 1hqm n GLU 181 Cb 0.35 -0.01 -0.11 0.00 -0.02 0.00 0.00 31.44 31.65 1hqm n GLU 181 CO 0.00 0.00 0.00 0.16 1.18 0.00 0.00 177.13 178.47 1hqm s ASP 182 N 0.02 5.54 -0.39 1.62 -4.77 -1.26 -3.28 116.67 114.14 1hqm s ASP 182 Ca 0.01 -1.27 0.07 0.00 -3.30 0.00 0.00 52.55 48.06 1hqm s ASP 182 Cb -0.01 -1.95 0.32 0.00 -1.09 0.00 0.00 42.92 40.19 1hqm s ASP 182 CO 0.01 -0.43 1.27 1.07 0.70 0.00 0.00 175.17 177.79 1hqm n THR 183 N 4.89 0.00 -4.43 2.11 5.66 -1.26 -5.06 114.28 116.19 1hqm n THR 183 Ca -0.11 -1.33 -0.21 0.00 -3.05 0.00 0.00 64.05 59.35 1hqm n THR 183 Cb 0.44 1.01 -0.11 0.00 -1.55 0.00 0.00 70.33 70.13 1hqm n THR 183 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 1hqm s ARG 184 N 0.18 1.59 0.00 1.09 1.81 -1.26 -5.14 118.95 117.22 1hqm s ARG 184 Ca 0.19 -1.86 0.00 0.00 -1.72 0.00 0.00 55.73 52.34 1hqm s ARG 184 Cb 0.32 -0.90 0.00 0.00 -0.45 0.00 0.00 34.95 33.92 1hqm s ARG 184 CO -0.08 -0.13 0.00 1.47 -0.68 0.00 0.00 175.30 175.89 1hqm n LEU 185 N -0.63 0.00 0.00 2.53 -0.00 -1.26 -4.82 117.00 112.81 1hqm n LEU 185 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.98 1hqm n LEU 185 Cb 0.66 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.08 1hqm n LEU 185 CO 0.41 0.00 0.00 0.61 -0.00 0.00 0.00 177.39 178.41 1hqm n GLY 186 N 5.00 1.14 2.76 1.47 0.00 -1.26 -4.59 105.19 109.71 1hqm n GLY 186 Ca 0.00 -0.60 -0.07 0.00 0.00 0.00 0.00 46.02 45.35 1hqm n GLY 186 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1hqm s GLN 187 N 0.00 1.01 0.00 1.61 -0.21 -1.26 -4.91 119.66 115.90 1hqm s GLN 187 Ca 0.00 -1.11 0.00 0.00 0.02 0.00 0.00 55.36 54.27 1hqm s GLN 187 Cb 0.00 -0.25 0.00 0.00 1.00 0.00 0.00 33.01 33.76 1hqm s GLN 187 CO 0.00 -1.32 0.00 -2.13 -2.12 0.00 0.00 175.29 169.72 1hqm n ARG 188 N 3.14 0.00 -1.95 2.91 0.63 -1.26 -4.81 116.66 115.32 1hqm n ARG 188 Ca 0.19 0.00 -0.24 0.00 -0.92 0.00 0.00 57.85 56.87 1hqm n ARG 188 Cb 0.55 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 33.40 1hqm n ARG 188 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 1hqm s THR 189 N -0.85 3.38 0.00 5.15 2.01 -1.26 -3.96 115.64 120.11 1hqm s THR 189 Ca 0.00 -0.41 0.00 0.00 0.31 0.00 0.00 61.69 61.59 1hqm s THR 189 Cb 0.00 -3.97 0.00 0.00 0.01 0.00 0.00 72.50 68.54 1hqm s THR 189 CO 0.00 -0.76 0.00 -0.67 -0.69 0.00 0.00 174.62 172.50 1hqm n ASP 190 N 15.10 0.00 -4.23 3.53 -0.08 -1.26 -5.14 116.55 124.48 1hqm n ASP 190 Ca 0.42 0.00 -0.30 0.00 -1.51 0.00 0.00 54.79 53.40 1hqm n ASP 190 Cb 0.46 0.15 0.20 0.00 2.34 0.00 0.00 41.12 44.27 1hqm n ASP 190 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1hqm n LEU 