#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hqp h GLN 2 N 0.00 0.64 -0.93 4.33 5.75 -2.06 -2.25 115.11 120.59 3hqp h GLN 2 Ca 0.00 -0.04 0.01 0.00 -0.15 0.00 0.00 58.65 58.47 3hqp h GLN 2 Cb 0.00 -0.14 -0.05 0.00 1.07 0.00 0.00 27.48 28.36 3hqp h GLN 2 CO 0.00 0.42 0.60 1.25 -2.65 0.00 0.00 178.83 178.46 3hqp h LEU 3 N 0.66 1.08 -0.60 -2.39 6.46 -2.06 -2.20 115.31 116.25 3hqp h LEU 3 Ca 0.40 -0.04 -0.13 0.00 -0.12 0.00 0.00 57.88 58.00 3hqp h LEU 3 Cb 0.47 -0.27 -0.01 0.00 -0.73 0.00 0.00 40.66 40.12 3hqp h LEU 3 CO -0.30 0.79 -0.30 0.00 -0.62 0.00 0.00 178.44 178.01 3hqp h ALA 4 N 1.40 0.78 -0.44 1.25 0.00 -1.87 -3.08 119.26 117.31 3hqp h ALA 4 Ca 0.34 -0.41 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 3hqp h ALA 4 Cb -0.13 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 3hqp h ALA 4 CO -0.07 0.65 0.01 1.25 0.00 0.00 0.00 179.25 181.09 3hqp h HIS 5 N 0.66 0.75 0.00 0.00 -0.00 -1.09 -2.46 115.15 113.01 3hqp h HIS 5 Ca 0.08 -0.09 -0.01 0.00 -0.00 0.00 0.00 60.37 60.34 3hqp h HIS 5 Cb 0.84 -0.21 -0.00 0.00 -0.00 0.00 0.00 27.41 28.04 3hqp h HIS 5 CO 0.04 0.70 -0.04 -0.91 -0.00 0.00 0.00 177.93 177.73 3hqp h ASN 6 N 0.67 0.00 1.30 3.26 2.35 -1.32 -1.95 115.58 119.89 3hqp h ASN 6 Ca 0.14 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 3hqp h ASN 6 Cb 0.41 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.78 3hqp h ASN 6 CO 0.02 0.04 0.00 0.18 -1.65 0.00 0.00 177.43 176.01 3hqp n LEU 7 N -4.31 0.61 -1.25 1.61 4.77 -0.93 -3.17 117.00 114.33 3hqp n LEU 7 Ca -0.03 0.56 0.12 0.00 -0.03 0.00 0.00 56.01 56.63 3hqp n LEU 7 Cb 0.12 -0.38 0.27 0.00 -2.33 0.00 0.00 43.42 41.10 3hqp n LEU 7 CO 0.33 -0.17 0.74 0.35 -1.33 0.00 0.00 177.39 177.30 3hqp n THR 8 N -2.08 0.76 -3.49 -5.08 -2.24 -0.74 -4.96 114.28 96.46 3hqp n THR 8 Ca 0.06 -0.88 -0.32 0.00 -2.27 0.00 0.00 64.05 60.63 3hqp n THR 8 Cb 0.39 0.73 -0.05 0.00 -2.10 0.00 0.00 70.33 69.30 3hqp n THR 8 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3hqp s LEU 9 N -1.23 4.21 0.03 3.22 1.43 -1.19 -5.11 118.68 120.05 3hqp s LEU 9 Ca 0.44 0.83 0.03 0.00 -1.03 0.00 0.00 54.13 54.40 3hqp s LEU 9 Cb 0.24 -3.53 -0.02 0.00 0.03 0.00 0.00 46.19 42.91 3hqp s LEU 9 CO 0.32 -0.02 -0.09 -0.55 0.23 0.00 0.00 176.35 176.25 3hqp s SER 10 N -2.32 0.97 0.45 2.29 0.15 -1.26 -5.04 113.70 108.94 3hqp s SER 10 Ca 0.45 -0.44 0.25 0.00 0.70 0.00 0.00 55.95 56.91 3hqp s SER 10 Cb -0.12 -0.01 0.72 0.00 -1.71 0.00 0.00 66.02 64.90 3hqp s SER 10 CO 0.22 -0.10 1.74 0.16 1.20 0.00 0.00 173.24 176.46 3hqp h ILE 11 N 4.60 0.21 -0.09 6.45 3.07 -2.02 -3.09 117.51 126.65 3hqp h ILE 11 Ca -0.35 -1.03 0.00 0.00 1.55 0.00 0.00 64.86 65.04 3hqp h ILE 11 Cb 1.20 1.86 0.00 0.00 -0.27 0.00 0.00 36.82 39.61 3hqp h ILE 11 CO 0.43 0.10 0.00 0.49 -1.05 0.00 0.00 178.15 178.12 3hqp n PHE 12 N -3.17 0.11 -1.82 0.16 3.72 -1.26 -4.94 117.46 110.26 3hqp n PHE 12 Ca 0.02 -0.05 -0.42 0.00 -0.05 0.00 0.00 57.45 56.95 3hqp n PHE 12 Cb 0.47 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.98 3hqp n PHE 12 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3hqp s ASP 13 N -1.75 6.48 0.23 4.37 1.01 -1.17 -4.96 116.67 120.89 3hqp s ASP 13 Ca 0.35 2.74 -0.30 0.00 0.71 0.00 0.00 52.55 56.04 3hqp s ASP 13 Cb 0.19 -2.59 -0.10 0.00 1.01 0.00 0.00 42.92 41.43 3hqp s ASP 13 CO 0.29 -0.91 1.42 -2.84 0.21 0.00 0.00 175.17 173.34 3hqp s PRO 14 N 1.44 4.29 0.68 8.23 0.02 -1.26 -5.01 135.00 143.39 3hqp s PRO 14 Ca 0.74 2.26 -0.14 0.00 0.02 0.00 0.00 61.00 63.88 3hqp s PRO 14 Cb -0.46 -3.13 0.01 0.00 0.02 0.00 0.00 34.50 30.94 3hqp s PRO 14 CO 0.32 -0.40 1.10 0.14 -0.33 0.00 0.00 177.00 177.83 3hqp s VAL 15 N 0.10 3.32 0.51 3.83 -7.23 -1.26 -5.01 120.40 114.66 3hqp s VAL 15 Ca 0.60 0.57 -0.21 0.00 -1.81 0.00 0.00 61.98 61.13 3hqp s VAL 15 Cb -0.41 -3.09 -0.06 0.00 0.56 0.00 0.00 36.38 33.37 3hqp s VAL 15 CO 0.41 -0.42 1.16 0.00 -0.31 0.00 0.00 175.10 175.94 3hqp s ALA 16 N -2.48 2.81 -0.90 1.32 0.00 -1.26 -4.93 121.76 116.32 3hqp s ALA 16 Ca 0.65 0.92 0.12 0.00 0.00 0.00 0.00 51.96 53.65 3hqp s ALA 16 Cb -0.19 -3.39 0.54 0.00 0.00 0.00 0.00 23.12 20.08 3hqp s ALA 16 CO 0.44 -0.79 1.39 0.27 0.00 0.00 0.00 175.76 177.08 3hqp n ASN 17 N -0.95 0.11 -4.08 0.00 0.23 -1.26 -4.70 115.26 104.60 3hqp n ASN 17 Ca 0.10 0.53 -0.14 0.00 -0.53 0.00 0.00 54.58 54.54 3hqp n ASN 17 Cb 0.49 -0.55 -0.12 0.00 -2.08 0.00 0.00 39.78 37.52 3hqp n ASN 17 CO 0.00 0.00 0.00 -0.72 -0.93 0.00 0.00 177.26 175.61 3hqp s TYR 18 N -3.06 0.77 -0.21 -2.53 -0.85 -1.26 -5.09 117.35 105.12 3hqp s TYR 18 Ca 0.05 -0.48 -0.11 0.00 -0.52 0.00 0.00 57.07 56.00 3hqp s TYR 18 Cb 0.07 -0.45 -0.05 0.00 0.38 0.00 0.00 41.96 41.91 3hqp s TYR 18 CO 0.21 -0.06 0.19 0.50 -1.52 0.00 0.00 175.55 174.88 3hqp s ARG 19 N -1.57 4.16 -0.14 -3.49 3.52 -1.26 -5.00 118.95 115.16 3hqp s ARG 19 Ca -0.08 -0.15 -0.27 0.00 -0.13 0.00 0.00 55.73 55.10 3hqp s ARG 19 Cb -0.10 -3.47 -0.24 0.00 -1.56 0.00 0.00 34.95 29.58 3hqp s ARG 19 CO 0.01 0.18 0.70 0.00 -0.81 0.00 0.00 175.30 175.37 3hqp h ALA 20 N 7.03 0.02 -2.48 6.12 0.00 -1.95 -3.43 119.26 124.56 3hqp h ALA 20 Ca -0.40 -0.52 -0.51 0.00 0.00 0.00 0.00 54.91 53.48 3hqp h ALA 20 Cb 1.16 0.05 0.12 0.00 0.00 0.00 0.00 17.79 19.11 3hqp h ALA 20 CO 0.72 0.05 0.37 0.00 0.00 0.00 0.00 179.25 180.39 3hqp s ALA 21 N -2.25 2.37 -0.02 0.00 0.00 -1.26 -1.00 121.76 119.60 3hqp s ALA 21 Ca -0.19 0.59 0.07 0.00 0.00 0.00 0.00 51.96 52.43 3hqp s ALA 21 Cb -0.02 -3.35 -0.02 0.00 0.00 0.00 0.00 23.12 19.73 3hqp s ALA 21 CO 0.65 -1.44 -0.22 1.03 0.00 0.00 0.00 175.76 175.78 3hqp s ARG 22 N -4.12 2.22 -0.20 0.00 1.81 -0.84 -4.92 118.95 112.89 3hqp s ARG 22 Ca 0.68 -0.87 -0.09 0.00 -1.72 0.00 0.00 55.73 53.74 3hqp s ARG 22 Cb -0.22 -2.15 -0.04 0.00 -0.45 0.00 0.00 34.95 32.09 3hqp s ARG 22 CO 0.43 0.58 0.10 0.42 -0.68 0.00 0.00 175.30 176.15 3hqp s ILE 23 N -0.67 4.99 -0.13 1.52 1.01 -1.26 -1.23 121.20 125.43 3hqp s ILE 23 Ca 0.11 0.04 -0.02 0.00 0.00 0.00 0.00 60.65 60.79 3hqp s ILE 23 Cb -0.10 -3.28 -0.02 0.00 0.01 0.00 0.00 42.46 39.06 3hqp s ILE 23 CO -0.00 0.42 -0.07 -0.63 0.00 0.00 0.00 174.94 174.66 3hqp s ILE 24 N 0.64 3.61 -0.09 2.92 1.01 -0.44 -1.53 121.20 127.32 3hqp s ILE 24 Ca 0.05 -0.47 0.04 0.00 0.00 0.00 0.00 60.65 60.26 3hqp s ILE 24 Cb -0.13 -2.54 -0.01 0.00 0.01 0.00 0.00 42.46 39.80 3hqp s ILE 24 CO 0.01 0.53 -0.21 0.00 0.00 0.00 0.00 174.94 175.27 3hqp s THR 26 N 0.12 4.82 -0.21 0.00 -1.32 -0.69 -0.46 115.64 117.90 3hqp s THR 26 Ca -0.10 1.40 -0.12 0.00 -1.21 0.00 0.00 61.69 61.66 3hqp s THR 26 Cb -0.16 -4.00 -0.05 0.00 -1.51 0.00 0.00 72.50 66.78 3hqp s THR 26 CO 0.06 0.41 0.21 -0.63 -2.21 0.00 0.00 174.62 172.46 3hqp s ILE 27 N -0.21 5.34 0.00 5.08 -1.09 -0.76 -2.75 121.20 126.81 3hqp s ILE 27 Ca 0.34 0.34 0.00 0.00 -2.23 0.00 0.00 60.65 59.10 3hqp s ILE 27 Cb -0.19 -3.55 0.00 0.00 -1.58 0.00 0.00 42.46 37.13 3hqp s ILE 27 CO 0.20 0.37 0.00 0.61 -1.23 0.00 0.00 174.94 174.88 3hqp n GLY 28 N 3.82 5.41 0.28 6.18 0.00 -1.24 -4.71 105.19 114.93 3hqp n GLY 28 Ca -0.14 -1.35 -0.03 0.00 0.00 0.00 0.00 46.02 44.50 3hqp n GLY 28 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3hqp h PRO 29 N 0.00 0.85 0.00 1.61 0.11 -1.82 -2.38 132.00 130.37 3hqp h PRO 29 Ca 0.00 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.05 3hqp h PRO 29 Cb 0.00 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 30.92 3hqp h PRO 29 CO 0.00 0.56 -0.03 0.77 -0.21 0.00 0.00 178.00 179.09 3hqp h SER 30 N 0.88 0.00 0.00 -2.05 0.02 -1.61 -3.31 113.55 107.47 3hqp h SER 30 Ca 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.24 3hqp h SER 30 Cb 0.02 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.56 3hqp h SER 30 CO -0.11 0.03 -0.03 0.35 -1.14 0.00 0.00 176.83 175.93 3hqp n THR 31 N -3.19 0.40 0.07 -2.27 -2.24 -1.13 -4.83 114.28 101.09 3hqp n THR 31 Ca -0.01 -0.41 -0.12 0.00 -2.27 0.00 0.00 64.05 61.24 3hqp n THR 31 Cb 0.23 0.76 -0.04 0.00 -2.10 0.00 0.00 70.33 69.19 3hqp n THR 31 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 3hqp h GLN 32 N 0.00 0.34 -6.91 -0.78 4.15 -1.52 -3.36 115.11 107.03 3hqp h GLN 32 Ca 0.00 -0.37 -0.55 0.00 0.77 0.00 0.00 58.65 58.50 3hqp h GLN 32 Cb 0.86 0.11 0.11 0.00 0.21 0.00 0.00 27.48 28.76 3hqp h GLN 32 CO 0.00 1.06 0.73 -1.13 -1.93 0.00 0.00 178.83 177.57 3hqp n SER 33 N -3.71 3.64 0.03 -0.69 3.41 -1.26 -4.80 113.62 110.23 3hqp n SER 33 Ca -0.06 1.22 0.19 0.00 -0.26 0.00 0.00 58.87 59.97 3hqp n SER 33 Cb 0.83 -1.60 0.69 0.00 -0.26 0.00 0.00 64.21 63.88 3hqp n SER 33 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 3hqp h VAL 34 N 2.89 0.73 -0.37 -3.33 3.04 -1.89 0.26 116.25 117.59 3hqp h VAL 34 Ca -0.50 0.00 -0.15 0.00 -1.01 0.00 0.00 66.70 65.04 3hqp h VAL 34 Cb 1.25 0.75 -0.01 0.00 -2.01 0.00 0.00 31.29 31.27 3hqp h VAL 34 CO 0.64 0.00 -0.36 -0.08 -1.01 0.00 0.00 177.57 176.76 3hqp h GLU 35 N 0.00 0.85 0.00 4.17 4.81 -1.95 -1.67 114.58 120.79 3hqp h GLU 35 Ca 0.23 -0.43 -0.11 0.00 -0.13 0.00 0.00 59.36 58.92 3hqp h GLU 35 Cb 0.92 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.29 3hqp h GLU 35 CO -0.00 1.07 -0.52 0.00 -0.73 0.00 0.00 179.01 178.83 3hqp h ALA 36 N 0.88 0.74 0.06 2.92 0.00 -1.32 -2.76 119.26 119.78 3hqp h ALA 36 Ca 0.06 -0.47 -0.27 0.00 0.00 0.00 0.00 54.91 54.24 3hqp h ALA 36 Cb 0.93 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.65 3hqp h ALA 36 CO 0.09 0.65 -1.11 -0.07 0.00 0.00 0.00 179.25 178.80 3hqp h LEU 37 N 0.00 0.69 -0.53 0.00 3.38 -1.09 -1.75 115.31 116.02 3hqp h LEU 37 Ca -0.01 -0.61 -0.00 0.00 0.09 0.00 0.00 57.88 57.35 3hqp h LEU 37 Cb 1.27 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.78 3hqp h LEU 37 CO 0.07 1.43 0.31 0.11 0.09 0.00 0.00 178.44 180.44 3hqp h LYS 38 N 0.25 0.72 -0.11 1.13 1.57 -1.33 -1.49 116.57 117.30 3hqp h LYS 38 Ca -0.13 -0.07 -0.05 0.00 -1.87 0.00 0.00 60.65 58.52 3hqp h LYS 38 Cb 1.77 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.93 3hqp h LYS 38 CO 0.20 0.53 -0.17 0.78 -0.57 0.00 0.00 179.45 180.22 3hqp h GLY 39 N 0.70 0.19 1.53 3.86 0.00 -1.50 -1.70 103.07 106.15 3hqp h GLY 39 Ca 0.19 -0.12 -0.22 0.00 0.00 0.00 0.00 47.33 47.18 3hqp h GLY 39 CO -0.03 0.11 -0.90 -2.00 0.00 0.00 0.00 176.54 173.71 3hqp h LEU 40 N 0.17 0.55 -0.34 3.11 5.85 -0.95 -2.44 115.31 121.26 3hqp h LEU 40 Ca 0.03 -0.42 -0.12 0.00 0.84 0.00 0.00 57.88 58.21 3hqp h LEU 40 Cb 0.40 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 3hqp h LEU 40 CO 0.03 1.21 -0.27 0.40 -0.34 0.00 0.00 178.44 179.47 3hqp h ILE 41 N 0.26 1.29 0.00 4.05 2.04 -1.15 -1.74 117.51 122.26 3hqp h ILE 41 Ca -0.07 -1.42 0.00 0.00 1.00 0.00 0.00 64.86 64.36 3hqp h ILE 41 Cb 1.53 1.46 0.00 0.00 -0.74 0.00 0.00 36.82 39.07 3hqp h ILE 41 CO 0.16 0.47 0.00 1.56 0.00 0.00 0.00 178.15 180.33 3hqp h GLN 42 N 0.55 0.00 0.00 2.37 4.20 -1.29 -2.73 115.11 118.21 3hqp h GLN 42 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 3hqp h GLN 42 Cb 0.84 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.62 3hqp h GLN 42 CO 0.07 0.00 -1.25 0.43 -0.67 0.00 0.00 178.83 177.41 3hqp n SER 43 N -3.01 0.62 0.00 1.46 7.64 -0.92 -4.97 113.62 114.44 3hqp n SER 43 Ca -0.01 0.22 0.00 0.00 1.01 0.00 0.00 58.87 60.09 3hqp n SER 43 Cb 0.20 0.85 0.00 0.00 -1.01 0.00 0.00 64.21 64.26 3hqp n SER 43 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3hqp n GLY 44 N 1.21 -0.87 3.68 0.23 0.00 -1.03 -3.85 105.19 104.56 3hqp n GLY 44 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 3hqp n GLY 44 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3hqp s MET 45 N 0.00 4.28 -0.22 1.61 0.00 -0.68 -4.22 119.30 120.07 3hqp s MET 45 Ca 0.00 1.86 0.07 0.00 0.00 0.00 0.00 55.69 57.62 3hqp s MET 45 Cb 0.00 -3.65 -0.18 0.00 0.00 0.00 0.00 34.83 31.00 3hqp s MET 45 CO 0.00 -0.60 -0.11 0.43 0.00 0.00 0.00 175.02 174.75 3hqp n SER 46 N 5.74 1.50 -4.12 1.11 7.64 -0.58 -4.64 113.62 120.27 3hqp n SER 46 Ca 0.13 -0.08 -0.26 0.00 1.01 0.00 0.00 58.87 59.67 3hqp n SER 46 Cb 0.44 0.12 -0.16 0.00 -1.01 0.00 0.00 64.21 63.61 3hqp n SER 46 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3hqp s VAL 47 N -2.47 1.43 -0.27 0.44 1.01 -1.12 -1.91 120.40 117.51 3hqp s VAL 47 Ca -0.23 -0.70 -0.10 0.00 0.00 0.00 0.00 61.98 60.95 3hqp s VAL 47 Cb 0.07 -1.24 -0.04 0.00 0.00 0.00 0.00 36.38 35.17 3hqp s VAL 47 CO 0.63 0.42 0.14 0.00 0.00 0.00 0.00 175.10 176.29 3hqp s ALA 48 N 0.19 3.37 -0.00 5.51 0.00 0.70 -1.90 121.76 129.63 3hqp s ALA 48 Ca -0.07 -1.14 -0.15 0.00 0.00 0.00 0.00 51.96 50.60 3hqp s ALA 48 Cb -0.13 -2.33 -0.06 0.00 0.00 0.00 0.00 23.12 20.60 3hqp s ALA 48 CO 0.03 -0.58 0.41 0.50 0.00 0.00 0.00 175.76 176.12 3hqp s ARG 49 N 1.69 3.92 -0.27 0.00 3.52 0.39 -0.26 118.95 127.95 3hqp s ARG 49 Ca 0.07 0.41 0.03 0.00 -0.13 0.00 0.00 55.73 56.10 3hqp s ARG 49 Cb -0.16 -3.23 0.06 0.00 -1.56 0.00 0.00 34.95 30.07 3hqp s ARG 49 CO 0.08 0.68 -0.10 -1.64 -0.81 0.00 0.00 175.30 173.51 3hqp s MET 50 N -1.03 2.25 -0.60 5.12 -1.94 0.64 -1.82 119.30 121.91 3hqp s MET 50 Ca 0.24 -1.35 -0.23 0.00 -1.71 0.00 0.00 55.69 52.63 3hqp s MET 50 Cb -0.17 -2.92 0.05 0.00 2.01 0.00 0.00 34.83 33.80 3hqp s MET 50 CO 0.13 -0.58 0.95 1.21 -0.01 0.00 0.00 175.02 176.72 3hqp s ASN 51 N 1.11 6.26 0.00 3.03 2.47 -1.26 -0.42 114.94 126.13 3hqp s ASN 51 Ca -0.08 -0.63 0.25 0.00 0.42 0.00 0.00 52.86 52.82 3hqp s ASN 51 Cb -0.20 -2.43 1.48 0.00 -1.45 0.00 0.00 41.25 38.66 3hqp s ASN 51 CO -0.05 -1.32 1.87 0.49 -3.72 0.00 0.00 177.10 174.37 3hqp n PHE 52 N 7.59 0.00 0.11 0.43 3.01 -1.00 -2.46 117.46 125.14 3hqp n PHE 52 Ca -0.01 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.42 3hqp n PHE 52 Cb 0.47 0.00 0.09 0.00 -0.01 0.00 0.00 39.48 40.02 3hqp n PHE 52 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 3hqp h SER 53 N 0.00 0.02 -2.05 4.37 0.02 -1.85 -3.45 113.55 110.59 3hqp h SER 53 Ca 0.00 -0.01 -0.54 0.00 -0.84 0.00 0.00 61.79 60.40 3hqp h SER 53 Cb 0.00 -0.00 -0.07 0.00 0.14 0.00 0.00 62.40 62.46 3hqp h SER 53 CO 0.00 0.73 -0.56 -1.00 -1.14 0.00 0.00 176.83 174.86 3hqp s HIS 54 N -3.37 2.81 0.00 3.45 3.76 -1.03 -5.05 115.29 115.86 3hqp s HIS 54 Ca -0.01 -0.26 0.00 0.00 -0.15 0.00 0.00 55.06 54.64 3hqp s HIS 54 Cb 0.12 -1.45 0.00 0.00 1.11 0.00 0.00 32.58 32.36 3hqp s HIS 54 CO 0.78 0.46 0.00 0.41 -0.85 0.00 0.00 174.74 175.54 3hqp n GLY 55 N -1.09 0.30 3.51 -2.22 0.00 -1.26 -4.87 105.19 99.55 3hqp n GLY 55 Ca -0.05 -0.90 -0.14 0.00 0.00 0.00 0.00 46.02 44.93 3hqp n GLY 55 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hqp s SER 56 N -4.00 0.81 0.24 1.61 1.04 -1.26 -5.02 113.70 107.12 3hqp s SER 56 Ca 0.00 -1.44 -0.06 0.00 0.48 0.00 0.00 55.95 54.93 3hqp s SER 56 Cb 0.00 0.67 0.30 0.00 0.10 0.00 0.00 66.02 67.09 3hqp s SER 56 CO 0.00 -1.31 1.87 0.45 0.98 0.00 0.00 173.24 175.23 3hqp h HIS 57 N 2.11 1.05 -0.35 5.02 -0.00 -1.97 0.21 115.15 121.22 3hqp h HIS 57 Ca -0.28 0.03 -0.10 0.00 -0.00 0.00 0.00 60.37 60.01 3hqp h HIS 57 Cb 1.24 -0.35 -0.02 0.00 -0.00 0.00 0.00 27.41 28.29 3hqp h HIS 57 CO 1.42 0.58 -0.20 1.49 -0.00 0.00 0.00 177.93 181.22 3hqp h GLU 58 N 1.07 0.67 -0.09 2.45 4.81 -1.99 -0.67 114.58 120.84 3hqp h GLU 58 Ca 0.37 -0.25 -0.03 0.00 -0.13 0.00 0.00 59.36 59.32 3hqp h GLU 58 Cb 0.07 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.41 3hqp h GLU 58 CO -0.14 0.82 -0.05 -0.92 -0.73 0.00 0.00 179.01 177.99 3hqp h TYR 59 N 0.59 0.22 0.00 0.92 3.20 -1.81 -3.05 116.97 117.04 3hqp h TYR 59 Ca 0.09 -0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.90 3hqp h TYR 59 Cb 0.67 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.89 3hqp h TYR 59 CO 0.03 0.57 0.00 0.45 -1.64 0.00 0.00 178.16 177.57 3hqp h HIS 60 N -0.19 0.00 -0.45 -3.82 3.86 -0.95 -2.70 115.15 110.90 3hqp h HIS 60 Ca 0.02 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.13 3hqp h HIS 60 Cb 0.52 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.97 3hqp h HIS 60 CO 0.07 0.00 -0.10 0.37 0.86 0.00 0.00 177.93 179.14 3hqp h GLN 61 N 0.00 0.86 -0.15 2.45 5.75 -1.08 -2.36 115.11 120.57 3hqp h GLN 61 Ca 0.00 -0.32 -0.03 0.00 -0.15 0.00 0.00 58.65 58.14 3hqp h GLN 61 Cb 0.59 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 29.08 3hqp h GLN 61 CO 0.00 0.96 -0.06 1.15 -2.65 0.00 0.00 178.83 178.23 3hqp h THR 62 N 0.70 1.14 0.10 2.39 2.02 -1.37 -0.91 112.91 116.98 3hqp h THR 62 Ca 0.12 -0.57 -0.01 0.00 0.77 0.00 0.00 66.41 66.72 3hqp h THR 62 Cb 0.64 1.09 0.00 0.00 -1.74 0.00 0.00 68.15 68.13 3hqp h THR 62 CO 0.04 0.18 -0.05 0.74 0.37 0.00 0.00 175.52 176.81 3hqp h THR 63 N 0.22 1.05 -0.18 3.16 2.02 -1.40 -2.08 112.91 115.70 3hqp h THR 63 Ca 0.05 -0.60 0.04 0.00 0.77 0.00 0.00 66.41 66.68 3hqp h THR 63 Cb 0.25 1.43 -0.05 0.00 -1.74 0.00 0.00 68.15 68.05 3hqp h THR 63 CO 0.01 0.14 -0.11 0.40 0.37 0.00 0.00 175.52 176.34 3hqp h ILE 64 N -0.42 0.67 -0.37 3.11 2.04 -1.00 0.14 117.51 121.68 3hqp h ILE 64 Ca -0.01 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.89 3hqp h ILE 64 Cb 0.34 0.67 -0.04 0.00 -0.74 0.00 0.00 36.82 37.06 3hqp h ILE 64 CO 0.02 0.00 0.11 0.78 0.00 0.00 0.00 178.15 179.07 3hqp h ASN 65 N -0.10 0.11 0.02 1.72 4.21 -1.23 -2.31 115.58 118.00 3hqp h ASN 65 Ca 0.10 0.05 -0.27 0.00 1.21 0.00 0.00 56.30 57.39 3hqp h ASN 65 Cb 0.25 0.04 0.02 0.00 -1.12 0.00 0.00 38.32 37.51 3hqp h ASN 65 CO -0.24 0.10 -1.04 0.78 -1.29 0.00 0.00 177.43 175.74 3hqp h ASN 66 N 0.26 0.90 -0.53 5.81 2.35 -1.11 -1.80 115.58 121.46 3hqp h ASN 66 Ca 0.17 -0.72 0.04 0.00 -0.55 0.00 0.00 56.30 55.24 3hqp h ASN 66 Cb 0.16 -0.27 -0.04 0.00 0.05 0.00 0.00 38.32 38.21 3hqp h ASN 66 CO -0.19 1.52 0.28 0.58 -1.65 0.00 0.00 177.43 177.98 3hqp h VAL 67 N 0.39 0.99 -0.27 2.81 2.07 -0.73 0.38 116.25 121.89 3hqp h VAL 67 Ca -0.13 -0.19 -0.09 0.00 0.82 0.00 0.00 66.70 67.11 3hqp h VAL 67 Cb 1.69 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 3hqp h VAL 67 CO 0.20 0.10 -0.22 0.03 0.02 0.00 0.00 177.57 177.70 3hqp h ARG 68 N 0.55 0.50 -0.19 1.57 3.08 -1.44 -2.07 114.38 116.38 3hqp h ARG 68 Ca 0.23 -0.18 -0.19 0.00 0.07 0.00 0.00 59.98 59.91 3hqp h ARG 68 Cb 0.10 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.12 3hqp h ARG 68 CO -0.14 0.69 -0.61 0.37 -1.07 0.00 0.00 179.97 179.22 3hqp h GLN 69 N 0.44 0.74 -0.47 0.04 4.15 -0.64 -2.40 115.11 116.97 3hqp h GLN 69 Ca 0.07 -0.55 -0.12 0.00 0.77 0.00 0.00 58.65 58.82 3hqp h GLN 69 Cb 0.64 0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.41 3hqp h GLN 69 CO 0.05 1.17 -0.20 0.00 -1.93 0.00 0.00 178.83 177.92 3hqp h ALA 70 N 0.58 0.65 -0.02 3.38 0.00 -0.22 -2.05 119.26 121.58 3hqp h ALA 70 Ca -0.02 -0.38 -0.11 0.00 0.00 0.00 0.00 54.91 54.40 3hqp h ALA 70 Cb 1.23 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 3hqp h ALA 70 CO 0.13 0.62 -0.51 0.00 0.00 0.00 0.00 179.25 179.50 3hqp h ALA 71 N 0.86 1.13 -0.15 0.00 0.00 -1.44 -2.60 119.26 117.05 3hqp h ALA 71 Ca 0.11 -0.46 -0.13 0.00 0.00 0.00 0.00 54.91 54.43 3hqp h ALA 71 Cb 0.77 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.48 3hqp h ALA 71 CO 0.06 0.64 -0.40 0.00 0.00 0.00 0.00 179.25 179.55 3hqp h ALA 72 N 1.45 0.25 0.00 0.00 0.00 -1.32 0.15 119.26 119.80 3hqp h ALA 72 Ca -0.00 -0.46 -0.05 0.00 0.00 0.00 0.00 54.91 54.40 3hqp h ALA 72 Cb 0.91 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 3hqp h ALA 72 CO 0.07 0.35 -0.24 0.93 0.00 0.00 0.00 179.25 180.37 3hqp h GLU 73 N 0.17 0.00 0.00 0.00 5.08 -1.34 -2.89 114.58 115.60 3hqp h GLU 73 Ca -0.01 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.13 3hqp h GLU 73 Cb 1.01 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.22 3hqp h GLU 73 CO 0.09 0.24 -1.61 1.28 -1.00 0.00 0.00 179.01 178.00 3hqp n LEU 74 N -3.56 0.79 -0.17 1.33 4.77 -0.99 -5.01 117.00 114.15 3hqp n LEU 74 Ca -0.01 0.36 0.00 0.00 -0.03 0.00 0.00 56.01 56.33 3hqp n LEU 74 Cb 0.38 0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 3hqp n LEU 74 CO 0.33 0.26 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 3hqp n GLY 75 N 1.48 1.04 3.41 -0.72 0.00 -0.17 -5.09 105.19 105.14 3hqp n GLY 75 Ca -0.14 -0.28 -0.20 0.00 0.00 0.00 0.00 46.02 45.40 3hqp n GLY 75 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hqp s VAL 76 N -2.34 0.86 -0.29 1.61 -7.23 0.36 -5.03 120.40 108.34 3hqp s VAL 76 Ca 0.00 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.13 3hqp s VAL 76 Cb 0.00 -2.67 0.03 0.00 0.56 0.00 0.00 36.38 34.30 3hqp s VAL 76 CO 0.00 0.00 0.03 0.20 -0.31 0.00 0.00 175.10 175.02 3hqp s ASN 77 N -3.44 4.89 -0.13 4.85 0.01 -1.26 -4.35 114.94 115.50 3hqp s ASN 77 Ca 0.35 -0.95 -0.03 0.00 -0.71 0.00 0.00 52.86 51.51 3hqp s ASN 77 Cb 0.07 -1.78 -0.03 0.00 0.41 0.00 0.00 41.25 39.92 3hqp s ASN 77 CO 0.15 -0.21 -0.01 -0.63 -1.51 0.00 0.00 177.10 174.89 3hqp s ILE 78 N 1.38 4.19 0.34 0.60 -1.09 -1.26 -4.69 121.20 120.66 3hqp s ILE 78 Ca -0.01 -0.27 -0.27 0.00 -2.23 0.00 0.00 60.65 57.88 3hqp s ILE 78 Cb -0.18 -2.81 -0.09 0.00 -1.58 0.00 0.00 42.46 37.80 3hqp s ILE 78 CO -0.00 0.53 1.07 0.00 -1.23 0.00 0.00 174.94 175.32 3hqp s ALA 79 N -0.15 3.25 -0.16 9.38 0.00 -0.80 -4.91 121.76 128.37 3hqp s ALA 79 Ca 0.04 0.80 -0.01 0.00 0.00 0.00 0.00 51.96 52.79 3hqp s ALA 79 Cb -0.13 -3.30 -0.01 0.00 0.00 0.00 0.00 23.12 19.68 3hqp s ALA 79 CO 0.02 -0.19 -0.10 0.42 0.00 0.00 0.00 175.76 175.91 3hqp s ILE 80 N -1.39 3.21 -0.05 0.00 1.01 -1.26 -0.21 121.20 122.50 3hqp s ILE 80 Ca 0.51 -0.59 0.07 0.00 0.00 0.00 0.00 60.65 60.63 3hqp s ILE 80 Cb -0.27 -2.38 -0.01 0.00 0.01 0.00 0.00 42.46 39.80 3hqp s ILE 80 CO 0.35 0.50 -0.25 0.00 0.00 0.00 0.00 174.94 175.53 3hqp s ALA 81 N 0.65 2.18 -0.34 9.38 0.00 0.64 -1.84 121.76 132.43 3hqp s ALA 81 Ca -0.05 -1.07 -0.08 0.00 0.00 0.00 0.00 51.96 50.76 3hqp s ALA 81 Cb -0.15 -0.65 0.03 0.00 0.00 0.00 0.00 23.12 22.35 3hqp s ALA 81 CO 0.03 0.45 0.13 -1.17 0.00 0.00 0.00 175.76 175.20 3hqp s LEU 82 N -0.31 4.38 -0.17 0.00 0.20 -0.77 -0.26 118.68 121.75 3hqp s LEU 82 Ca 0.01 -1.07 -0.24 0.00 0.69 0.00 0.00 54.13 53.52 3hqp s LEU 82 Cb -0.13 -1.91 -0.02 0.00 -0.43 0.00 0.00 46.19 43.71 3hqp s LEU 82 CO 0.02 -0.33 0.76 -0.62 -0.29 0.00 0.00 176.35 175.90 3hqp s ASP 83 N 1.45 6.87 0.71 3.68 -1.08 0.44 -0.62 116.67 128.12 3hqp s ASP 83 Ca -0.00 1.07 -0.11 0.00 -0.52 0.00 0.00 52.55 52.99 3hqp s ASP 83 Cb -0.19 -2.42 0.02 0.00 -1.46 0.00 0.00 42.92 38.87 3hqp s ASP 83 CO 0.04 -0.35 1.07 -0.89 0.52 0.00 0.00 175.17 175.56 3hqp s THR 84 N 2.03 3.85 -0.11 1.71 2.01 -0.70 -2.38 115.64 122.05 3hqp s THR 84 Ca 0.35 0.61 -0.15 0.00 0.31 0.00 0.00 61.69 62.81 3hqp s THR 84 Cb -0.16 -3.28 -0.13 0.00 0.01 0.00 0.00 72.50 68.93 3hqp s THR 84 CO 0.12 -0.78 0.44 0.11 -0.69 0.00 0.00 174.62 173.81 3hqp h LYS 85 N -0.80 -0.03 0.00 4.92 1.57 -1.90 -3.39 116.57 116.94 3hqp h LYS 85 Ca -0.44 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.36 3hqp h LYS 85 Cb 1.22 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.53 3hqp h LYS 85 CO 0.55 0.46 -0.03 0.41 -0.57 0.00 0.00 179.45 180.28 3hqp n GLY 86 N 1.57 -2.11 3.15 3.86 0.00 -1.26 -4.29 105.19 106.12 3hqp n GLY 86 Ca -0.05 -1.44 -0.41 0.00 0.00 0.00 0.00 46.02 44.11 3hqp n GLY 86 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3hqp n PRO 87 N -0.76 1.63 -4.41 1.61 -0.04 -1.26 -4.90 135.00 126.87 3hqp n PRO 87 Ca 0.00 -2.01 -0.25 0.00 -0.04 0.00 0.00 63.50 61.20 3hqp n PRO 87 Cb 0.03 -3.07 -0.10 0.00 -0.04 0.00 0.00 33.50 30.33 3hqp n PRO 87 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 3hqp s GLU 88 N 5.08 1.81 -0.12 0.54 -1.05 -1.26 -4.94 118.70 118.77 3hqp s GLU 88 Ca 0.58 -1.61 0.00 0.00 -0.15 0.00 0.00 54.97 53.80 3hqp s GLU 88 Cb 0.12 -1.90 -0.02 0.00 -0.44 0.00 0.00 34.13 31.90 3hqp s GLU 88 CO 0.11 0.36 -0.14 0.42 0.95 0.00 0.00 175.26 176.96 3hqp s ILE 89 N -2.26 3.02 0.10 1.83 1.01 -1.26 -5.01 121.20 118.64 3hqp s ILE 89 Ca 0.28 -0.68 0.07 0.00 0.00 0.00 0.00 60.65 60.32 3hqp s ILE 89 Cb -0.06 -2.25 -0.03 0.00 0.01 0.00 0.00 42.46 40.12 3hqp s ILE 89 CO 0.15 0.53 -0.18 -0.13 0.00 0.00 0.00 174.94 175.31 3hqp s ARG 90 N 0.21 1.05 0.93 2.79 1.81 -1.26 -2.14 118.95 122.34 3hqp s ARG 90 Ca -0.08 -1.13 -0.13 0.00 -1.72 0.00 0.00 55.73 52.66 3hqp s ARG 90 Cb -0.15 -1.20 0.19 0.00 -0.45 0.00 0.00 34.95 33.33 3hqp s ARG 90 CO 0.05 0.27 1.27 0.95 -0.68 0.00 0.00 175.30 177.17 3hqp s THR 91 N -1.33 2.02 0.16 0.02 -4.23 0.85 -2.37 115.64 110.75 3hqp s THR 91 Ca 0.05 -0.10 -0.01 0.00 -1.18 0.00 0.00 61.69 60.45 3hqp s THR 91 Cb -0.09 -2.91 0.03 0.00 1.34 0.00 0.00 72.50 70.87 3hqp s THR 91 CO 0.04 0.00 0.22 0.61 -0.54 0.00 0.00 174.62 174.94 3hqp n GLY 92 N -3.62 0.18 3.95 3.99 0.00 0.14 -4.10 105.19 105.73 3hqp n GLY 92 Ca 0.16 -1.89 -0.24 0.00 0.00 0.00 0.00 46.02 44.05 3hqp n GLY 92 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hqp s GLN 93 N -3.11 2.23 0.12 1.61 -0.21 0.11 -0.80 119.66 119.61 3hqp s GLN 93 Ca 0.14 -0.55 0.09 0.00 0.02 0.00 0.00 55.36 55.05 3hqp s GLN 93 Cb -0.01 -2.30 -0.04 0.00 1.00 0.00 0.00 33.01 31.67 3hqp s GLN 93 CO 0.09 -1.10 -0.21 -0.06 -2.12 0.00 0.00 175.29 171.90 3hqp s PHE 94 N -3.07 1.84 -0.08 0.91 0.08 -1.26 -3.04 117.98 113.37 3hqp s PHE 94 Ca 0.60 -0.43 -0.30 0.00 0.12 0.00 0.00 56.93 56.93 3hqp s PHE 94 Cb -0.10 -0.99 -0.04 0.00 -0.57 0.00 0.00 43.02 41.33 3hqp s PHE 94 CO 0.42 0.25 1.44 0.08 -0.10 0.00 0.00 175.22 177.32 3hqp s VAL 95 N -1.38 3.87 0.00 -0.44 1.01 0.11 -3.35 120.40 120.22 3hqp s VAL 95 Ca 0.09 1.12 0.00 0.00 0.00 0.00 0.00 61.98 63.19 3hqp s VAL 95 Cb -0.09 -3.72 0.00 0.00 0.00 0.00 0.00 36.38 32.57 3hqp s VAL 95 CO 0.05 -0.07 0.00 0.61 0.00 0.00 0.00 175.10 175.69 3hqp n GLY 96 N 3.81 2.63 0.00 4.51 0.00 -1.26 -4.42 105.19 110.45 3hqp n GLY 96 Ca 0.15 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.53 3hqp n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hqp n GLY 97 N 0.00 2.29 1.20 -0.02 0.00 -1.21 -5.15 105.19 102.30 3hqp n GLY 97 Ca 0.00 -0.24 -0.09 0.00 0.00 0.00 0.00 46.02 45.69 3hqp n GLY 97 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3hqp n ASP 98 N 0.00 0.91 -3.63 1.61 3.85 -1.26 -3.36 116.55 114.67 3hqp n ASP 98 Ca 0.00 -1.78 -0.18 0.00 -0.71 0.00 0.00 54.79 52.12 3hqp n ASP 98 Cb 0.00 0.39 -0.15 0.00 -1.35 0.00 0.00 41.12 40.01 3hqp n ASP 98 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3hqp s ALA 99 N -2.41 -0.12 -1.18 2.12 0.00 -0.53 -4.65 121.76 115.00 3hqp s ALA 99 Ca 0.08 0.41 -0.17 0.00 0.00 0.00 0.00 51.96 52.29 3hqp s ALA 99 Cb 0.00 -0.94 0.12 0.00 0.00 0.00 0.00 23.12 22.30 3hqp s ALA 99 CO 0.06 -0.75 1.50 0.08 0.00 0.00 0.00 175.76 176.64 3hqp s VAL 100 N 2.29 4.54 -0.37 0.00 1.01 -1.26 -2.11 120.40 124.50 3hqp s VAL 100 Ca 0.04 -2.02 -0.29 0.00 0.00 0.00 0.00 61.98 59.71 3hqp s VAL 100 Cb -0.13 -5.01 -0.00 0.00 0.00 0.00 0.00 36.38 31.24 3hqp s VAL 100 CO -0.07 -1.78 1.56 -0.04 0.00 0.00 0.00 175.10 174.76 3hqp s MET 101 N 3.05 3.51 0.25 2.72 -1.94 -1.20 -4.99 119.30 120.70 3hqp s MET 101 Ca 0.46 1.15 -0.17 0.00 -1.71 0.00 0.00 55.69 55.42 3hqp s MET 101 Cb -0.00 -4.08 -0.08 0.00 2.01 0.00 0.00 34.83 32.67 3hqp s MET 101 CO 0.00 -1.65 0.70 -1.21 -0.01 0.00 0.00 175.02 172.85 3hqp s GLU 102 N 5.17 4.09 0.13 2.03 2.02 -1.26 -3.07 118.70 127.81 3hqp s GLU 102 Ca 0.68 0.71 -0.30 0.00 0.02 0.00 0.00 54.97 56.08 3hqp s GLU 102 Cb -0.17 -2.69 -0.07 0.00 0.10 0.00 0.00 34.13 31.29 3hqp s GLU 102 CO 0.33 0.31 1.26 0.50 0.02 0.00 0.00 175.26 177.67 3hqp s ARG 103 N -2.43 4.42 0.00 1.61 3.52 -1.26 -3.02 118.95 121.79 3hqp s ARG 103 Ca 0.47 1.91 0.00 0.00 -0.13 0.00 0.00 55.73 57.98 3hqp s ARG 103 Cb -0.14 -3.27 0.00 0.00 -1.56 0.00 0.00 34.95 29.99 3hqp s ARG 103 CO 0.19 -0.24 0.00 0.41 -0.81 0.00 0.00 175.30 174.85 3hqp n GLY 104 N 2.82 0.77 3.91 8.12 0.00 0.34 -5.02 105.19 116.14 3hqp n GLY 104 Ca 0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.81 3hqp n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hqp s ALA 105 N -2.91 3.69 0.00 4.61 0.00 -1.17 -4.87 121.76 121.12 3hqp s ALA 105 Ca 0.00 -0.65 -0.10 0.00 0.00 0.00 0.00 51.96 51.21 3hqp s ALA 105 Cb 0.00 -2.20 -0.05 0.00 0.00 0.00 0.00 23.12 20.86 3hqp s ALA 105 CO 0.00 0.30 0.33 -0.08 0.00 0.00 0.00 175.76 176.31 3hqp s THR 106 N -2.02 5.18 0.26 0.00 -1.32 -1.26 -1.39 115.64 115.09 3hqp s THR 106 Ca 0.42 0.49 -0.05 0.00 -1.21 0.00 0.00 61.69 61.34 3hqp s THR 106 Cb -0.11 -3.61 -0.02 0.00 -1.51 0.00 0.00 72.50 67.25 3hqp s THR 106 CO 0.30 0.46 0.34 0.00 -2.21 0.00 0.00 174.62 173.51 3hqp s TYR 108 N -3.82 0.62 -0.38 0.00 2.02 -0.82 -0.14 117.35 114.82 3hqp s TYR 108 Ca 0.31 -0.15 -0.12 0.00 -0.37 0.00 0.00 57.07 56.75 3hqp s TYR 108 Cb 0.02 -0.57 0.03 0.00 -0.40 0.00 0.00 41.96 41.04 3hqp s TYR 108 CO 0.14 -0.15 0.22 0.14 -1.57 0.00 0.00 175.55 174.32 3hqp s VAL 109 N 0.82 4.66 0.20 0.71 -7.23 -1.03 -1.41 120.40 117.12 3hqp s VAL 109 Ca -0.10 -0.84 0.02 0.00 -1.81 0.00 0.00 61.98 59.24 3hqp s VAL 109 Cb -0.13 -3.61 -0.04 0.00 0.56 0.00 0.00 36.38 33.16 3hqp s VAL 109 CO -0.00 -0.25 0.36 0.28 -0.31 0.00 0.00 175.10 175.18 3hqp s THR 110 N 1.57 5.25 -0.96 5.32 -1.32 0.42 -2.40 115.64 123.51 3hqp s THR 110 Ca 0.02 -0.60 0.19 0.00 -1.21 0.00 0.00 61.69 60.09 3hqp s THR 110 Cb -0.19 -3.77 -0.19 0.00 -1.51 0.00 0.00 72.50 66.84 3hqp s THR 110 CO 0.07 -0.20 0.82 0.41 -2.21 0.00 0.00 174.62 173.51 3hqp n THR 111 N -0.84 0.00 -2.07 5.08 -1.04 0.42 -1.40 114.28 114.43 3hqp n THR 111 Ca -0.06 -0.07 -0.43 0.00 -2.04 0.00 0.00 64.05 61.46 3hqp n THR 111 Cb 0.55 1.02 -0.03 0.00 -1.82 0.00 0.00 70.33 70.05 3hqp n THR 111 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3hqp s ASP 112 N -2.76 6.50 0.00 8.00 3.68 -1.26 -4.89 116.67 125.94 3hqp s ASP 112 Ca 0.08 1.89 0.09 0.00 2.13 0.00 0.00 52.55 56.74 3hqp s ASP 112 Cb 0.15 -2.53 0.47 0.00 -1.45 0.00 0.00 42.92 39.55 3hqp s ASP 112 CO 0.76 -1.12 1.17 -2.65 0.13 0.00 0.00 175.17 173.47 3hqp n PRO 113 N 7.42 0.13 0.20 4.34 -0.02 -1.26 -2.49 135.00 143.32 3hqp n PRO 113 Ca 0.18 0.20 0.09 0.00 -2.02 0.00 0.00 63.50 61.95 3hqp n PRO 113 Cb 0.44 -1.50 0.24 0.00 -0.02 0.00 0.00 33.50 32.66 3hqp n PRO 113 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hqp h ALA 114 N 2.44 0.91 -0.73 3.55 0.00 -2.01 -3.16 119.26 120.25 3hqp h ALA 114 Ca 0.00 -0.17 -0.26 0.00 0.00 0.00 0.00 54.91 54.47 3hqp h ALA 114 Cb 0.09 -0.03 -0.16 0.00 0.00 0.00 0.00 17.79 17.69 3hqp h ALA 114 CO 0.00 0.24 0.33 1.19 0.00 0.00 0.00 179.25 181.01 3hqp n PHE 115 N -3.19 2.36 -0.09 0.00 3.01 -1.04 -4.47 117.46 114.05 3hqp n PHE 115 Ca 0.02 -1.24 -0.12 0.00 1.01 0.00 0.00 57.45 57.12 3hqp n PHE 115 Cb 0.55 -0.70 0.01 0.00 -0.01 0.00 0.00 39.48 39.32 3hqp n PHE 115 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3hqp h ALA 116 N 2.28 0.63 -0.00 4.37 0.00 -1.75 -3.29 119.26 121.49 3hqp h ALA 116 Ca 0.32 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3hqp h ALA 116 Cb 2.31 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.99 3hqp h ALA 116 CO 0.75 0.67 -0.17 -0.40 0.00 0.00 0.00 179.25 180.10 3hqp n ASP 117 N -4.04 0.98 -2.35 0.00 5.75 -1.26 0.04 116.55 115.66 3hqp n ASP 117 Ca -0.02 -0.99 -0.32 0.00 -0.01 0.00 0.00 54.79 53.44 3hqp n ASP 117 Cb 0.55 0.51 0.06 0.00 -1.03 0.00 0.00 41.12 41.22 3hqp n ASP 117 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3hqp n LYS 118 N -0.38 2.53 -3.06 0.11 5.02 -1.24 -4.16 118.16 116.99 3hqp n LYS 118 Ca 0.03 -2.98 -0.40 0.00 -2.02 0.00 0.00 58.31 52.94 3hqp n LYS 118 Cb 0.15 -2.16 -0.05 0.00 -0.02 0.00 0.00 35.03 32.95 3hqp n LYS 118 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3hqp s GLY 119 N -1.27 2.66 0.35 0.72 0.00 -1.17 -4.87 107.32 103.74 3hqp s GLY 119 Ca 0.57 0.15 0.04 0.00 0.00 0.00 0.00 44.72 45.47 3hqp s GLY 119 CO -0.08 1.10 0.13 -0.51 0.00 0.00 0.00 173.10 173.74 3hqp s THR 120 N 0.47 0.59 -0.37 0.90 -4.23 -0.16 0.07 115.64 112.91 3hqp s THR 120 Ca 0.37 -2.00 0.26 0.00 -1.18 0.00 0.00 61.69 59.14 3hqp s THR 120 Cb -0.18 -2.50 0.28 0.00 1.34 0.00 0.00 72.50 71.44 3hqp s THR 120 CO 0.19 0.00 1.77 0.07 -0.54 0.00 0.00 174.62 176.11 3hqp h LYS 121 N 2.02 0.00 0.00 3.99 2.10 -1.93 -2.94 116.57 119.82 3hqp h LYS 121 Ca -0.35 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.14 3hqp h LYS 121 Cb 1.26 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.56 3hqp h LYS 121 CO 0.57 0.00 -1.44 -0.25 -2.00 0.00 0.00 179.45 176.33 3hqp n ASP 122 N -2.43 0.80 -3.63 7.07 8.00 -1.26 -4.70 116.55 120.40 3hqp n ASP 122 Ca 0.02 0.35 -0.05 0.00 0.71 0.00 0.00 54.79 55.82 3hqp n ASP 122 Cb 0.26 0.27 -0.06 0.00 -0.02 0.00 0.00 41.12 41.56 3hqp n ASP 122 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3hqp s LYS 123 N -2.96 0.62 0.22 -1.24 2.20 -1.11 -1.95 119.74 115.52 3hqp s LYS 123 Ca -0.03 1.13 -0.06 0.00 -0.36 0.00 0.00 55.97 56.64 3hqp s LYS 123 Cb 0.09 0.22 -0.02 0.00 -1.51 0.00 0.00 37.83 36.60 3hqp s LYS 123 CO 0.81 -0.14 0.29 -0.59 -0.36 0.00 0.00 175.35 175.36 3hqp s PHE 124 N 1.74 0.80 0.01 4.03 -0.71 -0.50 -0.99 117.98 122.36 3hqp s PHE 124 Ca -0.09 -1.09 -0.00 0.00 -1.04 0.00 0.00 56.93 54.71 3hqp s PHE 124 Cb -0.06 -0.22 -0.04 0.00 -1.21 0.00 0.00 43.02 41.50 3hqp s PHE 124 CO -0.19 -0.80 0.10 -0.47 -1.34 0.00 0.00 175.22 172.51 3hqp s TYR 125 N -4.09 3.31 -0.05 3.49 5.04 -1.26 -0.44 117.35 123.35 3hqp s TYR 125 Ca 0.32 0.21 0.02 0.00 -2.44 0.00 0.00 57.07 55.17 3hqp s TYR 125 Cb 0.03 -1.73 0.01 0.00 0.35 0.00 0.00 41.96 40.63 3hqp s TYR 125 CO 0.11 0.56 -0.10 0.42 -1.34 0.00 0.00 175.55 175.20 3hqp s ILE 126 N -1.24 0.91 -1.23 3.14 1.01 -0.49 0.25 121.20 123.55 3hqp s ILE 126 Ca 0.24 -0.36 0.20 