#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hqp h GLN 2 N 0.00 0.11 -0.08 4.33 5.75 -2.05 0.31 115.11 123.48 3hqp h GLN 2 Ca 0.00 -0.01 0.04 0.00 -0.15 0.00 0.00 58.65 58.53 3hqp h GLN 2 Cb 0.00 -0.02 -0.06 0.00 1.07 0.00 0.00 27.48 28.47 3hqp h GLN 2 CO 0.00 0.07 -0.34 1.25 -2.65 0.00 0.00 178.83 177.17 3hqp h LEU 3 N 0.11 -1.03 -1.02 -2.39 6.46 -2.06 0.63 115.31 116.01 3hqp h LEU 3 Ca 0.43 0.14 -0.01 0.00 -0.12 0.00 0.00 57.88 58.32 3hqp h LEU 3 Cb 0.76 0.43 -0.04 0.00 -0.73 0.00 0.00 40.66 41.08 3hqp h LEU 3 CO -0.67 -0.38 0.52 0.00 -0.62 0.00 0.00 178.44 177.29 3hqp h ALA 4 N 0.31 1.26 -0.52 1.25 0.00 -1.63 -2.48 119.26 117.45 3hqp h ALA 4 Ca 0.08 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 3hqp h ALA 4 Cb 0.57 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3hqp h ALA 4 CO -0.33 0.63 0.02 1.25 0.00 0.00 0.00 179.25 180.82 3hqp h HIS 5 N 1.21 0.90 -0.01 0.00 -0.00 0.09 -2.77 115.15 114.58 3hqp h HIS 5 Ca 0.31 -0.12 0.00 0.00 -0.00 0.00 0.00 60.37 60.56 3hqp h HIS 5 Cb -0.03 -0.25 -0.00 0.00 -0.00 0.00 0.00 27.41 27.13 3hqp h HIS 5 CO 0.01 0.81 0.01 -0.91 -0.00 0.00 0.00 177.93 177.85 3hqp h ASN 6 N 0.80 0.01 1.08 3.26 2.35 -0.41 -1.92 115.58 120.75 3hqp h ASN 6 Ca 0.16 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.91 3hqp h ASN 6 Cb 0.44 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.81 3hqp h ASN 6 CO 0.02 0.01 0.00 0.18 -1.65 0.00 0.00 177.43 175.99 3hqp n LEU 7 N -4.54 0.38 0.15 1.61 4.77 -1.04 -2.88 117.00 115.45 3hqp n LEU 7 Ca -0.03 0.55 0.10 0.00 -0.03 0.00 0.00 56.01 56.60 3hqp n LEU 7 Cb 0.09 -0.44 0.07 0.00 -2.33 0.00 0.00 43.42 40.80 3hqp n LEU 7 CO 0.34 -0.16 0.36 0.71 -1.33 0.00 0.00 177.39 177.31 3hqp h THR 8 N 0.00 0.12 -4.24 -5.08 1.35 -1.41 -3.47 112.91 100.18 3hqp h THR 8 Ca 0.00 -1.19 -0.50 0.00 -0.55 0.00 0.00 66.41 64.17 3hqp h THR 8 Cb 0.54 1.84 0.08 0.00 -1.73 0.00 0.00 68.15 68.87 3hqp h THR 8 CO 0.00 0.07 0.37 -0.76 -0.25 0.00 0.00 175.52 174.95 3hqp s LEU 9 N -5.85 3.38 0.05 3.87 1.43 -1.14 -5.09 118.68 115.32 3hqp s LEU 9 Ca 0.03 1.77 -0.02 0.00 -1.03 0.00 0.00 54.13 54.88 3hqp s LEU 9 Cb 0.07 -4.52 -0.03 0.00 0.03 0.00 0.00 46.19 41.74 3hqp s LEU 9 CO 0.74 -1.29 -0.00 -0.55 0.23 0.00 0.00 176.35 175.48 3hqp s SER 10 N -3.08 0.39 0.48 2.29 0.15 -1.26 -5.04 113.70 107.63 3hqp s SER 10 Ca 0.62 -0.84 0.27 0.00 0.70 0.00 0.00 55.95 56.70 3hqp s SER 10 Cb -0.16 0.20 1.01 0.00 -1.71 0.00 0.00 66.02 65.36 3hqp s SER 10 CO 0.43 -0.55 1.85 0.16 1.20 0.00 0.00 173.24 176.33 3hqp h ILE 11 N 3.43 0.29 -0.01 6.45 3.07 -2.02 -3.00 117.51 125.73 3hqp h ILE 11 Ca -0.34 -0.91 0.00 0.00 1.55 0.00 0.00 64.86 65.17 3hqp h ILE 11 Cb 1.16 1.71 0.00 0.00 -0.27 0.00 0.00 36.82 39.42 3hqp h ILE 11 CO 0.59 0.12 -0.08 0.49 -1.05 0.00 0.00 178.15 178.23 3hqp n PHE 12 N -3.24 0.00 -1.63 0.16 3.72 -1.26 -4.89 117.46 110.32 3hqp n PHE 12 Ca 0.01 0.00 -0.44 0.00 -0.05 0.00 0.00 57.45 56.97 3hqp n PHE 12 Cb 0.40 -0.06 -0.03 0.00 -0.94 0.00 0.00 39.48 38.85 3hqp n PHE 12 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 3hqp n ASP 13 N -0.32 3.64 -4.78 4.37 8.00 -1.14 -4.92 116.55 121.40 3hqp n ASP 13 Ca 0.17 0.62 -0.37 0.00 0.71 0.00 0.00 54.79 55.92 3hqp n ASP 13 Cb 0.31 -1.51 -0.03 0.00 -0.02 0.00 0.00 41.12 39.88 3hqp n ASP 13 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 3hqp s PRO 14 N 5.24 3.96 0.99 -0.24 0.04 -1.26 -5.01 135.00 138.72 3hqp s PRO 14 Ca 0.95 1.63 -0.12 0.00 0.04 0.00 0.00 61.00 63.50 3hqp s PRO 14 Cb -0.45 -2.46 0.18 0.00 0.04 0.00 0.00 34.50 31.82 3hqp s PRO 14 CO 0.41 -0.35 1.09 0.14 0.04 0.00 0.00 177.00 178.33 3hqp s