#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 1.04 -0.18 4.33 5.75 -2.05 -1.39 115.11 122.61 3hqp h GLN 2 Ca 0.00 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.42 3hqp h GLN 2 Cb 0.00 -0.23 -0.01 0.00 1.07 0.00 0.00 27.48 28.31 3hqp h GLN 2 CO 0.00 0.69 0.06 1.25 -2.65 0.00 0.00 178.83 178.17 3hqp h LEU 3 N 1.07 0.26 -1.14 -2.39 6.46 -2.06 -0.94 115.31 116.58 3hqp h LEU 3 Ca 0.35 -0.20 -0.01 0.00 -0.12 0.00 0.00 57.88 57.89 3hqp h LEU 3 Cb 0.03 -0.07 -0.03 0.00 -0.73 0.00 0.00 40.66 39.86 3hqp h LEU 3 CO -0.12 0.40 0.38 0.00 -0.62 0.00 0.00 178.44 178.48 3hqp h ALA 4 N 0.88 1.34 -0.67 1.25 0.00 -1.98 -2.68 119.26 117.39 3hqp h ALA 4 Ca 0.06 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 3hqp h ALA 4 Cb 0.23 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 3hqp h ALA 4 CO -0.00 0.54 0.20 1.25 0.00 0.00 0.00 179.25 181.24 3hqp h HIS 5 N 0.99 1.08 -0.60 0.00 -0.00 -0.95 -2.88 115.15 112.79 3hqp h HIS 5 Ca 0.25 -0.11 0.08 0.00 -0.00 0.00 0.00 60.37 60.58 3hqp h HIS 5 Cb 0.03 -0.31 -0.04 0.00 -0.00 0.00 0.00 27.41 27.09 3hqp h HIS 5 CO 0.01 0.87 0.40 -0.91 -0.00 0.00 0.00 177.93 178.30 3hqp h ASN 6 N 0.98 0.46 0.58 3.26 2.35 -0.83 -1.11 115.58 121.27 3hqp h ASN 6 Ca 0.21 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 3hqp h ASN 6 Cb 0.30 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.58 3hqp h ASN 6 CO -0.01 0.29 0.00 0.18 -1.65 0.00 0.00 177.43 176.25 3hqp n LEU 7 N -4.48 0.00 0.04 1.61 4.77 -1.09 -2.66 117.00 115.20 3hqp n LEU 7 Ca 0.09 0.48 0.07 0.00 -0.03 0.00 0.00 56.01 56.62 3hqp n LEU 7 Cb 0.29 -0.48 -0.07 0.00 -2.33 0.00 0.00 43.42 40.82 3hqp n LEU 7 CO 0.34 -0.19 -0.33 0.35 -1.33 0.00 0.00 177.39 176.23 3hqp n THR 8 N -1.48 0.65 -2.17 -5.08 -2.24 -0.42 -4.99 114.28 98.56 3hqp n THR 8 Ca 0.05 -0.59 -0.38 0.00 -2.27 0.00 0.00 64.05 60.86 3hqp n THR 8 Cb 0.20 -0.36 -0.00 0.00 -2.10 0.00 0.00 70.33 68.07 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 -5.26 4.02 0.04 3.22 1.43 -1.09 -5.07 118.68 115.98 3hqp s LEU 9 Ca -0.04 2.41 0.06 0.00 -1.03 0.00 0.00 54.13 55.53 3hqp s LEU 9 Cb 0.10 -4.20 -0.02 0.00 0.03 0.00 0.00 46.19 42.10 3hqp s LEU 9 CO 0.83 -1.00 -0.16 -0.55 0.23 0.00 0.00 176.35 175.70 3hqp s SER 10 N -1.23 1.90 0.14 2.29 0.15 -1.26 -5.03 113.70 110.65 3hqp s SER 10 Ca 0.64 -0.48 0.24 0.00 0.70 0.00 0.00 55.95 57.05 3hqp s SER 10 Cb -0.31 -0.13 0.93 0.00 -1.71 0.00 0.00 66.02 64.79 3hqp s SER 10 CO 0.38 0.06 1.75 2.30 1.20 0.00 0.00 173.24 178.94 3hqp n ILE 11 N 1.84 0.57 0.91 6.45 -5.35 -1.26 -2.92 119.36 119.60 3hqp n ILE 11 Ca -0.18 -0.01 0.11 0.00 -0.27 0.00 0.00 62.75 62.40 3hqp n ILE 11 Cb 0.54 -0.77 0.09 0.00 -1.74 0.00 0.00 39.64 37.76 3hqp n ILE 11 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 3hqp n PHE 12 N -1.95 0.00 -1.68 4.28 3.72 -1.26 -4.92 117.46 115.65 3hqp n PHE 12 Ca 0.05 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.02 3hqp n PHE 12 Cb 0.32 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.83 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 -1.83 5.69 0.54 4.37 1.01 -1.15 -4.92 116.67 120.39 3hqp s ASP 13 Ca 0.25 1.95 -0.21 0.00 0.71 0.00 0.00 52.55 55.26 3hqp s ASP 13 Cb 0.18 -2.52 -0.07 0.00 1.01 0.00 0.00 42.92 41.53 3hqp s ASP 13 CO 0.28 -1.76 1.01 -0.81 0.21 0.00 0.00 175.17 174.10 3hqp n PRO 14 N 8.48 1.13 -1.61 8.23 -0.04 -1.26 -4.97 135.00 144.96 3hqp n PRO 14 Ca 0.27 0.42 -0.29 0.00 -0.04 0.00 0.00 63.50 63.86 3hqp n PRO 14 Cb 0.45 -2.17 0.13 0.00 -0.04 0.00 0.00 33.50 31.87 3hqp n PRO 14 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3hqp s VAL 15 N -1.43 1.99 0.72 0.52 -7.23 -1.26 -5.02 120.40 108.69 3hqp s VAL 15 Ca 0.71 0.00 -0.11 0.00 -1.81 0.00 0.00 61.98 60.77 3hqp s VAL 15 Cb -0.46 -2.80 0.03 0.00 0.56 0.00 0.00 36.38 33.71 3hqp s VAL 15 CO 0.51 0.00 1.08 0.00 -0.31 0.00 0.00 175.10 176.38 3hqp s ALA 16 N -3.35 2.47 -2.00 1.32 0.00 -1.26 -4.94 121.76 114.00 3hqp s ALA 16 Ca 0.64 0.24 0.01 0.00 0.00 0.00 0.00 51.96 52.84 3hqp s ALA 16 Cb -0.14 -3.24 0.06 0.00 0.00 0.00 0.00 23.12 19.80 3hqp s ALA 16 CO 0.52 -1.45 0.96 0.27 0.00 0.00 0.00 175.76 176.06 3hqp n ASN 17 N -3.17 0.00 -3.68 0.00 2.04 -1.26 -4.78 115.26 104.42 3hqp n ASN 17 Ca 0.09 -1.82 -0.15 0.00 -0.44 0.00 0.00 54.58 52.26 3hqp n ASN 17 Cb 0.53 0.00 -0.08 0.00 -2.53 0.00 0.00 39.78 37.70 3hqp n ASN 17 CO 0.00 0.00 0.00 -0.72 -0.44 0.00 0.00 177.26 176.10 3hqp s TYR 18 N -2.00 -0.43 -0.26 -2.53 -0.85 -1.26 -5.05 117.35 104.97 3hqp s TYR 18 Ca 0.01 0.85 -0.10 0.00 -0.52 0.00 0.00 57.07 57.32 3hqp s TYR 18 Cb 0.01 0.21 -0.04 0.00 0.38 0.00 0.00 41.96 42.51 3hqp s TYR 18 CO 0.01 -0.40 0.14 0.50 -1.52 0.00 0.00 175.55 174.28 3hqp s ARG 19 N -0.75 3.89 -0.15 -3.49 3.52 -1.26 -5.01 118.95 115.70 3hqp s ARG 19 Ca -0.08 -0.36 -0.26 0.00 -0.13 0.00 0.00 55.73 54.90 3hqp s ARG 19 Cb -0.03 -3.51 -0.25 0.00 -1.56 0.00 0.00 34.95 29.60 3hqp s ARG 19 CO 0.05 -0.11 0.62 0.00 -0.81 0.00 0.00 175.30 175.05 3hqp h ALA 20 N 8.07 0.07 -2.67 6.12 0.00 -1.96 -3.44 119.26 125.46 3hqp h ALA 20 Ca -0.37 -0.72 -0.54 0.00 0.00 0.00 0.00 54.91 53.29 3hqp h ALA 20 Cb 1.18 0.22 0.18 0.00 0.00 0.00 0.00 17.79 19.37 3hqp h ALA 20 CO 0.59 0.24 0.32 0.00 0.00 0.00 0.00 179.25 180.39 3hqp n ALA 21 N -2.84 0.04 -2.35 0.00 0.00 -1.26 -1.26 120.51 112.84 3hqp n ALA 21 Ca -0.17 -0.29 -0.30 0.00 0.00 0.00 0.00 53.44 52.69 3hqp n ALA 21 Cb 0.57 -2.24 -0.15 0.00 0.00 0.00 0.00 19.45 17.63 3hqp n ALA 21 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3hqp s ARG 22 N -3.95 1.84 -0.16 0.00 1.81 -0.55 -4.89 118.95 113.06 3hqp s ARG 22 Ca 0.74 -1.04 -0.03 0.00 -1.72 0.00 0.00 55.73 53.68 3hqp s ARG 22 Cb -0.31 -1.95 -0.02 0.00 -0.45 0.00 0.00 34.95 32.22 3hqp s ARG 22 CO 0.50 0.51 -0.06 0.42 -0.68 0.00 0.00 175.30 175.99 3hqp s ILE 23 N -0.75 3.63 -0.14 1.52 1.01 -1.26 -1.32 121.20 123.89 3hqp s ILE 23 Ca 0.11 -0.45 -0.04 0.00 0.00 0.00 0.00 60.65 60.27 3hqp s ILE 23 Cb -0.10 -2.58 -0.03 0.00 0.01 0.00 0.00 42.46 39.75 3hqp s ILE 23 CO 0.01 0.49 0.01 -0.63 0.00 0.00 0.00 174.94 174.82 3hqp s ILE 24 N 0.53 4.32 -0.09 2.92 1.01 -0.26 -1.59 121.20 128.05 3hqp s ILE 24 Ca -0.04 -0.22 0.04 0.00 0.00 0.00 0.00 60.65 60.43 3hqp s ILE 24 Cb -0.15 -2.88 0.00 0.00 0.01 0.00 0.00 42.46 39.44 3hqp s ILE 24 CO 0.03 0.53 -0.22 0.00 0.00 0.00 0.00 174.94 175.28 3hqp s THR 26 N 0.31 4.85 -0.24 0.00 -4.23 -0.67 -0.56 115.64 115.09 3hqp s THR 26 Ca -0.16 1.32 -0.11 0.00 -1.18 0.00 0.00 61.69 61.56 3hqp s THR 26 Cb -0.17 -3.97 -0.05 0.00 1.34 0.00 0.00 72.50 69.66 3hqp s THR 26 CO 0.07 0.42 0.19 -0.63 -0.54 0.00 0.00 174.62 174.14 3hqp s ILE 27 N -0.27 5.33 0.00 2.99 -1.09 -0.36 -2.27 121.20 125.53 3hqp s ILE 27 Ca 0.32 0.23 0.00 0.00 -2.23 0.00 0.00 60.65 58.98 3hqp s ILE 27 Cb -0.19 -3.53 0.00 0.00 -1.58 0.00 0.00 42.46 37.16 3hqp s ILE 27 CO 0.19 0.31 0.00 0.61 -1.23 0.00 0.00 174.94 174.82 3hqp n GLY 28 N 4.41 4.34 0.52 6.18 0.00 -1.24 -4.75 105.19 114.65 3hqp n GLY 28 Ca -0.14 -1.27 0.35 0.00 0.00 0.00 0.00 46.02 44.96 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 0.10 0.00 1.61 0.11 -1.78 0.37 132.00 132.41 3hqp h PRO 29 Ca 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 3hqp h PRO 29 Cb 0.00 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.09 3hqp h PRO 29 CO 0.00 0.07 -0.10 0.77 -0.21 0.00 0.00 178.00 178.53 3hqp h SER 30 N 0.11 0.00 0.00 -2.05 0.02 -1.56 -3.39 113.55 106.68 3hqp h SER 30 Ca 0.67 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.61 3hqp h SER 30 Cb 2.37 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.91 3hqp h SER 30 CO -0.15 0.01 0.00 0.35 -1.14 0.00 0.00 176.83 175.90 3hqp n THR 31 N -2.71 0.08 0.07 -2.27 -2.24 0.12 -4.87 114.28 102.46 3hqp n THR 31 Ca 0.04 -0.23 -0.06 0.00 -2.27 0.00 0.00 64.05 61.53 3hqp n THR 31 Cb 0.49 1.44 0.11 0.00 -2.10 0.00 0.00 70.33 70.27 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 0.31 -7.05 -0.78 4.15 -1.36 -3.31 115.11 107.07 3hqp h GLN 32 Ca 0.00 -0.21 -0.55 0.00 0.77 0.00 0.00 58.65 58.66 3hqp h GLN 32 Cb 0.41 0.03 0.17 0.00 0.21 0.00 0.00 27.48 28.30 3hqp h GLN 32 CO 0.00 0.81 0.25 -1.13 -1.93 0.00 0.00 178.83 176.83 3hqp n SER 33 N -3.90 0.99 0.23 -0.69 3.41 -1.26 -4.81 113.62 107.59 3hqp n SER 33 Ca -0.03 0.69 0.10 0.00 -0.26 0.00 0.00 58.87 59.37 3hqp n SER 33 Cb 0.61 -1.47 0.54 0.00 -0.26 0.00 0.00 64.21 63.63 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 -0.22 0.66 -0.31 -3.33 3.04 -1.87 -1.83 116.25 112.37 3hqp h VAL 34 Ca -0.48 -0.97 -0.16 0.00 -1.01 0.00 0.00 66.70 64.07 3hqp h VAL 34 Cb 1.33 1.63 -0.00 0.00 -2.01 0.00 0.00 31.29 32.23 3hqp h VAL 34 CO 0.48 0.21 -0.44 -0.08 -1.01 0.00 0.00 177.57 176.74 3hqp h GLU 35 N 0.00 0.85 -0.62 4.17 4.57 -1.94 -2.12 114.58 119.49 3hqp h GLU 35 Ca -0.00 -0.50 -0.06 0.00 -1.18 0.00 0.00 59.36 57.62 3hqp h GLU 35 Cb 0.61 0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 29.21 3hqp h GLU 35 CO 0.03 1.14 0.17 0.00 -1.18 0.00 0.00 179.01 179.16 3hqp h ALA 36 N 0.71 0.82 -0.56 2.92 0.00 -1.73 -2.68 119.26 118.74 3hqp h ALA 36 Ca 0.03 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.61 3hqp h ALA 36 Cb 1.04 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 3hqp h ALA 36 CO 0.10 0.52 -0.07 -0.07 0.00 0.00 0.00 179.25 179.73 3hqp h LEU 37 N 0.91 1.03 -0.65 0.00 3.38 -1.33 -1.61 115.31 117.03 3hqp h LEU 37 Ca 0.20 -0.34 0.03 0.00 0.09 0.00 0.00 57.88 57.87 3hqp h LEU 37 Cb 0.33 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.76 3hqp h LEU 37 CO -0.00 1.12 0.40 0.11 0.09 0.00 0.00 178.44 180.15 3hqp h LYS 38 N 0.91 0.75 -0.48 1.13 1.57 -1.32 0.48 116.57 119.61 3hqp h LYS 38 Ca 0.15 -0.05 0.05 0.00 -1.87 0.00 0.00 60.65 58.93 3hqp h LYS 38 Cb 0.63 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.73 3hqp h LYS 38 CO 0.04 0.50 0.23 0.78 -0.57 0.00 0.00 179.45 180.43 3hqp h GLY 39 N 0.77 0.66 1.00 3.86 0.00 -1.13 -0.27 103.07 107.97 3hqp h GLY 39 Ca 0.27 -0.15 0.01 0.00 0.00 0.00 0.00 47.33 47.45 3hqp h GLY 39 CO -0.12 0.09 0.50 1.41 0.00 0.00 0.00 176.54 178.42 3hqp h LEU 40 N 0.45 0.86 -0.38 3.11 4.07 -0.76 0.69 115.31 123.35 3hqp h LEU 40 Ca 0.21 -0.02 -0.04 0.00 0.08 0.00 0.00 57.88 58.11 3hqp h LEU 40 Cb 0.14 -0.21 -0.02 0.00 1.08 0.00 0.00 40.66 41.65 3hqp h LEU 40 CO -0.16 0.62 0.07 0.40 -1.08 0.00 0.00 178.44 178.28 3hqp h ILE 41 N 1.02 1.24 -0.00 1.22 2.04 -0.52 -0.82 117.51 121.68 3hqp h ILE 41 Ca 0.28 -0.84 -0.07 0.00 1.00 0.00 0.00 64.86 65.23 3hqp h ILE 41 Cb -0.11 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.01 3hqp h ILE 41 CO -0.06 0.29 -0.32 1.56 0.00 0.00 0.00 178.15 179.62 3hqp h GLN 42 N 0.48 0.00 0.00 2.37 4.20 -0.87 -2.47 115.11 118.82 3hqp h GLN 42 Ca 0.12 -0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.79 3hqp h GLN 42 Cb 0.36 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.13 3hqp h GLN 42 CO 0.01 0.32 -0.19 0.77 -0.67 0.00 0.00 178.83 179.07 3hqp h SER 43 N 0.00 0.00 0.00 1.46 0.02 -0.47 -3.47 113.55 111.09 3hqp h SER 43 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3hqp h SER 43 Cb 0.56 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.10 3hqp h SER 43 CO 0.04 0.19 0.00 0.61 -1.14 0.00 0.00 176.83 176.53 3hqp n GLY 44 N 0.63 0.11 3.72 -3.77 0.00 -0.61 -3.95 105.19 101.32 3hqp n GLY 44 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 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 4.24 -0.08 1.61 0.00 -0.41 -4.40 119.30 120.25 3hqp s MET 45 Ca 0.00 2.31 0.11 0.00 0.00 0.00 0.00 55.69 58.10 3hqp s MET 45 Cb 0.00 -3.16 -0.15 0.00 0.00 0.00 0.00 34.83 31.52 3hqp s MET 45 CO 0.00 -0.54 0.12 0.43 0.00 0.00 0.00 175.02 175.02 3hqp n SER 46 N 3.61 2.28 -3.99 1.11 7.64 -0.62 -4.62 113.62 119.03 3hqp n SER 46 Ca 0.12 0.00 -0.20 0.00 1.01 0.00 0.00 58.87 59.80 3hqp n SER 46 Cb 0.39 1.04 -0.15 0.00 -1.01 0.00 0.00 64.21 64.48 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 -2.46 0.72 -0.25 0.44 1.01 -1.09 -2.23 120.40 116.54 3hqp s VAL 47 Ca -0.05 -0.33 -0.09 0.00 0.00 0.00 0.00 61.98 61.51 3hqp s VAL 47 Cb 0.05 -0.65 -0.04 0.00 0.00 0.00 0.00 36.38 35.74 3hqp s VAL 47 CO 0.47 0.23 0.12 0.00 0.00 0.00 0.00 175.10 175.91 3hqp s ALA 48 N 0.18 3.36 -0.18 5.51 0.00 0.05 -1.31 121.76 129.37 3hqp s ALA 48 Ca -0.03 -1.04 -0.08 0.00 0.00 0.00 0.00 51.96 50.81 3hqp s ALA 48 Cb -0.08 -2.22 -0.04 0.00 0.00 0.00 0.00 23.12 20.78 3hqp s ALA 48 CO 0.00 -0.39 0.08 0.50 0.00 0.00 0.00 175.76 175.95 3hqp s ARG 49 N 1.45 4.00 -0.28 0.00 3.52 0.27 -0.35 118.95 127.56 3hqp s ARG 49 Ca 0.06 -0.31 -0.07 0.00 -0.13 0.00 0.00 55.73 55.28 3hqp s ARG 49 Cb -0.15 -3.25 0.00 0.00 -1.56 0.00 0.00 34.95 29.99 3hqp s ARG 49 CO 0.06 0.30 0.07 -1.64 -0.81 0.00 0.00 175.30 173.28 3hqp s MET 50 N 0.31 3.20 -0.51 5.12 -1.94 0.52 -1.22 119.30 124.78 3hqp s MET 50 Ca 0.05 -0.78 -0.22 0.00 -1.71 0.00 0.00 55.69 53.03 3hqp s MET 50 Cb -0.12 -3.34 0.04 0.00 2.01 0.00 0.00 34.83 33.42 3hqp s MET 50 CO -0.00 -0.39 0.79 1.21 -0.01 0.00 0.00 175.02 176.62 3hqp s ASN 51 N 1.52 6.31 0.00 3.03 3.84 -1.26 0.01 114.94 128.39 3hqp s ASN 51 Ca 0.03 -0.52 0.10 0.00 0.21 0.00 0.00 52.86 52.68 3hqp s ASN 51 Cb -0.17 -2.37 0.54 0.00 -0.55 0.00 0.00 41.25 38.70 3hqp s ASN 51 CO 0.02 -1.03 1.35 0.49 -2.79 0.00 0.00 177.10 175.14 3hqp n PHE 52 N 6.82 0.02 0.19 0.43 3.01 0.50 -1.88 117.46 126.56 3hqp n PHE 52 Ca -0.01 -0.01 0.08 0.00 1.01 0.00 0.00 57.45 58.51 3hqp n PHE 52 Cb 0.47 0.00 0.23 0.00 -0.01 0.00 0.00 39.48 40.17 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 0.15 0.00 -4.08 4.37 0.02 -1.84 -3.43 113.55 108.74 3hqp h SER 53 Ca 0.00 0.00 -0.68 0.00 -0.84 0.00 0.00 61.79 60.27 3hqp h SER 53 Cb 0.03 0.00 -0.24 0.00 0.14 0.00 0.00 62.40 62.34 3hqp h SER 53 CO 0.00 0.27 -0.87 -1.00 -1.14 0.00 0.00 176.83 174.09 3hqp s HIS 54 N -3.28 2.28 0.00 3.45 3.76 -0.79 -5.04 115.29 115.67 3hqp s HIS 54 Ca 0.03 -0.39 0.00 0.00 -0.15 0.00 0.00 55.06 54.55 3hqp s HIS 54 Cb 0.08 -1.29 0.00 0.00 1.11 0.00 0.00 32.58 32.48 3hqp s HIS 54 CO 0.68 0.25 0.00 0.41 -0.85 0.00 0.00 174.74 175.23 3hqp n GLY 55 N 1.27 0.74 3.65 -2.22 0.00 -1.26 -4.82 105.19 102.56 3hqp n GLY 55 Ca -0.18 -1.25 -0.03 0.00 0.00 0.00 0.00 46.02 44.56 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 -0.19 0.20 1.61 1.04 -1.26 -4.97 113.70 106.13 3hqp s SER 56 Ca 0.00 -0.22 -0.10 0.00 0.48 0.00 0.00 55.95 56.11 3hqp s SER 56 Cb 0.00 0.36 0.23 0.00 0.10 0.00 0.00 66.02 66.70 3hqp s SER 56 CO 0.00 -0.64 1.77 0.45 0.98 0.00 0.00 173.24 175.81 3hqp h HIS 57 N 2.00 0.50 -0.25 5.02 -0.00 -1.98 -0.98 115.15 119.46 3hqp h HIS 57 Ca -0.24 0.03 0.05 0.00 -0.00 0.00 0.00 60.37 60.21 3hqp h HIS 57 Cb 1.22 -0.14 -0.05 0.00 -0.00 0.00 0.00 27.41 28.45 3hqp h HIS 57 CO 0.33 0.20 -0.05 1.49 -0.00 0.00 0.00 177.93 179.90 3hqp h GLU 58 N 0.51 0.01 0.18 2.45 4.81 -1.99 -0.41 114.58 120.14 3hqp h GLU 58 Ca 0.28 -0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.52 3hqp h GLU 58 Cb 0.25 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.60 3hqp h GLU 58 CO -0.23 0.01 -0.31 -0.92 -0.73 0.00 0.00 179.01 176.84 3hqp h TYR 59 N 0.01 -0.83 0.00 0.92 3.20 -1.76 -2.72 116.97 115.79 3hqp h TYR 59 Ca 0.12 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.00 3hqp h TYR 59 Cb 0.18 0.34 0.00 0.00 1.54 0.00 0.00 36.73 38.79 3hqp h TYR 59 CO -0.24 -0.42 0.00 0.45 -1.64 0.00 0.00 178.16 176.30 3hqp h HIS 60 N -0.56 0.00 -0.46 -3.82 3.86 -0.97 -2.19 115.15 111.00 3hqp h HIS 60 Ca 0.02 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.13 3hqp h HIS 60 Cb 0.57 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.02 3hqp h HIS 60 CO -0.25 0.00 -0.07 0.37 0.86 0.00 0.00 177.93 178.84 3hqp h GLN 61 N 0.00 0.85 -0.70 2.45 5.75 -0.76 -0.61 115.11 122.10 3hqp h GLN 61 Ca 0.00 -0.31 0.03 0.00 -0.15 0.00 0.00 58.65 58.22 3hqp h GLN 61 Cb 0.35 -0.06 -0.04 0.00 1.07 0.00 0.00 27.48 28.79 3hqp h GLN 61 CO 0.00 0.94 0.44 1.15 -2.65 0.00 0.00 178.83 178.71 3hqp h THR 62 N 0.69 1.09 0.06 2.39 2.02 -1.27 -0.06 112.91 117.84 3hqp h THR 62 Ca 0.12 -0.29 0.01 0.00 0.77 0.00 0.00 66.41 67.02 3hqp h THR 62 Cb 0.60 0.16 -0.02 0.00 -1.74 0.00 0.00 68.15 67.16 3hqp h THR 62 CO 0.04 0.16 -0.14 0.74 0.37 0.00 0.00 175.52 176.69 3hqp h THR 63 N 0.86 0.68 -0.32 3.16 2.02 -1.35 0.26 112.91 118.22 3hqp h THR 63 Ca 0.28 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.52 3hqp h THR 63 Cb 0.02 0.68 -0.06 0.00 -1.74 0.00 0.00 68.15 67.05 3hqp h THR 63 CO -0.11 0.00 -0.06 