0.00 0.00 0.00 0.00 60.65 60.74 3hqp s ILE 126 Cb -0.12 -0.86 0.27 0.00 0.01 0.00 0.00 42.46 41.77 3hqp s ILE 126 CO 0.16 0.30 1.65 -0.90 0.00 0.00 0.00 174.94 176.15 3hqp n ASP 127 N 3.82 0.00 -4.70 3.58 5.68 -1.00 -4.56 116.55 119.37 3hqp n ASP 127 Ca -0.23 0.22 -0.42 0.00 -0.50 0.00 0.00 54.79 53.86 3hqp n ASP 127 Cb 0.52 -0.38 -0.03 0.00 -1.14 0.00 0.00 41.12 40.08 3hqp n ASP 127 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 3hqp s TYR 128 N -2.77 3.33 0.11 2.11 5.04 -1.26 -4.95 117.35 118.97 3hqp s TYR 128 Ca 0.15 1.28 -0.19 0.00 -2.44 0.00 0.00 57.07 55.87 3hqp s TYR 128 Cb 0.14 -3.41 -0.06 0.00 0.35 0.00 0.00 41.96 38.98 3hqp s TYR 128 CO 0.34 -1.25 1.68 1.96 -1.34 0.00 0.00 175.55 176.94 3hqp h GLN 129 N 7.10 0.39 -1.92 4.97 1.08 -1.95 -3.35 115.11 121.43 3hqp h GLN 129 Ca -0.38 -0.06 -0.54 0.00 -1.45 0.00 0.00 58.65 56.21 3hqp h GLN 129 Cb 1.19 -0.07 -0.41 0.00 -0.05 0.00 0.00 27.48 28.14 3hqp h GLN 129 CO 0.84 0.39 -0.85 0.27 -0.95 0.00 0.00 178.83 178.53 3hqp n ASN 130 N -4.80 3.39 0.08 1.46 6.94 -1.26 -4.83 115.26 116.24 3hqp n ASN 130 Ca -0.02 -3.44 -0.04 0.00 -0.02 0.00 0.00 54.58 51.05 3hqp n ASN 130 Cb 0.11 -0.55 0.15 0.00 -2.36 0.00 0.00 39.78 37.12 3hqp n ASN 130 CO 0.00 0.00 0.00 0.17 -1.03 0.00 0.00 177.26 176.40 3hqp h LEU 131 N 2.90 0.28 -0.93 -4.53 -0.00 -1.98 -3.08 115.31 107.96 3hqp h LEU 131 Ca 0.14 -0.15 -0.08 0.00 -0.00 0.00 0.00 57.88 57.79 3hqp h LEU 131 Cb 0.77 -0.08 -0.01 0.00 -0.00 0.00 0.00 40.66 41.34 3hqp h LEU 131 CO 0.72 0.77 -0.37 0.28 -0.00 0.00 0.00 178.44 179.85 3hqp h SER 132 N 0.20 0.00 1.52 0.17 0.02 -1.88 -2.74 113.55 110.84 3hqp h SER 132 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3hqp h SER 132 Cb 1.03 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.57 3hqp h SER 132 CO 0.09 0.37 0.00 0.11 -1.14 0.00 0.00 176.83 176.25 3hqp h LYS 133 N 0.00 0.00 0.00 3.45 1.57 -1.91 -3.36 116.57 116.32 3hqp h LYS 133 Ca -0.00 0.00 -0.40 0.00 -1.87 0.00 0.00 60.65 58.38 3hqp h LYS 133 Cb 0.89 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.15 3hqp h LYS 133 CO 0.05 0.00 -2.18 0.28 -0.57 0.00 0.00 179.45 177.03 3hqp n VAL 134 N -2.41 1.53 -3.69 0.50 0.31 -1.15 -4.98 118.33 108.44 3hqp n VAL 134 Ca 0.05 -0.28 -0.34 0.00 -0.01 0.00 0.00 64.34 63.76 3hqp n VAL 134 Cb 0.44 -1.93 -0.05 0.00 -0.91 0.00 0.00 33.84 31.38 3hqp n VAL 134 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 3hqp s VAL 135 N -2.47 5.21 0.23 2.52 -7.23 -1.05 -5.10 120.40 112.52 3hqp s VAL 135 Ca -0.36 0.20 0.08 0.00 -1.81 0.00 0.00 61.98 60.09 3hqp s VAL 135 Cb 0.12 -3.61 -0.04 0.00 0.56 0.00 0.00 36.38 33.42 3hqp s VAL 135 CO 0.52 0.26 0.05 -0.13 -0.31 0.00 0.00 175.10 175.49 3hqp s ARG 136 N -2.03 2.51 0.21 4.82 0.52 -1.26 -4.71 118.95 119.01 3hqp s ARG 136 Ca 0.32 -1.22 -0.32 0.00 -0.52 0.00 0.00 55.73 54.00 3hqp s ARG 136 Cb -0.13 -2.34 -0.15 0.00 0.52 0.00 0.00 34.95 32.85 3hqp s ARG 136 CO 0.19 0.40 1.17 -2.30 0.02 0.00 0.00 175.30 174.79 3hqp n PRO 137 N -0.74 1.35 0.00 3.54 -0.02 -1.26 -2.49 135.00 135.38 3hqp n PRO 137 Ca -0.08 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 3hqp n PRO 137 Cb 0.57 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 32.08 3hqp n PRO 137 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hqp n GLY 138 N 1.89 2.01 3.75 -1.23 0.00 0.92 -4.97 105.19 107.57 3hqp n GLY 138 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 3hqp n GLY 138 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hqp s ASN 139 N -0.46 3.75 -0.10 1.61 0.02 -1.04 -4.78 114.94 113.93 3hqp s ASN 139 Ca 0.00 1.34 -0.05 0.00 -1.02 0.00 0.00 52.86 53.14 3hqp s ASN 139 Cb 0.00 -2.03 -0.04 0.00 0.02 0.00 0.00 41.25 39.20 3hqp s ASN 139 CO 0.00 -2.45 0.08 -0.31 0.02 0.00 0.00 177.10 174.44 3hqp s TYR 140 N -3.05 3.40 -0.16 2.20 2.02 -1.26 -3.14 117.35 117.35 3hqp s TYR 140 Ca 0.63 0.37 0.01 0.00 -0.37 0.00 0.00 57.07 57.71 3hqp s TYR 140 Cb -0.16 -1.87 0.01 0.00 -0.40 0.00 0.00 41.96 39.53 3hqp s TYR 140 CO 0.56 0.62 -0.17 0.42 -1.57 0.00 0.00 175.55 175.40 3hqp s ILE 141 N -0.97 2.45 -0.25 2.71 1.01 0.87 -4.95 121.20 122.07 3hqp s ILE 141 Ca 0.14 -0.83 -0.12 0.00 0.00 0.00 0.00 60.65 59.84 3hqp s ILE 141 Cb -0.12 -2.03 -0.05 0.00 0.01 0.00 0.00 42.46 40.28 3hqp s ILE 141 CO 0.04 0.52 0.24 -0.31 0.00 0.00 0.00 174.94 175.43 3hqp s TYR 142 N 0.97 3.29 0.10 3.97 1.51 -1.13 -0.35 117.35 125.70 3hqp s TYR 142 Ca -0.03 0.29 0.09 0.00 -1.01 0.00 0.00 57.07 56.41 3hqp s TYR 142 Cb -0.15 -2.39 -0.04 0.00 -0.11 0.00 0.00 41.96 39.27 3hqp s TYR 142 CO -0.03 -0.06 -0.21 0.42 -1.11 0.00 0.00 175.55 174.56 3hqp s ILE 143 N 1.46 2.64 -0.77 2.71 -1.09 1.00 -0.65 121.20 126.50 3hqp s ILE 143 Ca 0.10 -1.49 -0.01 0.00 -2.23 0.00 0.00 60.65 57.03 3hqp s ILE 143 Cb -0.15 -2.17 -0.01 0.00 -1.58 0.00 0.00 42.46 38.56 3hqp s ILE 143 CO 0.08 0.17 0.72 -0.67 -1.23 0.00 0.00 174.94 174.01 3hqp n ASP 144 N 1.06 -7.67 -3.65 3.58 2.03 0.43 -1.28 116.55 111.05 3hqp n ASP 144 Ca -0.16 -0.14 -0.27 0.00 0.52 0.00 0.00 54.79 54.73 3hqp n ASP 144 Cb 0.53 -5.28 -0.01 0.00 -0.72 0.00 0.00 41.12 35.64 3hqp n ASP 144 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 3hqp n ASP 145 N -1.93 -3.61 -0.39 1.67 8.00 -1.24 -1.80 116.55 117.25 3hqp n ASP 145 Ca -0.01 -0.59 -0.05 0.00 0.71 0.00 0.00 54.79 54.85 3hqp n ASP 145 Cb 0.51 -2.98 -0.02 0.00 -0.02 0.00 0.00 41.12 38.62 3hqp n ASP 145 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hqp n GLY 146 N -1.26 0.76 0.08 0.44 0.00 -1.14 -4.80 105.19 99.27 3hqp n GLY 146 Ca 0.02 -0.59 -0.07 0.00 0.00 0.00 0.00 46.02 45.38 3hqp n GLY 146 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3hqp h ILE 147 N 0.00 1.64 -3.38 -0.61 2.04 -0.69 -3.45 117.51 113.06 3hqp h ILE 147 Ca -0.10 -3.15 -0.66 0.00 1.00 0.00 0.00 64.86 61.95 3hqp h ILE 147 Cb 0.40 2.73 -0.28 0.00 -0.74 0.00 0.00 36.82 38.93 3hqp h ILE 147 CO 0.15 0.90 -0.79 -0.22 0.00 0.00 0.00 178.15 178.20 3hqp s LEU 148 N -6.94 2.61 -0.16 1.44 2.96 -0.41 -4.99 118.68 113.20 3hqp s LEU 148 Ca -0.00 -0.36 -0.05 0.00 -0.22 0.00 0.00 54.13 53.50 3hqp s LEU 148 Cb 0.10 -1.57 -0.03 0.00 0.50 0.00 0.00 46.19 45.19 3hqp s LEU 148 CO 0.82 0.18 0.00 -0.63 -1.32 0.00 0.00 176.35 175.40 3hqp s ILE 149 N 0.27 4.28 -0.15 6.68 1.01 -1.26 -0.00 121.20 132.03 3hqp s ILE 149 Ca -0.11 -0.22 0.00 0.00 0.00 0.00 0.00 60.65 60.32 3hqp s ILE 149 Cb -0.16 -2.89 -0.00 0.00 0.01 0.00 0.00 42.46 39.42 3hqp s ILE 149 CO 0.06 0.50 -0.15 -0.76 0.00 0.00 0.00 174.94 174.59 3hqp s LEU 150 N 0.21 2.53 -0.20 2.97 1.43 0.53 -3.38 118.68 122.76 3hqp s LEU 150 Ca 0.00 -0.44 -0.06 0.00 -1.03 0.00 0.00 54.13 52.61 3hqp s LEU 150 Cb -0.13 -1.57 -0.03 0.00 0.03 0.00 0.00 46.19 44.49 3hqp s LEU 150 CO 0.02 0.10 0.02 -1.58 0.23 0.00 0.00 176.35 175.14 3hqp s GLN 151 N 0.72 3.69 0.12 1.70 0.74 -1.15 -0.09 119.66 125.40 3hqp s GLN 151 Ca -0.07 -0.48 -0.30 0.00 0.05 0.00 0.00 55.36 54.56 3hqp s GLN 151 Cb -0.15 -3.14 -0.06 0.00 1.10 0.00 0.00 33.01 30.76 3hqp s GLN 151 CO 0.01 0.04 0.96 0.08 -0.55 0.00 0.00 175.29 175.84 3hqp s VAL 152 N 0.96 4.46 -0.24 1.34 1.01 -1.19 -2.04 120.40 124.70 3hqp s VAL 152 Ca 0.02 2.06 -0.02 0.00 0.00 0.00 0.00 61.98 64.05 3hqp s VAL 152 Cb -0.14 -4.32 -0.14 0.00 0.00 0.00 0.00 36.38 31.78 3hqp s VAL 152 CO 0.02 0.33 -0.24 0.00 0.00 0.00 0.00 175.10 175.21 3hqp n GLN 153 N 2.71 0.57 -3.63 2.72 3.00 0.00 -0.06 117.38 122.69 3hqp n GLN 153 Ca 0.02 0.16 -0.06 0.00 -0.01 0.00 0.00 57.00 57.11 3hqp n GLN 153 Cb 0.49 -1.44 -0.02 0.00 0.00 0.00 0.00 30.24 29.27 3hqp n GLN 153 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 3hqp s SER 154 N -6.52 -0.30 0.31 1.08 1.04 -1.25 -4.71 113.70 103.35 3hqp s SER 154 Ca -0.32 -0.22 -0.27 0.00 0.48 0.00 0.00 55.95 55.62 3hqp s SER 154 Cb 0.10 0.47 -0.09 0.00 0.10 0.00 0.00 66.02 66.59 3hqp s SER 154 CO 0.51 -0.82 1.00 -1.00 0.98 0.00 0.00 173.24 173.91 3hqp s HIS 155 N -3.30 3.64 0.00 5.02 3.76 -1.26 -1.82 115.29 121.33 3hqp s HIS 155 Ca 0.08 1.76 0.00 0.00 -0.15 0.00 0.00 55.06 56.76 3hqp s HIS 155 Cb -0.01 -3.07 0.00 0.00 1.11 0.00 0.00 32.58 30.60 3hqp s HIS 155 CO -0.03 -0.10 0.00 0.39 -0.85 0.00 0.00 174.74 174.14 3hqp n GLU 156 N 0.79 0.00 -0.83 1.40 -0.58 -0.61 -4.87 120.64 115.94 3hqp n GLU 156 Ca 0.01 0.00 -0.05 0.00 -0.42 0.00 0.00 57.16 56.70 3hqp n GLU 156 Cb 0.48 -0.01 0.22 0.00 -0.57 0.00 0.00 31.44 31.57 3hqp n GLU 156 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 3hqp n ASP 157 N -1.28 3.28 0.00 1.62 10.43 -1.16 -4.96 116.55 124.48 3hqp n ASP 157 Ca 0.00 -3.52 0.00 0.00 2.57 0.00 0.00 54.79 53.84 3hqp n ASP 157 Cb 0.00 -0.67 0.00 0.00 1.84 0.00 0.00 41.12 42.29 3hqp n ASP 157 CO 0.00 0.00 0.00 1.21 -1.07 0.00 0.00 177.20 177.34 3hqp n GLU 158 N -0.88 0.00 0.00 -1.24 2.13 -1.26 -4.16 120.64 115.23 3hqp n GLU 158 Ca 0.36 0.00 0.15 0.00 0.66 0.00 0.00 57.16 58.33 3hqp n GLU 158 Cb 1.16 0.00 0.71 0.00 0.27 0.00 0.00 31.44 33.59 3hqp n GLU 158 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 3hqp n GLN 159 N 0.00 0.71 -4.56 5.31 1.13 -1.26 -4.80 117.38 113.91 3hqp n GLN 159 Ca 0.00 -0.15 -0.23 0.00 -1.94 0.00 0.00 57.00 54.67 3hqp n GLN 159 Cb 0.00 -1.50 -0.16 0.00 0.11 0.00 0.00 30.24 28.69 3hqp n GLN 159 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 3hqp s THR 160 N -2.40 1.06 -0.08 5.09 2.01 -1.26 -0.44 115.64 119.63 3hqp s THR 160 Ca 0.33 -0.48 0.02 0.00 0.31 0.00 0.00 61.69 61.87 3hqp s THR 160 Cb 0.20 -0.95 -0.02 0.00 0.01 0.00 0.00 72.50 71.75 3hqp s THR 160 CO 0.45 0.33 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.79 3hqp s LEU 161 N 0.36 2.61 -0.30 4.42 1.43 -1.01 -1.58 118.68 124.61 3hqp s LEU 161 Ca -0.08 -0.31 -0.29 0.00 -1.03 0.00 0.00 54.13 52.43 3hqp s LEU 161 Cb -0.12 -1.55 0.01 0.00 0.03 0.00 0.00 46.19 44.56 3hqp s LEU 161 CO 0.02 0.25 1.17 -0.70 0.23 0.00 0.00 176.35 177.32 3hqp s GLU 162 N -0.18 4.04 0.35 1.70 2.12 -0.76 -2.45 118.70 123.52 3hqp s GLU 162 Ca -0.01 1.19 0.09 0.00 0.36 0.00 0.00 54.97 56.60 3hqp s GLU 162 Cb -0.13 -3.78 -0.06 0.00 0.26 0.00 0.00 34.13 30.41 3hqp s GLU 162 CO 0.03 -0.95 -0.04 0.00 -0.54 0.00 0.00 175.26 173.76 3hqp s THR 164 N -2.57 0.05 -0.15 0.00 2.01 -0.87 -1.80 115.64 112.32 3hqp s THR 164 Ca 0.34 0.16 -0.29 0.00 0.31 0.00 0.00 61.69 62.21 3hqp s THR 164 Cb 0.02 -0.18 -0.01 0.00 0.01 0.00 0.00 72.50 72.34 3hqp s THR 164 CO 0.18 0.12 1.06 -0.69 -0.69 0.00 0.00 174.62 174.60 3hqp s VAL 165 N 1.09 4.64 -0.07 3.82 1.01 -0.49 -2.91 120.40 127.49 3hqp s VAL 165 Ca -0.09 1.94 0.14 0.00 0.00 0.00 0.00 61.98 63.97 3hqp s VAL 165 Cb -0.13 -4.25 -0.21 0.00 0.00 0.00 0.00 36.38 31.79 3hqp s VAL 165 CO -0.02 -0.07 0.64 0.35 0.00 0.00 0.00 175.10 175.99 3hqp n THR 166 N 4.90 1.48 -4.21 3.92 -2.24 -1.22 -0.50 114.28 116.42 3hqp n THR 166 Ca 0.11 -0.78 -0.18 0.00 -2.27 0.00 0.00 64.05 60.93 3hqp n THR 166 Cb 0.47 -0.91 -0.12 0.00 -2.10 0.00 0.00 70.33 67.67 3hqp n THR 166 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3hqp s ASN 167 N -5.95 1.51 -0.25 3.42 2.20 -1.26 -4.75 114.94 109.86 3hqp s ASN 167 Ca -0.05 -0.54 -0.29 0.00 -0.94 0.00 0.00 52.86 51.04 3hqp s ASN 167 Cb 0.08 -0.05 0.01 0.00 -2.00 0.00 0.00 41.25 39.28 3hqp s ASN 167 CO 0.82 -0.06 1.08 -0.44 -2.94 0.00 0.00 177.10 175.57 3hqp s SER 168 N -1.48 7.03 -0.25 3.54 0.01 -1.26 -4.64 113.70 116.64 3hqp s SER 168 Ca -0.02 1.33 -0.17 0.00 1.31 0.00 0.00 55.95 58.39 3hqp s SER 168 Cb -0.09 -2.54 0.07 0.00 0.21 0.00 0.00 66.02 63.67 3hqp s SER 168 CO 0.02 -0.75 0.64 -2.28 0.41 0.00 0.00 173.24 171.28 3hqp s HIS 169 N 3.39 -0.90 -0.29 2.43 5.04 -1.17 -5.04 115.29 118.74 3hqp s HIS 169 Ca 0.46 1.91 -0.20 0.00 -1.54 0.00 0.00 55.06 55.68 3hqp s HIS 169 Cb -0.15 0.47 -0.01 0.00 0.04 0.00 0.00 32.58 32.93 3hqp s HIS 169 CO 0.10 -0.45 0.64 0.99 -2.34 0.00 0.00 174.74 173.68 3hqp s THR 170 N 1.22 4.95 -0.13 0.89 2.01 -1.26 -3.25 115.64 120.06 3hqp s THR 170 Ca -0.07 0.97 -0.04 0.00 0.31 0.00 0.00 61.69 62.86 3hqp s THR 170 Cb -0.05 -3.98 -0.04 0.00 0.01 0.00 0.00 72.50 68.44 3hqp s THR 170 CO -0.13 -0.09 0.03 0.27 -0.69 0.00 0.00 174.62 174.02 3hqp s ILE 171 N 2.59 4.54 0.63 1.82 -4.36 -0.90 -4.91 121.20 120.61 3hqp s ILE 171 Ca 0.26 -0.14 -0.05 0.00 -0.26 0.00 0.00 60.65 60.46 3hqp s ILE 171 Cb -0.15 -2.97 0.13 0.00 1.25 0.00 0.00 42.46 40.72 3hqp s ILE 171 CO 0.11 0.55 0.86 -1.20 0.24 0.00 0.00 174.94 175.49 3hqp n SER 172 N 2.75 0.67 -4.73 4.36 7.64 -1.26 -1.45 113.62 121.60 3hqp n SER 172 Ca -0.18 -1.68 -0.37 0.00 1.01 0.00 0.00 58.87 57.65 3hqp n SER 172 Cb 0.53 -0.60 0.06 0.00 -1.01 0.00 0.00 64.21 63.19 3hqp n SER 172 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 3hqp s ASP 173 N -4.34 4.68 -0.91 6.43 1.01 -1.21 -3.71 116.67 118.62 3hqp s ASP 173 Ca 0.53 2.61 -0.20 0.00 0.71 0.00 0.00 52.55 56.20 3hqp s ASP 173 Cb -0.02 -2.62 0.03 0.00 1.01 0.00 0.00 42.92 41.32 3hqp s ASP 173 CO 0.36 -1.96 0.38 -2.11 0.21 0.00 0.00 175.17 172.05 3hqp n ARG 174 N -1.85 -0.55 -1.99 8.23 1.85 0.02 -4.91 116.66 117.46 3hqp n ARG 174 Ca 0.16 -0.08 -0.37 0.00 -1.00 0.00 0.00 57.85 56.55 3hqp n ARG 174 Cb 0.48 -1.65 0.03 0.00 -1.05 0.00 0.00 32.46 30.27 3hqp n ARG 174 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 3hqp s ARG 175 N -6.63 3.13 0.20 2.89 3.00 -1.24 -4.53 118.95 115.77 3hqp s ARG 175 Ca 0.28 1.93 -0.30 0.00 0.00 0.00 0.00 55.73 57.64 3hqp s ARG 175 Cb -0.16 -2.09 -0.08 0.00 0.00 0.00 0.00 34.95 32.62 3hqp s ARG 175 CO 0.69 -1.10 1.02 0.20 0.00 0.00 0.00 175.30 176.10 3hqp s GLY 176 N -1.38 3.01 -0.07 -3.53 0.00 -1.26 -0.10 107.32 103.98 3hqp s GLY 176 Ca 0.74 0.71 0.01 0.00 0.00 0.00 0.00 44.72 46.18 3hqp s GLY 176 CO 0.37 1.44 -0.08 0.54 0.00 0.00 0.00 173.10 175.37 3hqp s VAL 177 N -0.64 0.89 -0.03 1.40 0.11 -0.91 0.16 120.40 121.38 3hqp s VAL 177 Ca 0.45 -0.29 0.05 0.00 -2.93 0.00 0.00 61.98 59.26 3hqp s VAL 177 Cb -0.27 -0.87 -0.03 0.00 -1.53 0.00 0.00 36.38 33.68 3hqp s VAL 177 CO 0.34 0.31 -0.18 0.20 -3.33 0.00 0.00 175.10 172.44 3hqp s ASN 178 N 1.06 3.73 -0.46 3.54 0.01 0.18 -4.31 114.94 118.69 3hqp s ASN 178 Ca -0.08 -0.30 0.03 0.00 -0.71 0.00 0.00 52.86 51.80 3hqp s ASN 178 Cb -0.14 -0.68 0.13 0.00 0.41 0.00 0.00 41.25 40.97 3hqp s ASN 178 CO -0.01 0.33 0.24 -0.76 -1.51 0.00 0.00 177.10 175.39 3hqp s LEU 179 N -0.79 3.15 -0.03 0.60 2.01 -1.26 -2.85 118.68 119.50 3hqp s LEU 179 Ca 0.11 -2.72 -0.30 0.00 0.01 0.00 0.00 54.13 51.24 3hqp s LEU 179 Cb -0.10 -1.21 -0.05 0.00 0.01 0.00 0.00 46.19 44.84 3hqp s LEU 179 CO 0.01 -0.26 1.40 -2.84 1.01 0.00 0.00 176.35 175.67 3hqp s PRO 180 N 0.20 4.27 -0.35 1.29 0.02 -1.26 -3.40 135.00 135.76 3hqp s PRO 180 Ca 0.17 1.94 -0.01 0.00 0.02 0.00 0.00 61.00 63.12 3hqp s PRO 180 Cb -0.25 -3.64 0.00 0.00 0.02 0.00 0.00 34.50 30.63 3hqp s PRO 180 CO 0.00 -0.62 0.30 0.41 -0.33 0.00 0.00 177.00 176.77 3hqp n GLY 181 N 3.68 0.35 0.00 0.52 0.00 -1.26 -4.98 105.19 103.50 3hqp n GLY 181 Ca 0.14 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.80 3hqp n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hqp n ASP 183 N -1.24 -6.90 -4.76 0.00 4.64 -1.26 -4.97 116.55 102.05 3hqp n ASP 183 Ca 0.00 1.04 -0.41 0.00 -1.38 0.00 0.00 54.79 54.04 3hqp n ASP 183 Cb 0.00 -4.54 -0.03 0.00 -1.04 0.00 0.00 41.12 35.51 3hqp n ASP 183 CO 0.00 0.00 0.00 0.68 -0.82 0.00 0.00 177.20 177.06 3hqp s VAL 184 N -1.51 3.11 -1.95 5.18 -7.23 -1.26 -4.94 120.40 111.81 3hqp s VAL 184 Ca 0.04 1.10 0.27 0.00 -1.81 0.00 0.00 61.98 61.57 3hqp s VAL 184 Cb -0.01 -3.70 0.34 0.00 0.56 0.00 0.00 36.38 33.58 3hqp s VAL 184 CO 0.64 0.25 1.62 -0.67 -0.31 0.00 0.00 175.10 176.62 3hqp n ASP 185 N 1.18 1.14 -4.72 4.85 2.03 -1.26 -4.93 116.55 114.85 3hqp n ASP 185 Ca 0.00 -1.04 -0.42 0.00 0.52 0.00 0.00 54.79 53.85 3hqp n ASP 185 Cb 0.43 0.10 -0.03 0.00 -0.72 0.00 0.00 41.12 40.90 3hqp n ASP 185 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3hqp s LEU 186 N -2.37 4.37 1.09 -2.67 1.43 -1.26 -4.99 118.68 114.28 3hqp s LEU 186 Ca 0.28 2.59 -0.15 0.00 -1.03 0.00 0.00 54.13 55.82 3hqp s LEU 186 Cb 0.20 -3.59 0.23 0.00 0.03 0.00 0.00 46.19 43.05 3hqp s LEU 186 CO 0.47 -0.80 1.09 -2.16 0.23 0.00 0.00 176.35 175.18 3hqp s PRO 187 N 1.07 -0.27 0.03 1.29 0.04 -1.26 -4.82 135.00 131.07 3hqp s PRO 187 Ca 0.69 0.32 -0.30 0.00 0.04 0.00 0.00 61.00 61.75 3hqp s PRO 187 Cb -0.43 -1.67 -0.17 0.00 0.04 0.00 0.00 34.50 32.27 3hqp s PRO 187 CO 0.32 -3.16 1.28 0.00 0.04 0.00 0.00 177.00 175.47 3hqp h ALA 188 N -2.20 -0.98 -3.35 8.56 0.00 -1.99 -3.37 119.26 115.93 3hqp h ALA 188 Ca -0.52 -0.22 -0.63 0.00 0.00 0.00 0.00 54.91 53.54 3hqp h ALA 188 Cb 1.32 0.38 -0.40 0.00 0.00 0.00 0.00 17.79 19.09 3hqp h ALA 188 CO 0.50 -0.95 -0.71 0.54 0.00 0.00 0.00 179.25 178.63 3hqp s VAL 189 N -5.10 1.82 1.01 