191 N -2.16 -2.10 -4.73 -2.67 -0.00 -1.25 -4.55 117.00 99.54 1hqm n LEU 191 Ca 0.00 -0.21 -0.24 0.00 -0.00 0.00 0.00 56.01 55.56 1hqm n LEU 191 Cb 0.00 -1.01 -0.07 0.00 -0.00 0.00 0.00 43.42 42.34 1hqm n LEU 191 CO 0.00 -3.24 -0.18 1.51 -0.00 0.00 0.00 177.39 175.48 1hqm s ASP 192 N -2.04 4.48 -0.25 1.45 -4.77 -0.72 -4.71 116.67 110.10 1hqm s ASP 192 Ca 0.59 -0.98 -0.03 0.00 -3.30 0.00 0.00 52.55 48.83 1hqm s ASP 192 Cb -0.15 -0.55 0.08 0.00 -1.09 0.00 0.00 42.92 41.21 1hqm s ASP 192 CO 0.63 -0.45 0.09 -0.75 0.70 0.00 0.00 175.17 175.40 1hqm s LYS 193 N -3.87 0.41 0.00 2.11 2.20 -1.10 -2.57 119.74 116.91 1hqm s LYS 193 Ca 0.40 -0.56 0.00 0.00 -0.36 0.00 0.00 55.97 55.45 1hqm s LYS 193 Cb 0.01 -1.71 0.00 0.00 -1.51 0.00 0.00 37.83 34.62 1hqm s LYS 193 CO 0.22 -0.86 0.00 -0.11 -0.36 0.00 0.00 175.35 174.25 1hqm n LEU 194 N 5.11 0.00 0.00 5.43 0.00 -1.26 -3.48 117.00 122.80 1hqm n LEU 194 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 56.01 55.95 1hqm n LEU 194 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.86 1hqm n LEU 194 CO 0.09 -0.94 0.00 1.07 0.00 0.00 0.00 177.39 177.61 1hqm n THR 195 N -1.93 0.00 -1.66 1.96 5.66 -1.25 -4.39 114.28 112.68 1hqm n THR 195 Ca 0.00 0.00 -0.44 0.00 -3.05 0.00 0.00 64.05 60.56 1hqm n THR 195 Cb 0.00 0.00 -0.01 0.00 -1.55 0.00 0.00 70.33 68.77 1hqm n THR 195 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1hqm n LEU 196 N 0.00 2.91 0.05 1.09 -0.00 -1.19 -4.24 117.00 115.61 1hqm n LEU 196 Ca 0.00 1.19 -0.22 0.00 -0.00 0.00 0.00 56.01 56.97 1hqm n LEU 196 Cb 0.00 -1.41 -0.15 0.00 -0.00 0.00 0.00 43.42 41.86 1hqm n LEU 196 CO 0.00 -0.77 -0.64 0.03 -0.00 0.00 0.00 177.39 176.01 1hqm h ARG 197 N 2.72 0.35 -5.81 1.47 3.08 -1.72 0.25 114.38 114.72 1hqm h ARG 197 Ca -0.44 -0.59 -0.16 0.00 0.07 0.00 0.00 59.98 58.86 1hqm h ARG 197 Cb 1.30 0.22 0.00 0.00 0.08 0.00 0.00 29.97 31.57 1hqm h ARG 197 CO 0.65 1.28 -0.59 -0.89 -1.07 0.00 0.00 179.97 179.35 1hqm n ILE 198 N -3.57 -8.12 -0.78 2.04 -0.00 -1.26 -1.86 119.36 105.82 1hqm n ILE 198 Ca -0.27 0.25 -0.19 0.00 -0.00 0.00 0.00 62.75 62.53 1hqm n ILE 198 Cb 1.06 -5.72 0.17 0.00 -0.00 0.00 0.00 39.64 35.14 1hqm n ILE 198 CO 0.00 0.00 0.00 1.87 -0.00 0.00 0.00 176.55 178.42 1hqm n TRP 199 N -1.11 -3.53 0.00 1.39 -0.00 0.01 -3.01 117.44 111.18 1hqm n TRP 199 Ca -0.03 -0.63 0.00 0.00 -0.00 0.00 0.00 57.50 56.84 1hqm n TRP 199 Cb 0.56 -0.74 0.00 0.00 -0.00 0.00 0.00 31.31 31.12 1hqm n TRP 199 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 177.69 180.10 1hqm n THR 200 N -4.12 0.00 -3.94 5.87 -1.04 -1.26 -4.21 114.28 105.58 1hqm n