VAL 15 N -1.62 2.16 0.69 -0.36 -7.23 -1.26 -4.99 120.40 107.80 3hqp s VAL 15 Ca 0.61 0.05 -0.11 0.00 -1.81 0.00 0.00 61.98 60.72 3hqp s VAL 15 Cb -0.25 -2.52 0.01 0.00 0.56 0.00 0.00 36.38 34.18 3hqp s VAL 15 CO 0.31 -0.07 1.06 0.00 -0.31 0.00 0.00 175.10 176.09 3hqp s ALA 16 N -2.93 2.67 -2.00 1.32 0.00 -1.26 -4.94 121.76 114.61 3hqp s ALA 16 Ca 0.65 0.11 0.08 0.00 0.00 0.00 0.00 51.96 52.80 3hqp s ALA 16 Cb -0.19 -3.18 0.45 0.00 0.00 0.00 0.00 23.12 20.20 3hqp s ALA 16 CO 0.58 -1.21 1.23 0.27 0.00 0.00 0.00 175.76 176.62 3hqp n ASN 17 N -3.07 0.00 -3.71 0.00 2.04 -1.26 -4.79 115.26 104.48 3hqp n ASN 17 Ca 0.08 -1.61 -0.13 0.00 -0.44 0.00 0.00 54.58 52.48 3hqp n ASN 17 Cb 0.53 0.00 -0.07 0.00 -2.53 0.00 0.00 39.78 37.71 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 -0.21 -0.14 -2.53 -0.85 -1.26 -5.04 117.35 105.32 3hqp s TYR 18 Ca 0.11 0.20 -0.03 0.00 -0.52 0.00 0.00 57.07 56.83 3hqp s TYR 18 Cb 0.05 0.16 -0.03 0.00 0.38 0.00 0.00 41.96 42.53 3hqp s TYR 18 CO 0.09 -0.51 -0.04 0.50 -1.52 0.00 0.00 175.55 174.07 3hqp s ARG 19 N -2.18 3.54 -0.16 -3.49 3.52 -1.26 -5.02 118.95 113.90 3hqp s ARG 19 Ca -0.07 -0.51 -0.15 0.00 -0.13 0.00 0.00 55.73 54.86 3hqp s ARG 19 Cb -0.02 -2.87 -0.23 0.00 -1.56 0.00 0.00 34.95 30.27 3hqp s ARG 19 CO -0.01 0.32 0.33 0.00 -0.81 0.00 0.00 175.30 175.13 3hqp h ALA 20 N 6.45 0.31 -2.89 6.12 0.00 -1.95 -3.43 119.26 123.86 3hqp h ALA 20 Ca -0.34 -1.26 -0.53 0.00 0.00 0.00 0.00 54.91 52.78 3hqp h ALA 20 Cb 1.19 0.68 0.10 0.00 0.00 0.00 0.00 17.79 19.76 3hqp h ALA 20 CO 0.61 0.95 0.60 0.00 0.00 0.00 0.00 179.25 181.41 3hqp s ALA 21 N -2.45 3.08 0.09 0.00 0.00 -1.26 -0.81 121.76 120.40 3hqp s ALA 21 Ca -0.25 1.24 0.06 0.00 0.00 0.00 0.00 51.96 53.00 3hqp s ALA 21 Cb 0.06 -3.50 -0.04 0.00 0.00 0.00 0.00 23.12 19.64 3hqp s ALA 21 CO 0.69 -0.99 -0.04 1.03 0.00 0.00 0.00 175.76 176.44 3hqp s ARG 22 N -2.54 2.39 -0.15 0.00 1.81 -0.93 -4.93 118.95 114.61 3hqp s ARG 22 Ca 0.63 -0.90 -0.00 0.00 -1.72 0.00 0.00 55.73 53.73 3hqp s ARG 22 Cb -0.38 -2.45 -0.01 0.00 -0.45 0.00 0.00 34.95 31.66 3hqp s ARG 22 CO 0.47 0.53 -0.13 0.42 -0.68 0.00 0.00 175.30 175.91 3hqp s ILE 23 N -1.26 2.93 -0.19 1.52 1.01 -1.26 -1.55 121.20 122.40 3hqp s ILE 23 Ca 0.24 -0.69 -0.06 0.00 0.00 0.00 0.00 60.65 60.14 3hqp s ILE 23 Cb -0.11 -2.24 -0.03 0.00 0.01 0.00 0.00 42.46 40.08 3hqp s ILE 23 CO 0.16 0.51 0.02 -0.63 0.00 0.00 0.00 174.94 175.00 3hqp s ILE 24 N 0.60 4.28 -0.05 2.92 1.01 -0.57 -1.39 121.20 128.00 3hqp s ILE 24 Ca -0.08 -0.21 0.04 0.00 0.00 0.00 0.00 60.65 60.40 3hqp s ILE 24 Cb -0.16 -2.93 -0.02 0.00 0.01 0.00 0.00 42.46 39.36 3hqp s ILE 24 CO 0.03 0.44 -0.15 0.00 0.00 0.00 0.00 174.94 175.26 3hqp s THR 26 N -0.63 5.05 -0.19 0.00 -4.23 -0.98 0.82 115.64 115.48 3hqp s THR 26 Ca 0.09 0.95 -0.09 0.00 -1.18 0.00 0.00 61.69 61.46 3hqp s THR 26 Cb -0.11 -3.79 -0.05 0.00 1.34 0.00 0.00 72.50 69.89 3hqp s THR 26 CO 0.01 0.46 0.12 -0.63 -0.54 0.00 0.00 174.62 174.04 3hqp s ILE 27 N -0.32 5.29 0.00 2.99 -1.09 -0.03 -3.00 121.20 125.04 3hqp s ILE 27 Ca 0.25 0.14 0.00 0.00 -2.23 0.00 0.00 60.65 58.82 3hqp s ILE 27 Cb -0.16 -3.40 0.00 0.00 -1.58 0.00 0.00 42.46 37.32 3hqp s ILE 27 CO 0.13 0.46 0.00 0.61 -1.23 0.00 0.00 174.94 174.91 3hqp n GLY 28 N 3.36 3.74 0.34 6.18 0.00 -1.25 -4.71 105.19 112.85 3hqp n GLY 28 Ca -0.17 -0.83 0.13 0.00 0.00 0.00 0.00 46.02 45.16 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 0.64 0.00 1.61 0.11 -1.84 -0.43 132.00 132.09 3hqp h PRO 29 Ca 0.00 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.03 3hqp h PRO 29 Cb 0.00 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 