0.40 0.37 0.00 0.00 175.52 176.12 3hqp h ILE 64 N -0.26 0.70 -0.32 3.11 2.04 -0.69 0.17 117.51 122.25 3hqp h ILE 64 Ca 0.03 -0.01 -0.04 0.00 1.00 0.00 0.00 64.86 65.85 3hqp h ILE 64 Cb 0.29 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 37.03 3hqp h ILE 64 CO -0.09 0.00 0.07 0.78 0.00 0.00 0.00 178.15 178.91 3hqp h ASN 65 N 0.02 0.50 -0.46 1.72 2.35 -0.84 -2.34 115.58 116.53 3hqp h ASN 65 Ca 0.15 -0.25 -0.10 0.00 -0.55 0.00 0.00 56.30 55.56 3hqp h ASN 65 Cb 0.23 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.45 3hqp h ASN 65 CO -0.32 0.62 -0.09 0.78 -1.65 0.00 0.00 177.43 176.78 3hqp h ASN 66 N 0.37 0.92 -0.25 5.81 4.21 -0.14 -1.60 115.58 124.89 3hqp h ASN 66 Ca 0.10 -0.28 -0.00 0.00 1.21 0.00 0.00 56.30 57.32 3hqp h ASN 66 Cb 0.32 -0.25 -0.01 0.00 -1.12 0.00 0.00 38.32 37.26 3hqp h ASN 66 CO 0.00 1.03 0.15 0.58 -1.29 0.00 0.00 177.43 177.90 3hqp h VAL 67 N 0.84 1.11 -0.60 2.81 2.07 -0.67 -1.18 116.25 120.62 3hqp h VAL 67 Ca 0.14 -0.27 -0.07 0.00 0.82 0.00 0.00 66.70 67.32 3hqp h VAL 67 Cb 0.62 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 31.19 3hqp h VAL 67 CO 0.04 0.11 0.10 0.03 0.02 0.00 0.00 177.57 177.87 3hqp h ARG 68 N 0.31 0.96 -0.07 1.57 3.08 -1.25 -0.12 114.38 118.86 3hqp h ARG 68 Ca 0.09 -0.24 -0.02 0.00 0.07 0.00 0.00 59.98 59.89 3hqp h ARG 68 Cb 0.04 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 29.97 3hqp h ARG 68 CO -0.02 0.89 -0.01 0.37 -1.07 0.00 0.00 179.97 180.13 3hqp h GLN 69 N 0.91 0.14 -0.07 0.04 4.15 -1.27 -1.04 115.11 117.98 3hqp h GLN 69 Ca 0.19 -0.05 0.03 0.00 0.77 0.00 0.00 58.65 59.59 3hqp h GLN 69 Cb 0.39 -0.01 -0.04 0.00 0.21 0.00 0.00 27.48 28.03 3hqp h GLN 69 CO 0.01 0.46 -0.16 0.00 -1.93 0.00 0.00 178.83 177.20 3hqp h ALA 70 N 0.68 -0.13 -0.73 3.38 0.00 -1.06 0.10 119.26 121.50 3hqp h ALA 70 Ca 0.02 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 3hqp h ALA 70 Cb 0.40 0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 3hqp h ALA 70 CO 0.01 -0.63 0.35 0.00 0.00 0.00 0.00 179.25 178.98 3hqp h ALA 71 N 0.77 0.94 -0.23 0.00 0.00 -1.08 -2.09 119.26 117.57 3hqp h ALA 71 Ca 0.07 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 3hqp h ALA 71 Cb 0.33 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3hqp h ALA 71 CO -0.20 0.50 0.12 0.00 0.00 0.00 0.00 179.25 179.66 3hqp h ALA 72 N 1.17 0.30 -0.73 0.00 0.00 -0.90 0.19 119.26 119.28 3hqp h ALA 72 Ca 0.25 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 3hqp h ALA 72 Cb 0.12 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 3hqp h ALA 72 CO -0.03 -0.15 0.44 0.93 0.00 0.00 0.00 179.25 180.44 3hqp h GLU 73 N 0.25 0.99 -0.00 0.00 5.08 -0.73 -2.30 114.58 117.86 3hqp h GLU 73 Ca 0.08 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3hqp h GLU 73 Cb 0.10 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.14 3hqp h GLU 73 CO -0.01 0.69 -0.22 1.28 -1.00 0.00 0.00 179.01 179.74 3hqp n LEU 74 N -4.39 0.72 -2.62 1.33 4.77 -0.79 -4.96 117.00 111.05 3hqp n LEU 74 Ca 0.08 -0.10 -0.15 0.00 -0.03 0.00 0.00 56.01 55.81 3hqp n LEU 74 Cb 0.06 -0.18 0.06 0.00 -2.33 0.00 0.00 43.42 41.03 3hqp n LEU 74 CO 0.37 0.14 0.14 0.61 -1.33 0.00 0.00 177.39 177.32 3hqp n GLY 75 N 1.35 -0.08 3.37 -0.72 0.00 0.49 -5.04 105.19 104.55 3hqp n GLY 75 Ca 0.12 -0.05 -0.19 0.00 0.00 0.00 0.00 46.02 45.90 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 -3.23 0.70 -0.24 1.61 -7.23 -0.26 -5.03 120.40 106.73 3hqp s VAL 76 Ca 0.29 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.42 3hqp s VAL 76 Cb -0.13 -2.65 -0.00 0.00 0.56 0.00 0.00 36.38 34.17 3hqp s VAL 76 CO 0.50 0.00 -0.03 0.20 -0.31 0.00 0.00 175.10 175.46 3hqp s ASN 77 N -3.38 4.43 -0.14 4.85 0.01 -1.26 -4.37 114.94 115.08 3hqp s ASN 77 Ca 0.36 -0.51 0.02 0.00 -0.71 0.00 0.00 52.86 52.02 3hqp s ASN 77 Cb 0.07 -1.75 0.00 0.00 0.41 0.00 0.00 41.25 39.99 3hqp s ASN 77 CO 0.15 -0.06 -0.20 -0.63 -1.51 0.00 0.00 177.10 174.85 3hqp s ILE 78 N 1.46 2.30 0.41 0.60 -1.09 -1.26 -4.76 121.20 118.86 3hqp s ILE 78 Ca 0.04 -0.91 -0.24 0.00 -2.23 0.00 0.00 60.65 57.32 3hqp s ILE 78 Cb -0.15 -1.93 -0.08 0.00 -1.58 0.00 0.00 42.46 38.72 3hqp s ILE 78 CO -0.03 0.54 1.10 0.00 -1.23 0.00 0.00 174.94 175.32 3hqp s ALA 79 N 0.69 3.07 -0.19 9.38 0.00 -0.95 -4.90 121.76 128.86 3hqp s ALA 79 Ca -0.09 0.81 -0.03 0.00 0.00 0.00 0.00 51.96 52.65 3hqp s ALA 79 Cb -0.16 -3.32 -0.01 0.00 0.00 0.00 0.00 23.12 19.63 3hqp s ALA 79 CO 0.01 -0.38 -0.07 0.42 0.00 0.00 0.00 175.76 175.75 3hqp s ILE 80 N -1.58 3.28 -0.10 0.00 1.01 -1.26 -0.77 121.20 121.78 3hqp s ILE 80 Ca 0.59 -0.54 -0.01 0.00 0.00 0.00 0.00 60.65 60.70 3hqp s ILE 80 Cb -0.25 -2.46 -0.03 0.00 0.01 0.00 0.00 42.46 39.73 3hqp s ILE 80 CO 0.31 0.46 -0.06 0.00 0.00 0.00 0.00 174.94 175.65 3hqp s ALA 81 N 1.14 2.99 -0.30 9.38 0.00 0.53 -1.70 121.76 133.79 3hqp s ALA 81 Ca 0.01 -0.86 -0.08 0.00 0.00 0.00 0.00 51.96 51.03 3hqp s ALA 81 Cb -0.14 -1.34 0.01 0.00 0.00 0.00 0.00 23.12 21.65 3hqp s ALA 81 CO -0.01 0.46 0.10 -1.17 0.00 0.00 0.00 175.76 175.14 3hqp s LEU 82 N -0.43 3.96 -0.34 0.00 0.20 -0.72 -0.36 118.68 121.00 3hqp s LEU 82 Ca 0.06 -0.68 -0.16 0.00 0.69 0.00 0.00 54.13 54.05 3hqp s LEU 82 Cb -0.12 -1.92 -0.01 0.00 -0.43 0.00 0.00 46.19 43.71 3hqp s LEU 82 CO 0.02 -0.20 0.39 -0.62 -0.29 0.00 0.00 176.35 175.65 3hqp s ASP 83 N 1.53 6.21 0.72 3.68 -1.08 0.10 -0.32 116.67 127.51 3hqp s ASP 83 Ca 0.03 -0.16 -0.11 0.00 -0.52 0.00 0.00 52.55 51.79 3hqp s ASP 83 Cb -0.17 -2.21 0.02 0.00 -1.46 0.00 0.00 42.92 39.10 3hqp s ASP 83 CO 0.04 -0.36 1.09 0.42 0.52 0.00 0.00 175.17 176.88 3hqp s THR 84 N 2.10 3.49 0.01 1.71 -4.23 -0.72 -0.37 115.64 117.63 3hqp s THR 84 Ca 0.13 0.48 -0.26 0.00 -1.18 0.00 0.00 61.69 60.87 3hqp s THR 84 Cb -0.16 -3.43 -0.16 0.00 1.34 0.00 0.00 72.50 70.08 3hqp s THR 84 CO 0.12 -0.63 1.23 0.11 -0.54 0.00 0.00 174.62 174.90 3hqp h LYS 85 N -0.71 -0.52 0.00 3.99 1.57 -1.92 -3.38 116.57 115.60 3hqp h LYS 85 Ca -0.45 0.04 0.03 0.00 -1.87 0.00 0.00 60.65 58.39 3hqp h LYS 85 Cb 1.25 0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.67 3hqp h LYS 85 CO 0.63 -0.21 -0.03 0.41 -0.57 0.00 0.00 179.45 179.68 3hqp n GLY 86 N -0.43 -1.81 3.39 3.86 0.00 -1.26 -4.36 105.19 104.58 3hqp n GLY 86 Ca -0.10 -1.31 -0.35 0.00 0.00 0.00 0.00 46.02 44.26 3hqp n GLY 86 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3hqp n PRO 87 N -0.94 1.70 -4.35 1.61 -0.02 -1.26 -4.91 135.00 126.83 3hqp n PRO 87 Ca 0.00 -2.31 -0.19 0.00 -2.02 0.00 0.00 63.50 58.98 3hqp n PRO 87 Cb 0.04 -3.42 -0.10 0.00 -0.02 0.00 0.00 33.50 30.00 3hqp n PRO 87 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 3hqp s GLU 88 N 5.73 1.35 -0.09 -0.52 -1.05 -1.26 -4.99 118.70 117.87 3hqp s GLU 88 Ca 0.63 -1.60 0.03 0.00 -0.15 0.00 0.00 54.97 53.88 3hqp s GLU 88 Cb 0.05 -1.17 -0.01 0.00 -0.44 0.00 0.00 34.13 32.56 3hqp s GLU 88 CO 0.12 0.20 -0.19 0.42 0.95 0.00 0.00 175.26 176.76 3hqp s ILE 89 N -2.92 2.59 0.13 1.83 1.01 -1.26 -4.97 121.20 117.60 3hqp s ILE 89 Ca 0.23 -0.85 0.07 0.00 0.00 0.00 0.00 60.65 60.09 3hqp s ILE 89 Cb -0.01 -2.02 -0.04 0.00 0.01 0.00 0.00 42.46 40.40 3hqp s ILE 89 CO 0.07 0.56 -0.16 -0.13 0.00 0.00 0.00 174.94 175.28 3hqp s ARG 90 N 0.01 1.09 0.79 2.79 1.81 -1.26 -0.84 118.95 123.33 3hqp s ARG 90 Ca -0.06 -1.25 -0.11 0.00 -1.72 0.00 0.00 55.73 52.59 3hqp s ARG 90 Cb -0.15 -1.09 0.08 0.00 -0.45 0.00 0.00 34.95 33.34 3hqp s ARG 90 CO 0.05 0.22 1.15 0.95 -0.68 0.00 0.00 175.30 176.99 3hqp s THR 91 N -1.90 2.06 0.00 0.02 -4.23 -0.44 -0.75 115.64 110.40 3hqp s THR 91 Ca 0.10 -0.06 0.00 0.00 -1.18 0.00 0.00 61.69 60.55 3hqp s THR 91 Cb -0.06 -3.00 0.00 0.00 1.34 0.00 0.00 72.50 70.78 3hqp s THR 91 CO 0.04 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.73 3hqp n GLY 92 N -3.24 -0.97 3.95 3.99 0.00 0.96 -3.90 105.19 105.99 3hqp n GLY 92 Ca 0.08 -1.65 -0.23 0.00 0.00 0.00 0.00 46.02 44.22 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 -1.49 2.76 0.00 1.61 -0.21 0.20 -1.35 119.66 121.20 3hqp s GLN 93 Ca 0.00 -0.48 0.07 0.00 0.02 0.00 0.00 55.36 54.97 3hqp s GLN 93 Cb 0.00 -2.44 -0.02 0.00 1.00 0.00 0.00 33.01 31.55 3hqp s GLN 93 CO 0.00 -0.61 -0.22 -0.06 -2.12 0.00 0.00 175.29 172.29 3hqp s PHE 94 N -2.78 1.93 -0.04 0.91 0.08 -1.26 -2.19 117.98 114.64 3hqp s PHE 94 Ca 0.54 -0.37 -0.36 0.00 0.12 0.00 0.00 56.93 56.85 3hqp s PHE 94 Cb -0.10 -1.21 -0.14 0.00 -0.57 0.00 0.00 43.02 40.99 3hqp s PHE 94 CO 0.40 0.01 1.65 0.28 -0.10 0.00 0.00 175.22 177.47 3hqp n VAL 95 N 2.30 0.24 -0.22 -0.44 0.31 0.42 -0.84 118.33 120.11 3hqp n VAL 95 Ca -0.16 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.13 3hqp n VAL 95 Cb 0.53 -1.40 0.00 0.00 -0.91 0.00 0.00 33.84 32.06 3hqp n VAL 95 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3hqp n GLY 96 N 3.69 2.11 0.00 2.92 0.00 -1.26 -4.11 105.19 108.54 3hqp n GLY 96 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 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 -2.00 2.69 3.50 -0.02 0.00 -0.02 -5.03 105.19 104.31 3hqp n GLY 97 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 3hqp n GLY 97 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3hqp s ASP 98 N -1.32 -0.10 -0.04 1.61 3.84 -1.26 -2.53 116.67 116.87 3hqp s ASP 98 Ca 0.00 -0.79 0.02 0.00 -0.00 0.00 0.00 52.55 51.79 3hqp s ASP 98 Cb 0.00 0.54 0.01 0.00 -1.38 0.00 0.00 42.92 42.09 3hqp s ASP 98 CO 0.00 -1.05 -0.08 0.00 -0.00 0.00 0.00 175.17 174.04 3hqp s ALA 99 N -3.96 0.88 -0.60 2.11 0.00 0.17 -4.65 121.76 115.71 3hqp s ALA 99 Ca 0.17 -0.27 -0.20 0.00 0.00 0.00 0.00 51.96 51.65 3hqp s ALA 99 Cb 0.00 -0.39 0.08 0.00 0.00 0.00 0.00 23.12 22.82 3hqp s ALA 99 CO 0.03 0.10 0.79 0.08 0.00 0.00 0.00 175.76 176.76 3hqp s VAL 100 N 0.45 4.65 -0.11 0.00 1.01 -1.26 -1.58 120.40 123.56 3hqp s VAL 100 Ca -0.07 -0.67 -0.22 0.00 0.00 0.00 0.00 61.98 61.02 3hqp s VAL 100 Cb -0.11 -4.53 -0.04 0.00 0.00 0.00 0.00 36.38 31.70 3hqp s VAL 100 CO 0.01 -1.19 0.63 -0.04 0.00 0.00 0.00 175.10 174.51 3hqp s MET 101 N 3.18 4.37 -0.11 2.72 -1.94 -0.32 -4.90 119.30 122.30 3hqp s MET 101 Ca 0.16 0.72 0.02 0.00 -1.71 0.00 0.00 55.69 54.88 3hqp s MET 101 Cb -0.21 -3.47 -0.01 0.00 2.01 0.00 0.00 34.83 33.15 3hqp s MET 101 CO 0.09 0.02 -0.18 -2.00 -0.01 0.00 0.00 175.02 172.94 3hqp s GLU 102 N 0.99 3.13 0.02 2.03 2.12 -1.26 -1.08 118.70 124.66 3hqp s GLU 102 Ca 0.33 -0.77 -0.37 0.00 0.36 0.00 0.00 54.97 54.52 3hqp s GLU 102 Cb -0.17 -2.46 -0.16 0.00 0.26 0.00 0.00 34.13 31.61 3hqp s GLU 102 CO 0.14 0.25 1.49 -2.13 -0.54 0.00 0.00 175.26 174.47 3hqp n ARG 103 N 3.38 1.40 0.00 4.30 0.63 -1.26 -1.77 116.66 123.34 3hqp n ARG 103 Ca -0.18 0.51 0.00 0.00 -0.92 0.00 0.00 57.85 57.25 3hqp n ARG 103 Cb 0.53 -2.19 0.00 0.00 0.45 0.00 0.00 32.46 31.24 3hqp n ARG 103 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3hqp n GLY 104 N 3.12 2.34 3.78 5.14 0.00 0.24 -4.95 105.19 114.86 3hqp n GLY 104 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.36 2.58 -0.22 4.61 0.00 -0.73 -4.70 121.76 120.94 3hqp s ALA 105 Ca 0.00 0.47 -0.08 0.00 0.00 0.00 0.00 51.96 52.35 3hqp s ALA 105 Cb 0.00 -3.28 -0.04 0.00 0.00 0.00 0.00 23.12 19.80 3hqp s ALA 105 CO 0.00 -1.09 0.08 -0.08 0.00 0.00 0.00 175.76 174.67 3hqp s THR 106 N -2.40 4.67 0.29 0.00 -1.32 -1.26 -0.57 115.64 115.05 3hqp s THR 106 Ca 0.65 -0.06 0.06 0.00 -1.21 0.00 0.00 61.69 61.13 3hqp s THR 106 Cb -0.19 -3.15 -0.06 0.00 -1.51 0.00 0.00 72.50 67.60 3hqp s THR 106 CO 0.40 0.39 -0.04 0.00 -2.21 0.00 0.00 174.62 173.16 3hqp s TYR 108 N -3.03 2.72 -0.14 0.00 2.02 0.98 -0.54 117.35 119.36 3hqp s TYR 108 Ca 0.31 -1.23 -0.04 0.00 -0.37 0.00 0.00 57.07 55.73 3hqp s TYR 108 Cb 0.05 -1.85 -0.03 0.00 -0.40 0.00 0.00 41.96 39.72 3hqp s TYR 108 CO 0.13 -0.56 0.02 0.14 -1.57 0.00 0.00 175.55 173.70 3hqp s VAL 109 N 0.83 4.41 0.04 0.71 -7.23 -0.59 -1.27 120.40 117.30 3hqp s VAL 109 Ca -0.06 -0.19 0.03 0.00 -1.81 0.00 0.00 61.98 59.96 3hqp s VAL 109 Cb -0.15 -2.93 -0.02 0.00 0.56 0.00 0.00 36.38 33.84 3hqp s VAL 109 CO -0.01 0.53 -0.10 0.28 -0.31 0.00 0.00 175.10 175.48 3hqp s THR 110 N -0.11 0.77 -2.50 5.32 -1.32 -0.42 -0.78 115.64 116.60 3hqp s THR 110 Ca 0.05 -1.01 0.23 0.00 -1.21 0.00 0.00 61.69 59.75 3hqp s THR 110 Cb -0.12 -0.76 0.41 0.00 -1.51 0.00 0.00 72.50 70.52 3hqp s THR 110 CO 0.02 -0.20 1.48 0.35 -2.21 0.00 0.00 174.62 174.06 3hqp n THR 111 N 1.70 0.24 -2.22 5.08 -2.24 -0.88 -1.09 114.28 114.88 3hqp n THR 111 Ca -0.20 -0.49 -0.43 0.00 -2.27 0.00 0.00 64.05 60.67 3hqp n THR 111 Cb 0.55 0.77 -0.02 0.00 -2.10 0.00 0.00 70.33 69.53 3hqp n THR 111 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3hqp s ASP 112 N -1.68 6.64 0.00 3.42 3.68 -1.26 -4.89 116.67 122.57 3hqp s ASP 112 Ca 0.34 1.72 0.16 0.00 2.13 0.00 0.00 52.55 56.90 3hqp s ASP 112 Cb 0.20 -2.53 0.78 0.00 -1.45 0.00 0.00 42.92 39.91 3hqp s ASP 112 CO 0.30 -1.03 1.49 -2.65 0.13 0.00 0.00 175.17 173.42 3hqp n PRO 113 N 7.21 0.15 0.25 4.34 -0.02 -1.26 -2.31 135.00 143.36 3hqp n PRO 113 Ca 0.17 0.17 0.12 0.00 -2.02 0.00 0.00 63.50 61.93 3hqp n PRO 113 Cb 0.45 -1.50 0.66 0.00 -0.02 0.00 0.00 33.50 33.09 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 2.70 1.26 -0.30 3.55 0.00 -1.99 -2.77 119.26 121.70 3hqp h ALA 114 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3hqp h ALA 114 Cb 0.20 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3hqp h ALA 114 CO 0.00 0.19 0.00 1.19 0.00 0.00 0.00 179.25 180.63 3hqp n PHE 115 N -3.64 0.39 -0.11 0.00 3.01 -0.98 -4.48 117.46 111.65 3hqp n PHE 115 Ca -0.02 -0.20 0.00 0.00 1.01 0.00 0.00 57.45 58.25 3hqp n PHE 115 Cb 0.28 0.00 0.27 0.00 -0.01 0.00 0.00 39.48 40.02 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 4.21 1.42 -0.28 4.37 0.00 -1.67 -2.94 119.26 124.37 3hqp h ALA 116 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3hqp h ALA 116 Cb 0.71 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.27 3hqp h ALA 116 CO 0.00 0.46 0.00 -0.40 0.00 0.00 0.00 179.25 179.31 3hqp n ASP 117 N -4.36 2.74 -0.98 0.00 5.75 -1.26 0.63 116.55 119.07 3hqp n ASP 117 Ca 0.05 -1.96 0.03 0.00 -0.01 0.00 0.00 54.79 52.90 3hqp n ASP 117 Cb 0.13 -0.19 0.04 0.00 -1.03 0.00 0.00 41.12 40.07 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 0.40 0.25 -2.09 0.11 5.02 -1.13 -4.63 118.16 116.09 3hqp n LYS 118 Ca 0.10 -1.84 -0.38 0.00 -2.02 0.00 0.00 58.31 54.17 3hqp n LYS 118 Cb 0.39 -0.44 0.01 0.00 -0.02 0.00 0.00 35.03 34.97 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 -1.86 2.84 0.24 0.72 0.00 -0.93 -4.69 107.32 103.64 3hqp s GLY 119 Ca 0.23 1.10 0.03 0.00 0.00 0.00 0.00 44.72 46.08 3hqp s GLY 119 CO -0.09 1.60 0.10 -1.30 0.00 0.00 0.00 173.10 173.41 3hqp n THR 120 N -0.50 0.00 0.25 0.90 -2.24 -0.07 -0.44 114.28 112.19 3hqp n THR 120 Ca 0.07 -1.45 0.12 0.00 -2.27 0.00 0.00 64.05 60.52 3hqp n THR 120 Cb 0.46 0.55 0.68 0.00 -2.10 0.00 0.00 70.33 69.93 3hqp n THR 120 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 3hqp h LYS 121 N 0.00 0.00 0.18 -0.78 2.10 -1.91 -3.19 116.57 112.98 3hqp h LYS 121 Ca -0.19 0.00 -0.32 0.00 -2.00 0.00 0.00 60.65 58.14 3hqp h LYS 121 Cb 0.74 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 32.08 3hqp h LYS 121 CO 0.29 0.14 -1.50 -0.44 -2.00 0.00 0.00 179.45 175.94 3hqp h ASP 122 N 0.00 0.60 -2.52 7.07 3.32 -1.93 -3.44 116.42 119.52 3hqp h ASP 122 Ca -0.00 -0.73 -0.03 0.00 0.02 0.00 0.00 57.03 56.29 3hqp h ASP 122 Cb 0.39 -0.20 -0.24 0.00 0.22 0.00 0.00 39.33 39.51 3hqp h ASP 122 CO 0.02 1.59 -0.23 -0.75 -1.72 0.00 0.00 179.24 178.15 3hqp s LYS 123 N -2.61 0.47 0.15 3.56 2.20 -1.20 -0.01 119.74 122.29 3hqp s LYS 123 Ca -0.09 1.16 -0.06 0.00 -0.36 0.00 0.00 55.97 56.62 3hqp s LYS 123 Cb 0.06 0.43 -0.02 0.00 -1.51 0.00 0.00 37.83 36.78 3hqp s LYS 123 CO 0.89 -0.21 0.19 -0.59 -0.36 0.00 0.00 175.35 175.27 3hqp s PHE 124 N 2.39 0.56 0.04 4.03 -0.71 -0.39 -0.89 117.98 123.01 3hqp s PHE 124 Ca -0.05 -0.94 -0.18 0.00 -1.04 0.00 0.00 56.93 54.72 3hqp s PHE 124 Cb -0.11 -0.22 -0.06 0.00 -1.21 0.00 0.00 43.02 41.42 3hqp s PHE 124 CO -0.16 -0.63 0.51 -0.47 -1.34 0.00 0.00 175.22 173.13 3hqp s TYR 125 N -3.99 3.77 -0.11 3.49 5.04 -1.26 -1.31 117.35 122.98 3hqp s TYR 125 Ca 0.19 1.16 0.02 0.00 -2.44 0.00 0.00 57.07 55.99 3hqp s TYR 125 Cb 0.05 -2.42 0.01 0.00 0.35 0.00 0.00 41.96 39.95 3hqp s TYR 125 CO -0.00 0.59 -0.16 0.42 -1.34 0.00 0.00 175.55 175.07 3hqp s ILE 126 N -1.02 1.52 -1.98 3.14 1.01 -0.25 -0.02 121.20 123.60 3hqp s ILE 126 Ca 0.27 -0.66 0.00 0.00 