THR 200 Ca 0.10 0.00 -0.09 0.00 -2.04 0.00 0.00 64.05 62.02 1hqm n THR 200 Cb 0.38 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 68.86 1hqm n THR 200 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 1hqm s ASP 201 N 0.00 -0.10 0.00 8.00 1.11 -1.25 -0.13 116.67 124.30 1hqm s ASP 201 Ca 0.00 -0.85 0.00 0.00 0.18 0.00 0.00 52.55 51.88 1hqm s ASP 201 Cb 0.00 0.66 0.00 0.00 1.07 0.00 0.00 42.92 44.65 1hqm s ASP 201 CO 0.00 -1.26 0.00 0.61 1.18 0.00 0.00 175.17 175.70 1hqm n GLY 202 N -0.43 1.28 0.00 0.21 0.00 0.77 -4.89 105.19 102.13 1hqm n GLY 202 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1hqm n GLY 202 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1hqm n SER 203 N -0.14 0.00 -4.20 1.61 3.41 -1.26 -4.94 113.62 108.11 1hqm n SER 203 Ca 0.00 0.00 -0.36 0.00 -0.26 0.00 0.00 58.87 58.25 1hqm n SER 203 Cb 0.00 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.01 1hqm n SER 203 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 1hqm n VAL 204 N -0.71 0.26 -4.21 -3.33 3.14 -1.26 -4.87 118.33 107.35 1hqm n VAL 204 Ca 0.00 -0.42 -0.34 0.00 -2.96 0.00 0.00 64.34 60.62 1hqm n VAL 204 Cb 0.00 -0.25 -0.08 0.00 -1.06 0.00 0.00 33.84 32.45 1hqm n VAL 204 CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 1hqm s THR 205 N -2.08 4.59 0.00 1.55 2.01 -1.26 -4.53 115.64 115.93 1hqm s THR 205 Ca 0.50 -0.28 0.00 0.00 0.31 0.00 0.00 61.69 62.22 1hqm s THR 205 Cb -0.26 -3.01 0.00 0.00 0.01 0.00 0.00 72.50 69.24 1hqm s THR 205 CO 0.74 0.50 0.38 -2.65 -0.69 0.00 0.00 174.62 172.90 1hqm n PRO 206 N 1.72 0.00 -0.25 4.92 -0.02 -1.26 0.14 135.00 140.25 1hqm n PRO 206 Ca -0.17 0.38 0.07 0.00 -2.02 0.00 0.00 63.50 61.77 1hqm n PRO 206 Cb 0.53 -0.60 0.15 0.00 -0.02 0.00 0.00 33.50 33.57 1hqm n PRO 206 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1hqm n LEU 207 N -2.10 -0.17 -0.02 2.45 7.94 -1.26 0.22 117.00 124.06 1hqm n LEU 207 Ca 0.00 1.21 -0.11 0.00 -1.11 0.00 0.00 56.01 56.00 1hqm n LEU 207 Cb 0.00 -0.40 -0.05 0.00 0.53 0.00 0.00 43.42 43.50 1hqm n LEU 207 CO 0.00 -1.19 0.90 -0.33 -1.11 0.00 0.00 177.39 175.65 1hqm h GLU 208 N 0.00 0.19 0.67 1.96 5.08 0.87 1.08 114.58 124.43 1hqm h GLU 208 Ca 0.38 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.69 1hqm h GLU 208 Cb 0.70 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.91 1hqm h GLU 208 CO -0.70 0.18 -0.34 0.00 -1.00 0.00 0.00 179.01 177.15 1hqm h ALA 209 N 0.99 -0.93 -0.31 3.43 0.00 0.37 0.94 119.26 123.75 1hqm h ALA 209 Ca 0.05 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 54.81 1hqm h ALA 209 Cb 0.05 0.39 -0.08 0.00 0.00 0.00 0.00 