30.96 3hqp h PRO 29 CO 0.00 0.42 -0.18 0.77 -0.21 0.00 0.00 178.00 178.80 3hqp h SER 30 N 0.66 0.00 0.00 -2.05 0.02 -1.61 -3.37 113.55 107.19 3hqp h SER 30 Ca 0.58 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.52 3hqp h SER 30 Cb 0.96 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.50 3hqp h SER 30 CO -0.42 0.18 -0.41 0.35 -1.14 0.00 0.00 176.83 175.39 3hqp n THR 31 N -3.37 0.36 0.05 -2.27 -2.24 -0.31 -4.87 114.28 101.63 3hqp n THR 31 Ca -0.00 -0.44 -0.05 0.00 -2.27 0.00 0.00 64.05 61.29 3hqp n THR 31 Cb 0.39 0.37 -0.10 0.00 -2.10 0.00 0.00 70.33 68.89 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 0.01 0.00 -7.06 -0.78 4.15 -1.36 -3.38 115.11 106.70 3hqp h GLN 32 Ca -0.00 0.00 -0.54 0.00 0.77 0.00 0.00 58.65 58.88 3hqp h GLN 32 Cb 1.33 0.00 0.12 0.00 0.21 0.00 0.00 27.48 29.14 3hqp h GLN 32 CO 0.00 0.73 0.55 -1.54 -1.93 0.00 0.00 178.83 176.63 3hqp s SER 33 N -6.43 5.30 0.60 -0.69 1.04 -1.26 -4.84 113.70 107.41 3hqp s SER 33 Ca -0.00 2.59 0.31 0.00 0.48 0.00 0.00 55.95 59.33 3hqp s SER 33 Cb 0.09 -2.62 1.87 0.00 0.10 0.00 0.00 66.02 65.46 3hqp s SER 33 CO 0.81 -1.53 2.27 1.62 0.98 0.00 0.00 173.24 177.38 3hqp h VAL 34 N 1.26 0.49 -0.05 5.02 3.04 -1.90 -1.87 116.25 122.24 3hqp h VAL 34 Ca -0.51 0.00 -0.13 0.00 -1.01 0.00 0.00 66.70 65.06 3hqp h VAL 34 Cb 1.30 1.00 0.01 0.00 -2.01 0.00 0.00 31.29 31.58 3hqp h VAL 34 CO 0.57 0.00 -0.47 -0.08 -1.01 0.00 0.00 177.57 176.57 3hqp h GLU 35 N 0.00 0.40 0.00 4.17 4.57 -1.95 -3.10 114.58 118.67 3hqp h GLU 35 Ca 0.00 -0.37 -0.08 0.00 -1.18 0.00 0.00 59.36 57.73 3hqp h GLU 35 Cb 0.00 0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.67 3hqp h GLU 35 CO -0.00 1.02 -0.38 0.00 -1.18 0.00 0.00 179.01 178.48 3hqp h ALA 36 N 0.38 1.36 -0.28 2.92 0.00 -1.68 -2.86 119.26 119.11 3hqp h ALA 36 Ca -0.05 -0.34 -0.17 0.00 0.00 0.00 0.00 54.91 54.35 3hqp h ALA 36 Cb 1.15 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3hqp h ALA 36 CO 0.10 0.47 -0.50 -0.07 0.00 0.00 0.00 179.25 179.24 3hqp h LEU 37 N 0.00 0.92 -1.50 0.00 3.38 -1.47 -2.33 115.31 114.30 3hqp h LEU 37 Ca -0.00 -0.53 -0.03 0.00 0.09 0.00 0.00 57.88 57.41 3hqp h LEU 37 Cb 0.67 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 3hqp h LEU 37 CO 0.05 1.28 0.02 0.11 0.09 0.00 0.00 178.44 179.99 3hqp h LYS 38 N 0.60 0.35 -0.56 1.13 1.57 -1.44 0.40 116.57 118.61 3hqp h LYS 38 Ca 0.02 -0.05 -0.10 0.00 -1.87 0.00 0.00 60.65 58.64 3hqp h LYS 38 Cb 1.11 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.34 3hqp h LYS 38 CO 0.11 0.36 -0.04 0.78 -0.57 0.00 0.00 179.45 180.09 3hqp h GLY 39 N 0.61 1.08 0.76 3.86 0.00 -1.40 -1.49 103.07 106.49 3hqp h GLY 39 Ca 0.08 -0.80 -0.00 0.00 0.00 0.00 0.00 47.33 46.61 3hqp h GLY 39 CO 0.00 0.74 -0.00 1.41 0.00 0.00 0.00 176.54 178.69 3hqp h LEU 40 N 0.91 -0.00 -0.62 3.11 4.07 -0.70 -0.81 115.31 121.26 3hqp h LEU 40 Ca 0.16 -0.24 0.03 0.00 0.08 0.00 0.00 57.88 57.91 3hqp h LEU 40 Cb 0.58 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.28 3hqp h LEU 40 CO 0.03 0.24 0.38 0.40 -1.08 0.00 0.00 178.44 178.41 3hqp h ILE 41 N -0.25 1.07 0.00 1.22 2.04 -0.98 0.13 117.51 120.74 3hqp h ILE 41 Ca -0.00 -0.25 -0.08 0.00 1.00 0.00 0.00 64.86 65.53 3hqp h ILE 41 Cb 0.24 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 36.57 3hqp h ILE 41 CO 0.00 0.14 -0.37 1.56 0.00 0.00 0.00 178.15 179.47 3hqp h GLN 42 N 0.74 0.00 -0.12 2.37 4.20 -1.25 -2.97 115.11 118.08 3hqp h GLN 42 Ca 0.25 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.76 3hqp h GLN 42 Cb 0.04 0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.83 3hqp h GLN 42 CO -0.11 0.37 -0.72 0.77 -0.67 0.00 0.00 178.83 178.47 3hqp h SER 43 N 0.00 0.84 0.00 1.46 0.02 -0.47 -3.48 113.55 111.93 3hqp h SER 43 Ca -0.00 -0.65 0.00 0.00 -0.84 0.00 0.00 61.79 60.30 3hqp h SER 43 Cb 0.67 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.96 3hqp h SER 43 CO 0.05 1.36 0.00 0.61 -1.14 0.00 0.00 176.83 177.71 3hqp n GLY 44 N 0.76 -0.08 3.73 -3.77 0.00 0.29 -4.52 105.19 101.60 3hqp n GLY 44 Ca -0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 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 4.41 -0.02 1.61 0.00 -0.30 -4.32 119.30 120.67 3hqp s MET 45 Ca 0.00 1.98 0.08 0.00 0.00 0.00 0.00 55.69 57.75 3hqp s MET 45 Cb 0.00 -3.23 -0.13 0.00 0.00 0.00 0.00 34.83 31.47 3hqp s MET 45 CO 0.00 -0.24 0.16 0.43 0.00 0.00 0.00 175.02 175.37 3hqp n SER 46 N 2.97 3.08 -3.72 1.11 7.64 -0.48 -4.58 113.62 119.63 3hqp n SER 46 Ca 0.07 0.00 -0.19 0.00 1.01 0.00 0.00 58.87 59.76 3hqp n SER 46 Cb 0.44 1.28 -0.17 0.00 -1.01 0.00 0.00 64.21 64.74 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 -2.52 -0.02 -0.21 0.44 1.01 -1.17 -2.26 120.40 115.67 3hqp s VAL 47 Ca -0.03 0.31 -0.19 0.00 0.00 0.00 0.00 61.98 62.07 3hqp s VAL 47 Cb 0.05 -0.18 -0.03 0.00 0.00 0.00 0.00 36.38 36.22 3hqp s VAL 47 CO 0.34 0.16 0.56 0.00 0.00 0.00 0.00 175.10 176.16 3hqp s ALA 48 N 1.74 3.55 -0.21 5.51 0.00 -0.26 -0.98 121.76 131.11 3hqp s ALA 48 Ca -0.00 -0.39 -0.08 0.00 0.00 0.00 0.00 51.96 51.50 3hqp s ALA 48 Cb -0.12 -2.88 -0.04 0.00 0.00 0.00 0.00 23.12 20.08 3hqp s ALA 48 CO -0.03 -0.52 0.07 0.50 0.00 0.00 0.00 175.76 175.78 3hqp s ARG 49 N 1.83 3.84 -0.29 0.00 3.52 0.24 -1.09 118.95 127.00 3hqp s ARG 49 Ca 0.25 -0.40 -0.08 0.00 -0.13 0.00 0.00 55.73 55.37 3hqp s ARG 49 Cb -0.16 -3.28 -0.01 0.00 -1.56 0.00 0.00 34.95 29.94 3hqp s ARG 49 CO 0.10 0.06 0.11 -1.64 -0.81 0.00 0.00 175.30 173.12 3hqp s MET 50 N 0.95 3.42 -0.51 5.12 -1.94 -0.62 -0.85 119.30 124.87 3hqp s MET 50 Ca 0.04 -0.65 -0.24 0.00 -1.71 0.00 0.00 55.69 53.13 3hqp s MET 50 Cb -0.14 -3.46 0.04 0.00 2.01 0.00 0.00 34.83 33.28 3hqp s MET 50 CO 0.03 -0.34 0.89 1.21 -0.01 0.00 0.00 175.02 176.80 3hqp s ASN 51 N 1.60 6.38 0.00 3.03 3.84 -1.26 -0.61 114.94 127.91 3hqp s ASN 51 Ca 0.05 -0.25 0.00 0.00 0.21 0.00 0.00 52.86 52.87 3hqp s ASN 51 Cb -0.16 -2.42 0.03 0.00 -0.55 0.00 0.00 41.25 38.14 3hqp s ASN 51 CO 0.05 -1.11 0.95 0.49 -2.79 0.00 0.00 177.10 174.69 3hqp n PHE 52 N 7.17 0.00 1.39 0.43 3.01 -0.17 -2.19 117.46 127.10 3hqp n PHE 52 Ca 0.02 0.00 0.14 0.00 1.01 0.00 0.00 57.45 58.62 3hqp n PHE 52 Cb 0.48 0.00 0.47 0.00 -0.01 0.00 0.00 39.48 40.42 3hqp n PHE 52 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 3hqp n SER 53 N -0.51 1.22 -4.20 4.37 7.64 -1.26 -4.64 113.62 116.24 3hqp n SER 53 Ca 0.00 -1.18 -0.12 0.00 1.01 0.00 0.00 58.87 58.58 3hqp n SER 53 Cb 0.00 0.05 -0.10 0.00 -1.01 0.00 0.00 64.21 63.16 3hqp n SER 53 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 3hqp s HIS 54 N -2.24 1.02 0.00 1.43 3.76 -0.93 -4.98 115.29 113.35 3hqp s HIS 54 Ca 0.32 -0.87 0.00 0.00 -0.15 0.00 0.00 55.06 54.36 3hqp s HIS 54 Cb 0.20 -0.56 0.00 0.00 1.11 0.00 0.00 32.58 33.33 3hqp s HIS 54 CO 0.42 -0.08 0.00 0.41 -0.85 0.00 0.00 174.74 174.64 3hqp n GLY 55 N -0.10 1.09 3.78 -2.22 0.00 -1.26 -4.89 105.19 101.59 3hqp n GLY 55 Ca -0.11 -0.56 -0.02 0.00 0.00 0.00 0.00 46.02 45.33 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 -0.09 0.22 1.61 1.04 -1.26 -5.00 113.70 106.23 3hqp s SER 56 Ca 0.00 -0.42 -0.07 0.00 0.48 0.00 0.00 55.95 55.93 3hqp s SER 56 Cb 0.00 0.41 0.17 0.00 0.10 0.00 0.00 66.02 66.70 3hqp s SER 56 CO 0.00 -0.77 1.79 0.45 