0.00 0.00 0.00 60.65 60.26 3hqp s ILE 126 Cb -0.18 -1.39 0.00 0.00 0.01 0.00 0.00 42.46 40.90 3hqp s ILE 126 CO 0.17 0.45 0.90 -0.90 0.00 0.00 0.00 174.94 175.55 3hqp n ASP 127 N 4.19 0.02 -4.35 3.58 5.75 0.07 -4.32 116.55 121.49 3hqp n ASP 127 Ca -0.19 -1.81 -0.45 0.00 -0.01 0.00 0.00 54.79 52.32 3hqp n ASP 127 Cb 0.51 -0.01 -0.05 0.00 -1.03 0.00 0.00 41.12 40.54 3hqp n ASP 127 CO 0.00 0.00 0.00 -0.47 -0.11 0.00 0.00 177.20 176.62 3hqp s TYR 128 N -1.98 3.15 0.60 2.11 5.04 -1.26 -4.92 117.35 120.10 3hqp s TYR 128 Ca 0.00 -1.08 0.31 0.00 -2.44 0.00 0.00 57.07 53.86 3hqp s TYR 128 Cb 0.00 -3.77 1.82 0.00 0.35 0.00 0.00 41.96 40.36 3hqp s TYR 128 CO 0.00 -1.08 2.20 1.96 -1.34 0.00 0.00 175.55 177.28 3hqp h GLN 129 N 8.98 0.00 -0.56 4.97 1.08 -1.90 -1.76 115.11 125.92 3hqp h GLN 129 Ca -0.29 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.91 3hqp h GLN 129 Cb 1.10 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.53 3hqp h GLN 129 CO 1.03 0.00 0.00 0.09 -0.95 0.00 0.00 178.83 179.00 3hqp n ASN 130 N -3.71 3.06 -0.35 1.46 4.13 -1.26 -4.57 115.26 114.02 3hqp n ASN 130 Ca -0.01 -2.17 0.09 0.00 1.68 0.00 0.00 54.58 54.17 3hqp n ASN 130 Cb 0.19 -0.41 0.28 0.00 -1.54 0.00 0.00 39.78 38.29 3hqp n ASN 130 CO 0.00 0.00 0.00 0.25 0.28 0.00 0.00 177.26 177.79 3hqp h LEU 131 N 2.83 0.86 -1.18 3.41 5.85 -1.71 -1.60 115.31 123.76 3hqp h LEU 131 Ca 0.00 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.78 3hqp h LEU 131 Cb 0.89 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.80 3hqp h LEU 131 CO 0.09 0.43 0.00 0.28 -0.34 0.00 0.00 178.44 178.90 3hqp h SER 132 N 0.91 0.00 0.44 1.25 0.02 -1.85 -2.64 113.55 111.67 3hqp h SER 132 Ca 0.51 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 61.33 3hqp h SER 132 Cb 0.61 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.12 3hqp h SER 132 CO -0.28 0.00 -1.67 0.29 -1.14 0.00 0.00 176.83 174.03 3hqp n LYS 133 N -2.68 0.64 0.08 3.45 5.02 -0.62 -4.42 118.16 119.63 3hqp n LYS 133 Ca 0.01 0.05 -0.21 0.00 -2.02 0.00 0.00 58.31 56.14 3hqp n LYS 133 Cb 0.25 -1.68 -0.15 0.00 -0.02 0.00 0.00 35.03 33.43 3hqp n LYS 133 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3hqp h VAL 134 N 0.00 1.08 -3.25 -0.18 2.07 -1.26 -3.46 116.25 111.24 3hqp h VAL 134 Ca -0.15 -2.66 -0.66 0.00 0.82 0.00 0.00 66.70 64.05 3hqp h VAL 134 Cb 1.43 2.81 -0.12 0.00 -1.52 0.00 0.00 31.29 33.88 3hqp h VAL 134 CO 0.02 0.84 -0.61 0.68 0.02 0.00 0.00 177.57 178.51 3hqp s VAL 135 N -2.60 4.40 0.28 2.57 -7.23 -1.04 -5.07 120.40 111.71 3hqp s VAL 135 Ca -0.12 -0.48 0.09 0.00 -1.81 0.00 0.00 61.98 59.66 3hqp s VAL 135 Cb 0.06 -2.97 -0.04 0.00 0.56 0.00 0.00 36.38 33.99 3hqp s VAL 135 CO 0.87 0.40 0.01 -0.13 -0.31 0.00 0.00 175.10 175.94 3hqp s ARG 136 N -1.54 2.29 0.02 4.82 0.52 -1.26 -4.85 118.95 118.96 3hqp s ARG 136 Ca 0.20 -1.46 -0.36 0.00 -0.52 0.00 0.00 55.73 53.60 3hqp s ARG 136 Cb -0.12 -2.15 -0.14 0.00 0.52 0.00 0.00 34.95 33.06 3hqp s ARG 136 CO 0.10 0.32 1.60 -2.30 0.02 0.00 0.00 175.30 175.05 3hqp n PRO 137 N -0.93 1.72 0.00 3.54 -0.02 -1.26 -1.36 135.00 136.69 3hqp n PRO 137 Ca -0.06 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 3hqp n PRO 137 Cb 0.59 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 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 3.50 1.77 3.74 -1.23 0.00 0.76 -4.99 105.19 108.73 3hqp n GLY 138 Ca 0.20 -0.15 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.11 4.47 -0.05 1.61 0.02 -0.46 -4.61 114.94 115.81 3hqp s ASN 139 Ca 0.00 2.25 -0.04 0.00 -1.02 0.00 0.00 52.86 54.05 3hqp s ASN 139 Cb 0.00 -2.58 -0.04 0.00 0.02 0.00 0.00 41.25 38.65 3hqp s ASN 139 CO 0.00 -2.07 0.15 -0.31 0.02 0.00 0.00 177.10 174.89 3hqp s TYR 140 N -2.09 3.53 -0.18 2.20 2.02 -1.26 0.07 117.35 121.63 3hqp s TYR 140 Ca 0.72 0.40 -0.02 0.00 -0.37 0.00 0.00 57.07 57.80 3hqp s TYR 140 Cb -0.26 -1.86 -0.01 0.00 -0.40 0.00 0.00 41.96 39.43 3hqp s TYR 140 CO 0.44 0.67 -0.08 0.42 -1.57 0.00 0.00 175.55 175.43 3hqp s ILE 141 N -1.19 3.24 -0.20 2.71 1.01 0.14 -4.93 121.20 121.98 3hqp s ILE 141 Ca 0.22 -0.56 -0.14 0.00 0.00 0.00 0.00 60.65 60.17 3hqp s ILE 141 Cb -0.12 -2.43 -0.04 0.00 0.01 0.00 0.00 42.46 39.87 3hqp s ILE 141 CO 0.12 0.47 0.30 -0.31 0.00 0.00 0.00 174.94 175.52 3hqp s TYR 142 N 1.03 3.39 -0.05 3.97 1.51 -1.04 -0.95 117.35 125.20 3hqp s TYR 142 Ca -0.00 0.51 0.05 0.00 -1.01 0.00 0.00 57.07 56.62 3hqp s TYR 142 Cb -0.15 -2.40 -0.01 0.00 -0.11 0.00 0.00 41.96 39.30 3hqp s TYR 142 CO -0.01 0.10 -0.21 0.42 -1.11 0.00 0.00 175.55 174.74 3hqp s ILE 143 N 0.95 1.71 -0.65 2.71 -1.09 0.15 -1.47 121.20 123.52 3hqp s ILE 143 Ca 0.15 -0.88 -0.03 0.00 -2.23 0.00 0.00 60.65 57.66 3hqp s ILE 143 Cb -0.14 -1.45 -0.04 0.00 -1.58 0.00 0.00 42.46 39.25 3hqp s ILE 143 CO 0.05 0.48 0.58 -0.67 -1.23 0.00 0.00 174.94 174.15 3hqp n ASP 144 N 3.01 -5.15 -3.74 3.58 2.03 -0.08 -1.13 116.55 115.06 3hqp n ASP 144 Ca -0.18 -0.40 -0.26 0.00 0.52 0.00 0.00 54.79 54.47 3hqp n ASP 144 Cb 0.52 -3.61 0.05 0.00 -0.72 0.00 0.00 41.12 37.37 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 -2.44 -5.32 0.00 1.67 8.00 -1.26 -2.29 116.55 114.91 3hqp n ASP 145 Ca -0.04 -0.66 0.00 0.00 0.71 0.00 0.00 54.79 54.80 3hqp n ASP 145 Cb 0.57 -4.48 0.00 0.00 -0.02 0.00 0.00 41.12 37.18 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 -1.82 0.66 0.17 0.44 0.00 -1.21 -4.72 105.19 98.71 3hqp n GLY 146 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 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 0.96 -3.30 -0.61 2.04 -1.17 -3.42 117.51 112.01 3hqp h ILE 147 Ca 0.00 -0.13 -0.63 0.00 1.00 0.00 0.00 64.86 65.10 3hqp h ILE 147 Cb 0.00 0.54 -0.20 0.00 -0.74 0.00 0.00 36.82 36.42 3hqp h ILE 147 CO 0.00 0.07 -0.64 -0.22 0.00 0.00 0.00 178.15 177.36 3hqp s LEU 148 N -10.27 3.38 -0.14 1.44 2.96 -0.29 -4.99 118.68 110.78 3hqp s LEU 148 Ca -0.13 -0.07 0.00 0.00 -0.22 0.00 0.00 54.13 53.71 3hqp s LEU 148 Cb 0.12 -1.82 -0.01 0.00 0.50 0.00 0.00 46.19 44.98 3hqp s LEU 148 CO 0.72 0.18 -0.14 -0.63 -1.32 0.00 0.00 176.35 175.16 3hqp s ILE 149 N 0.31 2.89 -0.13 6.68 1.01 -1.26 0.34 121.20 131.04 3hqp s ILE 149 Ca -0.02 -0.71 -0.05 0.00 0.00 0.00 0.00 60.65 59.87 3hqp s ILE 149 Cb -0.14 -2.21 -0.04 0.00 0.01 0.00 0.00 42.46 40.08 3hqp s ILE 149 CO 0.02 0.52 0.05 -0.76 0.00 0.00 0.00 174.94 174.77 3hqp s LEU 150 N 0.56 3.84 -0.23 2.97 1.43 -0.13 -2.13 118.68 124.99 3hqp s LEU 150 Ca -0.09 0.20 -0.09 0.00 -1.03 0.00 0.00 54.13 53.12 3hqp s LEU 150 Cb -0.16 -1.92 -0.04 0.00 0.03 0.00 0.00 46.19 44.10 3hqp s LEU 150 CO 0.04 0.32 0.11 -1.58 0.23 0.00 0.00 176.35 175.46 3hqp s GLN 151 N -0.51 3.91 0.05 1.70 0.74 -0.45 0.23 119.66 125.33 3hqp s GLN 151 Ca 0.10 -0.36 -0.31 0.00 0.05 0.00 0.00 55.36 54.85 3hqp s GLN 151 Cb -0.12 -3.38 -0.07 0.00 1.10 0.00 0.00 33.01 30.54 3hqp s GLN 151 CO 0.02 0.04 1.49 0.08 -0.55 0.00 0.00 175.29 176.37 3hqp s VAL 152 N 1.06 3.37 -0.27 1.34 1.01 0.11 -0.92 120.40 126.09 3hqp s VAL 152 Ca 0.05 0.84 -0.07 0.00 0.00 0.00 0.00 61.98 62.81 3hqp s VAL 152 Cb -0.14 -3.54 -0.14 0.00 0.00 0.00 0.00 36.38 32.56 3hqp s VAL 152 CO 0.04 0.01 -0.30 1.67 0.00 0.00 0.00 175.10 176.52 3hqp n GLN 153 N 5.11 0.61 -3.83 2.72 -0.06 0.73 -0.17 117.38 122.51 3hqp n GLN 153 Ca 0.14 0.21 -0.06 0.00 -2.00 0.00 0.00 57.00 55.28 3hqp n GLN 153 Cb 0.42 -1.50 0.01 0.00 -4.06 0.00 0.00 30.24 25.11 3hqp n GLN 153 CO 0.00 0.00 0.00 -1.54 -0.20 0.00 0.00 177.06 175.32 3hqp s SER 154 N -7.05 -0.09 -0.23 1.69 1.04 -1.07 -4.74 113.70 103.27 3hqp s SER 154 Ca -0.37 -0.79 -0.13 0.00 0.48 0.00 0.00 55.95 55.14 3hqp s SER 154 Cb 0.12 0.69 -0.04 0.00 0.10 0.00 0.00 66.02 66.88 3hqp s SER 154 CO 0.54 -1.33 0.27 -1.00 0.98 0.00 0.00 173.24 172.71 3hqp s HIS 155 N -2.81 3.33 -0.13 5.02 3.76 -1.26 -1.26 115.29 121.94 3hqp s HIS 155 Ca 0.15 0.40 -0.20 0.00 -0.15 0.00 0.00 55.06 55.26 3hqp s HIS 155 Cb -0.04 -2.40 -0.18 0.00 1.11 0.00 0.00 32.58 31.07 3hqp s HIS 155 CO 0.07 0.01 0.52 0.93 -0.85 0.00 0.00 174.74 175.42 3hqp h GLU 156 N 7.53 0.00 0.00 1.40 4.39 -0.90 -3.47 114.58 123.53 3hqp h GLU 156 Ca -0.37 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.33 3hqp h GLU 156 Cb 1.17 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.82 3hqp h GLU 156 CO 0.68 0.69 0.00 -0.40 -1.16 0.00 0.00 179.01 178.82 3hqp n ASP 157 N -4.66 0.00 0.00 1.42 5.68 -1.17 -4.97 116.55 112.86 3hqp n ASP 157 Ca -0.08 -0.89 0.00 0.00 -0.50 0.00 0.00 54.79 53.33 3hqp n ASP 157 Cb 0.34 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.34 3hqp n ASP 157 CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.20 177.08 3hqp n GLU 158 N 0.00 0.00 0.00 0.11 2.13 -1.26 -2.70 120.64 118.93 3hqp n GLU 158 Ca 0.00 0.40 0.00 0.00 0.66 0.00 0.00 57.16 58.22 3hqp n GLU 158 Cb 0.00 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.21 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 -1.41 3.64 -4.69 5.31 6.02 -1.26 -4.88 117.38 120.11 3hqp n GLN 159 Ca 0.00 0.00 -0.25 0.00 -0.01 0.00 0.00 57.00 56.74 3hqp n GLN 159 Cb 0.01 -0.36 -0.16 0.00 1.02 0.00 0.00 30.24 30.75 3hqp n GLN 159 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 3hqp s THR 160 N -0.64 1.24 -0.15 5.09 2.01 -1.10 -2.06 115.64 120.03 3hqp s THR 160 Ca 0.00 -0.58 -0.02 0.00 0.31 0.00 0.00 61.69 61.40 3hqp s THR 160 Cb 0.00 -1.10 -0.02 0.00 0.01 0.00 0.00 72.50 71.39 3hqp s THR 160 CO 0.00 0.37 -0.08 -0.76 -0.69 0.00 0.00 174.62 173.46 3hqp s LEU 161 N 0.31 2.96 0.03 4.42 1.43 0.04 -0.17 118.68 127.70 3hqp s LEU 161 Ca -0.08 -0.25 -0.30 0.00 -1.03 0.00 0.00 54.13 52.47 3hqp s LEU 161 Cb -0.13 -1.69 -0.04 0.00 0.03 0.00 0.00 46.19 44.36 3hqp s LEU 161 CO 0.03 0.15 1.00 -0.70 0.23 0.00 0.00 176.35 177.06 3hqp s GLU 162 N 0.44 4.58 0.12 1.70 2.12 -0.39 -1.55 118.70 125.73 3hqp s GLU 162 Ca -0.07 1.46 0.02 0.00 0.36 0.00 0.00 54.97 56.75 3hqp s GLU 162 Cb -0.15 -3.43 -0.04 0.00 0.26 0.00 0.00 34.13 30.77 3hqp s GLU 162 CO 0.04 -0.01 -0.07 0.00 -0.54 0.00 0.00 175.26 174.69 3hqp s THR 164 N -3.55 4.40 -0.44 0.00 2.01 -0.10 -1.57 115.64 116.39 3hqp s THR 164 Ca 0.14 -0.20 -0.26 0.00 0.31 0.00 0.00 61.69 61.68 3hqp s THR 164 Cb 0.05 -2.89 0.02 0.00 0.01 0.00 0.00 72.50 69.70 3hqp s THR 164 CO -0.03 0.57 0.97 -0.69 -0.69 0.00 0.00 174.62 174.76 3hqp s VAL 165 N -0.52 4.45 -0.37 3.82 1.01 0.26 -1.35 120.40 127.70 3hqp s VAL 165 Ca 0.09 0.99 0.22 0.00 0.00 0.00 0.00 61.98 63.28 3hqp s VAL 165 Cb -0.12 -4.44 0.26 0.00 0.00 0.00 0.00 36.38 32.08 3hqp s VAL 165 CO 0.02 -0.78 1.53 0.71 0.00 0.00 0.00 175.10 176.58 3hqp h THR 166 N 6.03 0.15 -2.82 3.92 1.35 -1.76 0.68 112.91 120.47 3hqp h THR 166 Ca -0.23 -1.22 -0.08 0.00 -0.55 0.00 0.00 66.41 64.33 3hqp h THR 166 Cb 1.07 2.03 -0.18 0.00 -1.73 0.00 0.00 68.15 69.35 3hqp h THR 166 CO 1.04 0.09 -0.08 0.54 -0.25 0.00 0.00 175.52 176.86 3hqp s ASN 167 N -6.18 -0.35 -0.08 5.36 2.20 -1.26 -4.71 114.94 109.92 3hqp s ASN 167 Ca 0.06 0.17 -0.29 0.00 -0.94 0.00 0.00 52.86 51.86 3hqp s ASN 167 Cb 0.06 0.43 -0.02 0.00 -2.00 0.00 0.00 41.25 39.72 3hqp s ASN 167 CO 0.69 -0.61 0.96 -0.44 -2.94 0.00 0.00 177.10 174.76 3hqp s SER 168 N -1.69 7.22 -0.18 3.54 0.01 -1.26 -4.21 113.70 117.13 3hqp s SER 168 Ca -0.08 1.50 -0.27 0.00 1.31 0.00 0.00 55.95 58.41 3hqp s SER 168 Cb -0.02 -2.54 0.07 0.00 0.21 0.00 0.00 66.02 63.74 3hqp s SER 168 CO 0.01 -0.37 0.69 -2.28 0.41 0.00 0.00 173.24 171.70 3hqp s HIS 169 N 1.70 -0.72 -0.22 2.43 5.04 -0.24 -4.94 115.29 118.35 3hqp s HIS 169 Ca 0.47 1.57 -0.12 0.00 -1.54 0.00 0.00 55.06 55.45 3hqp s HIS 169 Cb -0.19 0.32 -0.05 0.00 0.04 0.00 0.00 32.58 32.70 3hqp s HIS 169 CO 0.20 -0.46 0.20 0.99 -2.34 0.00 0.00 174.74 173.33 3hqp s THR 170 N -0.26 5.34 -0.07 0.89 2.01 -1.26 -1.17 115.64 121.12 3hqp s THR 170 Ca -0.04 0.30 0.04 0.00 0.31 0.00 0.00 61.69 62.30 3hqp s THR 170 Cb -0.03 -3.54 -0.01 0.00 0.01 0.00 0.00 72.50 68.92 3hqp s THR 170 CO 0.05 0.35 -0.20 0.27 -0.69 0.00 0.00 174.62 174.40 3hqp s ILE 171 N 0.91 2.51 0.67 1.82 -4.36 -0.61 -4.96 121.20 117.18 3hqp s ILE 171 Ca 0.10 -0.90 -0.01 0.00 -0.26 0.00 0.00 60.65 59.58 3hqp s ILE 171 Cb -0.13 -1.96 0.09 0.00 1.25 0.00 0.00 42.46 41.71 3hqp s ILE 171 CO 0.04 0.56 0.94 -0.44 0.24 0.00 0.00 174.94 176.28 3hqp s SER 172 N -0.16 4.65 0.22 4.36 0.01 -1.26 -0.65 113.70 120.86 3hqp s SER 172 Ca -0.02 -0.14 -0.31 0.00 1.31 0.00 0.00 55.95 56.79 3hqp s SER 172 Cb -0.14 -0.42 -0.15 0.00 0.21 0.00 0.00 66.02 65.52 3hqp s SER 172 CO 0.04 -1.63 1.12 0.47 0.41 0.00 0.00 173.24 173.65 3hqp n ASP 173 N -2.72 1.42 -3.41 2.44 8.00 -1.05 -3.90 116.55 117.33 3hqp n ASP 173 Ca 0.12 1.15 -0.14 0.00 0.71 0.00 0.00 54.79 56.64 3hqp n ASP 173 Cb 0.60 -1.26 0.00 0.00 -0.02 0.00 0.00 41.12 40.45 3hqp n ASP 173 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 3hqp n ARG 174 N 1.42 -1.51 -2.66 -1.24 1.85 -0.46 -4.98 116.66 109.08 3hqp n ARG 174 Ca 0.13 1.19 -0.36 0.00 -1.00 0.00 0.00 57.85 57.81 3hqp n ARG 174 Cb 0.28 -3.97 -0.05 0.00 -1.05 0.00 0.00 32.46 27.67 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 -3.84 4.27 0.23 2.89 1.81 -1.25 -4.69 118.95 118.37 3hqp s ARG 175 Ca 0.03 1.39 -0.30 0.00 -1.72 0.00 0.00 55.73 55.13 3hqp s ARG 175 Cb -0.01 -2.53 -0.10 0.00 -0.45 0.00 0.00 34.95 31.87 3hqp s ARG 175 CO 0.83 -0.02 1.47 0.20 -0.68 0.00 0.00 175.30 177.09 3hqp s GLY 176 N -1.70 2.16 -0.04 -3.53 0.00 -1.26 -1.32 107.32 101.62 3hqp s GLY 176 Ca 0.57 1.34 0.06 0.00 0.00 0.00 0.00 44.72 46.70 3hqp s GLY 176 CO 0.24 2.36 -0.24 0.54 0.00 0.00 0.00 173.10 176.00 3hqp s VAL 177 N 0.24 2.18 -0.02 1.40 0.11 -0.02 -0.90 120.40 123.38 3hqp s VAL 177 Ca 0.62 -1.04 0.06 0.00 -2.93 0.00 0.00 61.98 58.69 3hqp s VAL 177 Cb -0.42 -1.78 -0.01 0.00 -1.53 0.00 0.00 36.38 32.63 3hqp s VAL 177 CO 0.41 0.57 -0.20 0.20 -3.33 0.00 0.00 175.10 172.75 3hqp s ASN 178 N -0.38 2.43 -0.67 3.54 0.01 -0.54 -4.19 114.94 115.14 3hqp s ASN 178 Ca 0.03 -0.38 0.05 0.00 -0.71 0.00 0.00 52.86 51.85 3hqp s ASN 178 Cb -0.12 -0.37 0.16 0.00 0.41 0.00 0.00 41.25 41.33 3hqp s ASN 178 CO 0.02 0.24 0.46 -0.76 -1.51 0.00 0.00 177.10 175.54 3hqp s LEU 179 N -0.37 4.56 -0.03 0.60 2.01 -1.26 -2.50 118.68 121.69 3hqp s LEU 179 Ca 0.05 -3.71 -0.36 0.00 0.01 0.00 0.00 54.13 50.12 3hqp s LEU 179 Cb -0.09 -1.56 -0.14 0.00 0.01 0.00 0.00 46.19 44.40 3hqp s LEU 179 CO 0.00 -0.11 1.66 -2.65 1.01 0.00 0.00 176.35 176.26 3hqp n PRO 180 N 2.16 1.72 -0.96 1.29 -0.02 -1.26 -2.36 135.00 135.57 3hqp n PRO 180 Ca 0.18 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 3hqp n PRO 180 Cb 0.35 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 3hqp n PRO 180 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hqp n GLY 181 N 3.70 0.65 0.12 -1.23 0.00 -1.26 -4.88 105.19 102.29 3hqp n GLY 181 Ca 0.21 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.07 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 -3.60 -2.52 -4.81 0.00 4.64 -1.26 -5.02 116.55 103.98 3hqp n ASP 183 Ca -0.09 1.02 -0.37 0.00 -1.38 0.00 0.00 54.79 53.98 3hqp n ASP 183 Cb 0.99 -4.19 -0.06 0.00 -1.04 0.00 0.00 41.12 36.81 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 -0.72 5.30 -0.87 5.18 -7.23 -1.26 -5.03 120.40 115.77 3hqp s VAL 184 Ca -0.15 0.50 -0.24 0.00 -1.81 0.00 0.00 61.98 60.28 3hqp s VAL 184 Cb 0.01 -3.57 0.05 0.00 0.56 0.00 0.00 36.38 33.43 3hqp s VAL 184 CO 0.59 0.52 1.31 -0.62 -0.31 0.00 0.00 175.10 176.59 3hqp s ASP 185 N -0.45 6.35 -0.03 4.85 2.15 -1.26 -4.96 116.67 123.32 3hqp s ASP 185 Ca 0.18 -1.09 0.03 0.00 0.43 0.00 0.00 52.55 52.10 3hqp s ASP 185 Cb -0.14 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 39.95 3hqp s ASP 185 CO 0.06 -1.59 -0.12 -0.76 -0.17 0.00 0.00 175.17 172.60 3hqp s LEU 186 N 4.98 1.82 0.33 -1.34 1.43 -1.26 -5.12 118.68 119.52 3hqp s LEU 186 Ca 0.38 -0.24 -0.29 0.00 -1.03 0.00 0.00 54.13 52.95 3hqp s LEU 186 Cb -0.05 -0.70 -0.11 0.00 0.03 0.00 0.00 46.19 45.37 3hqp s LEU 186 CO 0.01 0.09 1.45 -2.16 0.23 0.00 0.00 176.35 175.97 3hqp s PRO 187 N 0.17 4.20 0.23 1.29 0.04 -1.26 -4.91 135.00 134.76 3hqp s PRO 187 Ca -0.04 2.44 -0.06 0.00 0.04 0.00 0.00 61.00 63.38 3hqp s PRO 187 Cb -0.10 -3.02 0.36 0.00 0.04 0.00 0.00 34.50 31.78 3hqp s PRO 187 CO 0.01 -0.44 1.77 0.00 0.04 0.00 0.00 177.00 178.38 3hqp h ALA 188 N 3.69 1.00 -3.25 8.56 0.00 -1.98 -3.37 119.26 123.91 3hqp h ALA 188 Ca -0.49 0.07 -0.48 0.00 0.00 0.00 0.00 54.91 54.01 3hqp h ALA 188 Cb 1.23 -0.01 -0.38 0.00 0.00 0.00 0.00 17.79 18.63 3hqp h ALA 188 CO 0.69 -0.09 -0.78 0.54 0.00 0.00 0.00 179.25 179.61 3hqp s VAL 189 N -6.05 0.63 0.66 0.00 0.11 -1.26 -4.52 120.40 109.96 3hqp s VAL 189 Ca -0.13 -0.15 -0.01 0.00 -2.93 0.00 0.00 61.98 58.76 3hqp s VAL 189 Cb 0.19 -0.80 0.08 0.00 -1.53 0.00 0.00 36.38 34.31 3hqp s VAL 189 CO 0.76 0.20 0.92 -0.94 -3.33 0.00 0.00 175.10 172.72 3hqp s SER 190 N 1.86 4.76 0.24 3.54 1.04 -1.26 -4.91 113.70 118.97 3hqp s SER 190 Ca 0.04 -0.06 -0.07 0.00 0.48 0.00 0.00 55.95 56.33 3hqp s SER 190 Cb -0.13 -0.55 0.23 0.00 0.10 0.00 0.00 66.02 65.67 3hqp s SER 190 CO -0.07 -1.56 1.92 0.00 0.98 0.00 0.00 173.24 174.51 3hqp h ALA 191 N -0.34 1.19 -0.73 5.32 0.00 -1.99 -1.28 119.26 121.43 3hqp h ALA 191 Ca -0.40 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.47 3hqp h ALA 191 Cb 1.29 -0.38 -0.04 0.00 0.00 0.00 0.00 17.79 18.66 3hqp h ALA 191 CO 0.48 0.58 0.48 0.87 0.00 0.00 0.00 179.25 181.66 3hqp h LYS 192 N 1.27 0.88 -0.11 0.00 1.57 -1.99 -1.76 116.57 116.43 3hqp h LYS 192 Ca 0.34 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 59.04 3hqp h LYS 192 Cb -0.14 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 31.97 3hqp h LYS 192 CO -0.08 0.58 -0.06 -0.44 -0.57 0.00 0.00 179.45 178.89 3hqp h ASP 193 N 0.90 0.24 -0.66 0.86 3.32 -1.66 -0.86 116.42 118.56 3hqp h ASP 193 Ca 0.29 -0.42 0.11 0.00 0.02 0.00 0.00 57.03 57.02 3hqp h ASP 193 Cb 0.02 -0.07 -0.08 0.00 0.22 0.00 0.00 39.33 39.43 3hqp h ASP 193 CO -0.08 0.61 0.25 0.03 -1.72 0.00 0.00 179.24 178.33 3hqp h ARG 194 N -0.14 0.40 -0.01 3.56 3.08 -1.12 0.46 114.38 120.62 3hqp h ARG 194 Ca 0.02 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.06 3hqp h ARG 194 Cb 0.52 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.46 3hqp h ARG 194 CO 0.02 0.27 -0.07 0.28 -1.07 0.00 0.00 179.97 179.40 3hqp h VAL 195 N 0.42 0.82 -0.38 2.04 2.07 -1.26 -0.80 116.25 119.17 3hqp h VAL 195 Ca 0.34 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.80 3hqp h VAL 195 Cb 0.45 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 3hqp h VAL 195 CO -0.34 0.00 -0.01 0.44 0.02 0.00 0.00 177.57 177.68 3hqp h ASP 196 N -0.11 0.66 -0.94 0.57 3.32 -0.32 -1.35 116.42 118.24 3hqp h ASP 196 Ca 0.03 -0.31 0.02 0.00 0.02 0.00 0.00 57.03 56.79 3hqp h ASP 196 Cb 0.16 -0.18 -0.05 0.00 0.22 0.00 0.00 39.33 39.48 3hqp h ASP 196 CO -0.08 0.82 0.62 -0.07 -1.72 0.00 0.00 179.24 178.81 3hqp h LEU 197 N 0.49 1.05 -0.60 1.55 3.38 -0.14 -1.70 115.31 119.34 3hqp h LEU 197 Ca 0.11 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 3hqp h LEU 197 Cb 0.48 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 3hqp h LEU 197 CO 0.02 0.74 0.28 -0.61 0.09 0.00 0.00 178.44 178.96 3hqp h GLN 198 N 1.23 0.88 -0.38 1.13 5.75 -0.90 -1.85 115.11 120.97 3hqp h GLN 198 Ca 0.36 -0.14 0.07 0.00 -0.15 0.00 0.00 58.65 58.79 3hqp h GLN 198 Cb -0.06 -0.15 -0.06 0.00 1.07 0.00 0.00 27.48 28.27 3hqp h GLN 198 CO -0.10 0.72 0.00 0.35 -2.65 0.00 0.00 178.83 177.15 3hqp h PHE 199 N 0.83 -0.02 -0.72 3.99 3.57 -0.79 -0.65 116.94 123.16 3hqp h PHE 199 Ca 0.21 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.73 3hqp h PHE 199 Cb 0.14 0.07 -0.04 0.00 2.79 0.00 0.00 35.95 38.91 3hqp h PHE 199 CO 0.00 -0.07 0.45 0.78 -2.23 0.00 0.00 178.31 177.24 3hqp h GLY 200 N 0.11 1.03 0.79 2.40 0.00 -1.11 -0.23 103.07 106.07 3hqp h GLY 200 Ca 0.19 -0.41 -0.00 0.00 0.00 0.00 0.00 47.33 47.10 3hqp h GLY 200 CO -0.31 0.40 -0.04 -2.08 0.00 0.00 0.00 176.54 174.52 3hqp h VAL 201 N 0.99 1.06 -0.68 4.60 2.07 -0.82 -0.57 116.25 122.90 3hqp h VAL 201 Ca 0.26 -0.46 0.05 0.00 0.82 0.00 0.00 66.70 67.37 3hqp h VAL 201 Cb -0.06 1.36 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 3hqp h VAL 201 CO -0.05 0.11 0.45 -0.33 0.02 0.00 0.00 177.57 177.77 3hqp h GLU 202 N -0.31 0.72 -0.00 1.57 5.08 -0.80 -2.56 114.58 118.27 3hqp h GLU 202 Ca -0.01 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 3hqp h GLU 202 Cb 0.27 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.35 3hqp h GLU 202 CO 0.02 0.47 -0.48 1.04 -1.00 0.00 0.00 179.01 179.06 3hqp n GLN 203 N -4.47 0.33 -2.58 2.33 1.13 -0.13 -4.98 117.38 109.01 3hqp n GLN 203 Ca 0.09 -0.21 -0.06 0.00 -1.94 0.00 0.00 57.00 54.88 3hqp n GLN 203 Cb 0.19 -1.50 0.01 0.00 0.11 0.00 0.00 30.24 29.06 3hqp n GLN 203 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3hqp n GLY 204 N 1.45 0.41 3.75 1.08 0.00 -0.33 -5.02 105.19 106.51 3hqp n GLY 204 Ca 0.08 -0.49 -0.33 0.00 0.00 0.00 0.00 46.02 45.28 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 -2.83 2.86 -0.01 1.61 -7.23 -0.54 -4.97 120.40 109.30 3hqp s VAL 205 Ca 0.11 0.37 0.06 0.00 -1.81 0.00 0.00 61.98 60.71 3hqp s VAL 205 Cb -0.05 -2.83 -0.24 0.00 0.56 0.00 0.00 36.38 33.82 3hqp s VAL 205 CO 0.14 -0.28 0.79 0.44 -0.31 0.00 0.00 175.10 175.88 3hqp h ASP 206 N -0.51 0.14 -5.08 4.85 3.32 -1.68 -3.46 116.42 114.00 3hqp h ASP 206 Ca -0.46 -0.23 -0.06 0.00 0.02 0.00 0.00 57.03 56.30 3hqp h ASP 206 Cb 1.26 -0.04 -0.14 0.00 0.22 0.00 0.00 39.33 40.63 3hqp h ASP 206 CO 0.51 1.20 -0.12 0.00 -1.72 0.00 0.00 179.24 179.11 3hqp s MET 207 N -2.62 1.01 -0.16 3.56 0.23 -1.17 -2.55 119.30 117.60 3hqp s MET 207 Ca -0.07 -0.67 -0.02 0.00 -1.03 0.00 0.00 55.69 53.91 3hqp s MET 207 Cb 0.08 0.44 -0.01 0.00 -1.53 0.00 0.00 34.83 33.81 3hqp s MET 207 CO 0.82 -0.38 -0.10 0.42 -2.03 0.00 0.00 175.02 173.76 3hqp s ILE 208 N -3.55 3.20 -0.61 3.16 -1.09 0.12 -1.75 121.20 120.67 3hqp s ILE 208 Ca 0.02 -0.59 -0.21 0.00 -2.23 0.00 0.00 60.65 57.63 3hqp s ILE 208 Cb 0.02 -2.38 0.08 0.00 -1.58 0.00 0.00 42.46 38.59 3hqp s ILE 208 CO -0.10 0.49 0.85 -0.36 -1.23 0.00 0.00 174.94 174.59 3hqp s PHE 209 N 0.73 2.82 -0.41 3.97 0.08 0.56 -0.18 117.98 125.55 3hqp s PHE 209 Ca -0.04 -0.63 -0.23 0.00 0.12 0.00 0.00 56.93 56.15 3hqp s PHE 209 Cb -0.15 -4.11 0.02 0.00 -0.57 0.00 0.00 43.02 38.21 3hqp s PHE 209 CO 0.02 -1.45 0.78 0.00 -0.10 0.00 0.00 175.22 174.47 3hqp s ALA 210 N 3.48 3.35 0.44 5.36 0.00 0.57 -1.76 121.76 133.20 3hqp s ALA 210 Ca 0.19 -0.86 -0.23 0.00 0.00 0.00 0.00 51.96 51.07 3hqp s ALA 210 Cb -0.19 -3.42 -0.08 0.00 0.00 0.00 0.00 23.12 19.43 3hqp s ALA 210 CO 0.10 -1.73 1.08 -1.12 0.00 0.00 0.00 175.76 174.09 3hqp s SER 211 N 2.01 6.45 -1.36 0.00 0.01 -1.26 -1.05 113.70 118.49 3hqp s SER 211 Ca 0.30 2.09 -0.06 0.00 1.31 0.00 0.00 55.95 59.59 3hqp s SER 211 Cb -0.13 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.52 3hqp s SER 211 CO 0.20 -0.71 0.46 0.49 0.41 0.00 0.00 173.24 174.09 3hqp n PHE 212 N -0.47 -1.63 -2.28 2.43 3.72 -1.24 -4.49 117.46 113.50 3hqp n PHE 212 Ca 0.07 0.63 -0.43 0.00 -0.05 0.00 0.00 57.45 57.68 3hqp n PHE 212 Cb 0.50 -3.53 -0.02 0.00 -0.94 0.00 0.00 39.48 35.48 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 -3.89 3.97 -0.02 4.37 -1.09 -0.85 -4.72 121.20 118.98 3hqp s ILE 213 Ca 0.12 1.24 0.08 0.00 -2.23 0.00 0.00 60.65 59.86 3hqp s ILE 213 Cb -0.05 -3.80 -0.13 0.00 -1.58 0.00 0.00 42.46 36.91 3hqp s ILE 213 CO 0.90 -0.07 0.17 -2.11 -1.23 0.00 0.00 174.94 172.59 3hqp n ARG 214 N 6.29 0.56 -3.66 2.79 1.85 -1.26 -4.08 116.66 119.16 3hqp n ARG 214 Ca 0.14 -0.07 -0.10 0.00 -1.00 0.00 0.00 57.85 56.82 3hqp n ARG 214 Cb 0.44 -1.20 -0.04 0.00 -1.05 0.00 0.00 32.46 30.61 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 -3.10 -0.23 0.26 2.89 1.04 -1.26 -4.06 113.70 109.24 3hqp s SER 215 Ca -0.03 -0.36 0.01 0.00 0.48 0.00 0.00 55.95 56.05 3hqp s SER 215 Cb 0.05 0.49 0.35 0.00 0.10 0.00 0.00 66.02 67.01 3hqp s SER 215 CO 0.35 -0.89 1.68 0.00 0.98 0.00 0.00 173.24 175.36 3hqp h ALA 216 N 2.34 1.02 -0.49 5.32 0.00 -1.88 -2.89 119.26 122.68 3hqp h ALA 216 Ca -0.33 -0.38 0.07 0.00 0.00 0.00 0.00 54.91 54.27 3hqp h ALA 216 Cb 1.26 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.87 3hqp h ALA 216 CO 0.45 0.59 0.17 1.49 0.00 0.00 0.00 179.25 181.95 3hqp h GLU 217 N 0.44 0.33 -0.71 0.00 4.81 -1.96 -1.59 114.58 115.89 3hqp h GLU 217 Ca 0.06 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.21 3hqp h GLU 217 Cb 0.75 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 30.02 3hqp h GLU 217 CO 0.06 0.22 0.21 0.37 -0.73 0.00 0.00 179.01 179.14 3hqp h GLN 218 N 0.34 1.11 -0.55 1.92 4.15 -1.93 -0.15 115.11 119.99 3hqp h GLN 218 Ca 0.24 -0.24 0.04 0.00 0.77 0.00 0.00 58.65 59.46 3hqp h GLN 218 Cb 0.25 -0.16 -0.04 0.00 0.21 0.00 0.00 27.48 27.74 3hqp h GLN 218 CO -0.25 0.95 0.30 0.28 -1.93 0.00 0.00 178.83 178.18 3hqp h VAL 219 N 1.06 0.99 -0.81 2.39 2.07 -1.29 -0.64 116.25 120.03 3hqp h VAL 219 Ca 0.23 -0.20 0.03 0.00 0.82 0.00 0.00 66.70 67.58 3hqp h VAL 219 Cb 0.31 0.35 -0.05 0.00 -1.52 0.00 0.00 31.29 30.39 3hqp h VAL 219 CO -0.01 0.11 0.52 1.23 0.02 0.00 0.00 177.57 179.44 3hqp h GLY 220 N 0.59 1.17 0.82 2.17 0.00 -0.57 -0.24 103.07 107.00 3hqp h GLY 220 Ca 0.24 -0.39 0.02 0.00 0.00 0.00 0.00 47.33 47.20 3hqp h GLY 220 CO -0.14 0.34 0.12 -0.55 0.00 0.00 0.00 176.54 176.31 3hqp h ASP 221 N 1.01 0.16 -0.83 0.19 3.32 -0.56 -0.55 116.42 119.15 3hqp h ASP 221 Ca 0.32 0.02 0.03 0.00 0.02 0.00 0.00 57.03 57.42 3hqp h ASP 221 Cb 0.00 -0.01 -0.05 0.00 0.22 0.00 0.00 39.33 39.50 3hqp h ASP 221 CO -0.11 0.13 0.53 0.58 -1.72 0.00 0.00 179.24 178.65 3hqp h VAL 222 N 0.26 1.14 -0.63 -1.35 2.07 -0.46 0.82 116.25 118.09 3hqp h VAL 222 Ca 0.12 -0.36 -0.09 0.00 0.82 0.00 0.00 66.70 67.19 3hqp h VAL 222 Cb 0.06 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.81 3hqp h VAL 222 CO -0.10 0.19 0.05 -0.09 0.02 0.00 0.00 177.57 177.64 3hqp h ARG 223 N 1.05 1.09 -0.40 1.57 2.43 -0.74 -1.34 114.38 118.04 3hqp h ARG 223 Ca 0.33 -0.32 -0.09 0.00 -0.81 0.00 0.00 59.98 59.09 3hqp h ARG 223 Cb -0.02 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.40 3hqp h ARG 223 CO -0.11 1.03 -0.11 0.87 -1.51 0.00 0.00 179.97 180.14 3hqp h LYS 224 N 1.00 0.71 -0.07 0.20 1.57 -0.70 -1.77 116.57 117.50 3hqp h LYS 224 Ca 0.19 -0.23 -0.08 0.00 -1.87 0.00 0.00 60.65 58.65 3hqp h LYS 224 Cb 0.51 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.74 3hqp h LYS 224 CO 0.02 0.80 -0.34 0.00 -0.57 0.00 0.00 179.45 179.37 3hqp h ALA 225 N 1.23 1.30 0.00 3.86 0.00 -0.44 -2.18 119.26 123.03 3hqp h ALA 225 Ca 0.11 -0.34 -0.14 0.00 0.00 0.00 0.00 54.91 54.54 3hqp h ALA 225 Cb 0.57 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 3hqp h ALA 225 CO 0.04 0.49 -0.68 -0.07 0.00 0.00 0.00 179.25 179.03 3hqp h LEU 226 N 0.12 0.00 0.00 0.00 3.38 -1.00 -3.44 115.31 114.37 3hqp h LEU 226 Ca 0.02 0.00 0.27 0.00 0.09 0.00 0.00 57.88 58.25 3hqp h LEU 226 Cb 0.66 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.34 3hqp h LEU 226 CO 0.05 0.68 -0.36 0.61 0.09 0.00 0.00 178.44 179.51 3hqp n GLY 227 N 0.61 -1.91 0.32 0.83 0.00 -0.69 -1.61 105.19 102.76 3hqp n GLY 227 Ca -0.00 -1.23 0.28 0.00 0.00 0.00 0.00 46.02 45.06 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 0.07 -0.17 1.61 0.11 -1.88 -1.36 132.00 130.39 3hqp h PRO 228 Ca 0.02 -0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.92 3hqp h PRO 228 Cb 0.90 -0.02 0.01 0.00 0.11 0.00 0.00 31.00 32.00 3hqp h PRO 228 CO 0.01 0.05 -0.70 -0.22 -0.21 0.00 0.00 178.00 176.92 3hqp h LYS 229 N 0.08 0.78 -0.76 1.05 3.11 -1.99 -3.18 116.57 115.66 3hqp h LYS 229 Ca 0.79 -0.61 0.00 0.00 -2.81 0.00 0.00 60.65 58.02 3hqp h LYS 229 Cb 1.99 0.12 0.00 0.00 -1.00 0.00 0.00 32.23 33.34 3hqp h LYS 229 CO -0.75 1.22 0.00 0.41 -2.81 0.00 0.00 179.45 177.52 3hqp n GLY 230 N 0.64 2.32 0.27 5.01 0.00 -0.56 -4.51 105.19 108.36 3hqp n GLY 230 Ca -0.07 -0.52 0.15 0.00 0.00 0.00 0.00 46.02 45.58 3hqp n GLY 230 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3hqp h ARG 231 N 2.27 0.00 -0.01 1.61 0.11 -1.40 -2.27 114.38 114.69 3hqp h ARG 231 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3hqp h ARG 231 Cb 1.33 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.41 3hqp h ARG 231 CO 0.28 0.09 -0.38 -0.25 0.10 0.00 0.00 179.97 179.81 3hqp n ASP 232 N -3.41 1.65 -4.69 0.08 8.00 -1.26 -4.87 116.55 112.05 3hqp n ASP 232 Ca -0.01 -1.28 -0.42 0.00 0.71 0.00 0.00 54.79 53.78 3hqp n ASP 232 Cb 0.26 0.34 -0.03 0.00 -0.02 0.00 0.00 41.12 41.66 3hqp n ASP 232 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3hqp s ILE 233 N -2.47 3.76 0.16 0.53 1.01 -0.86 -4.97 121.20 118.36 3hqp s ILE 233 Ca 0.21 1.12 -0.30 0.00 0.00 0.00 0.00 60.65 61.69 3hqp s ILE 233 Cb 0.19 -3.72 -0.07 0.00 0.01 0.00 0.00 42.46 38.86 3hqp s ILE 233 CO 0.55 -0.01 1.11 -0.04 0.00 0.00 0.00 174.94 176.54 3hqp s MET 234 N 2.53 4.58 -0.42 2.79 -1.94 -1.06 -4.86 119.30 120.92 3hqp s MET 234 Ca 0.63 1.71 -0.16 0.00 -1.71 0.00 0.00 55.69 56.16 3hqp s MET 234 Cb -0.31 -3.29 0.03 0.00 2.01 0.00 0.00 34.83 33.27 3hqp s MET 234 CO 0.26 0.04 0.39 0.42 -0.01 0.00 0.00 175.02 176.11 3hqp s ILE 235 N -0.07 5.15 -0.26 2.53 1.01 -1.26 0.14 121.20 128.44 3hqp s ILE 235 Ca 0.50 -0.51 -0.12 0.00 0.00 0.00 0.00 60.65 60.52 3hqp s ILE 235 Cb -0.29 -4.01 -0.05 0.00 0.01 0.00 0.00 42.46 38.12 3hqp s ILE 235 CO 0.34 -0.40 0.24 -0.63 0.00 0.00 0.00 174.94 174.49 3hqp s ILE 236 N 1.95 5.28 -0.26 2.92 -1.09 0.75 -0.52 121.20 130.23 3hqp s ILE 236 Ca 0.09 0.31 -0.16 0.00 -2.23 0.00 0.00 60.65 58.66 3hqp s ILE 236 Cb -0.18 -3.58 -0.04 0.00 -1.58 0.00 0.00 42.46 37.08 3hqp s ILE 236 CO 0.12 0.25 0.40 0.00 -1.23 0.00 0.00 174.94 174.48 3hqp s LYS 238 N 2.00 4.20 -0.41 0.00 1.02 -0.22 -0.70 119.74 125.62 3hqp s LYS 238 Ca 0.17 1.03 -0.17 0.00 0.02 0.00 0.00 55.97 57.01 3hqp s LYS 238 Cb -0.16 -3.64 0.02 0.00 -0.52 0.00 0.00 37.83 33.53 3hqp s LYS 238 CO 0.09 -0.54 0.44 0.42 -0.92 0.00 0.00 175.35 174.84 3hqp s ILE 239 N 2.90 5.09 0.00 2.17 -1.09 -0.10 -2.00 121.20 128.16 3hqp s ILE 239 Ca 0.37 -0.30 0.00 0.00 -2.23 0.00 0.00 60.65 58.49 3hqp s ILE 239 Cb -0.15 -4.03 0.00 0.00 -1.58 0.00 0.00 42.46 36.70 3hqp s ILE 239 CO 0.07 -0.40 0.73 -1.84 -1.23 0.00 0.00 174.94 172.27 3hqp n GLU 240 N 5.60 0.00 -4.10 2.79 0.28 -1.26 -2.26 120.64 121.69 3hqp n GLU 240 Ca -0.07 -0.71 -0.12 0.00 -0.16 0.00 0.00 57.16 56.09 3hqp n GLU 240 Cb 0.48 -0.46 -0.06 0.00 1.43 0.00 0.00 31.44 32.82 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 -0.50 0.40 0.15 -1.84 2.20 -1.26 -3.25 114.94 110.83 3hqp s ASN 241 Ca 0.00 -1.28 -0.25 0.00 -0.94 0.00 0.00 52.86 50.39 3hqp s ASN 241 Cb 0.00 0.55 0.01 0.00 -2.00 0.00 0.00 41.25 39.81 3hqp s ASN 241 CO 0.00 -1.10 1.61 -0.74 -2.94 0.00 0.00 177.10 173.93 3hqp h HIS 242 N 2.30 -0.88 0.00 1.54 -0.00 -1.94 -2.49 115.15 113.69 3hqp h HIS 242 Ca -0.29 0.04 -0.11 0.00 -0.00 0.00 0.00 60.37 60.01 3hqp h HIS 242 Cb 1.25 0.42 -0.02 0.00 -0.00 0.00 0.00 27.41 29.06 3hqp h HIS 242 CO 0.80 -0.39 -0.53 -0.56 -0.00 0.00 0.00 177.93 177.26 3hqp h GLN 243 N -0.34 0.00 -0.44 5.26 3.07 -1.94 -1.35 115.11 119.37 3hqp h GLN 243 Ca 0.12 0.00 0.07 0.00 0.09 0.00 0.00 58.65 58.93 3hqp h GLN 243 Cb 0.54 0.00 -0.06 0.00 0.08 0.00 0.00 27.48 28.04 3hqp h GLN 243 CO -0.41 0.53 0.11 0.78 0.09 0.00 0.00 178.83 179.92 3hqp h GLY 244 N 2.10 0.54 1.00 0.06 0.00 -1.67 0.15 103.07 105.27 3hqp h GLY 244 Ca -0.01 -0.04 -0.05 0.00 0.00 0.00 0.00 47.33 47.24 3hqp h GLY 244 CO 0.07 -0.03 0.16 -2.08 0.00 0.00 0.00 176.54 174.66 3hqp h VAL 245 N 0.25 1.24 -0.61 4.60 2.07 -1.11 -2.98 116.25 119.71 3hqp h VAL 245 Ca 0.22 -0.85 -0.08 0.00 0.82 0.00 0.00 66.70 66.81 3hqp h VAL 245 Cb 0.26 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 3hqp h VAL 245 CO -0.27 0.32 0.06 -0.61 0.02 0.00 0.00 177.57 177.09 3hqp h GLN 246 N 0.82 1.02 -0.84 1.57 4.15 -0.88 -3.09 115.11 117.85 3hqp h GLN 246 Ca 0.18 -0.28 -0.32 0.00 0.77 0.00 0.00 58.65 59.00 3hqp h GLN 246 Cb 0.31 -0.11 -0.19 0.00 0.21 0.00 0.00 27.48 27.70 3hqp h GLN 246 CO -0.00 0.97 0.41 0.09 -1.93 0.00 0.00 178.83 178.36 3hqp n ASN 247 N -4.20 4.53 -0.32 -0.69 3.02 0.50 -4.74 115.26 113.37 3hqp n ASN 247 Ca 0.04 -3.35 0.01 0.00 -0.03 0.00 0.00 54.58 51.24 3hqp n ASN 247 Cb 0.31 -0.78 0.14 0.00 -0.61 0.00 0.00 39.78 38.83 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 2.16 1.06 -0.00 2.41 6.09 -1.44 -1.27 117.51 126.53 3hqp h ILE 248 Ca 0.39 -0.35 -0.00 0.00 -1.37 0.00 0.00 64.86 63.54 3hqp h ILE 248 Cb 2.54 -0.04 -0.00 0.00 0.47 0.00 0.00 36.82 39.79 3hqp h ILE 248 CO 0.87 0.18 0.00 0.44 -3.07 0.00 0.00 178.15 176.58 3hqp h ASP 249 N 1.01 0.00 -0.03 2.19 3.32 -1.88 0.22 116.42 121.26 3hqp h ASP 249 Ca 0.37 -0.06 -0.13 0.00 0.02 0.00 0.00 57.03 57.23 3hqp h ASP 249 Cb 0.14 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 3hqp h ASP 249 CO -0.16 0.07 -0.40 0.77 -1.72 0.00 0.00 179.24 