17.79 18.15 1hqm h ALA 209 CO -0.01 -1.03 -0.50 1.25 0.00 0.00 0.00 179.25 178.96 1hqm h LEU 210 N -0.93 -1.63 0.19 0.00 5.85 0.75 0.60 115.31 120.14 1hqm h LEU 210 Ca -0.09 0.22 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 1hqm h LEU 210 Cb 0.73 0.67 -0.02 0.00 0.37 0.00 0.00 40.66 42.41 1hqm h LEU 210 CO 0.13 -0.42 -0.27 0.78 -0.34 0.00 0.00 178.44 178.32 1hqm h ASN 211 N -0.44 -0.77 -1.05 1.25 4.21 0.15 -1.21 115.58 117.71 1hqm h ASN 211 Ca 0.08 0.07 0.33 0.00 1.21 0.00 0.00 56.30 58.00 1hqm h ASN 211 Cb 0.62 0.27 -0.14 0.00 -1.12 0.00 0.00 38.32 37.95 1hqm h ASN 211 CO -0.53 -0.33 0.62 1.56 -1.29 0.00 0.00 177.43 177.46 1hqm h GLN 212 N -0.48 0.29 0.57 0.81 4.20 0.12 -1.27 115.11 119.35 1hqm h GLN 212 Ca -0.02 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.65 1hqm h GLN 212 Cb 0.44 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.14 1hqm h GLN 212 CO -0.08 0.19 -0.50 0.00 -0.67 0.00 0.00 178.83 177.78 1hqm h ALA 213 N 1.79 -1.18 -0.82 3.87 0.00 0.14 -3.00 119.26 120.05 1hqm h ALA 213 Ca 0.73 -0.20 0.18 0.00 0.00 0.00 0.00 54.91 55.62 1hqm h ALA 213 Cb 1.78 0.70 -0.11 0.00 0.00 0.00 0.00 17.79 20.16 1hqm h ALA 213 CO -0.54 -1.19 0.33 -0.39 0.00 0.00 0.00 179.25 177.46 1hqm h VAL 214 N -1.04 0.56 -0.24 0.00 -1.51 -0.42 -2.34 116.25 111.27 1hqm h VAL 214 Ca -0.07 -0.14 0.03 0.00 -1.23 0.00 0.00 66.70 65.28 1hqm h VAL 214 Cb 0.89 0.11 -0.05 0.00 -2.13 0.00 0.00 31.29 30.10 1hqm h VAL 214 CO -0.02 0.08 -0.36 0.00 -1.23 0.00 0.00 177.57 176.04 1hqm h ALA 215 N 1.63 -0.63 -0.37 5.19 0.00 -1.37 0.94 119.26 124.65 1hqm h ALA 215 Ca 0.48 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.43 1hqm h ALA 215 Cb 0.82 0.96 -0.07 0.00 0.00 0.00 0.00 17.79 19.50 1hqm h ALA 215 CO -0.47 -0.79 -0.45 0.82 0.00 0.00 0.00 179.25 178.36 1hqm h ILE 216 N -0.27 0.00 -1.25 0.00 1.08 -1.41 0.65 117.51 116.31 1hqm h ILE 216 Ca 0.04 0.00 0.36 0.00 -0.39 0.00 0.00 64.86 64.88 1hqm h ILE 216 Cb 0.39 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 34.06 1hqm h ILE 216 CO -0.37 0.00 0.85 0.25 -0.69 0.00 0.00 178.15 178.19 1hqm h LEU 217 N -0.29 0.20 0.11 1.44 5.85 -1.20 0.13 115.31 121.56 1hqm h LEU 217 Ca 0.06 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 1hqm h LEU 217 Cb 0.46 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.52 1hqm h LEU 217 CO -0.50 -0.02 -0.05 0.11 -0.34 0.00 0.00 178.44 177.64 1hqm h LYS 218 N 0.15 -0.14 -0.98 1.25 1.57 0.27 0.03 116.57 118.71 1hqm h LYS 218 Ca 0.67 0.01 0.15 0.00 -1.87 0.00 0.00 60.65 59.61 1hqm h LYS 218 Cb 2.24 0.03 -0.09 0.00 0.08 0.00 0.00 32.23 34.49 1hqm