0.98 0.00 0.00 173.24 175.69 3hqp h HIS 57 N 2.00 1.22 -0.08 5.02 -0.00 -1.99 -1.10 115.15 120.23 3hqp h HIS 57 Ca -0.26 -0.08 -0.12 0.00 -0.00 0.00 0.00 60.37 59.91 3hqp h HIS 57 Cb 1.22 -0.37 -0.01 0.00 -0.00 0.00 0.00 27.41 28.24 3hqp h HIS 57 CO 0.73 0.91 -0.48 1.49 -0.00 0.00 0.00 177.93 180.57 3hqp h GLU 58 N 1.18 0.19 -0.01 2.45 4.81 -1.99 -1.84 114.58 119.38 3hqp h GLU 58 Ca 0.28 -0.10 -0.00 0.00 -0.13 0.00 0.00 59.36 59.40 3hqp h GLU 58 Cb 0.18 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.57 3hqp h GLU 58 CO -0.03 0.64 -0.00 -0.92 -0.73 0.00 0.00 179.01 177.96 3hqp h TYR 59 N 0.16 0.02 0.00 0.92 3.20 -1.83 -3.05 116.97 116.38 3hqp h TYR 59 Ca 0.01 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.84 3hqp h TYR 59 Cb 0.91 -0.00 -0.00 0.00 1.54 0.00 0.00 36.73 39.17 3hqp h TYR 59 CO 0.01 0.42 -0.14 0.45 -1.64 0.00 0.00 178.16 177.27 3hqp h HIS 60 N -0.39 0.00 -0.65 -3.82 3.86 -1.21 -2.45 115.15 110.49 3hqp h HIS 60 Ca 0.00 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.17 3hqp h HIS 60 Cb 0.42 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.86 3hqp h HIS 60 CO 0.07 0.14 0.23 0.37 0.86 0.00 0.00 177.93 179.60 3hqp h GLN 61 N 0.00 0.99 -0.58 2.45 5.75 -1.30 -1.37 115.11 121.05 3hqp h GLN 61 Ca -0.00 -0.20 -0.00 0.00 -0.15 0.00 0.00 58.65 58.30 3hqp h GLN 61 Cb 0.57 -0.15 -0.03 0.00 1.07 0.00 0.00 27.48 28.94 3hqp h GLN 61 CO 0.02 0.85 0.36 1.15 -2.65 0.00 0.00 178.83 178.56 3hqp h THR 62 N 0.93 1.16 0.04 2.39 2.02 -1.33 -1.86 112.91 116.26 3hqp h THR 62 Ca 0.21 -0.35 0.02 0.00 0.77 0.00 0.00 66.41 67.07 3hqp h THR 62 Cb 0.25 0.36 -0.04 0.00 -1.74 0.00 0.00 68.15 66.98 3hqp h THR 62 CO -0.01 0.17 -0.22 0.74 0.37 0.00 0.00 175.52 176.56 3hqp h THR 63 N 0.78 0.49 -0.36 3.16 2.02 -1.33 0.65 112.91 118.31 3hqp h THR 63 Ca 0.21 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.47 3hqp h THR 63 Cb -0.04 0.49 -0.09 0.00 -1.74 0.00 0.00 68.15 66.77 3hqp h THR 63 CO -0.04 0.00 -0.27 0.40 0.37 0.00 0.00 175.52 175.98 3hqp h ILE 64 N -0.37 0.31 -0.61 3.11 2.04 -0.99 0.26 117.51 121.27 3hqp h ILE 64 Ca 0.05 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.86 3hqp h ILE 64 Cb 0.43 0.31 -0.03 0.00 -0.74 0.00 0.00 36.82 36.80 3hqp h ILE 64 CO -0.18 0.00 0.19 0.78 0.00 0.00 0.00 178.15 178.95 3hqp h ASN 65 N -0.22 0.89 -0.37 1.72 2.35 -1.12 -2.53 115.58 116.29 3hqp h ASN 65 Ca 0.17 -0.21 -0.04 0.00 -0.55 0.00 0.00 56.30 55.68 3hqp h ASN 65 Cb 0.50 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 3hqp h ASN 65 CO -0.49 0.86 0.08 0.78 -1.65 0.00 0.00 177.43 177.01 3hqp h ASN 66 N 0.87 0.56 -0.06 5.81 2.35 -0.39 -1.63 115.58 123.09 3hqp h ASN 66 Ca 0.20 -0.24 0.02 0.00 -0.55 0.00 0.00 56.30 55.72 3hqp h ASN 66 Cb 0.29 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.49 3hqp h ASN 66 CO -0.01 0.66 -0.03 0.58 -1.65 0.00 0.00 177.43 176.98 3hqp h VAL 67 N 0.44 0.89 -0.74 2.81 2.07 -0.92 0.73 116.25 121.53 3hqp h VAL 67 Ca 0.11 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.64 3hqp h VAL 67 Cb 0.32 0.89 -0.04 0.00 -1.52 0.00 0.00 31.29 30.94 3hqp h VAL 67 CO 0.00 0.00 0.49 0.03 0.02 0.00 0.00 177.57 178.11 3hqp h ARG 68 N -0.03 0.97 -0.01 1.57 3.08 -1.42 0.55 114.38 119.08 3hqp h ARG 68 Ca 0.04 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 3hqp h ARG 68 Cb 0.09 -0.22 -0.00 0.00 0.08 0.00 0.00 29.97 29.92 3hqp h ARG 68 CO -0.09 0.64 0.00 0.37 -1.07 0.00 0.00 179.97 179.83 3hqp h GLN 69 N 1.00 0.02 -0.87 0.04 4.15 -1.08 0.70 115.11 119.07 3hqp h GLN 69 Ca 0.27 -0.01 0.07 0.00 0.77 0.00 0.00 58.65 59.75 3hqp h GLN 69 Cb -0.11 -0.00 -0.06 0.00 0.21 0.00 0.00 