177.79 3hqp h SER 250 N -0.06 0.58 -0.16 6.45 4.64 -1.92 -1.36 113.55 121.72 3hqp h SER 250 Ca 0.00 -0.25 -0.01 0.00 -0.47 0.00 0.00 61.79 61.06 3hqp h SER 250 Cb 0.06 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 3hqp h SER 250 CO -0.00 0.92 0.08 0.40 -0.87 0.00 0.00 176.83 177.36 3hqp h ILE 251 N 0.45 1.12 -0.92 0.95 2.04 -1.08 -2.58 117.51 117.48 3hqp h ILE 251 Ca 0.04 -0.34 0.04 0.00 1.00 0.00 0.00 64.86 65.60 3hqp h ILE 251 Cb 0.90 1.05 -0.05 0.00 -0.74 0.00 0.00 36.82 37.97 3hqp h ILE 251 CO 0.08 0.11 0.61 0.40 0.00 0.00 0.00 178.15 179.34 3hqp h ILE 252 N 0.14 1.14 -0.58 -0.67 2.04 -0.43 -1.55 117.51 117.60 3hqp h ILE 252 Ca 0.06 -0.39 0.04 0.00 1.00 0.00 0.00 64.86 65.57 3hqp h ILE 252 Cb 0.11 -0.10 -0.04 0.00 -0.74 0.00 0.00 36.82 36.04 3hqp h ILE 252 CO -0.01 0.21 0.32 -0.08 0.00 0.00 0.00 178.15 178.60 3hqp h GLU 253 N 1.14 0.61 0.00 2.37 4.57 -1.03 -3.04 114.58 119.20 3hqp h GLU 253 Ca 0.37 -0.04 -0.14 0.00 -1.18 0.00 0.00 59.36 58.38 3hqp h GLU 253 Cb 0.04 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.48 3hqp h GLU 253 CO -0.12 0.40 -0.67 0.93 -1.18 0.00 0.00 179.01 178.38 3hqp h GLU 254 N 0.63 0.00 -7.25 1.92 4.39 -1.06 -3.47 114.58 109.73 3hqp h GLU 254 Ca 0.25 0.00 -0.46 0.00 0.34 0.00 0.00 59.36 59.49 3hqp h GLU 254 Cb 0.11 0.00 0.09 0.00 -0.10 0.00 0.00 28.75 28.85 3hqp h GLU 254 CO -0.14 0.64 0.18 -1.54 -1.16 0.00 0.00 179.01 176.98 3hqp s SER 255 N -6.51 4.39 0.00 1.42 1.04 -0.62 -4.95 113.70 108.47 3hqp s SER 255 Ca 0.03 0.03 0.20 0.00 0.48 0.00 0.00 55.95 56.69 3hqp s SER 255 Cb 0.08 -0.49 0.15 0.00 0.10 0.00 0.00 66.02 65.85 3hqp s SER 255 CO 0.77 -1.84 1.12 0.47 0.98 0.00 0.00 173.24 174.74 3hqp n ASP 256 N -2.95 2.60 0.00 7.02 9.92 0.32 -4.96 116.55 128.50 3hqp n ASP 256 Ca 0.12 -1.80 0.00 0.00 -0.53 0.00 0.00 54.79 52.58 3hqp n ASP 256 Cb 0.60 0.03 0.00 0.00 -0.64 0.00 0.00 41.12 41.12 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 1.13 -0.12 3.07 0.44 0.00 -1.20 -4.17 105.19 104.35 3hqp n GLY 257 Ca 0.11 -1.14 -0.17 0.00 0.00 0.00 0.00 46.02 44.83 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 0.75 -0.12 -0.61 -1.09 -0.70 -1.58 121.20 115.85 3hqp s ILE 258 Ca 0.00 -0.81 0.01 0.00 -2.23 0.00 0.00 60.65 57.62 3hqp s ILE 258 Cb 0.00 -0.71 -0.01 0.00 -1.58 0.00 0.00 42.46 40.16 3hqp s ILE 258 CO 0.00 -0.07 -0.14 -0.32 -1.23 0.00 0.00 174.94 173.17 3hqp s MET 259 N -0.98 3.30 -0.95 2.79 -2.45 0.12 -1.44 119.30 119.69 3hqp s MET 259 Ca -0.02 -0.71 -0.22 0.00 -1.25 0.00 0.00 55.69 53.49 3hqp s MET 259 Cb -0.07 -2.58 0.07 0.00 1.25 0.00 0.00 34.83 33.50 3hqp s MET 259 CO 0.01 0.23 1.33 0.08 1.05 0.00 0.00 175.02 177.72 3hqp s VAL 260 N 0.29 4.10 -1.23 10.11 1.01 0.59 -0.92 120.40 134.34 3hqp s VAL 260 Ca -0.11 -0.78 -0.14 0.00 0.00 0.00 0.00 61.98 60.95 3hqp s VAL 260 Cb -0.16 -4.96 0.16 0.00 0.00 0.00 0.00 36.38 31.42 3hqp s VAL 260 CO 0.06 -1.81 1.52 0.00 0.00 0.00 0.00 175.10 174.87 3hqp n ALA 261 N 8.36 3.99 0.24 5.51 0.00 -0.96 -2.15 120.51 135.50 3hqp n ALA 261 Ca 0.25 -4.20 0.11 0.00 0.00 0.00 0.00 53.44 49.60 3hqp n ALA 261 Cb 0.50 -3.12 0.56 0.00 0.00 0.00 0.00 19.45 17.40 3hqp n ALA 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hqp h ARG 262 N 7.04 0.00 0.66 0.00 3.08 -1.82 -1.66 114.38 121.69 3hqp h ARG 262 Ca 0.34 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.36 3hqp h ARG 262 Cb 0.85 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.90 3hqp h ARG 262 CO 1.31 0.19 -0.33 0.78 -1.07 0.00 0.00 179.97 180.85 3hqp h GLY 263 N 1.62 -0.96 1.60 0.04 0.00 -1.86 -0.28 103.07 103.23 3hqp h GLY 263 Ca -0.00 0.36 -0.14 0.00 0.00 0.00 0.00 47.33 47.56 3hqp h GLY 263 CO 0.02 -0.35 -0.48 -0.55 0.00 0.00 0.00 176.54 175.19 3hqp h ASP 264 N -0.90 0.47 -0.88 0.19 3.32 -1.85 -3.11 116.42 113.66 3hqp h ASP 264 Ca -0.09 -0.23 0.03 0.00 0.02 0.00 0.00 57.03 56.77 3hqp h ASP 264 Cb 0.70 -0.13 -0.05 0.00 0.22 0.00 0.00 39.33 40.06 3hqp h ASP 264 CO 0.14 0.87 0.57 0.25 -1.72 0.00 0.00 179.24 179.35 3hqp h LEU 265 N 0.35 0.95 0.00 1.55 6.46 -1.28 -1.90 115.31 121.43 3hqp h LEU 265 Ca 0.02 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.77 3hqp h LEU 265 Cb 0.97 -0.21 0.00 0.00 -0.73 0.00 0.00 40.66 40.68 3hqp h LEU 265 CO 0.08 0.65 0.00 0.61 -0.62 0.00 0.00 178.44 179.17 3hqp n GLY 266 N -1.34 -1.03 0.10 3.75 0.00 -0.12 -0.55 105.19 106.01 3hqp n GLY 266 Ca 0.11 -0.07 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 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 -1.43 1.22 0.02 1.61 0.31 -1.11 -3.88 118.33 115.07 3hqp n VAL 267 Ca 0.06 -0.55 -0.10 0.00 -0.01 0.00 0.00 64.34 63.74 3hqp n VAL 267 Cb 0.19 -1.06 0.05 0.00 -0.91 0.00 0.00 33.84 32.10 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 0.52 -5.95 5.55 4.57 -0.95 -3.44 114.58 114.88 3hqp h GLU 268 Ca -0.48 -0.35 -0.61 0.00 -1.18 0.00 0.00 59.36 56.74 3hqp h GLU 268 Cb 1.84 0.05 -0.13 0.00 -0.16 0.00 0.00 28.75 30.35 3hqp h GLU 268 CO -0.05 0.96 -0.67 0.96 -1.18 0.00 0.00 179.01 179.04 3hqp s ILE 269 N -3.90 2.32 0.26 2.32 -4.36 0.29 -4.67 121.20 113.45 3hqp s ILE 269 Ca -0.07 -2.16 -0.31 0.00 -0.26 0.00 0.00 60.65 57.85 3hqp s ILE 269 Cb 0.11 -2.67 -0.12 0.00 1.25 0.00 0.00 42.46 41.02 3hqp s ILE 269 CO 0.84 -0.20 1.53 -2.65 0.24 0.00 0.00 174.94 174.70 3hqp n PRO 270 N -0.82 2.42 -0.35 0.37 -0.02 -1.26 -4.52 135.00 130.81 3hqp n PRO 270 Ca -0.05 0.86 0.10 0.00 -2.02 0.00 0.00 63.50 62.40 3hqp n PRO 270 Cb 0.63 -2.60 0.29 0.00 -0.02 0.00 0.00 33.50 31.80 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 4.70 1.62 0.00 3.55 0.00 -1.91 0.75 119.26 127.98 3hqp h ALA 271 Ca -0.46 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 3hqp h ALA 271 Cb 1.24 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 3hqp h ALA 271 CO 0.79 0.07 -0.11 1.05 0.00 0.00 0.00 179.25 181.05 3hqp h GLU 272 N 0.87 0.00 0.00 0.00 9.09 -1.92 -2.41 114.58 120.21 3hqp h GLU 272 Ca 0.53 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.94 3hqp h GLU 272 Cb 0.70 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.80 3hqp h GLU 272 CO -0.31 0.11 0.00 1.63 0.05 0.00 0.00 179.01 180.49 3hqp n LYS 273 N -3.37 0.16 0.15 1.06 4.76 0.26 -3.52 118.16 117.66 3hqp n LYS 273 Ca -0.01 0.27 0.03 0.00 -2.87 0.00 0.00 58.31 55.73 3hqp n LYS 273 Cb 0.30 -1.74 0.39 0.00 -1.84 0.00 0.00 35.03 32.14 3hqp n LYS 273 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 3hqp h VAL 274 N 0.00 1.20 -0.45 -0.18 2.07 -1.49 -2.24 116.25 115.16 3hqp h VAL 274 Ca 0.00 -0.93 -0.03 0.00 0.82 0.00 0.00 66.70 66.56 3hqp h VAL 274 Cb 0.48 1.39 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 3hqp h VAL 274 CO 0.00 0.28 0.16 0.58 0.02 0.00 0.00 177.57 178.60 3hqp h VAL 275 N 0.13 1.22 -0.24 2.57 2.07 -1.76 0.82 116.25 121.05 3hqp h VAL 275 Ca 0.02 -0.70 -0.12 0.00 0.82 0.00 0.00 66.70 66.72 3hqp h VAL 275 Cb 0.47 0.83 -0.00 0.00 -1.52 0.00 0.00 31.29 31.06 3hqp h VAL 275 CO 0.03 0.25 -0.33 0.58 0.02 0.00 0.00 177.57 178.12 3hqp h VAL 276 N 0.58 1.32 -0.84 2.57 2.07 -1.73 -2.52 116.25 117.70 3hqp h VAL 276 Ca 0.15 -1.53 0.01 0.00 0.82 0.00 0.00 66.70 66.15 3hqp h VAL 276 Cb 0.24 1.74 -0.04 0.00 -1.52 0.00 0.00 31.29 31.70 3hqp h VAL 276 CO -0.01 0.48 0.56 0.00 0.02 0.00 0.00 177.57 178.62 3hqp h ALA 277 N 0.65 1.07 -0.66 1.67 0.00 -1.30 -0.02 119.26 120.67 3hqp h ALA 277 Ca 0.03 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.91 3hqp h ALA 277 Cb 0.92 -0.34 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 3hqp h ALA 277 CO 0.08 0.47 0.41 0.37 0.00 0.00 0.00 179.25 180.57 3hqp h GLN 278 N 1.13 0.78 -0.24 0.00 4.15 -0.81 -0.01 115.11 120.11 3hqp h GLN 278 Ca 0.31 -0.05 -0.03 0.00 0.77 0.00 0.00 58.65 59.65 3hqp h GLN 278 Cb -0.12 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 27.38 3hqp h GLN 278 CO -0.07 0.51 0.02 0.87 -1.93 0.00 0.00 178.83 178.24 3hqp h LYS 279 N 0.80 0.41 0.12 1.69 1.57 -0.89 -2.07 116.57 118.20 3hqp h LYS 279 Ca 0.26 -0.12 0.01 0.00 -1.87 0.00 0.00 60.65 58.94 3hqp h LYS 279 Cb 0.02 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 3hqp h LYS 279 CO -0.11 0.56 -0.17 0.82 -0.57 0.00 0.00 179.45 179.99 3hqp h ILE 280 N 0.20 0.62 -0.47 1.86 2.04 -0.87 -2.36 117.51 118.53 3hqp h ILE 280 Ca 0.07 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.81 3hqp h ILE 280 Cb 0.36 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 3hqp h ILE 280 CO 0.01 0.00 -0.18 -0.07 0.00 0.00 0.00 178.15 177.90 3hqp h LEU 281 N -0.33 0.97 -0.39 1.44 3.38 -0.97 -1.76 115.31 117.64 3hqp h LEU 281 Ca 0.02 -0.39 -0.04 0.00 0.09 0.00 0.00 57.88 57.56 3hqp h LEU 281 Cb 0.34 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 3hqp h LEU 281 CO -0.08 1.14 0.10 0.40 0.09 0.00 0.00 178.44 180.10 3hqp h ILE 282 N 0.80 1.22 -0.55 1.22 2.04 -1.40 -2.48 117.51 118.36 3hqp h ILE 282 Ca 0.11 -0.76 -0.09 0.00 1.00 0.00 0.00 64.86 65.13 3hqp h ILE 282 Cb 0.75 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 3hqp h ILE 282 CO 0.06 0.26 0.01 0.28 0.00 0.00 0.00 178.15 178.76 3hqp h SER 283 N 0.49 0.95 -0.70 1.72 0.02 -1.32 -1.71 113.55 113.01 3hqp h SER 283 Ca 0.12 -0.30 -0.05 0.00 -0.84 0.00 0.00 61.79 60.72 3hqp h SER 283 Cb 0.29 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.55 3hqp h SER 283 CO -0.00 1.02 0.25 0.11 -1.14 0.00 0.00 176.83 177.07 3hqp h LYS 284 N 0.85 1.08 -0.44 3.45 1.57 -1.26 -1.41 116.57 120.40 3hqp h LYS 284 Ca 0.16 -0.20 -0.12 0.00 -1.87 0.00 0.00 60.65 58.61 3hqp h LYS 284 Cb 0.53 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 3hqp h LYS 284 CO 0.03 0.89 -0.20 0.00 -0.57 0.00 0.00 179.45 179.60 3hqp h ASN 286 N 0.75 0.59 0.19 0.00 -0.26 -0.96 0.29 115.58 116.18 3hqp h ASN 286 Ca 0.10 0.06 -0.19 0.00 -0.56 0.00 0.00 56.30 55.70 3hqp h ASN 286 Cb 0.77 -0.05 -0.00 0.00 -1.06 0.00 0.00 38.32 37.97 3hqp h ASN 286 CO 0.06 0.33 -0.74 0.58 -1.06 0.00 0.00 177.43 176.60 3hqp h VAL 287 N 0.71 1.36 0.00 2.81 2.07 -1.12 -3.07 116.25 119.01 3hqp h VAL 287 Ca 0.39 -2.12 -0.02 0.00 0.82 0.00 0.00 66.70 65.77 3hqp h VAL 287 Cb 0.39 2.10 -0.00 0.00 -1.52 0.00 0.00 31.29 32.26 3hqp h VAL 287 CO -0.26 0.64 -0.08 0.00 0.02 0.00 0.00 177.57 177.89 3hqp h ALA 288 N 0.87 0.96 0.00 1.67 0.00 -0.86 -3.48 119.26 118.42 3hqp h ALA 288 Ca -0.04 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3hqp h ALA 288 Cb 1.33 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.11 3hqp h ALA 288 CO 0.13 0.10 0.00 0.41 0.00 0.00 0.00 179.25 179.89 3hqp n GLY 289 N 0.83 0.61 3.44 0.00 0.00 0.87 -5.07 105.19 105.87 3hqp n GLY 289 Ca 0.03 -0.78 -0.33 0.00 0.00 0.00 0.00 46.02 44.94 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 -3.01 2.69 0.38 1.61 1.02 -0.25 -4.82 119.74 117.35 3hqp s LYS 290 Ca 0.00 -0.71 -0.26 0.00 0.02 0.00 0.00 55.97 55.02 3hqp s LYS 290 Cb 0.00 -2.41 -0.11 0.00 -0.52 0.00 0.00 37.83 34.79 3hqp s LYS 290 CO 0.00 0.52 1.12 -0.35 -0.92 0.00 0.00 175.35 175.72 3hqp n PRO 291 N 2.61 1.62 -4.33 -1.68 -0.04 -1.26 -4.28 135.00 127.64 3hqp n PRO 291 Ca -0.17 0.58 -0.18 0.00 -0.04 0.00 0.00 63.50 63.68 3hqp n PRO 291 Cb 0.52 -2.13 -0.14 0.00 -0.04 0.00 0.00 33.50 31.72 3hqp n PRO 291 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3hqp s VAL 292 N -1.18 0.78 -0.07 0.52 0.11 -1.26 -1.72 120.40 117.58 3hqp s VAL 292 Ca 0.60 -0.59 0.04 0.00 -2.93 0.00 0.00 61.98 59.10 3hqp s VAL 292 Cb -0.58 -0.68 0.00 0.00 -1.53 0.00 0.00 36.38 33.59 3hqp s VAL 292 CO 0.59 0.10 -0.19 -0.63 -3.33 0.00 0.00 175.10 171.64 3hqp s ILE 293 N -0.47 1.65 -0.19 7.04 1.01 -0.52 -1.50 121.20 128.23 3hqp s ILE 293 Ca 0.02 -0.80 -0.14 0.00 0.00 0.00 0.00 60.65 59.73 3hqp s ILE 293 Cb -0.05 -1.44 -0.04 0.00 0.01 0.00 0.00 42.46 40.94 3hqp s ILE 293 CO 0.00 0.47 0.29 0.00 0.00 0.00 0.00 174.94 175.71 3hqp s ALA 295 N 0.80 1.26 0.00 0.00 0.00 -0.91 -2.12 121.76 120.79 3hqp s ALA 295 Ca 0.15 -1.10 0.00 0.00 0.00 0.00 0.00 51.96 51.02 3hqp s ALA 295 Cb -0.13 -0.08 0.00 0.00 0.00 0.00 0.00 23.12 22.91 3hqp s ALA 295 CO 0.05 0.13 0.00 2.41 0.00 0.00 0.00 175.76 178.35 3hqp n THR 296 N 1.01 -1.18 -2.01 0.00 -1.04 -1.26 -3.31 114.28 106.49 3hqp n THR 296 Ca -0.19 0.00 -0.15 0.00 -2.04 0.00 0.00 64.05 61.67 3hqp n THR 296 Cb 0.55 -1.18 -0.03 0.00 -1.82 0.00 0.00 70.33 67.85 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 1.13 -1.17 -0.09 -2.82 6.02 -1.26 -4.77 117.38 114.42 3hqp n GLN 297 Ca 0.00 0.84 -0.13 0.00 -0.01 0.00 0.00 57.00 57.70 3hqp n GLN 297 Cb 0.00 -5.12 -0.04 0.00 1.02 0.00 0.00 30.24 26.09 3hqp n GLN 297 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.06 176.57 3hqp h MET 298 N 0.00 0.69 -0.81 -1.09 2.86 -1.89 -3.32 114.93 111.37 3hqp h MET 298 Ca -0.35 -0.36 -0.41 0.00 -2.06 0.00 0.00 59.70 56.52 3hqp h MET 298 Cb 1.18 0.01 -0.41 0.00 0.06 0.00 0.00 31.60 32.44 3hqp h MET 298 CO 0.44 0.97 -0.99 1.28 1.06 0.00 0.00 176.91 179.67 3hqp n LEU 299 N -4.28 3.00 -0.30 1.22 4.77 -1.26 -4.56 117.00 115.59 3hqp n LEU 299 Ca -0.04 -4.00 0.08 0.00 -0.03 0.00 0.00 56.01 52.02 3hqp n LEU 299 Cb 0.46 0.09 0.23 0.00 -2.33 0.00 0.00 43.42 41.87 3hqp n LEU 299 CO 0.45 1.64 1.10 -0.08 -1.33 0.00 0.00 177.39 179.16 3hqp h GLU 300 N 2.56 0.59 0.00 3.23 4.57 -1.97 -0.47 114.58 123.09 3hqp h GLU 300 Ca 0.08 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.23 3hqp h GLU 300 Cb 1.27 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 29.73 3hqp h GLU 300 CO 0.52 0.39 0.00 0.66 -1.18 0.00 0.00 179.01 179.40 3hqp h SER 301 N 0.61 0.00 -0.00 1.04 4.64 -1.93 -2.41 113.55 115.50 3hqp h SER 301 Ca 0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.79 3hqp h SER 301 Cb 0.69 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 3hqp h SER 301 CO -0.38 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 175.81 3hqp n MET 302 N -2.45 1.00 0.26 4.77 2.81 -0.18 -0.87 117.12 122.45 3hqp n MET 302 Ca 0.01 -0.01 0.12 0.00 -1.81 0.00 0.00 57.70 56.01 3hqp n MET 302 Cb 0.19 -1.43 0.69 0.00 -0.71 0.00 0.00 33.22 31.96 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 0.02 0.57 0.00 2.03 2.02 -1.58 -3.37 112.91 112.59 3hqp h THR 303 Ca 0.00 -0.61 0.00 0.00 0.77 0.00 0.00 66.41 66.57 3hqp h THR 303 Cb 0.00 1.40 0.00 0.00 -1.74 0.00 0.00 68.15 67.81 3hqp h THR 303 CO 0.00 0.13 -0.74 -1.22 0.37 0.00 0.00 175.52 174.06 3hqp n TYR 304 N -3.61 0.00 -4.20 3.16 4.02 -0.81 -1.49 117.16 114.23 3hqp n TYR 304 Ca -0.02 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.57 3hqp n TYR 304 Cb 0.26 0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.49 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 -2.18 4.77 0.01 7.72 0.02 -0.05 -4.95 114.94 120.27 3hqp s ASN 305 Ca 0.00 -0.24 0.23 0.00 -1.02 0.00 0.00 52.86 51.83 3hqp s ASN 305 Cb 0.00 -1.07 0.96 0.00 0.02 0.00 0.00 41.25 41.17 3hqp s ASN 305 CO 0.00 0.19 1.73 -0.81 0.02 0.00 0.00 177.10 178.23 3hqp n PRO 306 N 0.74 0.01 -3.88 -0.60 -0.04 -1.26 -4.25 135.00 125.71 3hqp n PRO 306 Ca -0.12 0.12 -0.10 0.00 -0.04 0.00 0.00 63.50 63.35 3hqp n PRO 306 Cb 0.52 -1.51 -0.09 0.00 -0.04 0.00 0.00 33.50 32.38 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 -3.01 0.62 0.75 0.54 1.70 -1.26 -4.90 118.95 113.39 3hqp s ARG 307 Ca 0.11 -0.66 -0.07 0.00 -0.47 0.00 0.00 55.73 54.64 3hqp s ARG 307 Cb 0.15 0.25 0.10 0.00 -0.57 0.00 0.00 34.95 34.88 3hqp s ARG 307 CO 0.42 -0.17 1.06 -1.25 -1.08 0.00 0.00 175.30 174.28 3hqp s PRO 308 N -2.45 1.82 0.91 3.89 0.04 -1.26 -4.70 135.00 133.25 3hqp s PRO 308 Ca -0.06 -0.46 -0.14 0.00 0.04 0.00 0.00 61.00 60.38 3hqp s PRO 308 Cb -0.02 -2.15 0.17 0.00 0.04 0.00 0.00 34.50 32.55 3hqp s PRO 308 CO -0.04 -1.48 1.26 0.95 0.04 0.00 0.00 177.00 177.74 3hqp s THR 309 N -3.33 2.02 0.15 1.26 -4.23 -1.26 -4.95 115.64 105.30 3hqp s THR 309 Ca 0.64 -0.08 -0.00 0.00 -1.18 0.00 0.00 61.69 61.07 3hqp s THR 309 Cb -0.08 -2.95 -0.17 0.00 1.34 0.00 0.00 72.50 70.64 3hqp s THR 309 CO 0.46 0.00 1.34 0.03 -0.54 0.00 0.00 174.62 175.91 3hqp h ARG 310 N -1.42 0.28 -0.73 3.99 2.47 -2.00 -2.95 114.38 114.02 3hqp h ARG 310 Ca -0.44 -0.31 -0.06 0.00 -1.26 0.00 0.00 59.98 57.92 3hqp h ARG 310 Cb 1.25 0.09 -0.03 0.00 -1.65 0.00 0.00 29.97 29.63 3hqp h ARG 310 CO 0.42 1.02 0.23 0.00 0.56 0.00 0.00 179.97 182.20 3hqp h ALA 311 N 0.87 0.95 -0.32 0.04 0.00 -1.99 -2.60 119.26 116.21 3hqp h ALA 311 Ca -0.06 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.57 3hqp h ALA 311 Cb 1.55 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 3hqp h ALA 311 CO 0.15 0.64 0.01 