0.00 0.11 -1.26 -4.51 120.40 112.47 3hqp s VAL 189 Ca -0.16 -2.35 -0.13 0.00 -2.93 0.00 0.00 61.98 56.41 3hqp s VAL 189 Cb 0.02 -2.32 0.20 0.00 -1.53 0.00 0.00 36.38 32.75 3hqp s VAL 189 CO 0.50 -0.72 1.10 -0.94 -3.33 0.00 0.00 175.10 171.70 3hqp s SER 190 N 0.72 2.50 0.39 3.54 1.04 -1.26 -4.82 113.70 115.82 3hqp s SER 190 Ca 0.13 1.12 0.08 0.00 0.48 0.00 0.00 55.95 57.77 3hqp s SER 190 Cb -0.21 -1.77 0.83 0.00 0.10 0.00 0.00 66.02 64.97 3hqp s SER 190 CO -0.09 -3.20 1.98 0.00 0.98 0.00 0.00 173.24 172.92 3hqp h ALA 191 N -1.94 1.77 -0.51 5.32 0.00 -2.00 -1.49 119.26 120.40 3hqp h ALA 191 Ca -0.55 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.30 3hqp h ALA 191 Cb 1.33 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 3hqp h ALA 191 CO 0.57 0.13 0.14 0.87 0.00 0.00 0.00 179.25 180.97 3hqp h LYS 192 N 0.64 0.81 -0.46 0.00 1.57 -2.01 -3.21 116.57 113.92 3hqp h LYS 192 Ca 0.27 -0.18 -0.03 0.00 -1.87 0.00 0.00 60.65 58.83 3hqp h LYS 192 Cb 0.25 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 3hqp h LYS 192 CO -0.08 0.76 0.14 -0.44 -0.57 0.00 0.00 179.45 179.27 3hqp h ASP 193 N 0.71 0.61 -0.45 0.86 3.32 -1.61 -2.85 116.42 117.01 3hqp h ASP 193 Ca 0.16 -0.08 -0.05 0.00 0.02 0.00 0.00 57.03 57.09 3hqp h ASP 193 Cb 0.30 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 3hqp h ASP 193 CO -0.00 0.58 0.13 -0.09 -1.72 0.00 0.00 179.24 178.14 3hqp h ARG 194 N 0.65 0.77 0.08 3.56 2.43 -1.50 -0.63 114.38 119.74 3hqp h ARG 194 Ca 0.15 -0.15 -0.25 0.00 -0.81 0.00 0.00 59.98 58.92 3hqp h ARG 194 Cb 0.20 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 3hqp h ARG 194 CO -0.01 0.69 -1.17 0.28 -1.51 0.00 0.00 179.97 178.25 3hqp h VAL 195 N 0.75 1.55 -0.37 0.20 2.07 -1.62 -2.47 116.25 116.35 3hqp h VAL 195 Ca 0.17 -3.19 -0.16 0.00 0.82 0.00 0.00 66.70 64.34 3hqp h VAL 195 Cb 0.27 2.89 -0.00 0.00 -1.52 0.00 0.00 31.29 32.92 3hqp h VAL 195 CO -0.00 0.92 -0.40 0.44 0.02 0.00 0.00 177.57 178.54 3hqp h ASP 196 N 0.04 0.99 0.30 0.57 3.32 -1.31 -2.42 116.42 117.93 3hqp h ASP 196 Ca -0.09 -0.47 -0.12 0.00 0.02 0.00 0.00 57.03 56.36 3hqp h ASP 196 Cb 1.90 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 41.15 3hqp h ASP 196 CO 0.17 1.27 -0.49 -0.07 -1.72 0.00 0.00 179.24 178.40 3hqp h LEU 197 N 0.74 0.23 -0.58 1.55 3.38 -1.19 -2.74 115.31 116.69 3hqp h LEU 197 Ca 0.05 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 3hqp h LEU 197 Cb 1.00 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.66 3hqp h LEU 197 CO 0.10 0.68 0.22 -0.61 0.09 0.00 0.00 178.44 178.92 3hqp h GLN 198 N 0.17 0.88 -0.13 1.13 5.75 -1.39 -2.84 115.11 118.69 3hqp h GLN 198 Ca 0.01 -0.17 -0.07 0.00 -0.15 0.00 0.00 58.65 58.27 3hqp h GLN 198 Cb 0.92 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 29.32 3hqp h GLN 198 CO 0.07 0.76 -0.26 0.35 -2.65 0.00 0.00 178.83 177.11 3hqp h PHE 199 N 0.81 0.25 -0.35 3.99 3.57 -1.32 -1.13 116.94 122.77 3hqp h PHE 199 Ca 0.19 -0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.62 3hqp h PHE 199 Cb 0.22 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 3hqp h PHE 199 CO 0.01 0.48 0.10 0.78 -2.23 0.00 0.00 178.31 177.44 3hqp h GLY 200 N 0.97 0.59 1.02 2.40 0.00 -1.34 -1.68 103.07 105.02 3hqp h GLY 200 Ca 0.03 -0.36 -0.13 0.00 0.00 0.00 0.00 47.33 46.88 3hqp h GLY 200 CO 0.04 0.33 -0.30 -2.08 0.00 0.00 0.00 176.54 174.54 3hqp h VAL 201 N 0.41 1.29 -0.47 4.60 2.07 -1.32 0.11 116.25 122.93 3hqp h VAL 201 Ca 0.11 -1.46 0.01 0.00 0.82 0.00 0.00 66.70 66.18 3hqp h VAL 201 Cb 0.27 1.49 -0.03 0.00 -1.52 0.00 0.00 31.29 31.51 3hqp h VAL 201 CO -0.00 0.48 0.30 -0.33 0.02 0.00 0.00 177.57 178.03 3hqp h GLU 202 N 0.55 0.58 0.05 1.57 5.08 -1.18 -3.07 114.58 118.16 3hqp h GLU 202 Ca 0.06 -0.03 -0.25 0.00 -1.00 0.00 0.00 59.36 58.13 3hqp h GLU 202 Cb 0.87 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.97 3hqp h GLU 202 CO 0.08 0.38 -1.22 1.96 -1.00 0.00 0.00 179.01 179.21 3hqp h GLN 203 N 0.60 0.11 0.00 2.33 1.08 -1.33 -3.49 115.11 114.41 3hqp h GLN 203 Ca 0.18 -0.19 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 3hqp h GLN 203 Cb -0.03 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.48 3hqp h GLN 203 CO -0.06 1.03 0.00 0.41 -0.95 0.00 0.00 178.83 179.25 3hqp n GLY 204 N 1.47 0.62 3.75 3.46 0.00 0.18 -5.09 105.19 109.57 3hqp n GLY 204 Ca -0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.62 3hqp n GLY 204 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hqp s VAL 205 N -1.08 2.86 -0.04 1.61 -7.23 -0.07 -4.98 120.40 111.47 3hqp s VAL 205 Ca 0.00 0.41 0.13 0.00 -1.81 0.00 0.00 61.98 60.70 3hqp s VAL 205 Cb 0.00 -2.93 -0.22 0.00 0.56 0.00 0.00 36.38 33.79 3hqp s VAL 205 CO 0.00 -0.24 0.71 0.44 -0.31 0.00 0.00 175.10 175.69 3hqp h ASP 206 N -0.13 0.00 -5.06 4.85 3.32 -1.71 -3.47 116.42 114.22 3hqp h ASP 206 Ca -0.47 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.49 3hqp h ASP 206 Cb 1.27 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 40.65 3hqp h ASP 206 CO 0.52 0.96 -0.23 0.00 -1.72 0.00 0.00 179.24 178.77 3hqp s MET 207 N -2.63 0.83 -0.11 3.56 0.23 -1.17 -3.13 119.30 116.87 3hqp s MET 207 Ca -0.04 -0.52 0.00 0.00 -1.03 0.00 0.00 55.69 54.10 3hqp s MET 207 Cb 0.08 0.36 -0.02 0.00 -1.53 0.00 0.00 34.83 33.72 3hqp s MET 207 CO 0.82 -0.27 -0.12 0.42 -2.03 0.00 0.00 175.02 173.84 3hqp s ILE 208 N -2.65 3.19 -1.07 3.16 -1.09 -0.32 -1.85 121.20 120.58 3hqp s ILE 208 Ca -0.04 -0.63 -0.10 0.00 -2.23 0.00 0.00 60.65 57.65 3hqp s ILE 208 Cb -0.01 -2.33 0.26 0.00 -1.58 0.00 0.00 42.46 38.81 3hqp s ILE 208 CO -0.04 0.54 1.07 -0.36 -1.23 0.00 0.00 174.94 174.92 3hqp s PHE 209 N 0.09 4.13 -0.16 3.97 0.08 0.21 -0.40 117.98 125.89 3hqp s PHE 209 Ca -0.05 -2.52 -0.29 0.00 0.12 0.00 0.00 56.93 54.19 3hqp s PHE 209 Cb -0.14 -3.87 -0.04 0.00 -0.57 0.00 0.00 43.02 38.39 3hqp s PHE 209 CO 0.04 -0.99 1.80 0.00 -0.10 0.00 0.00 175.22 175.98 3hqp s ALA 210 N -0.80 3.25 0.42 5.36 0.00 0.05 -1.72 121.76 128.31 3hqp s ALA 210 Ca 0.29 0.73 -0.21 0.00 0.00 0.00 0.00 51.96 52.76 3hqp s ALA 210 Cb -0.10 -3.89 -0.11 0.00 0.00 0.00 0.00 23.12 19.03 3hqp s ALA 210 CO -0.08 -2.01 0.95 -1.12 0.00 0.00 0.00 175.76 173.50 3hqp s SER 211 N 5.01 6.98 -1.22 0.00 0.01 -1.26 -0.86 113.70 122.36 3hqp s SER 211 Ca 0.81 1.70 -0.21 0.00 1.31 0.00 0.00 55.95 59.56 3hqp s SER 211 Cb -0.30 -2.54 0.01 0.00 0.21 0.00 0.00 66.02 63.39 3hqp s SER 211 CO 0.33 -0.33 0.67 0.49 0.41 0.00 0.00 173.24 174.81 3hqp n PHE 212 N -0.52 -1.69 -2.62 2.43 3.72 -1.25 -4.52 117.46 113.01 3hqp n PHE 212 Ca 0.06 0.40 -0.43 0.00 -0.05 0.00 0.00 57.45 57.43 3hqp n PHE 212 Cb 0.54 -3.28 -0.02 0.00 -0.94 0.00 0.00 39.48 35.77 3hqp n PHE 212 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 3hqp s ILE 213 N -3.60 4.61 -0.22 4.37 -1.09 -0.83 -4.67 121.20 119.76 3hqp s ILE 213 Ca 0.38 1.93 0.06 0.00 -2.23 0.00 0.00 60.65 60.79 3hqp s ILE 213 Cb -0.16 -4.25 -0.17 0.00 -1.58 0.00 0.00 42.46 36.30 3hqp s ILE 213 CO 0.90 -0.14 -0.14 -2.11 -1.23 0.00 0.00 174.94 172.22 3hqp n ARG 214 N 6.16 0.69 -3.90 2.79 1.85 -1.26 -4.16 116.66 118.83 3hqp n ARG 214 Ca 0.12 0.10 -0.09 0.00 -1.00 0.00 0.00 57.85 56.98 3hqp n ARG 214 Cb 0.46 -1.48 -0.05 0.00 -1.05 0.00 0.00 32.46 30.34 3hqp n ARG 214 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 3hqp s SER 215 N -6.05 -0.09 0.37 2.89 1.04 -1.26 -4.01 113.70 106.58 3hqp s SER 215 Ca -0.26 -0.76 0.11 0.00 0.48 0.00 0.00 55.95 55.52 3hqp s SER 215 Cb 0.08 0.52 0.71 0.00 0.10 0.00 0.00 66.02 67.43 3hqp s SER 215 CO 0.60 -1.01 1.84 0.00 0.98 0.00 0.00 173.24 175.65 3hqp h ALA 216 N 2.35 1.39 -0.82 5.32 0.00 -1.86 -2.72 119.26 122.92 3hqp h ALA 216 Ca -0.29 -0.31 0.04 0.00 0.00 0.00 0.00 54.91 54.35 3hqp h ALA 216 Cb 1.24 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.92 3hqp h ALA 216 CO 0.41 0.44 0.54 1.49 0.00 0.00 0.00 179.25 182.13 3hqp h GLU 217 N 0.08 0.97 -0.45 0.00 4.81 -1.97 -2.07 114.58 115.96 3hqp h GLU 217 Ca 0.01 -0.06 -0.12 0.00 -0.13 0.00 0.00 59.36 59.06 3hqp h GLU 217 Cb 0.60 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 3hqp h GLU 217 CO 0.04 0.64 -0.21 0.37 -0.73 0.00 0.00 179.01 179.13 3hqp h GLN 218 N 1.00 0.90 -0.68 1.92 4.15 -1.91 -2.79 115.11 117.70 3hqp h GLN 218 Ca 0.33 -0.37 -0.02 0.00 0.77 0.00 0.00 58.65 59.37 3hqp h GLN 218 Cb 0.06 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 27.67 3hqp h GLN 218 CO -0.10 1.02 0.36 0.28 -1.93 0.00 0.00 178.83 178.46 3hqp h VAL 219 N 0.78 1.21 -0.58 2.39 2.07 -1.34 -0.95 116.25 119.83 3hqp h VAL 219 Ca 0.11 -0.53 -0.04 0.00 0.82 0.00 0.00 66.70 67.05 3hqp h VAL 219 Cb 0.75 0.29 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 3hqp h VAL 219 CO 0.06 0.23 0.18 1.23 0.02 0.00 0.00 177.57 179.30 3hqp h GLY 220 N 1.01 0.93 1.45 2.17 0.00 -1.34 -2.07 103.07 105.23 3hqp h GLY 220 Ca 0.24 -0.51 -0.08 0.00 0.00 0.00 0.00 47.33 46.98 3hqp h GLY 220 CO -0.04 0.48 -0.11 -0.55 0.00 0.00 0.00 176.54 176.32 3hqp h ASP 221 N 0.85 0.64 -0.35 0.19 3.32 -0.95 0.29 116.42 120.41 3hqp h ASP 221 Ca 0.19 -0.18 -0.15 0.00 0.02 0.00 0.00 57.03 56.91 3hqp h ASP 221 Cb 0.24 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 3hqp h ASP 221 CO -0.01 0.78 -0.37 0.58 -1.72 0.00 0.00 179.24 178.50 3hqp h VAL 222 N 0.60 1.27 -0.34 -1.35 2.07 -1.00 0.47 116.25 117.97 3hqp h VAL 222 Ca 0.11 -1.54 -0.08 0.00 0.82 0.00 0.00 66.70 66.00 3hqp h VAL 222 Cb 0.55 1.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.67 3hqp h VAL 222 CO 0.03 0.52 -0.11 -0.09 0.02 0.00 0.00 177.57 177.93 3hqp h ARG 223 N 0.74 0.59 -0.51 1.57 2.43 -1.21 0.97 114.38 118.96 3hqp h ARG 223 Ca 0.06 -0.18 -0.12 0.00 -0.81 0.00 0.00 59.98 58.93 3hqp h ARG 223 Cb 0.95 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.43 3hqp h ARG 223 CO 0.09 0.69 -0.17 0.87 -1.51 0.00 0.00 179.97 179.94 3hqp h LYS 224 N 0.54 1.01 0.00 0.20 1.57 -0.65 -2.80 116.57 116.43 3hqp h LYS 224 Ca 0.10 -0.41 -0.08 0.00 -1.87 0.00 0.00 60.65 58.39 3hqp h LYS 224 Cb 0.52 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.77 3hqp h LYS 224 CO 0.03 1.09 -0.40 0.00 -0.57 0.00 0.00 179.45 179.60 3hqp h ALA 225 N 0.89 0.95 -0.13 3.86 0.00 0.30 -2.80 119.26 122.34 3hqp h ALA 225 Ca 0.12 -0.36 -0.16 0.00 0.00 0.00 0.00 54.91 54.51 3hqp h ALA 225 Cb 0.75 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 3hqp h ALA 225 CO 0.06 0.50 -0.61 -0.07 0.00 0.00 0.00 179.25 179.13 3hqp h LEU 226 N 0.00 0.50 0.00 0.00 3.38 -0.80 -3.42 115.31 114.97 3hqp h LEU 226 Ca -0.00 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.68 3hqp h LEU 226 Cb 0.96 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.57 3hqp h LEU 226 CO 0.05 0.98 0.00 0.61 0.09 0.00 0.00 178.44 180.18 3hqp n GLY 227 N 0.32 -1.85 0.18 0.83 0.00 -1.06 -3.94 105.19 99.69 3hqp n GLY 227 Ca -0.03 -1.65 0.06 0.00 0.00 0.00 0.00 46.02 44.40 3hqp n GLY 227 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3hqp h PRO 228 N 0.00 0.00 0.00 1.61 0.11 -1.89 -3.17 132.00 128.66 3hqp h PRO 228 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3hqp h PRO 228 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3hqp h PRO 228 CO 0.00 0.35 -0.27 1.63 -0.21 0.00 0.00 178.00 179.50 3hqp n LYS 229 N -3.35 0.17 -2.64 1.05 4.76 -1.26 -4.26 118.16 112.62 3hqp n LYS 229 Ca 0.01 0.09 -0.25 0.00 -2.87 0.00 0.00 58.31 55.29 3hqp n LYS 229 Cb 0.56 -1.65 -0.01 0.00 -1.84 0.00 0.00 35.03 32.10 3hqp n LYS 229 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3hqp n GLY 230 N 1.39 5.42 0.10 0.72 0.00 -1.20 -4.74 105.19 106.88 3hqp n GLY 230 Ca 0.05 -2.60 -0.11 0.00 0.00 0.00 0.00 46.02 43.35 3hqp n GLY 230 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3hqp n ARG 231 N -0.35 0.68 0.22 1.61 -4.01 -1.26 -4.26 116.66 109.29 3hqp n ARG 231 Ca 0.34 0.03 0.15 0.00 -1.04 0.00 0.00 57.85 57.32 3hqp n ARG 231 Cb 0.60 -1.53 0.54 0.00 -3.04 0.00 0.00 32.46 29.04 3hqp n ARG 231 CO 0.00 0.00 0.00 -0.44 -3.04 0.00 0.00 177.63 174.15 3hqp h ASP 232 N 0.00 0.00 -3.05 2.89 3.32 -1.92 -3.43 116.42 114.24 3hqp h ASP 232 Ca -0.55 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 55.96 3hqp h ASP 232 Cb 2.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.73 3hqp h ASP 232 CO 0.01 0.00 0.70 -0.63 -1.72 0.00 0.00 179.24 177.60 3hqp s ILE 233 N -3.48 3.80 0.22 0.35 1.01 -1.26 -5.01 121.20 116.84 3hqp s ILE 233 Ca 0.03 1.25 -0.30 0.00 0.00 0.00 0.00 60.65 61.63 3hqp s ILE 233 Cb 0.09 -3.80 -0.08 0.00 0.01 0.00 0.00 42.46 38.67 3hqp s ILE 233 CO 0.53 0.05 0.96 -0.04 0.00 0.00 0.00 174.94 176.45 3hqp s MET 234 N 1.65 4.80 -0.47 2.79 -1.94 -1.18 -4.92 119.30 120.03 3hqp s MET 234 Ca 0.61 1.52 -0.12 0.00 -1.71 0.00 0.00 55.69 56.00 3hqp s MET 234 Cb -0.31 -3.29 0.10 0.00 2.01 0.00 0.00 34.83 33.35 3hqp s MET 234 CO 0.28 0.42 0.37 0.42 -0.01 0.00 0.00 175.02 176.49 3hqp s ILE 235 N -0.94 4.60 -0.39 2.53 1.01 -1.26 -1.17 121.20 125.58 3hqp s ILE 235 Ca 0.43 -1.51 -0.23 0.00 0.00 0.00 0.00 60.65 59.33 3hqp s ILE 235 Cb -0.26 -3.91 0.01 0.00 0.01 0.00 0.00 42.46 38.31 3hqp s ILE 235 CO 0.33 -0.70 0.79 -0.63 0.00 0.00 0.00 174.94 174.73 3hqp s ILE 236 N 1.47 4.70 -0.25 2.92 -1.09 0.46 -1.59 121.20 127.83 3hqp s ILE 236 Ca 0.04 0.79 -0.20 0.00 -2.23 0.00 0.00 60.65 59.05 3hqp s ILE 236 Cb -0.26 -4.24 -0.02 0.00 -1.58 0.00 0.00 42.46 36.36 3hqp s ILE 236 CO 0.02 -0.51 0.61 0.00 -1.23 0.00 0.00 174.94 173.83 3hqp s LYS 238 N 2.42 4.42 -0.42 0.00 1.02 -0.04 -2.04 119.74 125.09 3hqp s LYS 238 Ca 0.26 0.88 -0.09 0.00 0.02 0.00 0.00 55.97 57.04 3hqp s LYS 238 Cb -0.16 -3.39 0.08 0.00 -0.52 0.00 0.00 37.83 33.85 3hqp s LYS 238 CO 0.09 0.23 0.26 0.42 -0.92 0.00 0.00 175.35 175.43 3hqp s ILE 239 N 0.21 4.17 -0.01 2.17 -1.09 -0.71 -1.96 121.20 123.98 3hqp s ILE 239 Ca 0.36 -1.46 0.02 0.00 -2.23 0.00 0.00 60.65 57.33 3hqp s ILE 239 Cb -0.19 -3.58 0.02 0.00 -1.58 0.00 0.00 42.46 37.13 3hqp s ILE 239 CO 0.19 -0.53 0.94 -1.84 -1.23 0.00 0.00 174.94 172.47 3hqp n GLU 240 N 4.90 0.14 -4.38 2.79 0.28 -1.26 -3.06 120.64 120.05 3hqp n GLU 240 Ca -0.10 -1.07 -0.19 0.00 -0.16 0.00 0.00 57.16 55.65 3hqp n GLU 240 Cb 0.43 -0.59 -0.10 0.00 1.43 0.00 0.00 31.44 32.61 3hqp n GLU 240 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 3hqp s ASN 241 N -1.02 1.75 0.07 -1.84 4.22 -1.26 -3.03 114.94 113.83 3hqp s ASN 241 Ca 0.03 -1.45 -0.15 0.00 -2.14 0.00 0.00 52.86 49.14 3hqp s ASN 241 Cb 0.02 0.18 -0.16 0.00 1.28 0.00 0.00 41.25 42.57 3hqp s ASN 241 CO 0.00 -0.75 1.28 -0.74 -2.04 0.00 0.00 177.10 174.85 3hqp h HIS 242 N 2.21 0.89 -0.00 1.54 -0.00 -1.94 -3.20 115.15 114.64 3hqp h HIS 242 Ca -0.38 -0.38 0.00 0.00 -0.00 0.00 0.00 60.37 59.61 3hqp h HIS 242 Cb 1.25 -0.14 0.00 0.00 -0.00 0.00 0.00 27.41 28.52 3hqp h HIS 242 CO 0.72 1.19 -0.13 0.00 -0.00 0.00 0.00 177.93 179.70 3hqp n GLN 243 N -4.10 0.59 0.08 5.26 10.64 -1.26 -3.30 117.38 125.29 3hqp n GLN 243 Ca -0.07 -0.21 -0.09 0.00 -1.83 0.00 0.00 57.00 54.80 3hqp n GLN 243 Cb 0.66 -1.50 -0.06 0.00 -0.86 0.00 0.00 30.24 28.48 3hqp n GLN 243 CO 0.00 0.00 0.00 0.78 -1.83 0.00 0.00 177.06 176.01 3hqp h GLY 244 N 4.97 0.16 1.64 2.61 0.00 -1.69 -2.85 103.07 107.92 3hqp h GLY 244 Ca 0.00 -0.34 -0.19 0.00 0.00 0.00 0.00 47.33 46.79 3hqp h GLY 244 CO 0.00 0.30 -0.80 -2.08 0.00 0.00 0.00 176.54 173.96 3hqp h VAL 245 N 0.06 1.41 0.00 4.60 2.07 -1.58 -3.23 116.25 119.58 3hqp h VAL 245 Ca -0.05 -2.31 0.00 0.00 0.82 0.00 0.00 66.70 65.16 3hqp h VAL 245 Cb 1.66 2.25 0.00 0.00 -1.52 0.00 0.00 31.29 33.68 3hqp h VAL 245 CO 0.14 0.69 -0.03 1.67 0.02 0.00 0.00 177.57 180.06 3hqp n GLN 246 N -3.78 0.14 -0.24 1.57 7.27 -1.21 -3.33 117.38 117.81 3hqp n GLN 246 Ca -0.04 0.11 0.07 0.00 0.07 0.00 0.00 57.00 57.21 3hqp n GLN 246 Cb 0.75 -1.66 0.17 0.00 2.41 0.00 0.00 30.24 31.91 3hqp n GLN 246 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 3hqp n ASN 247 N -1.91 3.08 -0.32 1.69 3.02 -1.08 -4.85 115.26 114.89 3hqp n ASN 247 Ca 0.06 -2.60 0.09 0.00 -0.03 0.00 0.00 54.58 52.10 3hqp n ASN 247 Cb 0.39 -0.36 0.30 0.00 -0.61 0.00 0.00 39.78 39.50 3hqp n ASN 247 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 3hqp h ILE 248 N 1.30 0.90 -0.34 2.41 6.09 -1.57 -2.64 117.51 123.66 3hqp h ILE 248 Ca 0.00 -0.30 -0.01 0.00 -1.37 0.00 0.00 64.86 63.17 3hqp h ILE 248 Cb 1.03 -0.05 -0.02 0.00 0.47 0.00 0.00 36.82 38.25 3hqp h ILE 248 CO 0.09 0.16 0.16 0.44 -3.07 0.00 0.00 178.15 175.93 3hqp h ASP 249 N 0.88 0.46 0.79 2.19 3.32 -1.88 -0.27 116.42 121.90 3hqp h ASP 249 Ca 0.47 -0.14 -0.12 0.00 0.02 0.00 0.00 57.03 57.26 3hqp h ASP 249 Cb 0.55 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.96 3hqp h ASP 249 CO -0.23 0.47 -0.56 0.77 -1.72 0.00 0.00 179.24 177.97 3hqp h SER 250 N 0.41 0.00 0.07 6.45 4.64 -1.92 -3.09 113.55 120.10 3hqp