27.48 27.52 3hqp h GLN 69 CO -0.06 0.30 0.57 0.00 -1.93 0.00 0.00 178.83 177.71 3hqp h ALA 70 N 0.72 1.56 -0.19 3.38 0.00 -0.70 -1.10 119.26 122.92 3hqp h ALA 70 Ca 0.00 -0.02 -0.22 0.00 0.00 0.00 0.00 54.91 54.68 3hqp h ALA 70 Cb 0.29 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.84 3hqp h ALA 70 CO 0.00 0.31 -0.72 0.00 0.00 0.00 0.00 179.25 178.84 3hqp h ALA 71 N 1.53 0.34 -0.11 0.00 0.00 -0.75 -3.00 119.26 117.28 3hqp h ALA 71 Ca 0.38 -0.58 -0.08 0.00 0.00 0.00 0.00 54.91 54.63 3hqp h ALA 71 Cb 0.22 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3hqp h ALA 71 CO -0.14 0.68 -0.28 0.00 0.00 0.00 0.00 179.25 179.51 3hqp h ALA 72 N 0.58 1.33 0.00 0.00 0.00 -0.40 -0.48 119.26 120.29 3hqp h ALA 72 Ca -0.04 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3hqp h ALA 72 Cb 1.35 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.05 3hqp h ALA 72 CO 0.15 0.47 -0.14 0.39 0.00 0.00 0.00 179.25 180.12 3hqp n GLU 73 N -4.15 0.03 0.00 0.00 1.02 -0.46 -2.94 120.64 114.15 3hqp n GLU 73 Ca -0.01 0.02 0.06 0.00 -0.02 0.00 0.00 57.16 57.21 3hqp n GLU 73 Cb 0.37 -1.53 0.00 0.00 -0.02 0.00 0.00 31.44 30.27 3hqp n GLU 73 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3hqp n LEU 74 N -1.57 1.45 -2.34 -4.62 4.77 -1.04 -5.01 117.00 108.64 3hqp n LEU 74 Ca 0.06 -0.79 -0.16 0.00 -0.03 0.00 0.00 56.01 55.09 3hqp n LEU 74 Cb 0.35 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.48 3hqp n LEU 74 CO 0.29 0.28 0.07 0.61 -1.33 0.00 0.00 177.39 177.32 3hqp n GLY 75 N 0.96 -0.12 3.23 -0.72 0.00 -0.30 -5.03 105.19 103.21 3hqp n GLY 75 Ca 0.05 -0.11 -0.21 0.00 0.00 0.00 0.00 46.02 45.76 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 -3.08 1.42 -0.18 1.61 -7.23 -0.53 -5.03 120.40 107.39 3hqp s VAL 76 Ca 0.29 -1.44 -0.17 0.00 -1.81 0.00 0.00 61.98 58.85 3hqp s VAL 76 Cb -0.13 -1.33 -0.04 0.00 0.56 0.00 0.00 36.38 35.44 3hqp s VAL 76 CO 0.36 -0.15 0.44 0.20 -0.31 0.00 0.00 175.10 175.63 3hqp s ASN 77 N -1.85 6.53 -0.07 4.85 0.01 -1.26 -4.37 114.94 118.77 3hqp s ASN 77 Ca 0.03 0.62 0.02 0.00 -0.71 0.00 0.00 52.86 52.82 3hqp s ASN 77 Cb -0.10 -2.26 0.01 0.00 0.41 0.00 0.00 41.25 39.32 3hqp s ASN 77 CO 0.03 -0.07 -0.12 -0.63 -1.51 0.00 0.00 177.10 174.81 3hqp s ILE 78 N 1.16 1.11 0.22 0.60 -1.09 -1.26 -4.78 121.20 117.16 3hqp s ILE 78 Ca 0.22 -0.46 -0.30 0.00 -2.23 0.00 0.00 60.65 57.88 3hqp s ILE 78 Cb -0.15 -1.03 -0.09 0.00 -1.58 0.00 0.00 42.46 39.62 3hqp s ILE 78 CO 0.09 0.35 1.11 0.00 -1.23 0.00 0.00 174.94 175.26 3hqp s ALA 79 N 0.74 3.40 -0.25 9.38 0.00 -0.96 -4.91 121.76 129.16 3hqp s ALA 79 Ca -0.13 0.87 -0.06 0.00 0.00 0.00 0.00 51.96 52.64 3hqp s ALA 79 Cb -0.16 -3.35 -0.02 0.00 0.00 0.00 0.00 23.12 19.60 3hqp s ALA 79 CO 0.03 -0.21 0.05 0.42 0.00 0.00 0.00 175.76 176.04 3hqp s ILE 80 N -0.61 4.03 -0.15 0.00 1.01 -1.26 -1.10 121.20 123.12 3hqp s ILE 80 Ca 0.48 -0.34 -0.03 0.00 0.00 0.00 0.00 60.65 60.76 3hqp s ILE 80 Cb -0.31 -2.91 -0.03 0.00 0.01 0.00 0.00 42.46 39.23 3hqp s ILE 80 CO 0.38 0.31 -0.05 0.00 0.00 0.00 0.00 174.94 175.58 3hqp s ALA 81 N 1.56 2.97 -0.31 9.38 0.00 -0.25 -1.73 121.76 133.37 3hqp s ALA 81 Ca 0.06 -0.83 -0.12 0.00 0.00 0.00 0.00 51.96 51.06 3hqp s ALA 81 Cb -0.15 -1.50 -0.03 0.00 0.00 0.00 0.00 23.12 21.43 3hqp s ALA 81 CO 0.02 0.24 0.24 -1.17 0.00 0.00 0.00 175.76 175.09 3hqp s LEU 82 N 0.28 4.30 -0.38 0.00 0.20 -0.23 -1.60 118.68 121.26 3hqp s LEU 82 Ca -0.04 -0.22 -0.16 0.00 0.69 0.00 0.00 54.13 54.41 3hqp s LEU 82 Cb -0.14 -2.16 0.00 0.00 -0.43 0.00 0.00 46.19 43.46 3hqp s LEU 82 CO 0.03 -0.17 0.38 -0.62 -0.29 0.00 0.00 176.35 175.68 3hqp s ASP 83 N 1.73 