0.93 0.00 0.00 0.00 179.25 180.98 3hqp h GLU 312 N 1.08 0.56 -0.40 0.00 5.08 -1.79 0.44 114.58 119.55 3hqp h GLU 312 Ca 0.23 -0.17 0.01 0.00 -1.00 0.00 0.00 59.36 58.43 3hqp h GLU 312 Cb 0.31 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 3hqp h GLU 312 CO -0.01 0.69 0.25 0.28 -1.00 0.00 0.00 179.01 179.22 3hqp h VAL 313 N 0.37 1.07 -0.44 3.13 2.07 -1.53 -2.32 116.25 118.60 3hqp h VAL 313 Ca 0.09 -0.17 0.04 0.00 0.82 0.00 0.00 66.70 67.48 3hqp h VAL 313 Cb 0.43 0.52 -0.04 0.00 -1.52 0.00 0.00 31.29 30.67 3hqp h VAL 313 CO 0.01 0.09 0.21 -1.28 0.02 0.00 0.00 177.57 176.63 3hqp h SER 314 N 0.51 0.30 -0.63 0.57 0.87 -1.28 -2.43 113.55 111.45 3hqp h SER 314 Ca 0.15 0.03 0.05 0.00 -1.23 0.00 0.00 61.79 60.79 3hqp h SER 314 Cb -0.02 -0.03 -0.05 0.00 -0.44 0.00 0.00 62.40 61.86 3hqp h SER 314 CO -0.06 0.22 0.35 -0.78 -0.53 0.00 0.00 176.83 176.03 3hqp h ASP 315 N 0.43 0.53 -0.58 6.23 3.58 -0.64 -0.88 116.42 125.09 3hqp h ASP 315 Ca 0.19 0.02 -0.09 0.00 0.42 0.00 0.00 57.03 57.58 3hqp h ASP 315 Cb 0.11 -0.08 -0.02 0.00 1.72 0.00 0.00 39.33 41.05 3hqp h ASP 315 CO -0.14 0.35 0.01 0.58 -2.88 0.00 0.00 179.24 177.17 3hqp h VAL 316 N 0.67 1.26 -0.29 2.25 2.07 -1.15 -2.12 116.25 118.94 3hqp h VAL 316 Ca 0.28 -1.11 -0.15 0.00 0.82 0.00 0.00 66.70 66.54 3hqp h VAL 316 Cb 0.15 0.84 -0.00 0.00 -1.52 0.00 0.00 31.29 30.76 3hqp h VAL 316 CO -0.16 0.40 -0.40 0.00 0.02 0.00 0.00 177.57 177.43 3hqp h ALA 317 N 0.98 0.43 0.00 1.67 0.00 -1.20 -3.06 119.26 118.08 3hqp h ALA 317 Ca 0.16 -0.45 -0.07 0.00 0.00 0.00 0.00 54.91 54.56 3hqp h ALA 317 Cb 0.53 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3hqp h ALA 317 CO 0.03 0.54 -0.31 -0.91 0.00 0.00 0.00 179.25 178.59 3hqp h ASN 318 N 0.53 0.00 -0.14 0.00 2.35 -1.12 -0.57 115.58 116.62 3hqp h ASN 318 Ca 0.03 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.78 3hqp h ASN 318 Cb 1.00 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.36 3hqp h ASN 318 CO 0.09 0.31 0.08 0.00 -1.65 0.00 0.00 177.43 176.27 3hqp h ALA 319 N 1.69 0.18 -0.76 -0.83 0.00 -1.32 0.16 119.26 118.38 3hqp h ALA 319 Ca -0.00 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 54.90 3hqp h ALA 319 Cb 0.68 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.36 3hqp h ALA 319 CO 0.04 -0.29 0.47 0.28 0.00 0.00 0.00 179.25 179.76 3hqp h VAL 320 N 0.14 1.07 -0.32 0.00 2.07 -1.36 -2.23 116.25 115.61 3hqp h VAL 320 Ca 0.05 -0.31 -0.07 0.00 0.82 0.00 0.00 66.70 67.20 3hqp h VAL 320 Cb 0.06 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 29.91 3hqp h VAL 320 CO -0.01 0.16 -0.09 -0.26 0.02 0.00 0.00 177.57 177.39 3hqp h PHE 321 N 0.90 0.57 0.00 1.57 0.04 -0.82 -2.58 116.94 116.61 3hqp h PHE 321 Ca 0.32 -0.08 -0.03 0.00 2.80 0.00 0.00 57.97 60.98 3hqp h PHE 321 Cb 0.09 -0.16 -0.00 0.00 2.20 0.00 0.00 35.95 38.08 3hqp h PHE 321 CO -0.04 0.62 -0.14 -0.91 -0.60 0.00 0.00 178.31 177.24 3hqp h ASN 322 N 0.50 0.00 0.00 2.17 -0.26 -0.28 -3.47 115.58 114.25 3hqp h ASN 322 Ca 0.10 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.84 3hqp h ASN 322 Cb 0.46 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.72 3hqp h ASN 322 CO 0.03 0.14 0.00 0.61 -1.06 0.00 0.00 177.43 177.14 3hqp n GLY 323 N -0.99 1.47 3.76 2.83 0.00 -0.97 -4.57 105.19 106.72 3hqp n GLY 323 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 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 3.63 0.10 4.61 0.00 -0.88 -4.91 121.76 122.31 3hqp s ALA 324 Ca 0.00 1.48 -0.13 0.00 0.00 0.00 0.00 51.96 53.31 3hqp s ALA 324 Cb 0.00 -3.59 -0.17 0.00 0.00 0.00 0.00 23.12 19.36 3hqp s ALA 324 CO 0.00 -0.91 1.28 -0.44 0.00 0.00 0.00 175.76 175.69 3hqp h ASP 325 N 4.09 0.93 -4.71 0.00 5.19 -1.59 -3.44 116.42 116.88 3hqp h ASP 325 Ca -0.48 -0.65 -0.29 0.00 -0.62 0.00 0.00 57.03 54.99 3hqp h ASP 325 Cb 1.23 -0.28 -0.21 0.00 0.18 0.00 0.00 39.33 40.24 3hqp h ASP 325 CO 0.72 1.45 -0.74 0.00 -3.12 0.00 0.00 179.24 177.55 3hqp s VAL 327 N -1.34 2.20 0.04 0.00 -7.23 -0.44 -1.21 120.40 112.41 3hqp s VAL 327 Ca -0.09 -1.66 0.07 0.00 -1.81 0.00 0.00 61.98 58.49 3hqp s VAL 327 Cb -0.10 -1.93 -0.02 0.00 0.56 0.00 0.00 36.38 34.88 3hqp s VAL 327 CO 0.01 0.14 -0.21 -0.32 -0.31 0.00 0.00 175.10 174.41 3hqp s MET 328 N -1.86 1.45 -0.15 4.82 1.75 -0.90 -1.11 119.30 123.30 3hqp s MET 328 Ca 0.13 -0.94 -0.01 0.00 -1.25 0.00 0.00 55.69 53.61 3hqp s MET 328 Cb -0.10 -1.56 -0.02 0.00 2.84 0.00 0.00 34.83 36.00 3hqp s MET 328 CO 0.05 0.40 -0.10 -0.51 -0.65 0.00 0.00 175.02 174.21 3hqp s LEU 329 N -1.14 2.82 0.00 4.11 1.43 0.72 -4.29 118.68 122.34 3hqp s LEU 329 Ca 0.08 -0.30 0.00 0.00 -1.03 0.00 0.00 54.13 52.88 3hqp s LEU 329 Cb -0.09 -1.65 0.00 0.00 0.03 0.00 0.00 46.19 44.48 3hqp s LEU 329 CO 0.02 0.14 0.00 -1.20 0.23 0.00 0.00 176.35 175.54 3hqp n SER 330 N 3.69 0.00 0.29 2.29 7.64 -1.26 -1.67 113.62 124.60 3hqp n SER 330 Ca -0.18 0.00 0.18 0.00 1.01 0.00 0.00 58.87 59.88 3hqp n SER 330 Cb 0.52 0.00 0.80 0.00 -1.01 0.00 0.00 64.21 64.53 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 1.54 0.23 0.00 -1.97 -1.85 103.07 101.02 3hqp h GLY 331 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.34 3hqp h GLY 331 CO 0.00 0.00 0.28 0.83 0.00 0.00 0.00 176.54 177.65 3hqp h GLU 332 N 0.00 0.52 0.00 4.80 3.07 -1.90 -1.76 114.58 119.31 3hqp h GLU 332 Ca -0.00 -0.03 -0.27 0.00 -0.50 0.00 0.00 59.36 58.56 3hqp h GLU 332 Cb 0.39 -0.12 -0.05 0.00 -0.84 0.00 0.00 28.75 28.13 3hqp h GLU 332 CO 0.00 0.34 -2.01 0.25 -1.40 0.00 0.00 179.01 176.20 3hqp n THR 333 N -4.48 1.01 0.04 1.13 -2.24 -1.16 -3.63 114.28 104.95 3hqp n THR 333 Ca 0.04 -0.51 -0.12 0.00 -2.27 0.00 0.00 64.05 61.19 3hqp n THR 333 Cb 0.09 -0.87 -0.07 0.00 -2.10 0.00 0.00 70.33 67.38 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 0.37 -0.00 0.00 6.98 0.00 -0.89 -3.35 119.26 122.37 3hqp h ALA 334 Ca -0.40 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.50 3hqp h ALA 334 Cb 1.76 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.55 3hqp h ALA 334 CO -0.02 -0.49 -0.09 0.36 0.00 0.00 0.00 179.25 179.01 3hqp n LYS 335 N -5.08 0.95 -1.74 0.00 2.85 -0.77 -1.78 118.16 112.58 3hqp n LYS 335 Ca -0.07 -1.09 -0.30 0.00 -1.05 0.00 0.00 58.31 55.80 3hqp n LYS 335 Cb 0.04 -0.74 0.05 0.00 -0.65 0.00 0.00 35.03 33.72 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 -0.77 1.64 0.34 2.58 0.00 -0.73 -4.87 107.32 105.51 3hqp s GLY 336 Ca 0.04 -0.17 0.23 0.00 0.00 0.00 0.00 44.72 44.82 3hqp s GLY 336 CO 0.00 0.18 1.45 0.50 0.00 0.00 0.00 173.10 175.23 3hqp h LYS 337 N -0.70 0.00 -2.07 2.90 1.57 -1.50 -3.40 116.57 113.38 3hqp h LYS 337 Ca -0.45 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 57.82 3hqp h LYS 337 Cb 1.23 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 33.14 3hqp h LYS 337 CO 0.61 0.00 -1.07 0.66 -0.57 0.00 0.00 179.45 179.08 3hqp n TYR 338 N -2.87 1.10 -0.09 -1.35 4.01 -1.26 -4.97 117.16 111.74 3hqp n TYR 338 Ca 0.03 -3.86 -0.07 0.00 -0.16 0.00 0.00 57.90 53.84 3hqp n TYR 338 Cb 0.52 -0.44 0.00 0.00 -0.31 0.00 0.00 39.34 39.12 3hqp n TYR 338 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3hqp h PRO 339 N 3.00 0.14 -0.37 -0.72 0.13 -1.78 -2.03 132.00 130.38 3hqp h PRO 339 Ca 0.11 -0.01 -0.12 0.00 -0.87 0.00 0.00 66.00 65.11 3hqp h PRO 339 Cb 0.86 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.94 3hqp h PRO 339 CO 0.58 0.09 -0.24 -0.91 -0.23 0.00 0.00 178.00 177.29 3hqp h ASN 340 N 0.15 0.76 -0.36 1.44 2.35 -1.93 -2.87 115.58 115.11 3hqp h ASN 340 Ca 0.15 -0.28 -0.14 0.00 -0.55 0.00 0.00 56.30 55.48 3hqp h ASN 340 Cb 0.17 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 3hqp h ASN 340 CO -0.21 0.97 -0.29 -0.33 -1.65 0.00 0.00 177.43 175.92 3hqp h GLU 341 N 0.64 0.89 -0.40 0.81 3.07 -1.92 -1.37 114.58 116.30 3hqp h GLU 341 Ca 0.09 -0.41 -0.12 0.00 -0.50 0.00 0.00 59.36 58.42 3hqp h GLU 341 Cb 0.75 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.63 3hqp h GLU 341 CO 0.06 1.06 -0.23 -0.24 -1.40 0.00 0.00 179.01 178.26 3hqp h VAL 342 N 0.75 1.27 -0.28 3.13 3.04 -1.28 0.50 116.25 123.39 3hqp h VAL 342 Ca 0.08 -1.35 -0.15 0.00 -1.01 0.00 0.00 66.70 64.28 3hqp h VAL 342 Cb 0.86 1.21 -0.00 0.00 -2.01 0.00 0.00 31.29 31.34 3hqp h VAL 342 CO 0.08 0.45 -0.41 0.58 -1.01 0.00 0.00 177.57 177.26 3hqp h VAL 343 N 0.69 1.30 -0.69 1.51 2.07 -1.45 -2.37 116.25 117.31 3hqp h VAL 343 Ca 0.09 -1.60 -0.02 0.00 0.82 0.00 0.00 66.70 65.99 3hqp h VAL 343 Cb 0.74 1.65 -0.03 0.00 -1.52 0.00 0.00 31.29 32.13 3hqp h VAL 343 CO 0.06 0.51 0.36 1.56 0.02 0.00 0.00 177.57 180.08 3hqp h GLN 344 N 0.52 0.97 0.13 1.57 4.20 -1.02 -1.38 115.11 120.10 3hqp h GLN 344 Ca 0.03 -0.13 0.01 0.00 0.06 0.00 0.00 58.65 58.62 3hqp h GLN 344 Cb 1.01 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.59 3hqp h GLN 344 CO 0.10 0.75 -0.15 1.88 -0.67 0.00 0.00 178.83 180.73 3hqp h TYR 345 N 0.95 -0.39 -0.83 2.96 0.05 -0.89 -1.96 116.97 116.87 3hqp h TYR 345 Ca 0.24 0.00 0.04 0.00 0.05 0.00 0.00 58.73 59.07 3hqp h TYR 345 Cb 0.07 0.15 -0.05 0.00 1.01 0.00 0.00 36.73 37.92 3hqp h TYR 345 CO -0.00 -0.23 0.55 1.98 -1.05 0.00 0.00 178.16 179.41 3hqp h MET 346 N -0.32 0.97 -0.32 4.88 4.05 -1.21 0.13 114.93 123.10 3hqp h MET 346 Ca 0.01 -0.06 -0.02 0.00 -0.28 0.00 0.00 59.70 59.35 3hqp h MET 346 Cb 0.31 -0.22 -0.01 0.00 -0.80 0.00 0.00 31.60 30.88 3hqp h MET 346 CO -0.05 0.64 0.13 0.00 0.23 0.00 0.00 176.91 177.86 3hqp h ALA 347 N 1.52 0.42 -0.82 0.39 0.00 -1.12 -1.10 119.26 118.55 3hqp h ALA 347 Ca 0.34 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 3hqp h ALA 347 Cb 0.09 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 3hqp h ALA 347 CO -0.11 0.01 0.49 -0.09 0.00 0.00 0.00 179.25 179.55 3hqp h ARG 348 N 0.37 1.12 -0.22 0.00 2.43 -0.53 -1.47 114.38 116.09 3hqp h ARG 348 Ca 0.11 -0.11 -0.11 0.00 -0.81 0.00 0.00 59.98 59.06 3hqp h ARG 348 Cb 0.18 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 29.49 3hqp h ARG 348 CO -0.01 0.80 -0.29 0.82 -1.51 0.00 0.00 179.97 179.78 3hqp h ILE 349 N 1.13 1.32 -0.46 1.20 2.04 -0.90 -2.28 117.51 119.57 3hqp h ILE 349 Ca 0.29 -1.48 0.05 0.00 1.00 0.00 0.00 64.86 64.72 3hqp h ILE 349 Cb -0.03 1.76 -0.04 0.00 -0.74 0.00 0.00 36.82 37.76 3hqp h ILE 349 CO -0.05 0.46 0.20 0.00 0.00 0.00 0.00 178.15 178.76 3hqp h LEU 351 N 0.41 0.57 -0.06 0.00 3.38 -1.23 0.05 115.31 118.43 3hqp h LEU 351 Ca 0.21 -0.05 -0.14 0.00 0.09 0.00 0.00 57.88 57.99 3hqp h LEU 351 Cb 0.15 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 40.76 3hqp h LEU 351 CO -0.17 0.49 -0.51 -0.08 0.09 0.00 0.00 178.44 178.26 3hqp h GLU 352 N 0.65 0.45 -0.26 1.13 4.57 -0.97 -3.07 114.58 117.08 3hqp h GLU 352 Ca 0.16 -0.40 -0.01 0.00 -1.18 0.00 0.00 59.36 57.93 3hqp h GLU 352 Cb 0.07 0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.74 3hqp h GLU 352 CO -0.02 1.05 0.10 0.00 -1.18 0.00 0.00 179.01 178.95 3hqp h ALA 353 N 0.41 1.70 -0.28 2.92 0.00 -0.75 -2.15 119.26 121.12 3hqp h ALA 353 Ca -0.05 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 3hqp h ALA 353 Cb 1.17 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 3hqp h ALA 353 CO 0.10 0.24 -0.15 0.37 0.00 0.00 0.00 179.25 179.82 3hqp h GLN 354 N 0.36 0.48 -0.36 0.00 4.15 -1.01 -2.43 115.11 116.30 3hqp h GLN 354 Ca 0.09 -0.15 -0.02 0.00 0.77 0.00 0.00 58.65 59.34 3hqp h GLN 354 Cb 0.08 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.71 3hqp h GLN 354 CO -0.01 0.62 0.12 0.77 -1.93 0.00 0.00 178.83 178.41 3hqp h SER 355 N 0.44 0.46 0.30 -0.69 0.02 -1.29 -2.92 113.55 109.88 3hqp h SER 355 Ca 0.08 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 3hqp h SER 355 Cb 0.53 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.95 3hqp h SER 355 CO 0.03 0.44 -0.54 0.00 -1.14 0.00 0.00 176.83 175.63 3hqp n ALA 356 N -2.48 3.67 -1.76 3.77 0.00 -0.96 -4.91 120.51 117.84 3hqp n ALA 356 Ca 0.02 -0.43 -0.39 0.00 0.00 0.00 0.00 53.44 52.63 3hqp n ALA 356 Cb 0.15 -1.03 -0.04 0.00 0.00 0.00 0.00 19.45 18.54 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 -2.84 4.44 -0.99 0.00 2.96 -0.96 -4.99 118.68 116.31 3hqp s LEU 357 Ca 0.14 2.25 -0.10 0.00 -0.22 0.00 0.00 54.13 56.21 3hqp s LEU 357 Cb 0.18 -3.76 0.25 0.00 0.50 0.00 0.00 46.19 43.36 3hqp s LEU 357 CO 0.68 -0.27 0.95 0.21 -1.32 0.00 0.00 176.35 176.60 3hqp s ASN 358 N -1.01 6.95 0.41 3.68 3.84 -1.26 -4.91 114.94 122.65 3hqp s ASN 358 Ca 0.48 -3.30 0.07 0.00 0.21 0.00 0.00 52.86 50.32 3hqp s ASN 358 Cb -0.30 -2.17 0.88 0.00 -0.55 0.00 0.00 41.25 39.10 3hqp s ASN 358 CO 0.39 -0.37 2.06 -0.33 -2.79 0.00 0.00 177.10 176.06 3hqp h GLU 359 N 6.96 0.51 -0.22 0.43 3.07 -1.94 -1.83 114.58 121.56 3hqp h GLU 359 Ca 0.15 -0.03 -0.17 0.00 -0.50 0.00 0.00 59.36 58.80 3hqp h GLU 359 Cb 0.92 -0.11 -0.00 0.00 -0.84 0.00 0.00 28.75 28.72 3hqp h GLU 359 CO 0.91 0.34 -0.56 -0.92 -1.40 0.00 0.00 179.01 177.38 3hqp h TYR 360 N 0.53 0.87 -0.37 4.33 3.20 -1.91 0.96 116.97 124.57 3hqp h TYR 360 Ca 0.14 -0.31 -0.15 0.00 3.14 0.00 0.00 58.73 61.55 3hqp h TYR 360 Cb -0.05 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.05 3hqp h TYR 360 CO 0.00 1.09 -0.36 0.28 -1.64 0.00 0.00 178.16 177.53 3hqp h VAL 361 N 0.52 1.28 -0.31 1.81 2.07 -1.87 -1.40 116.25 118.35 3hqp h VAL 361 Ca 0.01 -1.53 0.01 0.00 0.82 0.00 0.00 66.70 66.00 3hqp h VAL 361 Cb 1.14 1.37 -0.02 0.00 -1.52 0.00 0.00 31.29 32.26 3hqp h VAL 361 CO 0.11 0.51 0.19 0.15 0.02 0.00 0.00 177.57 178.56 3hqp h PHE 362 N 0.72 0.37 -0.12 1.57 -0.00 -1.12 -0.64 116.94 117.72 3hqp h PHE 362 Ca 0.07 0.01 0.04 0.00 -0.00 0.00 0.00 57.97 58.08 3hqp h PHE 362 Cb 0.93 -0.12 -0.04 0.00 -0.00 0.00 0.00 35.95 36.72 3hqp h PHE 362 CO 0.06 0.23 -0.11 0.35 -0.00 0.00 0.00 178.31 178.83 3hqp h PHE 363 N 0.40 -0.28 -0.60 0.41 3.57 -0.71 -2.21 116.94 117.52 3hqp h PHE 363 Ca 0.12 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.54 3hqp h PHE 363 Cb -0.03 0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.83 3hqp h PHE 363 CO -0.06 -0.17 0.01 -0.91 -2.23 0.00 0.00 178.31 174.95 3hqp h ASN 364 N -0.14 1.00 -0.69 0.41 2.35 -1.10 -1.34 115.58 116.08 3hqp h ASN 364 Ca 0.08 -0.27 -0.04 0.00 -0.55 0.00 0.00 56.30 55.52 3hqp h ASN 364 Cb 0.26 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.33 3hqp h ASN 364 CO -0.20 1.05 0.27 0.28 -1.65 0.00 0.00 177.43 177.18 3hqp h SER 365 N 0.95 0.95 -0.04 5.81 0.02 -0.99 -1.35 113.55 118.90 3hqp h SER 365 Ca 0.17 -0.17 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 3hqp h SER 365 Cb 0.53 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 62.82 3hqp h SER 365 CO 0.03 0.86 -0.04 0.40 -1.14 0.00 0.00 176.83 176.95 3hqp h ILE 366 N 0.98 1.37 -0.73 3.27 2.04 -1.32 -2.73 117.51 120.38 3hqp h ILE 366 Ca 0.23 -1.16 0.14 0.00 1.00 0.00 0.00 64.86 65.07 3hqp h ILE 366 Cb 0.21 2.07 -0.14 0.00 -0.74 0.00 0.00 36.82 38.22 3hqp h ILE 366 CO -0.02 0.31 -0.21 0.50 0.00 0.00 0.00 178.15 178.73 3hqp h LYS 367 N -0.35 -0.02 0.00 2.37 3.64 -1.18 -1.50 116.57 119.53 3hqp h LYS 367 Ca 0.01 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 3hqp h LYS 367 Cb 0.53 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.35 3hqp h LYS 367 CO 0.01 -0.01 -0.08 0.87 -2.27 0.00 0.00 179.45 177.97 3hqp h LYS 368 N -0.02 0.00 -0.17 1.90 6.56 -1.15 -2.84 116.57 120.86 3hqp h LYS 368 Ca 0.34 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.93 3hqp h LYS 368 Cb 0.55 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.21 3hqp h LYS 368 CO -0.76 0.08 0.00 1.28 -2.06 0.00 0.00 179.45 177.99 3hqp n LEU 369 N -3.33 2.29 -4.80 2.94 4.77 -0.57 -4.91 117.00 113.38 3hqp n LEU 369 Ca -0.01 -0.90 -0.38 0.00 -0.03 0.00 0.00 56.01 54.70 3hqp n LEU 369 Cb 0.26 -0.10 -0.06 0.00 -2.33 0.00 0.00 43.42 41.19 3hqp n LEU 369 CO 0.28 0.45 0.42 -1.10 -1.33 0.00 0.00 177.39 176.11 3hqp s GLN 370 N -1.80 4.38 0.18 3.23 -1.52 -1.07 -5.04 119.66 118.02 3hqp s GLN 370 Ca 0.34 0.97 -0.30 0.00 -1.95 0.00 0.00 55.36 54.42 3hqp s GLN 370 Cb 0.20 -3.09 -0.08 0.00 -0.22 0.00 0.00 33.01 29.82 3hqp s GLN 370 CO 0.30 0.50 1.23 -1.58 -0.25 0.00 0.00 175.29 175.49 3hqp s HIS 371 N -1.31 3.39 -0.18 0.91 5.65 -1.26 -5.02 115.29 117.47 3hqp s HIS 371 Ca 0.38 1.36 -0.06 0.00 0.25 0.00 0.00 55.06 56.99 3hqp s HIS 371 Cb -0.20 -3.47 -0.03 0.00 -1.18 0.00 0.00 32.58 27.70 3hqp s HIS 371 CO 0.23 -1.38 0.02 0.42 -0.65 0.00 0.00 174.74 173.37 3hqp s ILE 372 N 0.10 4.28 0.46 0.89 1.01 -1.26 -3.44 121.20 123.24 3hqp s ILE 372 Ca 0.54 -0.21 -0.15 0.00 0.00 0.00 0.00 60.65 60.83 3hqp s ILE 372 