h SER 250 Ca 0.12 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.43 3hqp h SER 250 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 3hqp h SER 250 CO -0.01 0.56 -0.03 0.40 -0.87 0.00 0.00 176.83 176.87 3hqp h ILE 251 N 0.00 1.15 -0.73 0.95 2.04 -1.13 -2.98 117.51 116.81 3hqp h ILE 251 Ca -0.01 -0.78 0.13 0.00 1.00 0.00 0.00 64.86 65.20 3hqp h ILE 251 Cb 1.10 1.66 -0.09 0.00 -0.74 0.00 0.00 36.82 38.76 3hqp h ILE 251 CO 0.07 0.19 0.31 0.40 0.00 0.00 0.00 178.15 179.13 3hqp h ILE 252 N -0.44 0.71 -0.90 -0.67 2.04 -1.09 0.67 117.51 117.84 3hqp h ILE 252 Ca -0.01 -0.17 0.08 0.00 1.00 0.00 0.00 64.86 65.77 3hqp h ILE 252 Cb 0.39 0.19 -0.06 0.00 -0.74 0.00 0.00 36.82 36.59 3hqp h ILE 252 CO 0.01 0.09 0.58 -0.08 0.00 0.00 0.00 178.15 178.75 3hqp h GLU 253 N 0.48 0.92 0.03 2.37 4.57 -1.54 -2.99 114.58 118.42 3hqp h GLU 253 Ca 0.39 -0.06 -0.31 0.00 -1.18 0.00 0.00 59.36 58.20 3hqp h GLU 253 Cb 0.54 -0.21 -0.04 0.00 -0.16 0.00 0.00 28.75 28.88 3hqp h GLU 253 CO -0.36 0.61 -1.81 0.39 -1.18 0.00 0.00 179.01 176.66 3hqp n GLU 254 N -4.51 0.66 -1.70 1.92 -0.58 -0.42 -4.95 120.64 111.06 3hqp n GLU 254 Ca 0.15 0.28 -0.30 0.00 -0.42 0.00 0.00 57.16 56.86 3hqp n GLU 254 Cb 0.26 -1.76 0.08 0.00 -0.57 0.00 0.00 31.44 29.44 3hqp n GLU 254 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3hqp s SER 255 N -6.29 4.78 -0.02 1.62 1.04 0.22 -4.98 113.70 110.07 3hqp s SER 255 Ca -0.09 1.18 0.13 0.00 0.48 0.00 0.00 55.95 57.64 3hqp s SER 255 Cb 0.08 -1.90 0.38 0.00 0.10 0.00 0.00 66.02 64.67 3hqp s SER 255 CO 0.81 -1.77 1.32 0.47 0.98 0.00 0.00 173.24 175.05 3hqp n ASP 256 N -3.29 3.20 0.00 7.02 9.92 -0.62 -4.87 116.55 127.90 3hqp n ASP 256 Ca 0.07 -2.08 0.00 0.00 -0.53 0.00 0.00 54.79 52.25 3hqp n ASP 256 Cb 0.57 -0.30 0.00 0.00 -0.64 0.00 0.00 41.12 40.75 3hqp n ASP 256 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3hqp n GLY 257 N 0.62 2.51 3.16 0.44 0.00 -1.25 -4.13 105.19 106.54 3hqp n GLY 257 Ca 0.14 -0.89 -0.26 0.00 0.00 0.00 0.00 46.02 45.01 3hqp n GLY 257 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hqp s ILE 258 N -2.00 1.45 -0.21 -0.61 -1.09 -0.42 -1.03 121.20 117.30 3hqp s ILE 258 Ca 0.00 -0.76 -0.03 0.00 -2.23 0.00 0.00 60.65 57.63 3hqp s ILE 258 Cb 0.00 -1.23 -0.01 0.00 -1.58 0.00 0.00 42.46 39.64 3hqp s ILE 258 CO 0.00 0.41 -0.06 -0.32 -1.23 0.00 0.00 174.94 173.74 3hqp s MET 259 N -0.20 3.37 -0.99 2.79 -2.45 -0.87 -0.40 119.30 120.55 3hqp s MET 259 Ca 0.02 -0.64 -0.23 0.00 -1.25 0.00 0.00 55.69 53.58 3hqp s MET 259 Cb -0.09 -2.94 0.04 0.00 1.25 0.00 0.00 34.83 33.08 3hqp s MET 259 CO 0.01 -0.14 1.49 0.08 1.05 0.00 0.00 175.02 177.51 3hqp s VAL 260 N 1.31 3.86 -1.07 10.11 1.01 0.22 -1.73 120.40 134.11 3hqp s VAL 260 Ca 0.04 -0.65 -0.18 0.00 0.00 0.00 0.00 61.98 61.19 3hqp s VAL 260 Cb -0.14 -4.94 0.12 0.00 0.00 0.00 0.00 36.38 31.42 3hqp s VAL 260 CO -0.03 -1.83 1.35 0.00 0.00 0.00 0.00 175.10 174.59 3hqp s ALA 261 N 5.56 3.41 -0.68 5.51 0.00 -1.17 -2.13 121.76 132.26 3hqp s ALA 261 Ca 0.48 -2.85 0.25 0.00 0.00 0.00 0.00 51.96 49.84 3hqp s ALA 261 Cb -0.01 -4.24 0.89 0.00 0.00 0.00 0.00 23.12 19.76 3hqp s ALA 261 CO -0.07 -3.09 1.76 0.54 0.00 0.00 0.00 175.76 174.89 3hqp n ARG 262 N 6.99 0.21 0.40 0.00 1.74 -1.23 -2.25 116.66 122.53 3hqp n ARG 262 Ca 0.32 0.27 -0.16 0.00 -0.77 0.00 0.00 57.85 57.51 3hqp n ARG 262 Cb 0.47 -1.79 -0.08 0.00 -1.02 0.00 0.00 32.46 30.04 3hqp n ARG 262 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 3hqp h GLY 263 N 3.75 -1.08 1.93 -0.13 0.00 -1.86 -1.10 103.07 104.58 3hqp h GLY 263 Ca 0.00 0.40 -0.19 0.00 0.00 0.00 0.00 47.33 47.54 3hqp h GLY 263 CO 0.00 -0.39 -0.93 -0.55 0.00 0.00 0.00 176.54 174.67 3hqp h ASP 264 N -1.21 0.00 -0.48 0.19 3.32 -1.85 -3.23 116.42 113.16 3hqp h ASP 264 Ca -0.11 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.87 3hqp h ASP 264 Cb 0.79 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.32 3hqp h ASP 264 CO 0.17 0.87 0.04 0.25 -1.72 0.00 0.00 179.24 178.85 3hqp h LEU 265 N 0.00 0.84 0.00 1.55 6.46 -1.36 -2.10 115.31 120.70 3hqp h LEU 265 Ca -0.03 -0.20 0.00 0.00 -0.12 0.00 0.00 57.88 57.53 3hqp h LEU 265 Cb 1.69 -0.22 0.00 0.00 -0.73 0.00 0.00 40.66 41.39 3hqp h LEU 265 CO 0.11 0.89 0.00 0.61 -0.62 0.00 0.00 178.44 179.43 3hqp n GLY 266 N -0.64 -0.68 0.06 3.75 0.00 -0.41 -1.17 105.19 106.10 3hqp n GLY 266 Ca 0.03 -0.11 -0.09 0.00 0.00 0.00 0.00 46.02 45.86 3hqp n GLY 266 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3hqp n VAL 267 N -1.09 0.74 0.18 1.61 0.31 -1.09 -4.19 118.33 114.79 3hqp n VAL 267 Ca 0.12 -0.30 0.05 0.00 -0.01 0.00 0.00 64.34 64.20 3hqp n VAL 267 Cb 0.09 -0.94 0.33 0.00 -0.91 0.00 0.00 33.84 32.41 3hqp n VAL 267 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 3hqp h GLU 268 N 0.00 0.00 -6.49 5.55 4.57 -1.12 -3.43 114.58 113.66 3hqp h GLU 268 Ca -0.29 0.00 -0.62 0.00 -1.18 0.00 0.00 59.36 57.27 3hqp h GLU 268 Cb 1.47 0.00 -0.21 0.00 -0.16 0.00 0.00 28.75 29.85 3hqp h GLU 268 CO -0.04 0.40 -0.84 -1.50 -1.18 0.00 0.00 179.01 175.85 3hqp s ILE 269 N -3.69 2.00 0.27 2.32 1.10 -0.32 -4.64 121.20 118.24 3hqp s ILE 269 Ca -0.01 -1.71 -0.27 0.00 -0.51 0.00 0.00 60.65 58.15 3hqp s ILE 269 Cb 0.12 -1.82 -0.15 0.00 0.15 0.00 0.00 42.46 40.76 3hqp s ILE 269 CO 0.70 -0.03 0.77 -2.65 -2.11 0.00 0.00 174.94 171.62 3hqp n PRO 270 N 0.87 0.76 0.12 3.50 -0.02 -1.26 -4.50 135.00 134.46 3hqp n PRO 270 Ca -0.18 0.27 0.05 0.00 -2.02 0.00 0.00 63.50 61.62 3hqp n PRO 270 Cb 0.54 -1.49 0.50 0.00 -0.02 0.00 0.00 33.50 33.03 3hqp n PRO 270 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hqp h ALA 271 N 1.49 1.79 0.00 3.55 0.00 -1.92 -1.76 119.26 122.40 3hqp h ALA 271 Ca -0.35 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.42 3hqp h ALA 271 Cb 1.38 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 3hqp h ALA 271 CO 0.58 0.18 -0.42 1.05 0.00 0.00 0.00 179.25 180.64 3hqp h GLU 272 N 0.29 0.00 0.00 0.00 9.09 -1.94 -2.94 114.58 119.08 3hqp h GLU 272 Ca 0.08 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.49 3hqp h GLU 272 Cb 0.03 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.13 3hqp h GLU 272 CO -0.01 0.42 0.00 0.87 0.05 0.00 0.00 179.01 180.34 3hqp h LYS 273 N 0.00 0.00 -0.68 1.06 1.79 -1.67 -3.20 116.57 113.88 3hqp h LYS 273 Ca -0.00 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.42 3hqp h LYS 273 Cb 0.82 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.44 3hqp h LYS 273 CO 0.06 0.00 0.22 0.28 -1.08 0.00 0.00 179.45 178.93 3hqp h VAL 274 N 0.00 1.25 -0.14 0.50 2.07 -1.58 -1.58 116.25 116.77 3hqp h VAL 274 Ca 0.00 -0.83 -0.01 0.00 0.82 0.00 0.00 66.70 66.68 3hqp h VAL 274 Cb 0.46 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 3hqp h VAL 274 CO 0.00 0.33 0.07 0.58 0.02 0.00 0.00 177.57 178.56 3hqp h VAL 275 N 0.99 1.13 -0.26 2.57 2.07 -1.75 0.79 116.25 121.80 3hqp h VAL 275 Ca 0.22 -0.36 -0.04 0.00 0.82 0.00 0.00 66.70 67.34 3hqp h VAL 275 Cb 0.27 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 3hqp h VAL 275 CO -0.01 0.11 0.02 0.58 0.02 0.00 0.00 177.57 178.30 3hqp h VAL 276 N 0.09 1.24 -0.55 2.57 2.07 -1.72 -2.06 116.25 117.90 3hqp h VAL 276 Ca 0.05 -0.84 0.02 0.00 0.82 0.00 0.00 66.70 66.74 3hqp h VAL 276 Cb 0.12 1.29 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 3hqp h VAL 276 CO -0.01 0.27 0.36 0.00 0.02 0.00 0.00 177.57 178.22 3hqp h ALA 277 N 0.84 1.65 -0.41 1.67 0.00 -1.22 -0.07 119.26 121.71 3hqp h ALA 277 Ca 0.08 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 3hqp h ALA 277 Cb 0.37 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 3hqp h ALA 277 CO 0.01 0.31 0.09 0.37 0.00 0.00 0.00 179.25 180.03 3hqp h GLN 278 N 0.70 0.67 -0.79 0.00 4.15 -0.62 -2.23 115.11 116.99 3hqp h GLN 278 Ca 0.21 -0.16 -0.03 0.00 0.77 0.00 0.00 58.65 59.43 3hqp h GLN 278 Cb -0.02 -0.09 -0.04 0.00 0.21 0.00 0.00 27.48 27.55 3hqp h GLN 278 CO -0.05 0.69 0.37 0.87 -1.93 0.00 0.00 178.83 178.78 3hqp h LYS 279 N 0.53 1.16 0.57 1.69 1.57 -0.64 -2.83 116.57 118.61 3hqp h LYS 279 Ca 0.13 -0.18 -0.03 0.00 -1.87 0.00 0.00 60.65 58.70 3hqp h LYS 279 Cb 0.33 -0.20 0.01 0.00 0.08 0.00 0.00 32.23 32.44 3hqp h LYS 279 CO 0.00 0.90 -0.27 0.82 -0.57 0.00 0.00 179.45 180.33 3hqp h ILE 280 N 1.13 0.32 -0.58 1.86 2.04 -0.94 -2.76 117.51 118.58 3hqp h ILE 280 Ca 0.27 -0.32 -0.04 0.00 1.00 0.00 0.00 64.86 65.77 3hqp h ILE 280 Cb 0.14 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 36.62 3hqp h ILE 280 CO -0.03 0.04 0.20 -0.07 0.00 0.00 0.00 178.15 178.29 3hqp h LEU 281 N -1.00 0.83 -0.34 1.44 3.38 -1.46 -0.89 115.31 117.27 3hqp h LEU 281 Ca -0.08 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.70 3hqp h LEU 281 Cb 0.65 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 3hqp h LEU 281 CO 0.13 0.80 0.20 0.40 0.09 0.00 0.00 178.44 180.06 3hqp h ILE 282 N 0.81 1.12 -0.22 1.22 2.04 -1.60 -1.62 117.51 119.27 3hqp h ILE 282 Ca 0.19 -0.30 -0.09 0.00 1.00 0.00 0.00 64.86 65.66 3hqp h ILE 282 Cb 0.25 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.03 3hqp h ILE 282 CO -0.01 0.12 -0.25 0.28 0.00 0.00 0.00 178.15 178.29 3hqp h SER 283 N 0.43 0.41 0.11 1.72 0.02 -1.31 -2.10 113.55 112.83 3hqp h SER 283 Ca 0.12 -0.13 -0.08 0.00 -0.84 0.00 0.00 61.79 60.86 3hqp h SER 283 Cb 0.03 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.44 3hqp h SER 283 CO -0.02 0.66 -0.27 0.11 -1.14 0.00 0.00 176.83 176.17 3hqp h LYS 284 N 0.36 0.26 -0.11 3.45 1.57 -0.92 -2.96 116.57 118.23 3hqp h LYS 284 Ca 0.06 -0.09 -0.17 0.00 -1.87 0.00 0.00 60.65 58.58 3hqp h LYS 284 Cb 0.64 -0.02 0.01 0.00 0.08 0.00 0.00 32.23 32.94 3hqp h LYS 284 CO 0.05 0.52 -0.58 0.00 -0.57 0.00 0.00 179.45 178.86 3hqp h ASN 286 N 0.20 0.49 -0.27 0.00 -0.26 -1.37 0.40 115.58 114.78 3hqp h ASN 286 Ca -0.04 -0.07 -0.11 0.00 -0.56 0.00 0.00 56.30 55.52 3hqp h ASN 286 Cb 1.23 -0.13 -0.00 0.00 -1.06 0.00 0.00 38.32 38.35 3hqp h ASN 286 CO 0.12 0.50 -0.25 0.58 -1.06 0.00 0.00 177.43 177.32 3hqp h VAL 287 N 0.52 1.31 0.00 2.81 2.07 -1.60 -3.23 116.25 118.13 3hqp h VAL 287 Ca 0.12 -1.41 -0.08 0.00 0.82 0.00 0.00 66.70 66.15 3hqp h VAL 287 Cb 0.22 1.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.60 3hqp h VAL 287 CO -0.00 0.45 -0.37 0.00 0.02 0.00 0.00 177.57 177.66 3hqp h ALA 288 N 0.69 1.04 -1.86 1.67 0.00 -1.11 -3.48 119.26 116.22 3hqp h ALA 288 Ca 0.04 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.57 3hqp h ALA 288 Cb 0.81 -0.06 0.02 0.00 0.00 0.00 0.00 17.79 18.56 3hqp h ALA 288 CO 0.06 0.47 -0.09 0.41 0.00 0.00 0.00 179.25 180.10 3hqp n GLY 289 N 0.11 0.64 3.11 0.00 0.00 0.14 -5.08 105.19 104.10 3hqp n GLY 289 Ca -0.01 -0.52 -0.22 0.00 0.00 0.00 0.00 46.02 45.27 3hqp n GLY 289 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hqp s LYS 290 N -4.84 1.14 0.18 1.61 1.02 -0.83 -4.87 119.74 113.15 3hqp s LYS 290 Ca 0.05 -0.50 -0.33 0.00 0.02 0.00 0.00 55.97 55.20 3hqp s LYS 290 Cb -0.02 -1.10 -0.14 0.00 -0.52 0.00 0.00 37.83 36.05 3hqp s LYS 290 CO 0.09 0.30 1.56 -2.30 -0.92 0.00 0.00 175.35 174.08 3hqp n PRO 291 N 2.74 2.17 -5.21 -1.68 -0.02 -1.26 -4.49 135.00 127.27 3hqp n PRO 291 Ca -0.14 0.78 -0.30 0.00 -2.02 0.00 0.00 63.50 61.82 3hqp n PRO 291 Cb 0.55 -2.54 -0.16 0.00 -0.02 0.00 0.00 33.50 31.33 3hqp n PRO 291 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3hqp s VAL 292 N 0.77 1.95 -0.14 -1.45 0.11 -1.26 -1.30 120.40 119.08 3hqp s VAL 292 Ca 0.77 -1.02 0.02 0.00 -2.93 0.00 0.00 61.98 58.82 3hqp s VAL 292 Cb -0.66 -1.64 0.00 0.00 -1.53 0.00 0.00 36.38 32.55 3hqp s VAL 292 CO 0.39 0.55 -0.20 -0.63 -3.33 0.00 0.00 175.10 171.88 3hqp s ILE 293 N -0.26 2.33 -0.01 7.04 1.01 0.46 -1.53 121.20 130.25 3hqp s ILE 293 Ca 0.00 -0.90 -0.17 0.00 0.00 0.00 0.00 60.65 59.58 3hqp s ILE 293 Cb -0.12 -1.95 -0.06 0.00 0.01 0.00 0.00 42.46 40.35 3hqp s ILE 293 CO 0.02 0.54 0.48 0.00 0.00 0.00 0.00 174.94 175.98 3hqp s ALA 295 N -0.61 0.01 0.05 0.00 0.00 -0.91 -2.14 121.76 118.16 3hqp s ALA 295 Ca 0.26 -0.81 0.00 0.00 0.00 0.00 0.00 51.96 51.41 3hqp s ALA 295 Cb -0.17 0.47 0.00 0.00 0.00 0.00 0.00 23.12 23.42 3hqp s ALA 295 CO 0.14 -0.48 0.00 2.41 0.00 0.00 0.00 175.76 177.83 3hqp n THR 296 N -0.03 -2.75 -1.33 0.00 -1.04 -1.26 -3.47 114.28 104.39 3hqp n THR 296 Ca -0.14 0.49 -0.11 0.00 -2.04 0.00 0.00 64.05 62.24 3hqp n THR 296 Cb 0.62 -1.95 -0.05 0.00 -1.82 0.00 0.00 70.33 67.14 3hqp n THR 296 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3hqp n GLN 297 N -0.04 -1.24 -2.78 -2.82 6.02 -1.26 -4.77 117.38 110.50 3hqp n GLN 297 Ca 0.00 0.87 -0.42 0.00 -0.01 0.00 0.00 57.00 57.44 3hqp n GLN 297 Cb 0.00 -5.04 -0.03 0.00 1.02 0.00 0.00 30.24 26.19 3hqp n GLN 297 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 3hqp s MET 298 N -2.84 4.43 -1.49 -1.09 -1.94 -1.26 -3.39 119.30 111.72 3hqp s MET 298 Ca 0.00 1.26 -0.07 0.00 -1.71 0.00 0.00 55.69 55.18 3hqp s MET 298 Cb 0.00 -3.52 0.02 0.00 2.01 0.00 0.00 34.83 33.34 3hqp s MET 298 CO 0.00 -0.21 0.76 1.28 -0.01 0.00 0.00 175.02 176.83 3hqp n LEU 299 N 4.66 -2.76 -0.19 -0.03 4.77 -1.26 -4.86 117.00 117.33 3hqp n LEU 299 Ca 0.06 -0.38 -0.00 0.00 -0.03 0.00 0.00 56.01 55.66 3hqp n LEU 299 Cb 0.50 -2.91 0.09 0.00 -2.33 0.00 0.00 43.42 38.77 3hqp n LEU 299 CO 0.51 0.34 0.86 -0.08 -1.33 0.00 0.00 177.39 177.68 3hqp h GLU 300 N -1.71 0.14 0.00 3.23 4.57 -1.95 -1.97 114.58 116.90 3hqp h GLU 300 Ca -0.54 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.64 3hqp h GLU 300 Cb 1.36 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.92 3hqp h GLU 300 CO 0.57 0.10 0.00 -1.13 -1.18 0.00 0.00 179.01 177.37 3hqp n SER 301 N -5.23 0.60 0.00 1.04 3.41 -1.26 -2.25 113.62 109.92 3hqp n SER 301 Ca 0.08 0.69 0.09 0.00 -0.26 0.00 0.00 58.87 59.47 3hqp n SER 301 Cb 0.32 -0.80 0.53 0.00 -0.26 0.00 0.00 64.21 64.00 3hqp n SER 301 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3hqp n MET 302 N -2.21 0.94 0.23 4.33 2.81 -0.74 -0.51 117.12 121.97 3hqp n MET 302 Ca 0.01 0.00 0.11 0.00 -1.81 0.00 0.00 57.70 56.01 3hqp n MET 302 Cb 0.15 -1.30 0.50 0.00 -0.71 0.00 0.00 33.22 31.86 3hqp n MET 302 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 3hqp h THR 303 N 0.00 0.52 0.00 2.03 2.02 -1.63 -3.36 112.91 112.48 3hqp h THR 303 Ca 0.00 -1.03 0.00 0.00 0.77 0.00 0.00 66.41 66.15 3hqp h THR 303 Cb 0.00 1.71 0.00 0.00 -1.74 0.00 0.00 68.15 68.12 3hqp h THR 303 CO 0.00 0.20 -0.69 -1.22 0.37 0.00 0.00 175.52 174.18 3hqp n TYR 304 N -3.39 0.00 -4.23 3.16 4.02 -0.83 -1.51 117.16 114.37 3hqp n TYR 304 Ca -0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 57.90 57.58 3hqp n TYR 304 Cb 0.40 0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.64 3hqp n TYR 304 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 176.86 175.05 3hqp s ASN 305 N -2.21 4.95 0.24 7.72 0.02 0.34 -4.95 114.94 121.05 3hqp s ASN 305 Ca 0.00 -0.13 0.22 0.00 -1.02 0.00 0.00 52.86 51.93 3hqp s ASN 305 Cb 0.00 -1.20 0.95 0.00 0.02 0.00 0.00 41.25 41.02 3hqp s ASN 305 CO 0.00 0.22 1.67 -0.81 0.02 0.00 0.00 177.10 178.20 3hqp n PRO 306 N 0.98 0.16 -3.81 -0.60 -0.04 -1.26 -4.21 135.00 126.22 3hqp n PRO 306 Ca -0.13 0.44 -0.12 0.00 -0.04 0.00 0.00 63.50 63.65 3hqp n PRO 306 Cb 0.52 -1.84 -0.09 0.00 -0.04 0.00 0.00 33.50 32.05 3hqp n PRO 306 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 3hqp s ARG 307 N -3.31 0.59 0.86 0.54 1.70 -1.26 -4.89 118.95 113.18 3hqp s ARG 307 Ca 0.03 -0.30 -0.09 0.00 -0.47 0.00 0.00 55.73 54.91 3hqp s ARG 307 Cb 0.09 0.25 0.17 0.00 -0.57 0.00 0.00 34.95 34.89 3hqp s ARG 307 CO 0.35 -0.15 1.18 -1.25 -1.08 0.00 0.00 175.30 174.34 3hqp s PRO 308 N -1.39 1.06 0.77 3.89 0.04 -1.26 -4.72 135.00 133.39 3hqp s PRO 308 Ca -0.14 -0.74 -0.10 0.00 0.04 0.00 0.00 61.00 60.06 3hqp s PRO 308 Cb -0.06 -2.06 0.07 0.00 0.04 0.00 0.00 34.50 32.49 3hqp s PRO 308 CO 0.03 -2.01 1.11 0.95 0.04 0.00 0.00 177.00 177.11 3hqp s THR 309 N -3.57 2.12 0.33 1.26 -4.23 -1.26 -4.96 115.64 105.33 3hqp s THR 309 Ca 0.71 -0.12 0.12 0.00 -1.18 0.00 0.00 61.69 61.22 3hqp s THR 309 Cb -0.04 -3.00 0.06 0.00 1.34 0.00 0.00 72.50 70.86 3hqp s THR 309 CO 0.49 0.00 1.75 0.03 -0.54 0.00 0.00 174.62 176.35 3hqp h ARG 310 N -0.86 0.00 -0.26 3.99 2.47 -2.00 -2.77 114.38 114.95 3hqp h ARG 310 Ca -0.45 0.00 -0.13 0.00 -1.26 0.00 0.00 59.98 58.14 3hqp h ARG 310 Cb 1.32 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.63 3hqp h ARG 310 CO 0.63 0.45 -0.38 0.00 0.56 0.00 0.00 179.97 181.23 3hqp h ALA 311 N 1.55 0.84 -0.17 0.04 0.00 -1.98 -2.26 119.26 117.28 3hqp h ALA 311 Ca -0.00 -0.43 -0.21 0.00 0.00 0.00 0.00 54.91 54.26 3hqp h ALA 311 Cb 0.82 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.50 3hqp h ALA 311 CO 0.06 0.64 -0.72 0.93 0.00 0.00 0.00 179.25 180.16 3hqp h GLU 312 