6.17 0.92 3.68 -1.08 0.21 0.06 116.67 128.37 3hqp s ASP 83 Ca 0.07 -0.48 -0.10 0.00 -0.52 0.00 0.00 52.55 51.52 3hqp s ASP 83 Cb -0.17 -2.20 0.15 0.00 -1.46 0.00 0.00 42.92 39.24 3hqp s ASP 83 CO 0.11 -0.44 1.15 -0.89 0.52 0.00 0.00 175.17 175.61 3hqp s THR 84 N 2.02 2.06 -0.06 1.71 2.01 -0.54 -1.00 115.64 121.83 3hqp s THR 84 Ca 0.11 0.02 -0.21 0.00 0.31 0.00 0.00 61.69 61.91 3hqp s THR 84 Cb -0.17 -2.04 -0.16 0.00 0.01 0.00 0.00 72.50 70.13 3hqp s THR 84 CO 0.12 -0.03 0.87 0.11 -0.69 0.00 0.00 174.62 175.01 3hqp h LYS 85 N -1.88 -0.17 0.00 4.92 1.57 -1.91 -3.42 116.57 115.68 3hqp h LYS 85 Ca -0.43 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.36 3hqp h LYS 85 Cb 1.27 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.62 3hqp h LYS 85 CO 0.42 0.30 0.00 0.41 -0.57 0.00 0.00 179.45 180.01 3hqp n GLY 86 N 0.68 -2.26 3.00 3.86 0.00 -1.26 -4.30 105.19 104.91 3hqp n GLY 86 Ca -0.08 -1.54 -0.42 0.00 0.00 0.00 0.00 46.02 43.98 3hqp n GLY 86 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3hqp n PRO 87 N -0.42 2.09 -4.41 1.61 -0.04 -1.26 -4.90 135.00 127.66 3hqp n PRO 87 Ca 0.00 -2.22 -0.26 0.00 -0.04 0.00 0.00 63.50 60.98 3hqp n PRO 87 Cb 0.00 -3.12 -0.09 0.00 -0.04 0.00 0.00 33.50 30.24 3hqp n PRO 87 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 3hqp s GLU 88 N 4.36 2.04 -0.09 0.54 -1.05 -1.26 -4.95 118.70 118.30 3hqp s GLU 88 Ca 0.54 -1.94 0.04 0.00 -0.15 0.00 0.00 54.97 53.45 3hqp s GLU 88 Cb 0.13 -1.80 0.00 0.00 -0.44 0.00 0.00 34.13 32.02 3hqp s GLU 88 CO 0.04 -0.01 -0.21 0.42 0.95 0.00 0.00 175.26 176.45 3hqp s ILE 89 N -2.63 1.81 0.16 1.83 1.01 -1.26 -4.97 121.20 117.15 3hqp s ILE 89 Ca 0.36 -0.88 0.06 0.00 0.00 0.00 0.00 60.65 60.20 3hqp s ILE 89 Cb 0.05 -1.57 -0.04 0.00 0.01 0.00 0.00 42.46 40.91 3hqp s ILE 89 CO 0.19 0.50 -0.13 -0.13 0.00 0.00 0.00 174.94 175.37 3hqp s ARG 90 N 0.38 1.16 0.00 2.79 0.52 -1.26 -1.59 118.95 120.95 3hqp s ARG 90 Ca -0.16 -1.44 0.00 0.00 -0.52 0.00 0.00 55.73 53.61 3hqp s ARG 90 Cb -0.17 -0.94 0.00 0.00 0.52 0.00 0.00 34.95 34.36 3hqp s ARG 90 CO 0.07 0.16 0.13 0.25 0.02 0.00 0.00 175.30 175.93 3hqp n THR 91 N -0.01 0.00 -0.12 0.02 -2.24 0.91 -2.11 114.28 110.72 3hqp n THR 91 Ca -0.11 0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.94 3hqp n THR 91 Cb 0.59 -0.56 0.00 0.00 -2.10 0.00 0.00 70.33 68.27 3hqp n THR 91 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hqp n GLY 92 N 1.70 0.86 3.77 3.38 0.00 -1.26 -3.81 105.19 109.83 3hqp n GLY 92 Ca 0.00 -1.89 -0.39 0.00 0.00 0.00 0.00 46.02 43.73 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 -1.63 4.26 0.09 1.61 -0.21 -0.81 -1.59 119.66 121.37 3hqp s GLN 93 Ca 0.00 1.96 0.07 0.00 0.02 0.00 0.00 55.36 57.41 3hqp s GLN 93 Cb 0.00 -2.90 -0.04 0.00 1.00 0.00 0.00 33.01 31.07 3hqp s GLN 93 CO 0.00 -0.18 -0.13 -0.06 -2.12 0.00 0.00 175.29 172.80 3hqp s PHE 94 N -1.27 2.68 0.00 0.91 0.08 -1.26 -2.26 117.98 116.86 3hqp s PHE 94 Ca 0.52 -0.19 -0.30 0.00 0.12 0.00 0.00 56.93 57.08 3hqp s PHE 94 Cb -0.34 -1.43 -0.06 0.00 -0.57 0.00 0.00 43.02 40.62 3hqp s PHE 94 CO 0.44 0.39 1.43 0.08 -0.10 0.00 0.00 175.22 177.46 3hqp s VAL 95 N -1.15 3.65 0.00 -0.44 1.01 0.78 -2.93 120.40 121.32 3hqp s VAL 95 Ca 0.19 1.03 0.00 0.00 0.00 0.00 0.00 61.98 63.21 3hqp s VAL 95 Cb -0.11 -3.67 0.00 0.00 0.00 0.00 0.00 36.38 32.61 3hqp s VAL 95 CO 0.11 -0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.82 3hqp n GLY 96 N 3.68 0.79 0.00 4.51 0.00 -1.26 -4.33 105.19 108.58 3hqp n GLY 96 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 -2.19 2.90 3.43 -0.02 0.00 -1.15 -5.03 105.19 103.14 3hqp n GLY 97 