Cb -0.33 -2.92 -0.08 0.00 0.01 0.00 0.00 42.46 39.14 3hqp s ILE 372 CO 0.36 0.46 0.90 -2.16 0.00 0.00 0.00 174.94 174.50 3hqp s PRO 373 N 0.58 3.94 0.56 2.79 0.04 -1.26 -5.19 135.00 136.46 3hqp s PRO 373 Ca 0.00 0.81 -0.06 0.00 0.04 0.00 0.00 61.00 61.80 3hqp s PRO 373 Cb -0.14 -2.24 -0.01 0.00 0.04 0.00 0.00 34.50 32.16 3hqp s PRO 373 CO 0.02 -0.14 0.87 -1.64 0.04 0.00 0.00 177.00 176.15 3hqp s MET 374 N -3.81 3.13 0.64 4.56 -1.94 -1.22 -5.07 119.30 115.59 3hqp s MET 374 Ca 0.57 0.09 -0.16 0.00 -1.71 0.00 0.00 55.69 54.47 3hqp s MET 374 Cb -0.10 -2.29 -0.01 0.00 2.01 0.00 0.00 34.83 34.44 3hqp s MET 374 CO 0.28 -0.55 1.12 -1.54 -0.01 0.00 0.00 175.02 174.32 3hqp s SER 375 N -4.24 5.15 0.24 3.03 1.04 -1.26 -4.84 113.70 112.82 3hqp s SER 375 Ca 0.52 2.07 -0.04 0.00 0.48 0.00 0.00 55.95 58.98 3hqp s SER 375 Cb -0.10 -2.56 0.45 0.00 0.10 0.00 0.00 66.02 63.91 3hqp s SER 375 CO 0.45 -1.60 1.72 0.00 0.98 0.00 0.00 173.24 174.79 3hqp h ALA 376 N 0.24 1.04 -0.30 5.32 0.00 -1.97 -1.50 119.26 122.09 3hqp h ALA 376 Ca -0.48 0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.45 3hqp h ALA 376 Cb 1.25 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 3hqp h ALA 376 CO 0.54 -0.23 -0.26 0.38 0.00 0.00 0.00 179.25 179.68 3hqp h ASP 377 N 0.41 0.59 -0.25 0.00 3.04 -1.93 -1.03 116.42 117.26 3hqp h ASP 377 Ca 0.41 -0.21 -0.08 0.00 -3.24 0.00 0.00 57.03 53.91 3hqp h ASP 377 Cb 0.64 -0.16 -0.01 0.00 -1.04 0.00 0.00 39.33 38.76 3hqp h ASP 377 CO -0.42 0.84 -0.14 -0.08 -2.04 0.00 0.00 179.24 177.40 3hqp h GLU 378 N 0.51 0.54 -0.86 4.15 4.81 -1.76 -2.54 114.58 119.43 3hqp h GLU 378 Ca 0.07 -0.24 0.08 0.00 -0.13 0.00 0.00 59.36 59.14 3hqp h GLU 378 Cb 0.71 -0.01 -0.07 0.00 0.63 0.00 0.00 28.75 30.01 3hqp h GLU 378 CO 0.05 0.80 0.52 0.00 -0.73 0.00 0.00 179.01 179.66 3hqp h ALA 379 N 0.72 1.22 -0.25 2.92 0.00 -1.10 0.84 119.26 123.60 3hqp h ALA 379 Ca 0.05 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.00 3hqp h ALA 379 Cb 0.65 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 3hqp h ALA 379 CO 0.04 0.21 0.08 0.28 0.00 0.00 0.00 179.25 179.86 3hqp h VAL 380 N 0.91 0.92 -0.46 0.00 2.07 -1.13 0.10 116.25 118.67 3hqp h VAL 380 Ca 0.40 -0.07 -0.14 0.00 0.82 0.00 0.00 66.70 67.71 3hqp h VAL 380 Cb 0.27 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 30.75 3hqp h VAL 380 CO -0.21 0.03 -0.25 0.00 0.02 0.00 0.00 177.57 177.17 3hqp h SER 382 N 0.84 0.44 0.52 0.00 0.87 -0.68 -2.13 113.55 113.39 3hqp h SER 382 Ca 0.10 -0.20 -0.13 0.00 -1.23 0.00 0.00 61.79 60.33 3hqp h SER 382 Cb 0.83 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 62.66 3hqp h SER 382 CO 0.07 0.52 -0.60 0.28 -0.53 0.00 0.00 176.83 176.57 3hqp h SER 383 N 0.33 0.09 -0.28 6.23 0.02 -0.74 -2.45 113.55 116.76 3hqp h SER 383 Ca 0.10 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 3hqp h SER 383 Cb 0.24 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.74 3hqp h SER 383 CO -0.00 0.67 0.18 0.00 -1.14 0.00 0.00 176.83 176.53 3hqp h ALA 384 N 1.33 0.35 -0.73 3.77 0.00 -0.84 -0.67 119.26 122.46 3hqp h ALA 384 Ca -0.01 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 3hqp h ALA 384 Cb 1.07 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 3hqp h ALA 384 CO 0.08 -0.16 0.28 0.28 0.00 0.00 0.00 179.25 179.73 3hqp h VAL 385 N 0.36 1.25 -0.68 0.00 2.07 -1.32 -1.81 116.25 116.13 3hqp h VAL 385 Ca 0.10 -0.81 0.06 0.00 0.82 0.00 0.00 66.70 66.87 3hqp h VAL 385 Cb -0.02 0.41 -0.06 0.00 -1.52 0.00 0.00 31.29 30.10 3hqp h VAL 385 CO -0.02 0.33 0.38 -1.13 0.02 0.00 0.00 177.57 177.14 3hqp h ASN 386 N 1.06 0.56 -0.92 0.57 -0.73 -1.19 -1.56 115.58 113.38 3hqp h ASN 386 Ca 0.24 0.03 0.06 0.00 1.87 0.00 0.00 56.30 58.50 3hqp h ASN 386 Cb 0.23 -0.08 -0.06 0.00 0.27 0.00 0.00 38.32 38.68 3hqp h ASN 386 CO -0.02 0.36 0.58 0.28 -0.37 0.00 0.00 177.43 178.27 3hqp h SER 387 N 0.70 0.94 -0.16 1.15 0.02 -0.66 -0.95 113.55 114.58 3hqp h SER 387 Ca 0.30 0.01 0.03 0.00 -0.84 0.00 0.00 61.79 61.29 3hqp h SER 387 Cb 0.19 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.50 3hqp h SER 387 CO -0.18 0.61 -0.05 0.58 -1.14 0.00 0.00 176.83 176.65 3hqp h VAL 388 N 1.08 0.82 -0.40 2.27 2.07 -0.46 0.24 116.25 121.88 3hqp h VAL 388 Ca 0.39 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.87 3hqp h VAL 388 Cb 0.12 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 3hqp h VAL 388 CO -0.16 0.00 0.08 1.88 0.02 0.00 0.00 177.57 179.39 3hqp h TYR 389 N -0.02 0.69 -0.18 1.57 0.05 -1.16 0.12 116.97 118.03 3hqp h TYR 389 Ca 0.08 -0.09 -0.05 0.00 0.05 0.00 0.00 58.73 58.72 3hqp h TYR 389 Cb 0.14 -0.19 -0.01 0.00 1.01 0.00 0.00 36.73 37.67 3hqp h TYR 389 CO -0.20 0.67 -0.12 0.93 -1.05 0.00 0.00 178.16 178.39 3hqp h GLU 390 N 0.50 0.29 -0.00 4.88 5.08 -0.90 -3.07 114.58 121.36 3hqp h GLU 390 Ca 0.12 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 3hqp h GLU 390 Cb 0.35 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.56 3hqp h GLU 390 CO 0.01 0.42 -0.80 -2.37 -1.00 0.00 0.00 179.01 175.26 3hqp n THR 391 N -4.26 0.00 -3.74 1.13 5.66 0.05 -4.99 114.28 108.12 3hqp n THR 391 Ca -0.00 -0.10 -0.25 0.00 -3.05 0.00 0.00 64.05 60.65 3hqp n THR 391 Cb 0.27 1.02 0.05 0.00 -1.55 0.00 0.00 70.33 70.12 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 -1.29 -5.96 -2.15 1.09 5.02 0.33 -4.96 118.16 110.23 3hqp n LYS 392 Ca 0.04 0.68 -0.37 0.00 -2.02 0.00 0.00 58.31 56.63 3hqp n LYS 392 Cb 0.29 -5.52 0.00 0.00 -0.02 0.00 0.00 35.03 29.78 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 -3.42 2.96 -1.39 7.82 0.00 -0.68 -4.88 121.76 122.17 3hqp s ALA 393 Ca 0.39 1.03 0.20 0.00 0.00 0.00 0.00 51.96 53.59 3hqp s ALA 393 Cb -0.19 -3.43 -0.11 0.00 0.00 0.00 0.00 23.12 19.39 3hqp s ALA 393 CO 0.80 -0.81 0.92 1.63 0.00 0.00 0.00 175.76 178.29 3hqp n LYS 394 N -0.56 0.94 -3.55 0.00 5.02 -1.19 -4.76 118.16 114.05 3hqp n LYS 394 Ca 0.08 -0.46 -0.14 0.00 -2.02 0.00 0.00 58.31 55.77 3hqp n LYS 394 Cb 0.47 -1.42 -0.05 0.00 -0.02 0.00 0.00 35.03 34.01 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 -2.59 -1.39 0.08 7.82 0.00 -1.26 -4.18 121.76 120.25 3hqp s ALA 395 Ca 0.12 0.61 0.08 0.00 0.00 0.00 0.00 51.96 52.77 3hqp s ALA 395 Cb 0.16 0.44 -0.03 0.00 0.00 0.00 0.00 23.12 23.68 3hqp s ALA 395 CO 0.67 -0.54 -0.21 -1.64 0.00 0.00 0.00 175.76 174.04 3hqp s MET 396 N -2.59 1.26 -0.12 0.00 -1.94 -0.76 -2.06 119.30 113.09 3hqp s MET 396 Ca -0.04 -1.09 0.02 0.00 -1.71 0.00 0.00 55.69 52.87 3hqp s MET 396 Cb -0.01 -1.48 0.01 0.00 2.01 0.00 0.00 34.83 35.37 3hqp s MET 396 CO -0.03 0.36 -0.17 0.08 -0.01 0.00 0.00 175.02 175.25 3hqp s VAL 397 N -1.01 1.65 -0.13 -6.03 1.01 0.04 -0.02 120.40 115.91 3hqp s VAL 397 Ca 0.07 -0.73 0.03 0.00 0.00 0.00 0.00 61.98 61.35 3hqp s VAL 397 Cb -0.10 -1.49 0.01 0.00 0.00 0.00 0.00 36.38 34.80 3hqp s VAL 397 CO 0.03 0.47 -0.22 0.68 0.00 0.00 0.00 175.10 176.06 3hqp s VAL 398 N 0.96 2.04 -0.12 2.92 -7.23 -0.30 -0.20 120.40 118.47 3hqp s VAL 398 Ca -0.06 -0.97 -0.30 0.00 -1.81 0.00 0.00 61.98 58.84 3hqp s VAL 398 Cb -0.15 -1.79 -0.02 0.00 0.56 0.00 0.00 36.38 34.98 3hqp s VAL 398 CO -0.02 0.55 1.12 -0.76 -0.31 0.00 0.00 175.10 175.68 3hqp s LEU 399 N 0.73 4.22 -0.14 1.32 1.43 -1.04 -0.47 118.68 124.73 3hqp s LEU 399 Ca -0.09 1.63 -0.07 0.00 -1.03 0.00 0.00 54.13 54.57 3hqp s LEU 399 Cb -0.16 -3.55 0.06 0.00 0.03 0.00 0.00 46.19 42.57 3hqp s LEU 399 CO 0.00 -0.58 0.32 -0.55 0.23 0.00 0.00 176.35 175.77 3hqp s SER 400 N 1.39 -0.23 -0.19 2.29 0.15 -0.73 -4.86 113.70 111.51 3hqp s SER 400 Ca 0.51 0.70 -0.10 0.00 0.70 0.00 0.00 55.95 57.76 3hqp s SER 400 Cb -0.21 0.67 -0.20 0.00 -1.71 0.00 0.00 66.02 64.57 3hqp s SER 400 CO 0.17 -0.20 0.10 0.59 1.20 0.00 0.00 173.24 175.11 3hqp n ASN 401 N 4.57 2.00 0.07 5.45 3.02 -1.26 -3.89 115.26 125.22 3hqp n ASN 401 Ca -0.19 0.22 0.13 0.00 -0.03 0.00 0.00 54.58 54.70 3hqp n ASN 401 Cb 0.53 -0.80 0.31 0.00 -0.61 0.00 0.00 39.78 39.21 3hqp n ASN 401 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3hqp n THR 402 N -3.81 0.37 -0.77 3.41 -2.24 -1.26 -4.49 114.28 105.50 3hqp n THR 402 Ca -0.38 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 3hqp n THR 402 Cb 0.92 -0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.85 3hqp n THR 402 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hqp n GLY 403 N 1.36 0.83 0.10 3.38 0.00 -1.26 -4.94 105.19 104.66 3hqp n GLY 403 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 3hqp n GLY 403 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3hqp h ARG 404 N 3.10 -0.13 -0.18 1.61 2.43 -1.93 -2.71 114.38 116.57 3hqp h ARG 404 Ca 0.00 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 3hqp h ARG 404 Cb 0.00 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 3hqp h ARG 404 CO 0.00 0.27 0.12 0.77 -1.51 0.00 0.00 179.97 179.62 3hqp h SER 405 N -0.58 0.20 -0.08 -3.80 0.02 -1.92 -2.06 113.55 105.32 3hqp h SER 405 Ca -0.01 -0.01 -0.14 0.00 -0.84 0.00 0.00 61.79 60.79 3hqp h SER 405 Cb 0.47 -0.05 0.01 0.00 0.14 0.00 0.00 62.40 62.97 3hqp h SER 405 CO 0.02 0.15 -0.48 0.00 -1.14 0.00 0.00 176.83 175.38 3hqp h ALA 406 N 1.89 0.17 -0.04 3.77 0.00 -1.88 -2.17 119.26 120.99 3hqp h ALA 406 Ca 0.07 -0.50 -0.03 0.00 0.00 0.00 0.00 54.91 54.44 3hqp h ALA 406 Cb -0.02 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3hqp h ALA 406 CO -0.01 0.34 -0.13 0.00 0.00 0.00 0.00 179.25 179.45 3hqp h ARG 407 N 0.03 0.07 0.00 0.00 3.08 -1.26 -0.61 114.38 115.69 3hqp h ARG 407 Ca -0.04 -0.01 -0.15 0.00 0.07 0.00 0.00 59.98 59.85 3hqp h ARG 407 Cb 1.14 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.15 3hqp h ARG 407 CO 0.10 0.20 -0.72 1.25 -1.07 0.00 0.00 179.97 179.73 3hqp h LEU 408 N 0.06 0.00 0.03 3.04 5.85 -1.27 -1.54 115.31 121.48 3hqp h LEU 408 Ca 0.01 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.66 3hqp h LEU 408 Cb 0.27 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.30 3hqp h LEU 408 CO 0.02 0.72 -0.32 0.58 -0.34 0.00 0.00 178.44 179.10 3hqp h VAL 409 N 0.00 1.60 -0.07 1.05 2.07 -1.03 -3.27 116.25 116.61 3hqp h VAL 409 Ca -0.01 -2.17 0.02 0.00 0.82 0.00 0.00 66.70 65.36 3hqp h VAL 409 Cb 1.36 3.00 -0.00 0.00 -1.52 0.00 0.00 31.29 34.13 3hqp h VAL 409 CO 0.09 0.59 0.08 0.00 0.02 0.00 0.00 177.57 178.35 3hqp h ALA 410 N 0.16 1.62 -0.89 1.67 0.00 -1.14 -1.86 119.26 118.81 3hqp h ALA 410 Ca -0.05 -0.00 0.13 0.00 0.00 0.00 0.00 54.91 54.99 3hqp h ALA 410 Cb 1.14 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.87 3hqp h ALA 410 CO 0.06 -0.11 0.58 -0.22 0.00 0.00 0.00 179.25 179.56 3hqp h LYS 411 N 0.00 0.72 -0.54 0.00 3.64 -1.32 -2.84 116.57 116.23 3hqp h LYS 411 Ca 0.03 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3hqp h LYS 411 Cb 0.18 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 3hqp h LYS 411 CO -0.00 0.47 0.00 0.66 -2.27 0.00 0.00 179.45 178.31 3hqp n TYR 412 N -4.56 0.71 -3.45 1.91 4.01 -0.70 -4.96 117.16 110.13 3hqp n TYR 412 Ca 0.17 -0.36 -0.19 0.00 -0.16 0.00 0.00 57.90 57.36 3hqp n TYR 412 Cb 0.43 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.50 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 1.35 -1.48 -1.18 -0.72 5.12 -1.07 -4.25 116.66 114.42 3hqp n ARG 413 Ca 0.21 0.86 -0.31 0.00 -1.93 0.00 0.00 57.85 56.68 3hqp n ARG 413 Cb 0.55 -4.62 0.12 0.00 -1.16 0.00 0.00 32.46 27.34 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 -4.71 1.76 -0.42 5.56 0.04 -1.26 -4.54 135.00 131.43 3hqp s PRO 414 Ca 0.27 1.08 0.02 0.00 0.04 0.00 0.00 61.00 62.41 3hqp s PRO 414 Cb -0.08 -1.85 0.51 0.00 0.04 0.00 0.00 34.50 33.13 3hqp s PRO 414 CO 0.81 -1.97 1.83 0.27 0.04 0.00 0.00 177.00 177.99 3hqp n ASN 415 N -3.73 4.54 -4.11 6.66 6.94 -1.26 -4.90 115.26 119.40 3hqp n ASN 415 Ca 0.08 -3.39 -0.09 0.00 -0.02 0.00 0.00 54.58 51.16 3hqp n ASN 415 Cb 0.54 -0.84 -0.10 0.00 -2.36 0.00 0.00 39.78 37.02 3hqp n ASN 415 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3hqp n PRO 417 N -0.05 2.09 -3.69 0.00 -0.02 -1.26 -4.87 135.00 127.20 3hqp n PRO 417 Ca -0.08 0.75 -0.38 0.00 -2.02 0.00 0.00 63.50 61.77 3hqp n PRO 417 Cb 0.63 -2.62 -0.12 0.00 -0.02 0.00 0.00 33.50 31.36 3hqp n PRO 417 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3hqp s ILE 418 N -1.22 4.39 -0.41 4.25 1.01 -0.77 -1.83 121.20 126.62 3hqp s ILE 418 Ca 0.65 -0.53 -0.18 0.00 0.00 0.00 0.00 60.65 60.59 3hqp s ILE 418 Cb -0.44 -3.26 0.02 0.00 0.01 0.00 0.00 42.46 38.79 3hqp s ILE 418 CO 0.55 0.06 0.47 -0.69 0.00 0.00 0.00 174.94 175.33 3hqp s VAL 419 N 1.57 5.04 -0.16 2.92 1.01 0.98 -0.14 120.40 131.62 3hqp s VAL 419 Ca 0.04 -0.17 -0.15 0.00 0.00 0.00 0.00 61.98 61.69 3hqp s VAL 419 Cb -0.17 -4.04 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 3hqp s VAL 419 CO 0.05 -0.41 0.36 0.00 0.00 0.00 0.00 175.10 175.11 3hqp s VAL 421 N 0.75 4.62 0.07 0.00 1.01 0.38 -0.18 120.40 127.05 3hqp s VAL 421 Ca 0.19 -0.42 0.07 0.00 0.00 0.00 0.00 61.98 61.82 3hqp s VAL 421 Cb -0.14 -3.36 -0.03 0.00 0.00 0.00 0.00 36.38 32.86 3hqp s VAL 421 CO 0.06 0.06 -0.18 0.28 0.00 0.00 0.00 175.10 175.32 3hqp s THR 422 N 1.61 1.47 -2.75 3.92 -1.32 -0.26 -1.78 115.64 116.54 3hqp s THR 422 Ca 0.05 -1.29 0.25 0.00 -1.21 0.00 0.00 61.69 59.48 3hqp s THR 422 Cb -0.17 -1.33 0.33 0.00 -1.51 0.00 0.00 72.50 69.82 3hqp s THR 422 CO 0.06 0.00 1.42 0.35 -2.21 0.00 0.00 174.62 174.25 3hqp n THR 423 N 1.51 0.09 -4.40 5.08 -2.24 -1.26 -0.11 114.28 112.95 3hqp n THR 423 Ca -0.19 -0.47 -0.30 0.00 -2.27 0.00 0.00 64.05 60.83 3hqp n THR 423 Cb 0.54 1.09 -0.17 0.00 -2.10 0.00 0.00 70.33 69.70 3hqp n THR 423 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3hqp s ARG 424 N -1.91 2.43 0.44 -0.78 0.52 -1.26 -4.67 118.95 113.73 3hqp s ARG 424 Ca 0.32 -0.63 0.21 0.00 -0.52 0.00 0.00 55.73 55.11 3hqp s ARG 424 Cb 0.20 -2.07 1.05 0.00 0.52 0.00 0.00 34.95 34.65 3hqp s ARG 424 CO 0.31 -0.09 1.92 1.25 0.02 0.00 0.00 175.30 178.71 3hqp h LEU 425 N 7.54 0.00 -0.81 2.53 5.85 -1.95 -2.28 115.31 126.19 3hqp h LEU 425 Ca -0.33 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.28 3hqp h LEU 425 Cb 1.17 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.19 3hqp h LEU 425 CO 0.52 0.24 -0.29 -0.61 -0.34 0.00 0.00 178.44 177.96 3hqp h GLN 426 N 0.00 0.57 -0.52 1.25 4.15 -1.97 -2.82 115.11 115.76 3hqp h GLN 426 Ca -0.00 -0.24 -0.04 0.00 0.77 0.00 0.00 58.65 59.14 3hqp h GLN 426 Cb 0.55 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.19 3hqp h GLN 426 CO 0.03 0.80 0.18 1.15 -1.93 0.00 0.00 178.83 179.06 3hqp h THR 427 N 0.49 1.23 -0.61 2.39 2.02 -1.71 0.27 112.91 116.99 3hqp h THR 427 Ca 0.06 -0.73 0.12 0.00 0.77 0.00 0.00 66.41 66.63 3hqp h THR 427 Cb 0.75 0.72 -0.11 0.00 -1.74 0.00 0.00 68.15 67.77 3hqp h THR 427 CO 0.06 0.27 -0.12 0.00 0.37 0.00 0.00 175.52 176.10 3hqp h ARG 429 N 0.02 0.71 -0.00 0.00 3.08 -1.15 -3.14 114.38 113.89 3hqp h ARG 429 Ca 0.30 -0.40 -0.10 0.00 0.07 0.00 0.00 59.98 59.85 3hqp h ARG 429 Cb 0.46 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 3hqp h ARG 429 CO -0.61 1.02 -0.45 1.96 -1.07 0.00 0.00 179.97 180.82 3hqp h GLN 430 N 0.44 0.01 0.00 0.04 4.20 -0.02 -1.92 115.11 117.86 3hqp h GLN 430 Ca 0.03 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.74 3hqp h GLN 430 Cb 0.93 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.71 3hqp h GLN 430 CO 0.08 0.46 0.00 1.28 -0.67 0.00 0.00 178.83 179.98 3hqp n LEU 431 N -4.00 0.34 0.08 1.46 4.77 0.49 -2.69 117.00 117.45 3hqp n LEU 431 Ca -0.02 0.58 0.07 0.00 -0.03 0.00 0.00 56.01 56.61 3hqp n LEU 431 Cb 0.48 -0.53 0.32 0.00 -2.33 0.00 0.00 43.42 41.36 3hqp n LEU 431 CO 0.40 -0.40 0.70 0.59 -1.33 0.00 0.00 177.39 177.35 3hqp n ASN 432 N -1.87 0.30 -1.16 -1.43 4.13 -0.72 -0.61 115.26 113.89 3hqp n ASN 432 Ca 0.03 0.62 0.12 0.00 1.68 0.00 0.00 54.58 57.03 3hqp n ASN 432 Cb 0.21 -0.67 0.21 0.00 -1.54 0.00 0.00 39.78 37.99 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 -1.88 0.50 -3.80 2.41 -5.35 -1.09 -4.77 119.36 105.38 3hqp n ILE 433 Ca 0.00 -0.75 -0.36 0.00 -0.27 0.00 0.00 62.75 61.37 3hqp n ILE 433 Cb 0.07 1.00 -0.10 0.00 -1.74 0.00 0.00 39.64 38.86 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 -1.49 4.96 0.33 7.28 2.01 0.22 -4.65 115.64 124.30 3hqp s THR 434 Ca 0.39 0.04 -0.29 0.00 0.31 0.00 0.00 61.69 62.13 3hqp s THR 434 Cb 0.23 -3.29 -0.11 0.00 0.01 0.00 0.00 72.50 69.34 3hqp s THR 434 CO 0.32 0.38 1.54 1.67 -0.69 0.00 0.00 174.62 177.84 3hqp n GLN 435 N 4.17 2.67 -1.34 4.92 0.00 -1.26 -3.71 117.38 122.84 