N 0.50 0.79 -0.53 0.00 5.08 -1.91 -0.35 114.58 118.16 3hqp h GLU 312 Ca 0.05 -0.62 0.00 0.00 -1.00 0.00 0.00 59.36 57.79 3hqp h GLU 312 Cb 0.88 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 30.23 3hqp h GLU 312 CO 0.08 1.23 0.33 0.28 -1.00 0.00 0.00 179.01 179.93 3hqp h VAL 313 N 0.52 1.15 -0.84 3.13 2.07 -1.53 -2.50 116.25 118.25 3hqp h VAL 313 Ca -0.04 -0.32 -0.00 0.00 0.82 0.00 0.00 66.70 67.15 3hqp h VAL 313 Cb 1.35 0.41 -0.04 0.00 -1.52 0.00 0.00 31.29 31.49 3hqp h VAL 313 CO 0.15 0.15 0.51 -1.28 0.02 0.00 0.00 177.57 177.13 3hqp h SER 314 N 0.72 1.01 -0.33 0.57 0.87 -1.27 -2.48 113.55 112.63 3hqp h SER 314 Ca 0.19 -0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.66 3hqp h SER 314 Cb -0.04 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 61.65 3hqp h SER 314 CO -0.04 0.77 0.08 -0.78 -0.53 0.00 0.00 176.83 176.33 3hqp h ASP 315 N 1.15 0.50 -0.65 6.23 3.58 -0.82 -0.58 116.42 125.83 3hqp h ASP 315 Ca 0.30 -0.23 -0.09 0.00 0.42 0.00 0.00 57.03 57.43 3hqp h ASP 315 Cb -0.05 -0.13 -0.02 0.00 1.72 0.00 0.00 39.33 40.84 3hqp h ASP 315 CO -0.06 0.60 0.06 0.58 -2.88 0.00 0.00 179.24 177.55 3hqp h VAL 316 N 0.37 1.27 -0.28 2.25 2.07 -1.39 -1.72 116.25 118.82 3hqp h VAL 316 Ca 0.10 -1.09 -0.13 0.00 0.82 0.00 0.00 66.70 66.40 3hqp h VAL 316 Cb 0.30 0.70 -0.00 0.00 -1.52 0.00 0.00 31.29 30.77 3hqp h VAL 316 CO 0.00 0.41 -0.35 0.00 0.02 0.00 0.00 177.57 177.65 3hqp h ALA 317 N 1.03 0.41 0.00 1.67 0.00 -1.39 -3.13 119.26 117.85 3hqp h ALA 317 Ca 0.19 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 3hqp h ALA 317 Cb 0.50 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 3hqp h ALA 317 CO 0.02 0.48 -0.07 -0.91 0.00 0.00 0.00 179.25 178.77 3hqp h ASN 318 N 0.47 0.00 -0.31 0.00 2.35 -1.03 -1.93 115.58 115.13 3hqp h ASN 318 Ca 0.03 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.66 3hqp h ASN 318 Cb 0.93 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.29 3hqp h ASN 318 CO 0.08 0.07 -0.26 0.00 -1.65 0.00 0.00 177.43 175.67 3hqp h ALA 319 N 1.93 0.80 -0.23 -0.83 0.00 -1.28 -0.84 119.26 118.82 3hqp h ALA 319 Ca -0.00 -0.39 -0.05 0.00 0.00 0.00 0.00 54.91 54.46 3hqp h ALA 319 Cb 0.59 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3hqp h ALA 319 CO 0.01 0.65 -0.06 0.28 0.00 0.00 0.00 179.25 180.12 3hqp h VAL 320 N 0.70 1.29 -0.99 0.00 2.07 -1.40 -2.20 116.25 115.71 3hqp h VAL 320 Ca 0.09 -1.07 0.04 0.00 0.82 0.00 0.00 66.70 66.58 3hqp h VAL 320 Cb 0.80 1.51 -0.06 0.00 -1.52 0.00 0.00 31.29 32.02 3hqp h VAL 320 CO 0.07 0.33 0.65 -0.26 0.02 0.00 0.00 177.57 178.37 3hqp h PHE 321 N 0.18 1.21 -0.92 1.57 0.04 -1.30 -1.11 116.94 116.62 3hqp h PHE 321 Ca 0.06 0.03 0.09 0.00 2.80 0.00 0.00 57.97 60.95 3hqp h PHE 321 Cb 0.53 -0.40 -0.07 0.00 2.20 0.00 0.00 35.95 38.21 3hqp h PHE 321 CO 0.05 0.70 0.59 -0.91 -0.60 0.00 0.00 178.31 178.14 3hqp h ASN 322 N 1.25 0.86 0.00 2.17 -0.26 -1.11 -3.47 115.58 115.02 3hqp h ASN 322 Ca 0.39 0.02 0.00 0.00 -0.56 0.00 0.00 56.30 56.15 3hqp h ASN 322 Cb 0.01 -0.16 0.00 0.00 -1.06 0.00 0.00 38.32 37.11 3hqp h ASN 322 CO -0.12 0.51 0.00 0.61 -1.06 0.00 0.00 177.43 177.37 3hqp n GLY 323 N -1.39 1.89 3.74 2.83 0.00 -0.42 -4.67 105.19 107.16 3hqp n GLY 323 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 3hqp n GLY 323 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hqp s ALA 324 N -2.00 3.46 0.20 4.61 0.00 -0.85 -4.89 121.76 122.28 3hqp s ALA 324 Ca 0.00 0.99 -0.06 0.00 0.00 0.00 0.00 51.96 52.89 3hqp s ALA 324 Cb 0.00 -3.43 0.13 0.00 0.00 0.00 0.00 23.12 19.82 3hqp s ALA 324 CO 0.00 -0.41 1.59 -0.44 0.00 0.00 0.00 175.76 176.50 3hqp h ASP 325 N 5.24 0.83 -4.41 0.00 5.19 -1.59 -3.44 116.42 118.23 3hqp h ASP 325 Ca -0.45 -0.32 -0.44 0.00 -0.62 0.00 0.00 57.03 55.20 3hqp h ASP 325 Cb 1.21 -0.23 -0.21 0.00 0.18 0.00 0.00 39.33 40.28 3hqp h ASP 325 CO 0.75 1.05 -0.79 0.00 -3.12 0.00 0.00 179.24 177.13 3hqp s VAL 327 N -1.28 1.74 0.17 0.00 -7.23 -0.37 -1.68 120.40 111.76 3hqp s VAL 327 Ca -0.00 -0.95 0.11 0.00 -1.81 0.00 0.00 61.98 59.33 3hqp s VAL 327 Cb -0.10 -1.44 -0.04 0.00 0.56 0.00 0.00 36.38 35.36 3hqp s VAL 327 CO 0.03 0.49 -0.24 -0.32 -0.31 0.00 0.00 175.10 174.75 3hqp s MET 328 N -0.53 1.53 -0.15 4.82 1.75 -0.91 -1.33 119.30 124.47 3hqp s MET 328 Ca 0.08 -1.46 0.02 0.00 -1.25 0.00 0.00 55.69 53.09 3hqp s MET 328 Cb -0.08 -1.89 0.02 0.00 2.84 0.00 0.00 34.83 35.71 3hqp s MET 328 CO -0.01 0.42 -0.19 -0.51 -0.65 0.00 0.00 175.02 174.07 3hqp s LEU 329 N -2.51 2.01 0.00 4.11 1.43 0.49 -4.42 118.68 119.79 3hqp s LEU 329 Ca 0.19 -0.58 0.00 0.00 -1.03 0.00 0.00 54.13 52.71 3hqp s LEU 329 Cb -0.09 -1.38 0.00 0.00 0.03 0.00 0.00 46.19 44.75 3hqp s LEU 329 CO 0.09 0.03 0.00 -1.20 0.23 0.00 0.00 176.35 175.50 3hqp n SER 330 N 4.38 0.00 0.29 2.29 7.64 -1.26 -1.70 113.62 125.26 3hqp n SER 330 Ca -0.20 0.00 0.18 0.00 1.01 0.00 0.00 58.87 59.86 3hqp n SER 330 Cb 0.51 0.00 0.98 0.00 -1.01 0.00 0.00 64.21 64.68 3hqp n SER 330 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 3hqp h GLY 331 N 0.00 0.00 1.26 0.23 0.00 -1.98 -2.61 103.07 99.98 3hqp h GLY 331 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 3hqp h GLY 331 CO 0.00 0.00 0.26 0.83 0.00 0.00 0.00 176.54 177.63 3hqp h GLU 332 N 0.00 0.94 0.00 4.80 3.07 -1.89 -1.49 114.58 120.01 3hqp h GLU 332 Ca 0.00 -0.15 -0.22 0.00 -0.50 0.00 0.00 59.36 58.49 3hqp h GLU 332 Cb 0.16 -0.16 -0.04 0.00 -0.84 0.00 0.00 28.75 27.87 3hqp h GLU 332 CO 0.00 0.77 -2.09 0.25 -1.40 0.00 0.00 179.01 176.54 3hqp n THR 333 N -4.31 0.82 0.14 1.13 -2.24 -1.05 -3.33 114.28 105.45 3hqp n THR 333 Ca 0.06 -0.64 -0.12 0.00 -2.27 0.00 0.00 64.05 61.08 3hqp n THR 333 Cb 0.17 -0.34 -0.07 0.00 -2.10 0.00 0.00 70.33 67.98 3hqp n THR 333 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hqp h ALA 334 N 1.13 -0.42 0.00 6.98 0.00 -1.28 -3.37 119.26 122.31 3hqp h ALA 334 Ca -0.32 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3hqp h ALA 334 Cb 1.69 0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.65 3hqp h ALA 334 CO 0.02 -0.49 0.00 0.36 0.00 0.00 0.00 179.25 179.14 3hqp n LYS 335 N -5.08 1.76 -1.17 0.00 2.85 -0.91 -1.86 118.16 113.74 3hqp n LYS 335 Ca -0.09 -1.12 -0.30 0.00 -1.05 0.00 0.00 58.31 55.76 3hqp n LYS 335 Cb 0.27 -0.90 0.14 0.00 -0.65 0.00 0.00 35.03 33.88 3hqp n LYS 335 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 3hqp s GLY 336 N -0.64 1.62 0.23 2.58 0.00 -0.61 -4.90 107.32 105.60 3hqp s GLY 336 Ca 0.00 -0.04 0.23 0.00 0.00 0.00 0.00 44.72 44.91 3hqp s GLY 336 CO 0.00 0.45 1.11 0.50 0.00 0.00 0.00 173.10 175.16 3hqp h LYS 337 N -1.57 0.00 -2.23 2.90 1.57 -1.48 -3.42 116.57 112.34 3hqp h LYS 337 Ca -0.49 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 57.70 3hqp h LYS 337 Cb 1.28 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 33.19 3hqp h LYS 337 CO 0.54 0.00 -0.82 0.66 -0.57 0.00 0.00 179.45 179.26 3hqp n TYR 338 N -2.71 1.69 -0.23 -1.35 4.01 -1.26 -4.97 117.16 112.34 3hqp n TYR 338 Ca 0.01 -3.87 -0.08 0.00 -0.16 0.00 0.00 57.90 53.79 3hqp n TYR 338 Cb 0.54 -0.41 0.04 0.00 -0.31 0.00 0.00 39.34 39.21 3hqp n TYR 338 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 3hqp h PRO 339 N 4.37 1.10 -0.09 -0.72 0.11 -1.81 -2.56 132.00 132.40 3hqp h PRO 339 Ca 0.15 -0.31 -0.10 0.00 0.11 0.00 0.00 66.00 65.86 3hqp h PRO 339 Cb 0.78 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.76 3hqp h PRO 339 CO 0.64 1.02 -0.34 -0.91 -0.21 0.00 0.00 178.00 178.21 3hqp h ASN 340 N 1.03 0.46 -0.62 -2.05 2.35 -1.93 -3.29 115.58 111.52 3hqp h ASN 340 Ca 0.20 -0.62 -0.02 0.00 -0.55 0.00 0.00 56.30 55.31 3hqp h ASN 340 Cb 0.47 -0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.67 3hqp h ASN 340 CO 0.02 1.00 0.33 -0.33 -1.65 0.00 0.00 177.43 176.80 3hqp h GLU 341 N -0.06 0.90 -0.32 0.81 3.07 -1.94 -1.25 114.58 115.80 3hqp h GLU 341 Ca -0.02 -0.11 -0.16 0.00 -0.50 0.00 0.00 59.36 58.58 3hqp h GLU 341 Cb 0.97 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 28.70 3hqp h GLU 341 CO 0.07 0.68 -0.43 -0.24 -1.40 0.00 0.00 179.01 177.69 3hqp h VAL 342 N 0.91 1.28 -0.26 3.13 3.04 -1.57 0.11 116.25 122.88 3hqp h VAL 342 Ca 0.23 -1.61 -0.19 0.00 -1.01 0.00 0.00 66.70 64.12 3hqp h VAL 342 Cb 0.06 1.49 0.00 0.00 -2.01 0.00 0.00 31.29 30.83 3hqp h VAL 342 CO -0.03 0.53 -0.58 0.58 -1.01 0.00 0.00 177.57 177.06 3hqp h VAL 343 N 0.65 1.28 -0.89 1.51 2.07 -1.59 -1.16 116.25 118.11 3hqp h VAL 343 Ca 0.04 -1.76 -0.02 0.00 0.82 0.00 0.00 66.70 65.78 3hqp h VAL 343 Cb 1.00 1.71 -0.04 0.00 -1.52 0.00 0.00 31.29 32.44 3hqp h VAL 343 CO 0.10 0.57 0.49 1.56 0.02 0.00 0.00 177.57 180.31 3hqp h GLN 344 N 0.62 1.24 -0.27 1.57 4.20 -1.09 0.11 115.11 121.49 3hqp h GLN 344 Ca 0.00 -0.14 -0.09 0.00 0.06 0.00 0.00 58.65 58.48 3hqp h GLN 344 Cb 1.19 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 28.72 3hqp h GLN 344 CO 0.13 0.91 -0.18 1.88 -0.67 0.00 0.00 178.83 180.90 3hqp h TYR 345 N 1.25 0.70 -0.27 2.96 0.05 -0.95 -2.55 116.97 118.17 3hqp h TYR 345 Ca 0.31 -0.19 0.02 0.00 0.05 0.00 0.00 58.73 58.93 3hqp h TYR 345 Cb 0.02 -0.16 -0.02 0.00 1.01 0.00 0.00 36.73 37.58 3hqp h TYR 345 CO 0.01 0.87 0.11 1.98 -1.05 0.00 0.00 178.16 180.09 3hqp h MET 346 N 0.33 0.24 -0.69 4.88 4.05 -0.79 -0.16 114.93 122.79 3hqp h MET 346 Ca 0.05 -0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.45 3hqp h MET 346 Cb 0.71 -0.05 -0.03 0.00 -0.80 0.00 0.00 31.60 31.42 3hqp h MET 346 CO 0.05 0.16 0.37 0.00 0.23 0.00 0.00 176.91 177.72 3hqp h ALA 347 N 1.15 1.36 -0.39 0.39 0.00 -0.84 -0.40 119.26 120.52 3hqp h ALA 347 Ca 0.11 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 3hqp h ALA 347 Cb 0.06 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 3hqp h ALA 347 CO -0.10 0.52 0.04 -0.09 0.00 0.00 0.00 179.25 179.63 3hqp h ARG 348 N 0.96 0.67 -0.41 0.00 2.43 -1.05 -2.64 114.38 114.34 3hqp h ARG 348 Ca 0.24 -0.19 -0.11 0.00 -0.81 0.00 0.00 59.98 59.11 3hqp h ARG 348 Cb 0.03 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.50 3hqp h ARG 348 CO -0.04 0.74 -0.17 0.82 -1.51 0.00 0.00 179.97 179.81 3hqp h ILE 349 N 0.51 1.28 -0.48 1.20 2.04 -0.59 -2.29 117.51 119.18 3hqp h ILE 349 Ca 0.12 -1.30 -0.01 0.00 1.00 0.00 0.00 64.86 64.67 3hqp h ILE 349 Cb 0.41 1.24 -0.02 0.00 -0.74 0.00 0.00 36.82 37.71 3hqp h ILE 349 CO 0.01 0.44 0.27 0.00 0.00 0.00 0.00 178.15 178.87 3hqp h LEU 351 N 0.65 0.69 -0.47 0.00 3.38 -1.25 -1.66 115.31 116.66 3hqp h LEU 351 Ca 0.17 -0.49 -0.11 0.00 0.09 0.00 0.00 57.88 57.54 3hqp h LEU 351 Cb 0.00 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3hqp h LEU 351 CO -0.03 1.04 -0.13 -0.08 0.09 0.00 0.00 178.44 179.34 3hqp h GLU 352 N 0.35 0.92 -0.88 1.13 4.57 -1.20 -2.35 114.58 117.12 3hqp h GLU 352 Ca 0.03 -0.36 0.00 0.00 -1.18 0.00 0.00 59.36 57.86 3hqp h GLU 352 Cb 0.87 -0.05 -0.04 0.00 -0.16 0.00 0.00 28.75 29.37 3hqp h GLU 352 CO 0.07 1.01 0.55 0.00 -1.18 0.00 0.00 179.01 179.47 3hqp h ALA 353 N 0.88 1.12 -0.28 2.92 0.00 -1.19 -2.70 119.26 120.00 3hqp h ALA 353 Ca 0.12 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3hqp h ALA 353 Cb 0.68 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 3hqp h ALA 353 CO 0.05 0.56 0.04 0.37 0.00 0.00 0.00 179.25 180.27 3hqp h GLN 354 N 1.21 0.42 -0.53 0.00 4.15 -1.06 -0.83 115.11 118.46 3hqp h GLN 354 Ca 0.32 -0.07 -0.10 0.00 0.77 0.00 0.00 58.65 59.57 3hqp h GLN 354 Cb -0.08 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 27.52 3hqp h GLN 354 CO -0.06 0.42 -0.06 0.77 -1.93 0.00 0.00 178.83 177.97 3hqp h SER 355 N 0.41 0.94 1.22 -0.69 0.02 -1.10 -2.90 113.55 111.45 3hqp h SER 355 Ca 0.10 -0.28 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 3hqp h SER 355 Cb 0.21 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.50 3hqp h SER 355 CO 0.00 1.03 -0.23 0.00 -1.14 0.00 0.00 176.83 176.49 3hqp n ALA 356 N -2.49 2.54 -2.14 3.77 0.00 -1.00 -4.87 120.51 116.33 3hqp n ALA 356 Ca 0.02 -0.11 -0.42 0.00 0.00 0.00 0.00 53.44 52.93 3hqp n ALA 356 Cb 0.36 -1.36 -0.03 0.00 0.00 0.00 0.00 19.45 18.43 3hqp n ALA 356 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3hqp s LEU 357 N -4.32 4.36 -0.80 0.00 2.96 -0.35 -4.97 118.68 115.57 3hqp s LEU 357 Ca 0.09 2.33 -0.19 0.00 -0.22 0.00 0.00 54.13 56.15 3hqp s LEU 357 Cb 0.13 -3.58 0.13 0.00 0.50 0.00 0.00 46.19 43.36 3hqp s LEU 357 CO 0.64 -0.69 0.96 0.21 -1.32 0.00 0.00 176.35 176.15 3hqp s ASN 358 N 1.29 6.47 0.16 3.68 3.84 -1.26 -4.90 114.94 124.22 3hqp s ASN 358 Ca 0.65 -1.81 -0.04 0.00 0.21 0.00 0.00 52.86 51.88 3hqp s ASN 358 Cb -0.37 -2.36 0.02 0.00 -0.55 0.00 0.00 41.25 37.99 3hqp s ASN 358 CO 0.30 -1.08 1.41 -0.33 -2.79 0.00 0.00 177.10 174.61 3hqp h GLU 359 N 8.91 0.48 -0.48 0.43 3.07 -1.93 -2.40 114.58 122.66 3hqp h GLU 359 Ca -0.03 -0.39 -0.04 0.00 -0.50 0.00 0.00 59.36 58.40 3hqp h GLU 359 Cb 1.05 0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 29.02 3hqp h GLU 359 CO 1.07 1.02 0.14 -0.92 -1.40 0.00 0.00 179.01 178.93 3hqp h TYR 360 N 0.33 0.79 -0.72 4.33 3.20 -1.91 0.92 116.97 123.92 3hqp h TYR 360 Ca -0.03 -0.08 -0.07 0.00 3.14 0.00 0.00 58.73 61.68 3hqp h TYR 360 Cb 1.32 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 39.33 3hqp h TYR 360 CO 0.05 0.70 0.18 0.28 -1.64 0.00 0.00 178.16 177.73 3hqp h VAL 361 N 0.65 1.26 -0.61 1.81 2.07 -1.96 0.11 116.25 119.59 3hqp h VAL 361 Ca 0.15 -0.97 -0.03 0.00 0.82 0.00 0.00 66.70 66.67 3hqp h VAL 361 Cb 0.29 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.55 3hqp h VAL 361 CO -0.00 0.38 0.25 0.15 0.02 0.00 0.00 177.57 178.37 3hqp h PHE 362 N 1.09 0.91 -0.15 1.57 3.57 -1.17 -0.26 116.94 122.51 3hqp h PHE 362 Ca 0.23 -0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.66 3hqp h PHE 362 Cb 0.37 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.83 3hqp h PHE 362 CO 0.03 0.72 0.07 0.35 -2.23 0.00 0.00 178.31 177.25 3hqp h PHE 363 N 0.84 0.21 -0.66 0.41 3.57 -0.54 -1.68 116.94 119.10 3hqp h PHE 363 Ca 0.20 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.68 3hqp h PHE 363 Cb 0.18 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 38.83 3hqp h PHE 363 CO 0.01 0.25 0.37 -0.91 -2.23 0.00 0.00 178.31 175.80 3hqp h ASN 364 N 0.11 0.80 -0.14 0.41 4.21 -0.82 -1.86 115.58 118.30 3hqp h ASN 364 Ca 0.05 -0.06 -0.02 0.00 1.21 0.00 0.00 56.30 57.48 3hqp h ASN 364 Cb 0.12 -0.20 -0.00 0.00 -1.12 0.00 0.00 38.32 37.11 3hqp h ASN 364 CO -0.01 0.64 -0.01 0.28 -1.29 0.00 0.00 177.43 177.05 3hqp h SER 365 N 0.92 0.25 -0.28 5.81 0.02 -0.92 -3.07 113.55 116.27 3hqp h SER 365 Ca 0.24 -0.32 -0.01 0.00 -0.84 0.00 0.00 61.79 60.86 3hqp h SER 365 Cb 0.01 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.47 3hqp h SER 365 CO -0.04 0.51 0.15 0.40 -1.14 0.00 0.00 176.83 176.71 3hqp h ILE 366 N -0.02 1.12 -0.48 3.27 2.04 -1.12 -3.05 117.51 119.27 3hqp h ILE 366 Ca 0.04 -0.32 0.09 0.00 1.00 0.00 0.00 64.86 65.66 3hqp h ILE 366 Cb 0.38 0.84 -0.07 0.00 -0.74 0.00 0.00 36.82 37.23 3hqp h ILE 366 CO 0.01 0.12 0.06 0.50 0.00 0.00 0.00 178.15 178.84 3hqp h LYS 367 N 0.33 0.18 0.00 2.37 3.64 -1.40 -2.42 116.57 119.27 3hqp h LYS 367 Ca 0.10 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3hqp h LYS 367 Cb 0.06 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 3hqp h LYS 367 CO -0.02 0.12 0.00 1.63 -2.27 0.00 0.00 179.45 178.91 3hqp n LYS 368 N -5.15 0.85 -0.08 1.90 4.01 -1.16 -2.94 118.16 115.58 3hqp n LYS 368 Ca 0.05 0.00 0.06 0.00 -0.51 0.00 0.00 58.31 57.92 3hqp n LYS 368 Cb 0.25 -1.50 0.11 0.00 -0.51 0.00 0.00 35.03 33.37 3hqp n LYS 368 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 3hqp n LEU 369 N -1.02 2.49 -4.87 -0.35 4.77 -0.91 -4.98 117.00 112.13 3hqp n LEU 369 Ca 0.21 -1.41 -0.35 0.00 -0.03 0.00 0.00 56.01 54.43 3hqp n LEU 369 Cb 0.10 -0.11 -0.05 0.00 -2.33 0.00 0.00 43.42 41.03 3hqp n LEU 369 CO 0.16 0.54 0.02 -1.10 -1.33 0.00 0.00 177.39 175.68 3hqp s GLN 370 N -1.05 3.69 0.03 3.23 -1.52 -1.15 -5.06 119.66 117.84 3hqp s GLN 370 Ca 0.20 0.09 -0.30 0.00 -1.95 0.00 0.00 55.36 53.40 3hqp s GLN 370 Cb 0.12 -3.06 -0.06 0.00 -0.22 0.00 0.00 33.01 29.79 3hqp s GLN 370 CO 0.17 0.62 1.41 -1.58 -0.25 0.00 0.00 175.29 175.66 3hqp s HIS 371 N -1.31 2.93 -0.17 0.91 5.65 -1.26 -5.01 115.29 117.02 3hqp s HIS 371 Ca 0.29 0.83 -0.07 0.00 0.25 0.00 0.00 55.06 56.36 3hqp s HIS 371 Cb -0.14 -3.68 -0.04 0.00 -1.18 0.00 0.00 32.58 27.54 3hqp s HIS 371 CO 0.16 -2.51 0.07 0.42 -0.65 0.00 0.00 174.74 172.23 3hqp s ILE 372 N 2.07 4.84 0.41 0.89 1.01 -1.26 -3.41 121.20 125.76 3hqp s ILE 372 Ca 0.65 -0.02 -0.24 0.00 0.00 0.00 0.00 60.65 61.04 3hqp s ILE 372 Cb -0.33 -3.17 -0.08 0.00 0.01 0.00 0.00 42.46 38.89 3hqp s ILE 372 CO 0.28 0.48 1.13 -2.16 0.00 0.00 0.00 174.94 174.67 3hqp s PRO 373 N 0.15 4.02 0.68 2.79 0.04 -1.26 -5.19 135.00 136.23 3hqp s PRO 373 Ca 0.05 1.71 -0.07 0.00 0.04 0.00 0.00 61.00 62.73 3hqp s PRO 373 Cb -0.12 -2.56 0.04 0.00 0.04 0.00 0.00 34.50 31.90 3hqp s PRO 373 CO 0.00 -0.32 1.00 -1.64 0.04 0.00 0.00 177.00 176.09 3hqp s MET 374 N -2.46 2.43 0.53 4.56 -1.94 -1.22 -5.08 119.30 116.11 3hqp s MET 374 Ca 0.59 -0.11 -0.18 0.00 -1.71 0.00 0.00 55.69 54.27 3hqp s MET 374 Cb -0.27 -2.17 -0.07 0.00 2.01 0.00 0.00 34.83 34.33 3hqp s MET 374 CO 0.34 -1.10 1.04 -1.54 -0.01 0.00 0.00 175.02 173.75 3hqp s SER 375 N -4.45 6.17 0.32 3.03 1.04 -1.26 -4.89 113.70 113.67 3hqp s SER 375 Ca 0.58 1.85 0.06 0.00 0.48 0.00 0.00 55.95 58.93 3hqp s SER 375 Cb -0.11 -2.55 0.72 0.00 0.10 0.00 0.00 66.02 64.19 3hqp s SER 375 CO 0.46 -0.90 1.84 0.00 0.98 0.00 0.00 173.24 175.62 3hqp h ALA 376 N 1.10 1.71 -0.14 5.32 0.00 -1.98 -0.97 119.26 124.31 3hqp h ALA 376 Ca -0.48 0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.50 3hqp h ALA 376 Cb 1.22 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.80 3hqp h ALA 376 CO 0.59 0.02 -0.35 0.22 0.00 0.00 0.00 179.25 179.73 3hqp h ASP 377 N 0.80 -1.08 0.39 0.00 -0.00 -1.93 -2.79 116.42 111.82 3hqp h ASP 377 Ca 0.49 0.16 -0.29 0.00 -0.00 0.00 0.00 57.03 57.39 3hqp h ASP 377 Cb 0.69 0.46 0.02 0.00 -0.00 0.00 0.00 39.33 40.50 3hqp h ASP 377 CO -0.26 -0.37 -1.25 -0.08 -0.00 0.00 0.00 179.24 177.28 3hqp h GLU 378 N -0.41 0.43 -0.17 0.28 4.81 -1.67 -3.19 114.58 114.66 3hqp h GLU 378 Ca 0.09 -0.65 0.01 0.00 -0.13 0.00 0.00 59.36 58.68 3hqp h GLU 378 Cb 0.57 0.23 -0.01 0.00 0.63 0.00 0.00 28.75 30.17 3hqp h GLU 378 CO -0.37 1.29 0.11 0.00 -0.73 0.00 0.00 179.01 179.31 3hqp h ALA 379 N 0.45 1.90 -0.06 2.92 0.00 -1.24 -1.12 119.26 122.10 3hqp h ALA 379 Ca -0.17 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 3hqp h ALA 379 Cb 1.95 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.67 3hqp h ALA 379 CO 0.22 0.09 0.01 0.28 0.00 0.00 0.00 179.25 179.85 3hqp h VAL 380 N 0.21 1.21 -0.70 0.00 2.07 -1.48 -2.42 116.25 115.13 3hqp h VAL 380 Ca 0.06 -0.63 -0.07 0.00 0.82 0.00 0.00 66.70 66.88 3hqp h VAL 380 Cb -0.00 1.51 -0.03 0.00 -1.52 0.00 0.00 31.29 31.25 3hqp h VAL 380 CO -0.01 0.17 0.16 0.00 0.02 0.00 0.00 177.57 177.92 3hqp h SER 382 N 1.06 1.13 0.98 0.00 0.87 -1.25 -1.77 113.55 114.57 3hqp h SER 382 Ca 0.22 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 3hqp h SER 382 Cb 0.38 -0.29 0.00 0.00 -0.44 0.00 0.00 62.40 62.05 3hqp h SER 382 CO 0.00 0.89 -0.54 0.28 -0.53 0.00 0.00 176.83 176.94 3hqp h SER 383 N 1.28 0.00 -0.13 6.23 0.02 -1.27 -2.20 113.55 117.48 3hqp h SER 383 Ca 0.32 -0.17 -0.19 0.00 -0.84 0.00 0.00 61.79 60.91 3hqp h SER 383 Cb -0.00 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.55 3hqp h SER 383 CO -0.06 0.09 -0.67 0.00 -1.14 0.00 0.00 176.83 175.05 3hqp h ALA 384 N 2.48 0.25 -0.33 3.77 0.00 -0.66 -1.99 119.26 122.79 3hqp h ALA 384 Ca 0.00 -0.56 -0.18 0.00 0.00 0.00 0.00 54.91 54.17 3hqp h ALA 384 Cb 0.76 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 3hqp h ALA 384 CO 0.00 0.55 -0.49 0.28 0.00 0.00 0.00 179.25 179.60 3hqp h VAL 385 N 0.36 1.27 -1.00 0.00 2.07 -1.39 -2.59 116.25 114.96 3hqp h VAL 385 Ca -0.05 -1.66 0.15 0.00 0.82 0.00 0.00 66.70 65.96 3hqp h VAL 385 Cb 1.31 1.53 -0.09 0.00 -1.52 0.00 0.00 31.29 32.51 3hqp h VAL 385 CO 0.14 0.55 0.62 -1.13 0.02 0.00 0.00 177.57 177.77 3hqp h ASN 386 N 0.71 0.85 -0.66 0.57 -0.73 -1.41 -0.70 115.58 114.21 3hqp h ASN 386 Ca 0.03 0.07 -0.06 0.00 1.87 0.00 0.00 56.30 58.21 3hqp h ASN 386 Cb 1.09 -0.09 -0.03 0.00 0.27 0.00 0.00 38.32 39.56 3hqp h ASN 386 CO 0.11 0.39 0.18 0.28 -0.37 0.00 0.00 177.43 178.01 3hqp h SER 387 N 0.88 0.99 -0.11 1.15 0.02 -1.17 -2.33 113.55 112.98 3hqp h SER 387 Ca 0.54 -0.23 0.03 0.00 -0.84 0.00 0.00 61.79 61.29 3hqp h SER 387 Cb 0.69 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.94 3hqp h SER 387 CO -0.32 0.96 -0.07 0.58 -1.14 0.00 0.00 176.83 176.84 3hqp h VAL 388 N 0.98 0.79 -0.01 2.27 2.07 -0.75 0.22 116.25 121.81 3hqp h VAL 388 Ca 0.21 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.65 3hqp h VAL 388 Cb 0.34 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 3hqp h VAL 388 CO -0.00 0.00 -0.39 1.88 0.02 0.00 0.00 177.57 179.08 3hqp h TYR 389 N -0.07 0.02 0.10 1.57 0.05 -1.39 0.24 116.97 117.49 3hqp h TYR 389 Ca 0.07 -0.01 -0.26 0.00 0.05 0.00 0.00 58.73 58.58 3hqp h TYR 389 Cb 0.17 -0.01 -0.01 0.00 1.01 0.00 0.00 36.73 37.90 3hqp h TYR 389 CO -0.19 0.40 -1.22 0.93 -1.05 0.00 0.00 178.16 177.04 3hqp h GLU 390 N 0.02 0.20 -0.00 4.88 5.08 -1.03 -3.35 114.58 120.37 3hqp h GLU 390 Ca -0.00 -0.34 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 3hqp h GLU 390 Cb 0.69 0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.07 3hqp h GLU 390 CO 0.05 1.15 -0.81 -2.37 -1.00 0.00 0.00 179.01 176.03 3hqp n THR 391 N -3.47 0.00 -3.71 1.13 5.66 0.74 -4.99 114.28 109.64 3hqp n THR 391 Ca -0.07 -0.09 -0.26 0.00 -3.05 0.00 0.00 64.05 60.58 3hqp n THR 391 Cb 1.01 1.05 0.06 0.00 -1.55 0.00 0.00 70.33 70.90 3hqp n THR 391 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 3hqp n LYS 392 N -1.14 -6.99 -1.87 1.09 5.02 0.82 -4.97 118.16 110.12 3hqp n LYS 392 Ca 0.05 0.74 -0.39 0.00 -2.02 0.00 0.00 58.31 56.69 3hqp n LYS 392 Cb 0.33 -5.73 0.02 0.00 -0.02 0.00 0.00 35.03 29.64 3hqp n LYS 392 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hqp s ALA 393 N -3.33 2.98 -1.78 7.82 0.00 -0.96 -4.92 121.76 121.58 3hqp s ALA 393 Ca 0.57 1.31 0.19 0.00 0.00 0.00 0.00 51.96 54.02 3hqp s ALA 393 Cb -0.26 -3.54 0.01 0.00 0.00 0.00 0.00 23.12 19.32 3hqp s ALA 393 CO 0.77 -1.19 0.97 1.63 0.00 0.00 0.00 175.76 177.93 3hqp n LYS 394 N -0.66 1.51 -3.48 0.00 5.02 -1.20 -4.73 118.16 114.62 3hqp n LYS 394 Ca 0.08 -0.96 -0.14 0.00 -2.02 0.00 0.00 58.31 55.28 3hqp n LYS 394 Cb 0.44 -1.36 -0.04 0.00 -0.02 0.00 0.00 35.03 34.06 3hqp n LYS 394 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hqp s ALA 395 N -2.10 -1.71 0.07 7.82 0.00 -1.26 -4.27 121.76 120.31 3hqp s ALA 395 Ca 0.16 0.93 0.07 0.00 0.00 0.00 0.00 51.96 53.12 3hqp s ALA 395 Cb 0.15 0.40 -0.03 0.00 0.00 0.00 0.00 23.12 23.64 3hqp s ALA 395 CO 0.46 -0.58 -0.19 1.41 0.00 0.00 0.00 175.76 176.85 3hqp s MET 396 N -2.55 1.16 -0.12 0.00 1.75 -0.70 -2.85 119.30 115.99 3hqp s MET 396 Ca -0.03 -1.00 0.01 0.00 -1.25 0.00 0.00 55.69 53.42 3hqp s MET 396 Cb -0.01 -1.31 0.02 0.00 2.84 0.00 0.00 34.83 36.37 3hqp s MET 396 CO -0.03 0.32 -0.15 0.08 -0.65 0.00 0.00 175.02 174.59 3hqp s VAL 397 N -0.99 1.49 -0.01 10.11 1.01 0.03 -0.22 120.40 131.82 3hqp s VAL 397 Ca 0.05 -0.62 0.08 0.00 0.00 0.00 0.00 61.98 61.49 3hqp s VAL 397 Cb -0.09 -1.37 -0.02 0.00 0.00 0.00 0.00 36.38 34.90 3hqp s VAL 397 CO 0.03 0.44 -0.24 0.68 0.00 0.00 0.00 175.10 176.00 3hqp s VAL 398 N 1.10 1.94 -0.27 2.92 -7.23 -0.23 0.27 120.40 118.90 3hqp s VAL 398 Ca -0.04 -1.09 -0.14 0.00 -1.81 0.00 0.00 61.98 58.89 3hqp s VAL 398 Cb -0.14 -1.62 -0.04 0.00 0.56 0.00 0.00 36.38 35.14 3hqp s VAL 398 CO -0.03 0.50 0.33 -0.76 -0.31 0.00 0.00 175.10 174.83 3hqp s LEU 399 N -0.69 4.04 -0.11 1.32 1.43 -1.03 -1.41 118.68 122.23 3hqp s LEU 399 Ca 0.10 0.23 -0.04 0.00 -1.03 0.00 0.00 54.13 53.39 3hqp s LEU 399 Cb -0.09 -2.35 0.06 0.00 0.03 0.00 0.00 46.19 43.83 3hqp s LEU 399 CO -0.00 -0.14 0.16 -0.55 0.23 0.00 0.00 176.35 176.05 3hqp s SER 400 N 1.62 1.02 -0.15 2.29 0.15 -1.16 -4.84 113.70 112.63 3hqp s SER 400 Ca 0.13 0.14 -0.23 0.00 0.70 0.00 0.00 55.95 56.69 3hqp s SER 400 Cb -0.16 0.23 -0.24 0.00 -1.71 0.00 0.00 66.02 64.14 3hqp s SER 400 CO 0.10 -0.27 0.55 0.78 1.20 0.00 0.00 173.24 175.60 3hqp h ASN 401 N 8.36 0.11 -2.45 5.45 4.21 -1.97 -3.37 115.58 125.94 3hqp h ASN 401 Ca -0.14 -0.80 -0.52 0.00 1.21 0.00 0.00 56.30 56.05 3hqp h ASN 401 Cb 1.13 -0.04 -0.02 0.00 -1.12 0.00 0.00 38.32 38.27 3hqp h ASN 401 CO 0.18 1.32 -0.46 0.42 -1.29 0.00 0.00 177.43 177.60 3hqp s THR 402 N -2.34 5.29 -2.00 2.81 -4.23 -1.26 -4.22 115.64 109.70 3hqp s THR 402 Ca -0.22 -0.78 0.06 0.00 -1.18 0.00 0.00 61.69 59.56 3hqp s THR 402 Cb 0.02 -3.77 0.16 0.00 1.34 0.00 0.00 72.50 70.25 3hqp s THR 402 CO 0.68 -0.16 0.75 0.61 -0.54 0.00 0.00 174.62 175.96 3hqp n GLY 403 N -0.81 -0.24 0.28 3.99 0.00 -1.26 -3.96 105.19 103.20 3hqp n GLY 403 Ca -0.08 -0.04 0.01 0.00 0.00 0.00 0.00 46.02 45.92 3hqp n GLY 403 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3hqp h ARG 404 N 0.00 0.70 -0.18 1.61 3.08 -1.94 0.24 114.38 117.89 3hqp h ARG 404 Ca 0.00 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 59.96 3hqp h ARG 404 Cb 0.00 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 3hqp h ARG 404 CO 0.00 0.46 -0.06 0.77 -1.07 0.00 0.00 179.97 180.07 3hqp h SER 405 N 0.72 0.36 -0.64 7.04 0.02 -1.89 -2.66 113.55 116.50 3hqp h SER 405 Ca 0.36 -0.39 -0.02 0.00 -0.84 0.00 0.00 61.79 60.90 3hqp h SER 405 Cb 0.31 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 62.72 3hqp h SER 405 CO -0.23 0.67 0.31 0.00 -1.14 0.00 0.00 176.83 176.44 3hqp h ALA 406 N 0.70 0.82 0.00 3.77 0.00 -1.66 -2.45 119.26 120.44 3hqp h ALA 406 Ca 0.04 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 3hqp h ALA 406 Cb 0.52 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3hqp h ALA 406 CO 0.02 0.38 -0.30 0.00 0.00 0.00 0.00 179.25 179.35 3hqp h ARG 407 N 0.88 0.00 0.00 0.00 3.08 -0.61 -1.99 114.38 115.74 3hqp h ARG 407 Ca 0.22 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.25 3hqp h ARG 407 Cb 0.11 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.16 3hqp h ARG 407 CO -0.03 0.30 -0.11 1.25 -1.07 0.00 0.00 179.97 180.31 3hqp h LEU 408 N 0.00 0.00 0.16 3.04 5.85 -1.08 -2.11 115.31 121.17 3hqp h LEU 408 Ca -0.00 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.41 3hqp h LEU 408 Cb 0.59 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.62 3hqp h LEU 408 CO 0.04 0.11 -1.55 0.58 -0.34 0.00 0.00 178.44 177.28 3hqp h VAL 409 N 0.00 1.02 0.00 1.05 2.07 -1.21 -3.33 116.25 115.86 3hqp h VAL 409 Ca -0.00 -2.47 -0.03 0.00 0.82 0.00 0.00 66.70 65.02 3hqp h VAL 409 Cb 1.01 2.78 -0.00 0.00 -1.52 0.00 0.00 31.29 33.56 3hqp h VAL 409 CO 0.01 0.78 -0.13 0.00 0.02 0.00 0.00 177.57 178.26 3hqp h ALA 410 N 0.04 1.58 -0.99 1.67 0.00 -1.41 -2.42 119.26 117.73 3hqp h ALA 410 Ca -0.31 -0.12 0.17 0.00 0.00 0.00 0.00 54.91 54.64 3hqp h ALA 410 Cb 1.93 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 19.61 3hqp h ALA 410 CO 0.13 0.16 0.62 -0.22 0.00 0.00 0.00 179.25 179.94 3hqp h LYS 411 N 0.00 0.79 -0.30 0.00 3.64 -1.48 -2.33 116.57 116.89 3hqp h LYS 411 Ca -0.00 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 3hqp h LYS 411 Cb 0.27 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 3hqp h LYS 411 CO 0.02 0.52 0.00 0.66 -2.27 0.00 0.00 179.45 178.38 3hqp n TYR 412 N -4.68 0.39 -3.48 1.91 4.01 -0.91 -4.99 117.16 109.40 3hqp n TYR 412 Ca 0.21 -0.20 -0.16 0.00 -0.16 0.00 0.00 57.90 57.59 3hqp n TYR 412 Cb 0.50 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.54 3hqp n TYR 412 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3hqp n ARG 413 N 0.69 -1.39 -1.60 -0.72 5.12 -0.88 -4.33 116.66 113.54 3hqp n ARG 413 Ca 0.16 0.98 -0.31 0.00 -1.93 0.00 0.00 57.85 56.76 3hqp n ARG 413 Cb 0.39 -4.04 0.06 0.00 -1.16 0.00 0.00 32.46 27.71 3hqp n ARG 413 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 3hqp s PRO 414 N -4.40 2.64 -0.25 5.56 0.04 -1.26 -4.52 135.00 132.80 3hqp s PRO 414 Ca 0.10 0.78 0.06 0.00 0.04 0.00 0.00 61.00 61.99 3hqp s PRO 414 Cb -0.04 -1.97 0.52 0.00 0.04 0.00 0.00 34.50 33.05 3hqp s PRO 414 CO 0.83 -1.27 1.52 0.27 0.04 0.00 0.00 177.00 178.40 3hqp n ASN 415 N -3.22 3.88 -4.04 6.66 6.94 -1.26 -4.88 115.26 119.35 3hqp n ASN 415 Ca 0.07 -2.91 -0.08 0.00 -0.02 0.00 0.00 54.58 51.64 3hqp n ASN 415 Cb 0.55 -0.69 -0.10 0.00 -2.36 0.00 0.00 39.78 37.18 3hqp n ASN 415 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3hqp s PRO 417 N -3.54 2.90 -0.26 0.00 0.02 -1.26 -4.84 135.00 128.02 3hqp s PRO 417 Ca 0.03 2.10 -0.06 0.00 0.02 0.00 0.00 61.00 63.10 3hqp s PRO 417 Cb 0.05 -2.05 -0.00 0.00 0.02 0.00 0.00 34.50 32.51 3hqp s PRO 417 CO -0.09 -1.34 0.04 0.42 -0.33 0.00 0.00 177.00 175.71 3hqp s ILE 418 N -1.38 3.85 -0.28 2.83 1.01 -0.47 -1.72 121.20 125.04 3hqp s ILE 418 Ca 0.77 -0.53 -0.12 0.00 0.00 0.00 0.00 60.65 60.77 3hqp s ILE 418 Cb -0.38 -2.88 -0.04 0.00 0.01 0.00 0.00 42.46 39.17 3hqp s ILE 418 CO 0.42 0.24 0.25 -0.69 0.00 0.00 0.00 174.94 175.16 3hqp s VAL 419 N 1.52 5.27 -0.30 2.92 1.01 0.69 -0.12 120.40 131.38 3hqp s VAL 419 Ca 0.04 0.26 -0.04 0.00 0.00 0.00 0.00 61.98 62.24 3hqp s VAL 419 Cb -0.16 -3.60 0.04 0.00 0.00 0.00 0.00 36.38 32.66 3hqp s VAL 419 CO 0.01 0.20 0.03 0.00 0.00 0.00 0.00 175.10 175.34 3hqp s VAL 421 N 1.34 4.60 0.05 0.00 1.01 -0.50 0.55 120.40 127.45 3hqp s VAL 421 Ca -0.03 0.12 0.08 0.00 0.00 0.00 0.00 61.98 62.15 3hqp s VAL 421 Cb -0.19 -4.40 -0.03 0.00 0.00 0.00 0.00 36.38 31.75 3hqp s VAL 421 CO 0.00 -0.91 -0.20 0.28 0.00 0.00 0.00 175.10 174.27 3hqp s THR 422 N 3.39 2.64 -0.51 3.92 -1.32 0.63 -2.97 115.64 121.42 3hqp s THR 422 Ca 0.26 -1.29 0.24 0.00 -1.21 0.00 0.00 61.69 59.69 3hqp s THR 422 Cb -0.14 -2.11 0.04 0.00 -1.51 0.00 0.00 72.50 68.78 3hqp s THR 422 CO 0.18 0.31 1.24 0.71 -2.21 0.00 0.00 174.62 174.85 3hqp h THR 423 N 3.96 0.00 -3.44 5.08 1.35 -1.75 0.12 112.91 118.23 3hqp h THR 423 Ca -0.48 -0.66 -0.60 0.00 -0.55 0.00 0.00 66.41 64.11 3hqp h THR 423 Cb 1.15 1.23 -0.12 0.00 -1.73 0.00 0.00 68.15 68.68 3hqp h THR 423 CO 0.46 0.00 -0.37 -0.13 -0.25 0.00 0.00 175.52 175.24 3hqp s ARG 424 N -3.23 4.17 0.43 4.72 3.00 -1.26 -4.66 118.95 122.12 3hqp s ARG 424 Ca 0.04 -0.03 0.23 0.00 0.00 0.00 0.00 55.73 55.97 3hqp s ARG 424 Cb 0.12 -3.49 0.89 0.00 0.00 0.00 0.00 34.95 32.47 3hqp s ARG 424 CO 0.74 0.11 1.82 1.25 0.00 0.00 0.00 175.30 179.22 3hqp h LEU 425 N 7.23 0.00 -0.30 2.53 5.85 -1.94 -2.99 115.31 125.70 3hqp h LEU 425 Ca -0.39 0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.13 3hqp h LEU 425 Cb 1.16 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.19 3hqp h LEU 425 CO 0.71 0.25 -0.83 -0.61 -0.34 0.00 0.00 178.44 177.63 3hqp h GLN 426 N 0.00 0.38 0.00 1.25 4.15 -1.96 -3.13 115.11 115.79 3hqp h GLN 426 Ca -0.00 -0.36 -0.03 0.00 0.77 0.00 0.00 58.65 59.03 3hqp h GLN 426 Cb 0.76 0.09 -0.00 0.00 0.21 0.00 0.00 27.48 28.53 3hqp h GLN 426 CO 0.03 1.02 -0.15 1.15 -1.93 0.00 0.00 178.83 178.95 3hqp h THR 427 N 0.24 1.03 -0.35 2.39 2.02 -1.82 0.20 112.91 116.60 3hqp h THR 427 Ca -0.05 -0.51 -0.00 0.00 0.77 0.00 0.00 66.41 66.61 3hqp h THR 427 Cb 1.43 1.28 -0.02 0.00 -1.74 0.00 0.00 68.15 69.11 3hqp h THR 427 CO 0.14 0.14 0.21 0.00 0.37 0.00 0.00 175.52 176.39 3hqp h ARG 429 N 0.46 0.32 0.00 0.00 3.08 -1.35 -3.30 114.38 113.58 3hqp h ARG 429 Ca 0.13 -0.33 -0.09 0.00 0.07 0.00 0.00 59.98 59.75 3hqp h ARG 429 Cb -0.00 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 3hqp h ARG 429 CO -0.02 1.02 -0.44 1.96 -1.07 0.00 0.00 179.97 181.42 3hqp h GLN 430 N 0.19 0.00 0.00 0.04 4.20 -0.61 -2.85 115.11 116.07 3hqp h GLN 430 Ca -0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.65 3hqp h GLN 430 Cb 1.51 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.29 3hqp h GLN 430 CO 0.15 0.44 0.00 1.28 -0.67 0.00 0.00 178.83 180.02 3hqp n LEU 431 N -3.34 0.00 0.00 1.46 4.77 -0.76 -3.58 117.00 115.54 3hqp n LEU 431 Ca 0.01 0.00 0.09 0.00 -0.03 0.00 0.00 56.01 56.08 3hqp n LEU 431 Cb 0.63 0.00 0.43 0.00 -2.33 0.00 0.00 43.42 42.15 3hqp n LEU 431 CO 0.39 0.00 0.81 0.59 -1.33 0.00 0.00 177.39 177.84 3hqp n ASN 432 N -0.81 0.00 -0.81 -1.43 4.13 -1.07 -2.28 115.26 113.00 3hqp n ASN 432 Ca 0.14 0.41 0.09 0.00 1.68 0.00 0.00 54.58 56.90 3hqp n ASN 432 Cb 0.07 -0.46 0.13 0.00 -1.54 0.00 0.00 39.78 37.97 3hqp n ASN 432 CO 0.00 0.00 0.00 2.30 0.28 0.00 0.00 177.26 179.84 3hqp n ILE 433 N -1.46 0.30 -3.75 2.41 -5.35 -1.23 -4.73 119.36 105.54 3hqp n ILE 433 Ca 0.06 -0.65 -0.35 0.00 -0.27 0.00 0.00 62.75 61.53 3hqp n ILE 433 Cb 0.21 1.11 -0.09 0.00 -1.74 0.00 0.00 39.64 39.14 3hqp n ILE 433 CO 0.00 0.00 0.00 -0.89 -1.76 0.00 0.00 176.55 173.90 3hqp s THR 434 N -1.34 5.28 0.18 7.28 2.01 -0.96 -4.57 115.64 123.51 3hqp s THR 434 Ca 0.26 0.15 -0.30 0.00 0.31 0.00 0.00 61.69 62.10 3hqp s THR 434 Cb 0.16 -3.42 -0.09 0.00 0.01 0.00 0.00 72.50 69.16 3hqp s THR 434 CO 0.23 0.41 1.35 -1.58 -0.69 0.00 0.00 174.62 174.35 3hqp s GLN 435 N 0.59 4.35 0.00 4.92 -0.44 -1.26 -3.79 119.66 124.03 3hqp s GLN 435 Ca 0.07 2.09 0.00 0.00 -2.50 0.00 0.00 55.36 55.02 3hqp s GLN 435 Cb -0.12 -3.20 0.00 0.00 -1.64 0.00 0.00 33.01 28.05 3hqp s GLN 435 CO 0.00 -0.33 0.00 0.41 0.50 0.00 0.00 175.29 175.87 3hqp n GLY 436 N 2.73 2.00 3.85 2.59 0.00 -0.17 -4.79 105.19 