h LYS 218 CO -0.20 0.36 0.62 1.49 -0.57 0.00 0.00 179.45 181.15 1hqm h GLU 219 N -0.80 0.82 0.24 3.15 4.81 0.18 0.69 114.58 123.67 1hqm h GLU 219 Ca -0.01 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.15 1hqm h GLU 219 Cb 0.56 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.76 1hqm h GLU 219 CO 0.02 0.54 -0.12 0.45 -0.73 0.00 0.00 179.01 179.18 1hqm h HIS 220 N 0.85 -0.30 -0.97 0.92 3.86 -1.06 -1.94 115.15 116.51 1hqm h HIS 220 Ca 0.52 -0.01 0.30 0.00 -1.16 0.00 0.00 60.37 60.02 1hqm h HIS 220 Cb 0.69 0.10 -0.17 0.00 1.06 0.00 0.00 27.41 29.09 1hqm h HIS 220 CO -0.00 0.07 0.20 -0.07 0.86 0.00 0.00 177.93 178.99 1hqm h LEU 221 N -0.90 -0.17 0.35 2.43 -0.00 -0.09 0.32 115.31 117.25 1hqm h LEU 221 Ca -0.03 0.26 -0.00 0.00 -0.00 0.00 0.00 57.88 58.10 1hqm h LEU 221 Cb 0.50 0.38 -0.03 0.00 -0.00 0.00 0.00 40.66 41.52 1hqm h LEU 221 CO 0.05 -0.33 -0.49 0.78 -0.00 0.00 0.00 178.44 178.46 1hqm h ASN 222 N 0.06 -1.39 -0.63 -0.43 2.35 0.60 -2.51 115.58 113.62 1hqm h ASN 222 Ca 0.65 0.13 0.19 0.00 -0.55 0.00 0.00 56.30 56.71 1hqm h ASN 222 Cb 1.45 0.48 -0.03 0.00 0.05 0.00 0.00 38.32 40.27 1hqm h ASN 222 CO -0.82 -0.60 0.45 -1.22 -1.65 0.00 0.00 177.43 173.59 1hqm n TYR 223 N -5.34 0.04 -1.79 1.19 4.01 0.11 -2.68 117.16 112.69 1hqm n TYR 223 Ca -0.10 0.04 -0.29 0.00 -0.16 0.00 0.00 57.90 57.39 1hqm n TYR 223 Cb 0.42 -0.24 -0.07 0.00 -0.31 0.00 0.00 39.34 39.14 1hqm n TYR 223 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1hqm n PHE 224 N -2.76 2.19 0.00 -0.72 3.01 -0.95 -4.60 117.46 113.63 1hqm n PHE 224 Ca 0.15 -1.25 0.00 0.00 1.01 0.00 0.00 57.45 57.36 1hqm n PHE 224 Cb 0.65 -2.42 0.00 0.00 -0.01 0.00 0.00 39.48 37.70 1hqm n PHE 224 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1hqm n ALA 225 N 14.23 0.00 -2.71 4.37 0.00 -1.09 -5.08 120.51 130.23 1hqm n ALA 225 Ca 0.45 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.51 1hqm n ALA 225 Cb 0.46 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.85 1hqm n ALA 225 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1hqm s ASN 226 N 0.11 6.71 0.27 0.00 0.02 -1.26 -5.08 114.94 115.71 1hqm s ASN 226 Ca 0.00 0.84 0.07 0.00 -1.02 0.00 0.00 52.86 52.75 1hqm s ASN 226 Cb 0.00 -2.30 -0.03 0.00 0.02 0.00 0.00 41.25 38.93 1hqm s ASN 226 CO 0.00 -0.04 0.23 -2.16 0.02 0.00 0.00 177.10 175.15 1hqm s PRO 227 N 0.81 2.90 0.00 -0.60 0.04 -1.26 -5.21 135.00 131.67 1hqm s PRO 227 Ca 0.27 -1.10 0.22 0.00 0.04 0.00 0.00 61.00 60.43 1hqm s PRO 227 Cb -0.15 -2.56 0.17 0.00 0.04 0.00 0.00 34.50 32.00 1hqm s PRO 227 CO 0.11 0.31 1.19 0.39 0.04 0.00 0.00 177.00 179.04