3hqp n GLN 435 Ca -0.16 0.94 -0.12 0.00 -0.00 0.00 0.00 57.00 57.67 3hqp n GLN 435 Cb 0.52 -2.70 -0.05 0.00 0.00 0.00 0.00 30.24 28.01 3hqp n GLN 435 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3hqp n GLY 436 N 1.36 1.27 3.30 1.69 0.00 -0.39 -4.85 105.19 107.57 3hqp n GLY 436 Ca 0.05 -0.42 -0.32 0.00 0.00 0.00 0.00 46.02 45.33 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 -2.40 2.30 -0.07 1.61 1.01 -1.24 -1.84 120.40 119.77 3hqp s VAL 437 Ca 0.00 -0.97 0.05 0.00 0.00 0.00 0.00 61.98 61.07 3hqp s VAL 437 Cb 0.00 -1.87 -0.01 0.00 0.00 0.00 0.00 36.38 34.50 3hqp s VAL 437 CO 0.00 0.56 -0.24 -1.61 0.00 0.00 0.00 175.10 173.82 3hqp s GLU 438 N -0.06 2.63 -0.16 2.72 2.02 0.80 -4.92 118.70 121.73 3hqp s GLU 438 Ca -0.06 -0.86 -0.07 0.00 0.02 0.00 0.00 54.97 54.00 3hqp s GLU 438 Cb -0.14 -2.14 -0.04 0.00 0.10 0.00 0.00 34.13 31.90 3hqp s GLU 438 CO 0.05 0.29 0.07 -1.12 0.02 0.00 0.00 175.26 174.57 3hqp s SER 439 N 0.04 5.69 -0.20 -0.19 0.01 -1.26 -0.50 113.70 117.29 3hqp s SER 439 Ca -0.09 0.14 -0.05 0.00 1.31 0.00 0.00 55.95 57.26 3hqp s SER 439 Cb -0.15 -1.92 -0.02 0.00 0.21 0.00 0.00 66.02 64.13 3hqp s SER 439 CO 0.05 0.23 -0.01 -0.69 0.41 0.00 0.00 173.24 173.23 3hqp s VAL 440 N 0.05 3.86 -0.19 3.43 1.01 0.75 -4.96 120.40 124.35 3hqp s VAL 440 Ca 0.06 -0.35 -0.27 0.00 0.00 0.00 0.00 61.98 61.43 3hqp s VAL 440 Cb -0.12 -2.74 -0.01 0.00 0.00 0.00 0.00 36.38 33.51 3hqp s VAL 440 CO 0.01 0.43 0.90 0.12 0.00 0.00 0.00 175.10 176.56 3hqp s PHE 441 N 1.02 3.39 -0.38 5.22 5.36 -1.26 -1.10 117.98 130.24 3hqp s PHE 441 Ca 0.02 1.32 -0.08 0.00 -0.96 0.00 0.00 56.93 57.22 3hqp s PHE 441 Cb -0.14 -3.11 0.05 0.00 -0.34 0.00 0.00 43.02 39.48 3hqp s PHE 441 CO 0.01 -0.34 0.18 0.12 -1.46 0.00 0.00 175.22 173.74 3hqp s PHE 442 N 2.55 3.29 -0.58 10.12 5.36 0.84 -4.93 117.98 134.64 3hqp s PHE 442 Ca 0.40 -1.37 -0.28 0.00 -0.96 0.00 0.00 56.93 54.72 3hqp s PHE 442 Cb -0.16 -2.56 0.02 0.00 -0.34 0.00 0.00 43.02 39.98 3hqp s PHE 442 CO 0.10 -0.75 1.32 0.34 -1.46 0.00 0.00 175.22 174.77 3hqp s ASP 443 N 1.68 6.26 0.39 6.13 2.15 -1.26 -4.17 116.67 127.84 3hqp s ASP 443 Ca 0.01 0.18 0.25 0.00 0.43 0.00 0.00 52.55 53.43 3hqp s ASP 443 Cb -0.21 -2.55 0.64 0.00 -0.30 0.00 0.00 42.92 40.50 3hqp s ASP 443 CO 0.03 -1.63 1.71 0.00 -0.17 0.00 0.00 175.17 175.12 3hqp h ALA 444 N 10.41 1.00 -0.29 3.66 0.00 -1.83 -1.47 119.26 130.74 3hqp h ALA 444 Ca -0.26 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.53 3hqp h ALA 444 Cb 1.08 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 3hqp h ALA 444 CO 1.19 0.00 -0.27 -0.44 0.00 0.00 0.00 179.25 179.72 3hqp h ASP 445 N 0.00 0.75 0.42 0.00 3.32 -1.89 -1.28 116.42 117.74 3hqp h ASP 445 Ca 0.00 -0.46 0.00 0.00 0.02 0.00 0.00 57.03 56.59 3hqp h ASP 445 Cb 0.83 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.17 3hqp h ASP 445 CO 0.00 1.06 -1.02 2.29 -1.72 0.00 0.00 179.24 179.85 3hqp n LYS 446 N -4.27 0.28 0.00 3.56 2.85 -1.19 -4.45 118.16 114.94 3hqp n LYS 446 Ca -0.04 -0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.22 3hqp n LYS 446 Cb 0.46 -1.59 -0.00 0.00 -0.65 0.00 0.00 35.03 33.25 3hqp n LYS 446 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 3hqp n LEU 447 N -1.95 0.49 0.00 -5.58 4.77 -0.56 -5.11 117.00 109.07 3hqp n LEU 447 Ca 0.02 -0.73 0.00 0.00 -0.03 0.00 0.00 56.01 55.27 3hqp n LEU 447 Cb 0.43 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 3hqp n LEU 447 CO 0.40 0.12 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 3hqp n GLY 448 N 0.57 -0.13 0.11 -0.72 0.00 -0.48 -4.71 105.19 99.82 3hqp n GLY 448 Ca 0.00 -1.75 0.13 0.00 0.00 0.00 0.00 46.02 44.40 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 -0.01 0.88 -3.60 1.61 8.25 -1.26 -4.45 115.22 116.63 3hqp n HIS 449 Ca 0.00 0.27 -0.25 0.00 -0.26 0.00 0.00 57.72 57.48 3hqp n HIS 449 Cb 0.00 -0.94 0.04 0.00 1.12 0.00 0.00 29.99 30.21 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 -2.23 -4.39 0.28 0.41 2.03 -1.26 -4.86 116.55 106.52 3hqp n ASP 450 Ca 0.05 -0.90 0.14 0.00 0.52 0.00 0.00 54.79 54.59 3hqp n ASP 450 Cb 0.39 -3.92 0.81 0.00 -0.72 0.00 0.00 41.12 37.68 3hqp n ASP 450 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 3hqp h GLU 451 N -1.71 0.00 -0.01 -0.67 3.07 -2.00 -2.24 114.58 111.02 3hqp h GLU 451 Ca -0.64 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.22 3hqp h GLU 451 Cb 1.35 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.26 3hqp h GLU 451 CO 0.50 0.07 -0.09 0.41 -1.40 0.00 0.00 179.01 178.50 3hqp n GLY 452 N -0.95 -0.54 4.10 -3.84 0.00 -1.26 -4.91 105.19 97.78 3hqp n GLY 452 Ca -0.02 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.49 0.00 -0.26 1.61 4.76 -0.84 -4.84 118.16 118.09 3hqp n LYS 453 Ca 0.17 0.00 -0.04 0.00 -2.87 0.00 0.00 58.31 55.56 3hqp n LYS 453 Cb 0.30 -2.71 0.06 0.00 -1.84 0.00 0.00 35.03 30.84 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 0.90 0.92 -0.05 1.97 3.07 -1.92 -2.12 114.58 117.36 3hqp h GLU 454 Ca 0.00 -0.06 -0.17 0.00 -0.50 0.00 0.00 59.36 58.63 3hqp h GLU 454 Cb 0.00 -0.21 -0.01 0.00 -0.84 0.00 0.00 28.75 27.69 3hqp h GLU 454 CO 0.00 0.61 -0.73 0.45 -1.40 0.00 0.00 179.01 177.94 3hqp h HIS 455 N 0.95 0.36 -0.05 4.33 3.86 -1.91 -1.45 115.15 121.23 3hqp h HIS 455 Ca 0.27 -0.16 -0.23 0.00 -1.16 0.00 0.00 60.37 59.09 3hqp h HIS 455 Cb -0.08 -0.05 0.02 0.00 1.06 0.00 0.00 27.41 28.35 3hqp h HIS 455 CO -0.03 0.90 -0.86 0.00 0.86 0.00 0.00 177.93 178.80 3hqp h ARG 456 N 0.18 0.68 -0.20 2.45 3.08 -1.88 -1.03 114.38 117.64 3hqp h ARG 456 Ca -0.03 -0.66 0.02 0.00 0.07 0.00 0.00 59.98 59.39 3hqp h ARG 456 Cb 1.29 0.17 -0.02 0.00 0.08 0.00 0.00 29.97 31.49 3hqp h ARG 456 CO 0.12 1.26 0.06 0.28 -1.07 0.00 0.00 179.97 180.61 3hqp h VAL 457 N 0.34 0.94 -0.67 2.04 2.07 -1.39 -1.01 116.25 118.57 3hqp h VAL 457 Ca -0.09 -0.05 0.13 0.00 0.82 0.00 0.00 66.70 67.50 3hqp h VAL 457 Cb 1.52 0.77 -0.09 0.00 -1.52 0.00 0.00 31.29 31.97 3hqp h VAL 457 CO 0.17 0.03 0.20 0.00 0.02 0.00 0.00 177.57 177.99 3hqp h ALA 458 N 1.13 0.87 -0.43 1.67 0.00 -1.23 -0.53 119.26 120.74 3hqp h ALA 458 Ca 0.09 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 3hqp h ALA 458 Cb 0.06 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3hqp h ALA 458 CO -0.10 -0.27 0.24 0.00 0.00 0.00 0.00 179.25 179.13 3hqp h ALA 459 N 1.52 0.55 -0.69 0.00 0.00 -0.66 -0.51 119.26 119.46 3hqp h ALA 459 Ca 0.36 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.14 3hqp h ALA 459 Cb 0.55 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 3hqp h ALA 459 CO -0.41 0.07 0.23 0.78 0.00 0.00 0.00 179.25 179.92 3hqp h GLY 460 N 0.57 1.15 1.17 0.00 0.00 -0.63 -1.99 103.07 103.34 3hqp h GLY 460 Ca 0.15 -0.67 -0.15 0.00 0.00 0.00 0.00 47.33 46.67 3hqp h GLY 460 CO -0.03 0.63 -0.33 -2.08 0.00 0.00 0.00 176.54 174.73 3hqp h VAL 461 N 1.01 1.27 -0.84 4.60 2.07 -0.93 -2.57 116.25 120.86 3hqp h VAL 461 Ca 0.22 -1.49 -0.01 0.00 0.82 0.00 0.00 66.70 66.24 3hqp h VAL 461 Cb 0.28 1.30 -0.04 0.00 -1.52 0.00 0.00 31.29 31.31 3hqp h VAL 461 CO -0.01 0.50 0.48 -0.08 0.02 0.00 0.00 177.57 178.48 3hqp h GLU 462 N 0.77 1.16 -0.72 1.57 4.57 -1.00 -2.00 114.58 118.93 3hqp h GLU 462 Ca 0.08 -0.12 -0.01 0.00 -1.18 0.00 0.00 59.36 58.12 3hqp h GLU 462 Cb 0.91 -0.23 -0.03 0.00 -0.16 0.00 0.00 28.75 29.23 3hqp h GLU 462 CO 0.08 0.84 0.40 0.35 -1.18 0.00 0.00 179.01 179.50 3hqp h PHE 463 N 1.16 0.98 -0.46 0.92 3.57 -1.23 -0.49 116.94 121.39 3hqp h PHE 463 Ca 0.30 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.75 3hqp h PHE 463 Cb -0.00 -0.31 -0.02 0.00 2.79 0.00 0.00 35.95 38.41 3hqp h PHE 463 CO 0.00 0.69 0.17 0.00 -2.23 0.00 0.00 178.31 176.94 3hqp h ALA 464 N 1.20 0.60 -0.88 2.41 0.00 -1.21 0.01 119.26 121.39 3hqp h ALA 464 Ca 0.25 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 3hqp h ALA 464 Cb 0.03 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 3hqp h ALA 464 CO -0.04 0.22 0.53 0.87 0.00 0.00 0.00 179.25 180.83 3hqp h LYS 465 N 0.60 1.19 0.00 0.00 1.79 -1.17 0.14 116.57 119.11 3hqp h LYS 465 Ca 0.15 -0.11 -0.12 0.00 -2.18 0.00 0.00 60.65 58.39 3hqp h LYS 465 Cb 0.21 -0.25 -0.02 0.00 -1.58 0.00 0.00 32.23 30.59 3hqp h LYS 465 CO -0.01 0.83 -0.59 0.66 -1.08 0.00 0.00 179.45 179.26 3hqp h SER 466 N 1.21 0.00 0.39 0.86 4.64 -0.62 -2.66 113.55 117.38 3hqp h SER 466 Ca 0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 3hqp h SER 466 Cb -0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 3hqp h SER 466 CO -0.06 0.59 -0.15 0.29 -0.87 0.00 0.00 176.83 176.63 3hqp n LYS 467 N -3.61 0.63 -0.85 4.77 4.76 -0.05 -4.94 118.16 118.87 3hqp n LYS 467 Ca -0.00 -0.25 0.00 0.00 -2.87 0.00 0.00 58.31 55.19 3hqp n LYS 467 Cb 0.64 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 32.34 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 1.32 0.56 0.21 0.72 0.00 -0.62 -4.97 105.19 102.41 3hqp n GLY 468 Ca 0.13 -0.17 -0.12 0.00 0.00 0.00 0.00 46.02 45.85 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 0.80 -3.97 1.61 0.05 -1.02 -3.46 116.97 110.99 3hqp h TYR 469 Ca 0.00 -0.33 -0.40 0.00 0.05 0.00 0.00 58.73 58.05 3hqp h TYR 469 Cb 0.00 -0.13 -0.22 0.00 1.01 0.00 0.00 36.73 37.38 3hqp h TYR 469 CO 0.00 1.11 -0.78 0.14 -1.05 0.00 0.00 178.16 177.58 3hqp s VAL 470 N -3.81 1.02 0.22 -2.88 -7.23 -1.23 -4.73 120.40 101.76 3hqp s VAL 470 Ca -0.08 -1.18 0.07 0.00 -1.81 0.00 0.00 61.98 58.98 3hqp s VAL 470 Cb 0.10 -0.98 -0.05 0.00 0.56 0.00 0.00 36.38 36.01 3hqp s VAL 470 CO 0.86 -0.18 -0.10 -1.10 -0.31 0.00 0.00 175.10 174.27 3hqp s GLN 471 N -1.54 1.37 -0.09 4.82 1.11 -1.26 -4.31 119.66 119.76 3hqp s GLN 471 Ca -0.02 -1.64 -0.40 0.00 0.01 0.00 0.00 55.36 53.31 3hqp s GLN 471 Cb -0.09 -1.05 -0.18 0.00 -1.01 0.00 0.00 33.01 30.68 3hqp s GLN 471 CO 0.02 0.11 1.34 2.41 0.01 0.00 0.00 175.29 179.18 3hqp n THR 472 N -0.43 0.05 0.00 -0.19 -1.04 -1.26 -1.20 114.28 110.21 3hqp n THR 472 Ca -0.07 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 3hqp n THR 472 Cb 0.62 -0.54 0.00 0.00 -1.82 0.00 0.00 70.33 68.59 3hqp n THR 472 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3hqp n GLY 473 N 2.63 2.75 3.83 3.41 0.00 -0.97 -5.01 105.19 111.83 3hqp n GLY 473 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.91 5.64 0.16 1.61 1.01 -0.34 -4.83 116.67 119.02 3hqp s ASP 474 Ca 0.00 1.58 -0.07 0.00 0.71 0.00 0.00 52.55 54.76 3hqp s ASP 474 Cb 0.00 -2.49 -0.06 0.00 1.01 0.00 0.00 42.92 41.38 3hqp s ASP 474 CO 0.00 -1.27 0.43 -0.31 0.21 0.00 0.00 175.17 174.24 3hqp s TYR 475 N -3.04 3.48 -0.07 4.23 2.02 -1.26 -1.87 117.35 120.84 3hqp s TYR 475 Ca 0.58 0.70 -0.00 0.00 -0.37 0.00 0.00 57.07 57.97 3hqp s TYR 475 Cb -0.13 -2.11 0.03 0.00 -0.40 0.00 0.00 41.96 39.34 3hqp s TYR 475 CO 0.53 0.40 -0.02 0.00 -1.57 0.00 0.00 175.55 174.89 3hqp s VAL 477 N 1.59 4.96 -0.13 0.00 1.01 -0.87 -1.22 120.40 125.73 3hqp s VAL 477 Ca -0.00 1.40 0.02 0.00 0.00 0.00 0.00 61.98 63.39 3hqp s VAL 477 Cb -0.13 -4.04 0.01 0.00 0.00 0.00 0.00 36.38 32.23 3hqp s VAL 477 CO -0.04 0.07 -0.19 -0.69 0.00 0.00 0.00 175.10 174.26 3hqp s VAL 478 N 1.99 1.80 -0.11 2.92 1.01 0.59 -0.78 120.40 127.83 3hqp s VAL 478 Ca 0.33 -0.82 0.03 0.00 0.00 0.00 0.00 61.98 61.52 3hqp s VAL 478 Cb -0.16 -1.62 -0.00 0.00 0.00 0.00 0.00 36.38 34.60 3hqp s VAL 478 CO 0.11 0.50 -0.21 -0.63 0.00 0.00 0.00 175.10 174.88 3hqp s ILE 479 N 0.95 2.36 -0.00 2.22 1.01 0.71 -0.99 121.20 127.47 3hqp s ILE 479 Ca -0.05 -0.91 -0.00 0.00 0.00 0.00 0.00 60.65 59.68 3hqp s ILE 479 Cb -0.15 -1.93 0.00 0.00 0.01 0.00 0.00 42.46 40.39 3hqp s ILE 479 CO -0.03 0.55 0.02 0.00 0.00 0.00 0.00 174.94 175.48 3hqp n HIS 480 N 3.52 -0.20 -3.09 3.97 1.44 -0.92 -2.51 115.22 117.44 3hqp n HIS 480 Ca -0.19 -0.01 -0.25 0.00 -2.01 0.00 0.00 57.72 55.26 3hqp n HIS 480 Cb 0.53 0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.64 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 -1.01 3.59 1.02 1.59 0.00 -1.26 -1.74 121.76 123.95 3hqp s ALA 481 Ca 0.00 -0.77 -0.03 0.00 0.00 0.00 0.00 51.96 51.17 3hqp s ALA 481 Cb -0.00 -2.28 0.04 0.00 0.00 0.00 0.00 23.12 20.87 3hqp s ALA 481 CO -0.00 -0.16 0.17 -0.40 0.00 0.00 0.00 175.76 175.37 3hqp n ASP 482 N -1.97 -0.74 0.20 0.00 5.68 -1.26 -4.89 116.55 113.57 3hqp n ASP 482 Ca -0.03 -0.76 0.04 0.00 -0.50 0.00 0.00 54.79 53.54 3hqp n ASP 482 Cb 0.56 -0.14 0.44 0.00 -1.14 0.00 0.00 41.12 40.83 3hqp n ASP 482 CO 0.00 0.00 0.00 0.45 -1.33 0.00 0.00 177.20 176.32 3hqp h HIS 483 N -1.47 0.01 0.01 2.11 3.86 -1.97 -3.33 115.15 114.36 3hqp h HIS 483 Ca -0.06 -0.00 -0.28 0.00 -1.16 0.00 0.00 60.37 58.87 3hqp h HIS 483 Cb 0.18 -0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.60 3hqp h HIS 483 CO 0.00 0.27 -1.55 1.17 0.86 0.00 0.00 177.93 178.68 3hqp n LYS 484 N -4.22 0.58 -2.16 2.45 4.81 -1.26 -4.97 118.16 113.39 3hqp n LYS 484 Ca -0.02 0.50 -0.42 0.00 -0.87 0.00 0.00 58.31 57.50 3hqp n LYS 484 Cb 0.32 -1.70 -0.03 0.00 0.02 0.00 0.00 35.03 33.64 3hqp n LYS 484 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 3hqp s VAL 485 N -2.40 3.14 -0.03 3.15 1.01 -1.25 -5.03 120.40 118.99 3hqp s VAL 485 Ca -0.30 0.89 0.06 0.00 0.00 0.00 0.00 61.98 62.62 3hqp s VAL 485 Cb 0.07 -3.57 -0.01 0.00 0.00 0.00 0.00 36.38 32.88 3hqp s VAL 485 CO 0.59 0.10 -0.20 -0.54 0.00 0.00 0.00 175.10 175.05 3hqp s LYS 486 N 0.41 1.82 0.00 2.72 -0.14 -1.26 -4.61 119.74 118.67 3hqp s LYS 486 Ca 0.61 -0.71 0.00 0.00 -1.36 0.00 0.00 55.97 54.51 3hqp s LYS 486 Cb -0.38 -1.66 0.00 0.00 -1.68 0.00 0.00 37.83 34.12 3hqp s LYS 486 CO 0.35 0.36 0.00 0.41 -0.76 0.00 0.00 175.35 175.72 3hqp n GLY 487 N 2.82 2.20 3.69 -3.33 0.00 -1.26 -5.04 105.19 104.27 3hqp n GLY 487 Ca -0.16 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.19 0.17 -0.22 1.61 -0.85 -1.26 -5.08 117.35 109.53 3hqp s TYR 488 Ca 0.00 -0.57 -0.17 0.00 -0.52 0.00 0.00 57.07 55.81 3hqp s TYR 488 Cb 0.00 0.38 -0.03 0.00 0.38 0.00 0.00 41.96 42.68 3hqp s TYR 488 CO 0.00 -1.09 0.44 0.00 -1.52 0.00 0.00 175.55 173.38 3hqp s ALA 489 N -3.95 3.56 -0.39 9.51 0.00 -1.26 -4.42 121.76 124.81 3hqp s ALA 489 Ca 0.18 -0.56 0.05 0.00 0.00 0.00 0.00 51.96 51.63 3hqp s ALA 489 Cb -0.03 -2.74 0.13 0.00 0.00 0.00 0.00 23.12 20.49 3hqp s ALA 489 CO 0.09 -0.48 1.11 0.27 0.00 0.00 0.00 175.76 176.75 3hqp n ASN 490 N 4.89 2.41 -3.79 0.00 2.04 -1.19 -4.32 115.26 115.30 3hqp n ASN 490 Ca -0.07 -2.01 -0.14 0.00 -0.44 0.00 0.00 54.58 51.92 3hqp n ASN 490 Cb 0.51 -0.10 -0.15 0.00 -2.53 0.00 0.00 39.78 37.50 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 -1.02 -0.00 0.05 -3.83 0.74 -0.71 -4.91 119.66 109.97 3hqp s GLN 491 Ca 0.10 0.18 0.07 0.00 0.05 0.00 0.00 55.36 55.77 3hqp s GLN 491 Cb 0.05 -0.18 -0.03 0.00 1.10 0.00 0.00 33.01 33.95 3hqp s GLN 491 CO 0.07 -0.13 -0.16 0.95 -0.55 0.00 0.00 175.29 175.46 3hqp s THR 492 N 0.86 2.93 0.03 -0.34 -4.23 -1.26 -2.16 115.64 111.47 3hqp s THR 492 Ca -0.07 -1.18 0.01 0.00 -1.18 0.00 0.00 61.69 59.28 3hqp s THR 492 Cb -0.10 -2.26 -0.02 0.00 1.34 0.00 0.00 72.50 71.46 3hqp s THR 492 CO -0.03 0.30 -0.06 0.00 -0.54 0.00 0.00 174.62 174.30 3hqp s ARG 493 N -1.56 0.43 -0.29 3.99 1.70 -0.16 -5.00 118.95 118.07 3hqp s ARG 493 Ca 0.16 -0.64 -0.07 0.00 -0.47 0.00 0.00 55.73 54.70 3hqp s ARG 493 Cb -0.11 -0.16 0.00 0.00 -0.57 0.00 0.00 34.95 34.12 3hqp s ARG 493 CO 0.07 0.02 0.08 0.42 -1.08 0.00 0.00 175.30 174.81 3hqp s ILE 494 N -1.27 4.05 0.16 4.99 1.01 -1.26 -0.30 121.20 128.58 3hqp s ILE 494 Ca -0.11 -0.60 0.10 0.00 0.00 0.00 0.00 60.65 60.05 3hqp s ILE 494 Cb -0.09 -3.05 -0.04 0.00 0.01 0.00 0.00 42.46 39.28 3hqp s ILE 494 CO -0.00 0.12 -0.24 -1.48 0.00 0.00 0.00 174.94 173.34 3hqp s LEU 495 N 1.52 2.38 -0.37 2.97 0.05 -0.36 -4.93 118.68 119.95 3hqp s LEU 495 Ca 0.03 -0.80 -0.21 0.00 0.05 0.00 0.00 54.13 53.20 3hqp s LEU 495 Cb -0.17 -1.11 0.01 0.00 -2.05 0.00 0.00 46.19 42.87 3hqp s LEU 495 CO 0.03 0.11 0.65 -0.22 -0.55 0.00 0.00 176.35 176.37 3hqp s LEU 496 N -2.36 4.27 0.47 1.48 2.96 -1.26 -0.75 118.68 123.49 3hqp s LEU 496 Ca 0.16 0.10 -0.22 0.00 -0.22 0.00 0.00 54.13 53.95 3hqp s LEU 496 Cb -0.09 -2.80 -0.07 0.00 0.50 0.00 0.00 46.19 43.73 3hqp s LEU 496 CO 0.07 -0.63 1.12 0.68 -1.32 0.00 0.00 176.35 176.27 3hqp s VAL 497 N 2.77 3.30 0.00 1.68 -7.23 -0.78 -4.90 120.40 115.24 3hqp s VAL 497 Ca 0.25 0.92 0.00 0.00 -1.81 0.00 0.00 61.98 61.34 3hqp s VAL 497 Cb -0.14 -3.44 0.00 0.00 0.56 0.00 0.00 36.38 33.36 3hqp s VAL 497 CO 0.16 -0.07 0.26 -0.62 -0.31 0.00 0.00 175.10 174.52