111.41 3hqp n GLY 436 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 3hqp n GLY 436 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hqp s VAL 437 N -2.86 5.31 -0.11 1.61 1.01 -1.25 -1.37 120.40 122.75 3hqp s VAL 437 Ca 0.00 0.47 -0.01 0.00 0.00 0.00 0.00 61.98 62.44 3hqp s VAL 437 Cb 0.00 -3.53 0.03 0.00 0.00 0.00 0.00 36.38 32.88 3hqp s VAL 437 CO 0.00 0.59 -0.04 -1.61 0.00 0.00 0.00 175.10 174.04 3hqp s GLU 438 N -0.96 1.11 0.31 2.72 2.02 0.84 -4.93 118.70 119.80 3hqp s GLU 438 Ca 0.18 -0.14 -0.22 0.00 0.02 0.00 0.00 54.97 54.82 3hqp s GLU 438 Cb -0.14 -1.41 -0.09 0.00 0.10 0.00 0.00 34.13 32.59 3hqp s GLU 438 CO 0.08 -0.31 0.84 -1.12 0.02 0.00 0.00 175.26 174.76 3hqp s SER 439 N 1.82 7.10 -0.11 -0.19 0.01 -1.26 -1.28 113.70 119.79 3hqp s SER 439 Ca 0.04 1.60 0.02 0.00 1.31 0.00 0.00 55.95 58.92 3hqp s SER 439 Cb -0.13 -2.49 0.01 0.00 0.21 0.00 0.00 66.02 63.62 3hqp s SER 439 CO -0.07 -0.10 -0.16 -0.69 0.41 0.00 0.00 173.24 172.63 3hqp s VAL 440 N -1.73 1.55 -0.26 3.43 1.01 0.19 -4.87 120.40 119.72 3hqp s VAL 440 Ca 0.50 -0.67 -0.27 0.00 0.00 0.00 0.00 61.98 61.54 3hqp s VAL 440 Cb -0.15 -1.41 0.00 0.00 0.00 0.00 0.00 36.38 34.83 3hqp s VAL 440 CO 0.20 0.45 0.94 0.12 0.00 0.00 0.00 175.10 176.81 3hqp s PHE 441 N 0.96 3.28 -0.40 5.22 5.36 -1.26 -0.27 117.98 130.87 3hqp s PHE 441 Ca -0.07 1.23 -0.12 0.00 -0.96 0.00 0.00 56.93 57.02 3hqp s PHE 441 Cb -0.15 -3.25 0.04 0.00 -0.34 0.00 0.00 43.02 39.32 3hqp s PHE 441 CO -0.01 -0.51 0.26 0.12 -1.46 0.00 0.00 175.22 173.62 3hqp s PHE 442 N 3.11 3.26 -0.70 10.12 5.36 0.03 -4.93 117.98 134.23 3hqp s PHE 442 Ca 0.40 -1.01 -0.26 0.00 -0.96 0.00 0.00 56.93 55.10 3hqp s PHE 442 Cb -0.15 -2.65 -0.04 0.00 -0.34 0.00 0.00 43.02 39.84 3hqp s PHE 442 CO 0.09 -0.70 2.00 0.34 -1.46 0.00 0.00 175.22 175.49 3hqp s ASP 443 N 1.81 5.01 0.42 6.13 -1.08 -1.26 -4.33 116.67 123.37 3hqp s ASP 443 Ca 0.03 0.09 0.19 0.00 -0.52 0.00 0.00 52.55 52.34 3hqp s ASP 443 Cb -0.21 -2.54 0.93 0.00 -1.46 0.00 0.00 42.92 39.65 3hqp s ASP 443 CO 0.06 -2.68 1.87 0.00 0.52 0.00 0.00 175.17 174.94 3hqp h ALA 444 N 14.22 1.23 0.29 3.66 0.00 -1.83 -2.21 119.26 134.63 3hqp h ALA 444 Ca -0.12 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 3hqp h ALA 444 Cb 1.11 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.86 3hqp h ALA 444 CO 1.19 0.37 -0.14 -0.44 0.00 0.00 0.00 179.25 180.23 3hqp h ASP 445 N 0.00 -0.33 1.10 0.00 3.32 -1.88 -1.84 116.42 116.79 3hqp h ASP 445 Ca -0.00 -0.16 -0.00 0.00 0.02 0.00 0.00 57.03 56.89 3hqp h ASP 445 Cb 0.64 0.09 -0.00 0.00 0.22 0.00 0.00 39.33 40.27 3hqp h ASP 445 CO 0.04 -0.01 -0.90 0.07 -1.72 0.00 0.00 179.24 176.72 3hqp h LYS 446 N -0.69 0.00 0.00 3.56 2.10 -1.98 -3.38 116.57 116.18 3hqp h LYS 446 Ca -0.04 0.00 -0.33 0.00 -2.00 0.00 0.00 60.65 58.28 3hqp h LYS 446 Cb 0.48 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 31.74 3hqp h LYS 446 CO 0.07 0.00 -2.24 1.28 -2.00 0.00 0.00 179.45 176.56 3hqp n LEU 447 N -2.72 0.43 0.00 7.07 4.77 -0.83 -5.12 117.00 120.59 3hqp n LEU 447 Ca 0.00 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 3hqp n LEU 447 Cb 0.55 0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.90 3hqp n LEU 447 CO 0.39 0.51 0.00 0.61 -1.33 0.00 0.00 177.39 177.57 3hqp n GLY 448 N 1.97 3.31 0.03 -0.72 0.00 -0.69 -4.86 105.19 104.23 3hqp n GLY 448 Ca -0.31 -1.92 0.12 0.00 0.00 0.00 0.00 46.02 43.91 3hqp n GLY 448 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3hqp n HIS 449 N -1.22 0.24 -3.48 1.61 8.25 -1.25 -4.48 115.22 114.90 3hqp n HIS 449 Ca 0.00 0.08 -0.19 0.00 -0.26 0.00 0.00 57.72 57.35 3hqp n HIS 449 Cb 0.00 -0.63 0.06 0.00 1.12 0.00 0.00 29.99 30.55 3hqp n HIS 449 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 3hqp n ASP 450 N -1.71 -3.40 -4.58 0.41 2.03 -1.26 -4.95 116.55 103.09 3hqp n ASP 450 Ca 0.05 -0.74 -0.42 0.00 0.52 0.00 0.00 54.79 54.20 3hqp n ASP 450 Cb 0.30 -4.70 -0.02 0.00 -0.72 0.00 0.00 41.12 35.97 3hqp n ASP 450 CO 0.00 0.00 0.00 -1.83 -1.92 0.00 0.00 177.20 173.45 3hqp s GLU 451 N -5.31 3.43 0.00 -0.67 1.03 -1.26 -2.23 118.70 113.69 3hqp s GLU 451 Ca 0.17 0.55 0.00 0.00 0.03 0.00 0.00 54.97 55.72 3hqp s GLU 451 Cb -0.03 -4.07 0.00 0.00 -0.80 0.00 0.00 34.13 29.23 3hqp s GLU 451 CO 0.77 -1.77 0.00 0.41 -1.33 0.00 0.00 175.26 173.34 3hqp n GLY 452 N 5.15 1.38 4.05 -3.83 0.00 -1.26 -4.94 105.19 105.74 3hqp n GLY 452 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 3hqp n GLY 452 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3hqp n LYS 453 N 0.00 0.00 -0.10 1.61 4.76 -0.95 -4.85 118.16 118.64 3hqp n LYS 453 Ca 0.00 0.00 -0.08 0.00 -2.87 0.00 0.00 58.31 55.36 3hqp n LYS 453 Cb 0.00 -2.97 0.00 0.00 -1.84 0.00 0.00 35.03 30.22 3hqp n LYS 453 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 3hqp h GLU 454 N 0.94 0.35 0.00 1.97 3.07 -1.92 -2.77 114.58 116.22 3hqp h GLU 454 Ca 0.00 -0.02 -0.09 0.00 -0.50 0.00 0.00 59.36 58.75 3hqp h GLU 454 Cb 0.00 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 27.82 3hqp h GLU 454 CO 0.00 0.23 -0.42 0.45 -1.40 0.00 0.00 179.01 177.87 3hqp h HIS 455 N 0.37 0.00 0.20 4.33 3.86 -1.92 -2.24 115.15 119.74 3hqp h HIS 455 Ca 0.14 0.00 -0.33 0.00 -1.16 0.00 0.00 60.37 59.02 3hqp h HIS 455 Cb 0.03 0.00 0.02 0.00 1.06 0.00 0.00 27.41 28.52 3hqp h HIS 455 CO -0.09 0.42 -1.55 0.00 0.86 0.00 0.00 177.93 177.58 3hqp h ARG 456 N 0.00 0.41 -0.65 2.45 3.08 -1.92 -2.70 114.38 115.06 3hqp h ARG 456 Ca -0.00 -0.71 -0.05 0.00 0.07 0.00 0.00 59.98 59.29 3hqp h ARG 456 Cb 0.79 0.26 -0.03 0.00 0.08 0.00 0.00 29.97 31.07 3hqp h ARG 456 CO 0.05 1.32 0.19 0.28 -1.07 0.00 0.00 179.97 180.75 3hqp h VAL 457 N 0.11 1.24 -0.64 2.04 2.07 -1.49 -0.75 116.25 118.83 3hqp h VAL 457 Ca -0.27 -0.85 -0.01 0.00 0.82 0.00 0.00 66.70 66.39 3hqp h VAL 457 Cb 2.10 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 32.37 3hqp h VAL 457 CO 0.22 0.33 0.34 0.00 0.02 0.00 0.00 177.57 178.48 3hqp h ALA 458 N 1.25 1.40 -0.01 1.67 0.00 -1.47 -1.42 119.26 120.68 3hqp h ALA 458 Ca 0.21 -0.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.89 3hqp h ALA 458 Cb 0.29 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3hqp h ALA 458 CO -0.01 0.49 -0.60 0.00 0.00 0.00 0.00 179.25 179.13 3hqp h ALA 459 N 1.49 0.97 0.07 0.00 0.00 -1.05 -1.57 119.26 119.18 3hqp h ALA 459 Ca 0.23 -0.55 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 3hqp h ALA 459 Cb 0.03 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3hqp h ALA 459 CO -0.04 0.75 -0.03 0.78 0.00 0.00 0.00 179.25 180.71 3hqp h GLY 460 N 1.73 -0.10 1.01 0.00 0.00 -0.72 -2.84 103.07 102.15 3hqp h GLY 460 Ca -0.01 0.04 0.01 0.00 0.00 0.00 0.00 47.33 47.37 3hqp h GLY 460 CO 0.08 -0.04 0.49 -2.08 0.00 0.00 0.00 176.54 175.00 3hqp h VAL 461 N -0.64 1.19 -0.65 4.60 2.07 -1.33 -1.71 116.25 119.78 3hqp h VAL 461 Ca -0.01 -0.34 0.14 0.00 0.82 0.00 0.00 66.70 67.30 3hqp h VAL 461 Cb 0.53 0.10 -0.12 0.00 -1.52 0.00 0.00 31.29 30.28 3hqp h VAL 461 CO 0.02 0.18 -0.09 -0.08 0.02 0.00 0.00 177.57 177.62 3hqp h GLU 462 N 1.00 0.05 -0.27 1.57 4.57 -1.34 0.18 114.58 120.33 3hqp h GLU 462 Ca 0.27 -0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.41 3hqp h GLU 462 Cb -0.12 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.45 3hqp h GLU 462 CO -0.06 0.03 0.04 0.35 -1.18 0.00 0.00 179.01 178.19 3hqp h PHE 463 N 0.05 0.49 -0.75 0.92 3.57 -1.18 -1.82 116.94 118.22 3hqp h PHE 463 Ca 0.33 -0.07 -0.01 0.00 3.53 0.00 0.00 57.97 61.74 3hqp h PHE 463 Cb 0.53 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.10 3hqp h PHE 463 CO -0.46 0.57 0.42 0.00 -2.23 0.00 0.00 178.31 176.61 3hqp h ALA 464 N 0.86 0.95 -0.30 2.41 0.00 -0.75 -2.04 119.26 120.39 3hqp h ALA 464 Ca 0.08 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 3hqp h ALA 464 Cb 0.35 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3hqp h ALA 464 CO 0.01 0.46 0.05 0.87 0.00 0.00 0.00 179.25 180.64 3hqp h LYS 465 N 1.03 0.49 -0.02 0.00 1.79 -0.62 -0.30 116.57 118.94 3hqp h LYS 465 Ca 0.26 -0.13 -0.05 0.00 -2.18 0.00 0.00 60.65 58.55 3hqp h LYS 465 Cb 0.02 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.61 3hqp h LYS 465 CO -0.04 0.59 -0.22 0.66 -1.08 0.00 0.00 179.45 179.36 3hqp h SER 466 N 0.32 0.03 -0.08 0.86 4.64 -1.14 -2.45 113.55 115.73 3hqp h SER 466 Ca 0.09 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 3hqp h SER 466 Cb 0.34 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 3hqp h SER 466 CO 0.01 0.25 0.00 0.29 -0.87 0.00 0.00 176.83 176.50 3hqp n LYS 467 N -4.27 1.84 -0.94 4.77 4.76 -0.78 -4.94 118.16 118.59 3hqp n LYS 467 Ca -0.02 -1.23 0.00 0.00 -2.87 0.00 0.00 58.31 54.19 3hqp n LYS 467 Cb 0.28 -1.46 0.00 0.00 -1.84 0.00 0.00 35.03 32.02 3hqp n LYS 467 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3hqp n GLY 468 N 1.21 0.59 0.12 0.72 0.00 -0.92 -4.94 105.19 101.97 3hqp n GLY 468 Ca 0.18 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.08 3hqp n GLY 468 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3hqp h TYR 469 N 0.00 0.35 -3.78 1.61 0.05 -1.29 -3.44 116.97 110.47 3hqp h TYR 469 Ca 0.00 -0.07 -0.68 0.00 0.05 0.00 0.00 58.73 58.03 3hqp h TYR 469 Cb 0.00 -0.09 -0.20 0.00 1.01 0.00 0.00 36.73 37.46 3hqp h TYR 469 CO 0.00 0.57 -0.82 0.14 -1.05 0.00 0.00 178.16 177.00 3hqp s VAL 470 N -4.79 2.70 0.52 -2.88 -7.23 -1.14 -4.68 120.40 102.90 3hqp s VAL 470 Ca -0.14 -1.55 0.04 0.00 -1.81 0.00 0.00 61.98 58.52 3hqp s VAL 470 Cb 0.06 -2.22 0.01 0.00 0.56 0.00 0.00 36.38 34.79 3hqp s VAL 470 CO 0.73 0.11 0.27 -1.10 -0.31 0.00 0.00 175.10 174.80 3hqp s GLN 471 N -2.09 2.24 0.29 4.82 1.11 -1.26 -4.40 119.66 120.36 3hqp s GLN 471 Ca 0.17 -2.10 -0.30 0.00 0.01 0.00 0.00 55.36 53.14 3hqp s GLN 471 Cb -0.10 -1.94 -0.11 0.00 -1.01 0.00 0.00 33.01 29.84 3hqp s GLN 471 CO 0.09 -0.49 1.61 0.99 0.01 0.00 0.00 175.29 177.50 3hqp s THR 472 N -2.78 2.04 0.00 -0.19 2.01 -1.26 -2.63 115.64 112.82 3hqp s THR 472 Ca 0.27 0.03 0.00 0.00 0.31 0.00 0.00 61.69 62.30 3hqp s THR 472 Cb -0.01 -3.02 0.00 0.00 0.01 0.00 0.00 72.50 69.48 3hqp s THR 472 CO 0.16 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.71 3hqp n GLY 473 N 2.33 1.10 3.83 4.40 0.00 -0.05 -5.02 105.19 111.79 3hqp n GLY 473 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 3hqp n GLY 473 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hqp s ASP 474 N -3.04 5.38 0.13 1.61 1.01 -1.08 -4.77 116.67 115.91 3hqp s ASP 474 Ca 0.00 1.50 -0.07 0.00 0.71 0.00 0.00 52.55 54.69 3hqp s ASP 474 Cb 0.00 -2.37 -0.06 0.00 1.01 0.00 0.00 42.92 41.50 3hqp s ASP 474 CO 0.00 -1.42 0.40 -0.31 0.21 0.00 0.00 175.17 174.05 3hqp s TYR 475 N -3.11 3.50 -0.03 4.23 2.02 -1.26 -1.32 117.35 121.38 3hqp s TYR 475 Ca 0.58 0.66 0.01 0.00 -0.37 0.00 0.00 57.07 57.95 3hqp s TYR 475 Cb -0.13 -2.08 0.02 0.00 -0.40 0.00 0.00 41.96 39.37 3hqp s TYR 475 CO 0.54 0.44 -0.01 0.00 -1.57 0.00 0.00 175.55 174.96 3hqp s VAL 477 N 0.88 5.23 -0.09 0.00 1.01 -1.13 -0.71 120.40 125.59 3hqp s VAL 477 Ca -0.09 0.53 0.03 0.00 0.00 0.00 0.00 61.98 62.45 3hqp s VAL 477 Cb -0.13 -3.66 -0.01 0.00 0.00 0.00 0.00 36.38 32.59 3hqp s VAL 477 CO -0.01 0.25 -0.20 -0.69 0.00 0.00 0.00 175.10 174.44 3hqp s VAL 478 N 1.45 2.43 -0.19 2.92 1.01 0.50 -0.79 120.40 127.73 3hqp s VAL 478 Ca 0.15 -0.90 0.01 0.00 0.00 0.00 0.00 61.98 61.24 3hqp s VAL 478 Cb -0.15 -1.95 0.03 0.00 0.00 0.00 0.00 36.38 34.32 3hqp s VAL 478 CO 0.08 0.55 -0.17 -0.63 0.00 0.00 0.00 175.10 174.94 3hqp s ILE 479 N 0.13 1.97 0.00 2.22 1.01 0.14 -0.94 121.20 125.73 3hqp s ILE 479 Ca -0.10 -1.03 0.00 0.00 0.00 0.00 0.00 60.65 59.51 3hqp s ILE 479 Cb -0.16 -1.87 0.00 0.00 0.01 0.00 0.00 42.46 40.44 3hqp s ILE 479 CO 0.06 0.39 0.00 0.00 0.00 0.00 0.00 174.94 175.39 3hqp n HIS 480 N 4.61 -0.37 -3.69 3.97 1.44 -0.81 -2.47 115.22 117.90 3hqp n HIS 480 Ca -0.19 0.00 -0.22 0.00 -2.01 0.00 0.00 57.72 55.30 3hqp n HIS 480 Cb 0.48 0.00 -0.02 0.00 0.12 0.00 0.00 29.99 30.58 3hqp n HIS 480 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3hqp s ALA 481 N -1.00 3.85 1.02 1.59 0.00 -1.26 -0.91 121.76 125.04 3hqp s ALA 481 Ca 0.00 -1.11 -0.02 0.00 0.00 0.00 0.00 51.96 50.83 3hqp s ALA 481 Cb 0.00 -1.89 0.03 0.00 0.00 0.00 0.00 23.12 21.26 3hqp s ALA 481 CO 0.00 0.11 0.15 -0.40 0.00 0.00 0.00 175.76 175.62 3hqp n ASP 482 N -1.59 -0.61 -1.31 0.00 5.75 -1.26 -4.89 116.55 112.64 3hqp n ASP 482 Ca -0.07 -0.80 -0.03 0.00 -0.01 0.00 0.00 54.79 53.88 3hqp n ASP 482 Cb 0.57 -0.13 0.01 0.00 -1.03 0.00 0.00 41.12 40.54 3hqp n ASP 482 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3hqp n HIS 483 N -2.54 0.31 0.00 2.11 1.44 -1.26 -3.88 115.22 111.40 3hqp n HIS 483 Ca 0.02 -0.87 0.00 0.00 -2.01 0.00 0.00 57.72 54.86 3hqp n HIS 483 Cb 0.07 -0.43 0.00 0.00 0.12 0.00 0.00 29.99 29.75 3hqp n HIS 483 CO 0.00 0.00 0.00 1.17 -2.81 0.00 0.00 176.34 174.70 3hqp n LYS 484 N 0.72 0.00 -2.75 -1.40 0.00 -1.26 -5.09 118.16 108.38 3hqp n LYS 484 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 58.31 57.95 3hqp n LYS 484 Cb 0.57 -0.08 -0.03 0.00 0.00 0.00 0.00 35.03 35.49 3hqp n LYS 484 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 3hqp s VAL 485 N -1.00 4.86 -0.03 3.15 1.01 -1.25 -5.06 120.40 122.09 3hqp s VAL 485 Ca 0.00 1.99 0.08 0.00 0.00 0.00 0.00 61.98 64.04 3hqp s VAL 485 Cb 0.00 -4.29 -0.02 0.00 0.00 0.00 0.00 36.38 32.07 3hqp s VAL 485 CO 0.00 0.18 -0.26 -0.54 0.00 0.00 0.00 175.10 174.48 3hqp s LYS 486 N 0.91 2.17 0.00 2.72 -0.14 -1.26 -4.64 119.74 119.50 3hqp s LYS 486 Ca 0.50 -0.93 0.00 0.00 -1.36 0.00 0.00 55.97 54.18 3hqp s LYS 486 Cb -0.21 -2.06 0.00 0.00 -1.68 0.00 0.00 37.83 33.88 3hqp s LYS 486 CO 0.27 0.54 0.00 0.41 -0.76 0.00 0.00 175.35 175.81 3hqp n GLY 487 N 2.51 2.47 3.48 -3.33 0.00 -1.26 -5.03 105.19 104.02 3hqp n GLY 487 Ca -0.16 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.70 3hqp n GLY 487 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3hqp s TYR 488 N -2.53 -0.60 -0.14 1.61 -0.85 -1.26 -5.12 117.35 108.46 3hqp s TYR 488 Ca 0.00 0.78 -0.29 0.00 -0.52 0.00 0.00 57.07 57.04 3hqp s TYR 488 Cb 0.00 0.47 -0.01 0.00 0.38 0.00 0.00 41.96 42.81 3hqp s TYR 488 CO 0.00 -0.70 1.02 0.00 -1.52 0.00 0.00 175.55 174.34 3hqp s ALA 489 N -2.26 3.48 0.00 9.51 0.00 -1.26 -4.57 121.76 126.65 3hqp s ALA 489 Ca -0.06 0.32 0.00 0.00 0.00 0.00 0.00 51.96 52.22 3hqp s ALA 489 Cb -0.00 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.65 3hqp s ALA 489 CO 0.00 -0.73 0.70 0.27 0.00 0.00 0.00 175.76 176.00 3hqp n ASN 490 N 5.38 1.37 -3.81 0.00 2.04 -1.14 -4.24 115.26 114.86 3hqp n ASN 490 Ca 0.10 -1.42 -0.15 0.00 -0.44 0.00 0.00 54.58 52.66 3hqp n ASN 490 Cb 0.48 0.00 -0.16 0.00 -2.53 0.00 0.00 39.78 37.57 3hqp n ASN 490 CO 0.00 0.00 0.00 -1.58 -0.44 0.00 0.00 177.26 175.24 3hqp s GLN 491 N -0.42 0.09 -0.03 -3.83 0.74 -0.09 -4.92 119.66 111.19 3hqp s GLN 491 Ca 0.00 0.11 0.04 0.00 0.05 0.00 0.00 55.36 55.56 3hqp s GLN 491 Cb 0.00 -0.30 -0.03 0.00 1.10 0.00 0.00 33.01 33.79 3hqp s GLN 491 CO 0.00 -0.12 -0.14 0.95 -0.55 0.00 0.00 175.29 175.43 3hqp s THR 492 N 0.87 3.12 0.05 -0.34 -4.23 -1.26 -1.92 115.64 111.93 3hqp s THR 492 Ca -0.08 -0.78 0.07 0.00 -1.18 0.00 0.00 61.69 59.72 3hqp s THR 492 Cb -0.11 -2.25 -0.03 0.00 1.34 0.00 0.00 72.50 71.45 3hqp s THR 492 CO -0.02 0.54 -0.19 -0.13 -0.54 0.00 0.00 174.62 174.27 3hqp s ARG 493 N -0.90 1.27 -0.36 3.99 0.52 -0.12 -4.98 118.95 118.37 3hqp s ARG 493 Ca 0.13 -0.93 -0.05 0.00 -0.52 0.00 0.00 55.73 54.36 3hqp s ARG 493 Cb -0.11 -1.39 0.07 0.00 0.52 0.00 0.00 34.95 34.05 3hqp s ARG 493 CO 0.02 0.35 0.13 0.42 0.02 0.00 0.00 175.30 176.24 3hqp s ILE 494 N -0.85 3.52 0.03 1.52 1.01 -1.26 -0.37 121.20 124.80 3hqp s ILE 494 Ca 0.06 -1.49 0.06 0.00 0.00 0.00 0.00 60.65 59.28 3hqp s ILE 494 Cb -0.09 -3.14 -0.03 0.00 0.01 0.00 0.00 42.46 39.21 3hqp s ILE 494 CO 0.02 -0.36 -0.17 -1.48 0.00 0.00 0.00 174.94 172.96 3hqp s LEU 495 N 1.30 2.66 -0.18 2.97 0.05 0.11 -4.91 118.68 120.68 3hqp s LEU 495 Ca 0.01 -0.38 -0.26 0.00 0.05 0.00 0.00 54.13 53.55 3hqp s LEU 495 Cb -0.21 -1.55 -0.01 0.00 -2.05 0.00 0.00 46.19 42.37 3hqp s LEU 495 CO -0.00 0.26 0.85 -0.22 -0.55 0.00 0.00 176.35 176.69 3hqp s LEU 496 N -1.38 4.16 0.25 1.48 2.96 -1.26 -1.30 118.68 123.58 3hqp s LEU 496 Ca 0.15 1.18 -0.25 0.00 -0.22 0.00 0.00 54.13 54.98 3hqp s LEU 496 Cb -0.11 -3.26 -0.09 0.00 0.50 0.00 0.00 46.19 43.24 3hqp s LEU 496 CO 0.05 -0.44 0.85 0.68 -1.32 0.00 0.00 176.35 176.18 3hqp s VAL 497 N 2.32 4.31 -2.64 1.68 -7.23 -0.44 -4.94 120.40 113.46 3hqp s VAL 497 Ca 0.38 1.71 0.27 0.00 -1.81 0.00 0.00 61.98 62.53 3hqp s VAL 497 Cb -0.16 -4.06 0.45 0.00 0.56 0.00 0.00 36.38 33.17 3hqp s VAL 497 CO 0.11 0.31 1.61 -0.62 -0.31 0.00 0.00 175.10 176.20