Ca 0.00 -0.76 -0.21 0.00 0.00 0.00 0.00 46.02 45.05 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 0.00 2.37 -0.06 1.61 1.47 -1.26 -3.39 116.67 117.41 3hqp s ASP 98 Ca 0.00 -1.32 -0.01 0.00 1.18 0.00 0.00 52.55 52.40 3hqp s ASP 98 Cb 0.00 -0.09 0.03 0.00 -0.34 0.00 0.00 42.92 42.52 3hqp s ASP 98 CO 0.00 -0.54 0.03 0.00 0.68 0.00 0.00 175.17 175.33 3hqp s ALA 99 N -3.26 0.48 -0.28 2.11 0.00 -0.48 -4.72 121.76 115.61 3hqp s ALA 99 Ca 0.34 0.03 -0.28 0.00 0.00 0.00 0.00 51.96 52.04 3hqp s ALA 99 Cb 0.07 -0.66 0.01 0.00 0.00 0.00 0.00 23.12 22.54 3hqp s ALA 99 CO 0.14 -0.44 1.03 0.08 0.00 0.00 0.00 175.76 176.56 3hqp s VAL 100 N 1.98 4.61 -0.27 0.00 1.01 -1.26 -2.05 120.40 124.43 3hqp s VAL 100 Ca 0.04 1.80 -0.08 0.00 0.00 0.00 0.00 61.98 63.73 3hqp s VAL 100 Cb -0.12 -4.34 -0.03 0.00 0.00 0.00 0.00 36.38 31.89 3hqp s VAL 100 CO -0.04 -0.33 0.11 -0.04 0.00 0.00 0.00 175.10 174.80 3hqp s MET 101 N 3.38 3.61 -0.01 2.72 -1.94 -0.28 -4.87 119.30 121.92 3hqp s MET 101 Ca 0.43 -0.52 0.01 0.00 -1.71 0.00 0.00 55.69 53.90 3hqp s MET 101 Cb -0.14 -3.44 -0.04 0.00 2.01 0.00 0.00 34.83 33.23 3hqp s MET 101 CO 0.11 -0.25 0.01 -2.00 -0.01 0.00 0.00 175.02 172.88 3hqp s GLU 102 N 1.64 2.84 -0.05 2.03 2.12 -1.26 -0.44 118.70 125.57 3hqp s GLU 102 Ca 0.06 -0.58 -0.30 0.00 0.36 0.00 0.00 54.97 54.51 3hqp s GLU 102 Cb -0.16 -2.70 -0.08 0.00 0.26 0.00 0.00 34.13 31.45 3hqp s GLU 102 CO 0.05 0.63 2.04 -2.13 -0.54 0.00 0.00 175.26 175.32 3hqp n ARG 103 N 1.43 2.51 0.00 4.30 0.63 -1.26 -1.84 116.66 122.44 3hqp n ARG 103 Ca -0.15 0.87 0.00 0.00 -0.92 0.00 0.00 57.85 57.65 3hqp n ARG 103 Cb 0.53 -3.01 0.00 0.00 0.45 0.00 0.00 32.46 30.42 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 4.90 2.66 3.73 5.14 0.00 0.47 -4.97 105.19 117.13 3hqp n GLY 104 Ca 0.23 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.59 1.85 -0.13 4.61 0.00 -0.76 -4.68 121.76 120.06 3hqp s ALA 105 Ca 0.00 0.22 0.02 0.00 0.00 0.00 0.00 51.96 52.21 3hqp s ALA 105 Cb 0.00 -3.28 0.01 0.00 0.00 0.00 0.00 23.12 19.84 3hqp s ALA 105 CO 0.00 -2.16 -0.21 -0.08 0.00 0.00 0.00 175.76 173.31 3hqp s THR 106 N -2.85 2.19 0.40 0.00 -1.32 -1.26 0.35 115.64 113.14 3hqp s THR 106 Ca 0.63 -0.95 0.03 0.00 -1.21 0.00 0.00 61.69 60.20 3hqp s THR 106 Cb -0.19 -1.87 -0.03 0.00 -1.51 0.00 0.00 72.50 68.90 3hqp s THR 106 CO 0.57 0.55 0.10 0.00 -2.21 0.00 0.00 174.62 173.62 3hqp s TYR 108 N -3.20 1.51 -0.19 0.00 2.02 0.21 -0.53 117.35 117.17 3hqp s TYR 108 Ca 0.25 -0.30 0.01 0.00 -0.37 0.00 0.00 57.07 56.65 3hqp s TYR 108 Cb 0.04 -0.96 0.02 0.00 -0.40 0.00 0.00 41.96 40.66 3hqp s TYR 108 CO 0.14 -0.00 -0.18 0.14 -1.57 0.00 0.00 175.55 174.07 3hqp s VAL 109 N -0.50 2.21 -0.01 0.71 -7.23 -0.99 -2.00 120.40 112.60 3hqp s VAL 109 Ca 0.06 -0.93 0.04 0.00 -1.81 0.00 0.00 61.98 59.34 3hqp s VAL 109 Cb -0.07 -1.96 -0.03 0.00 0.56 0.00 0.00 36.38 34.88 3hqp s VAL 109 CO -0.00 0.50 -0.11 0.28 -0.31 0.00 0.00 175.10 175.46 3hqp s THR 110 N 1.30 3.34 -2.53 5.32 -1.32 -0.46 -2.39 115.64 118.89 3hqp s THR 110 Ca 0.04 -0.81 0.23 0.00 -1.21 0.00 0.00 61.69 59.94 3hqp s THR 110 Cb -0.13 -2.40 0.40 0.00 -1.51 0.00 0.00 72.50 68.86 3hqp s THR 110 CO -0.12 0.45 1.41 0.35 -2.21 0.00 0.00 174.62 174.51 3hqp n THR 111 N 1.82 0.39 -2.21 5.08 -2.24 -0.97 -1.48 114.28 114.66 3hqp n THR 111 Ca -0.16 -0.65 -0.43 0.00 -2.27 0.00 0.00 64.05 60.54 3hqp n THR 111 Cb 0.52 0.97 -0.02 0.00 -2.10 0.00 0.00 70.33 69.70 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 -1.58 6.68 0.67 3.42 3.68 -1.26 -4.91 116.67 123.37 3hqp s ASP 112 Ca 0.37 1.79 0.43 0.00 2.13 0.00 0.00 52.55 57.27 3hqp s ASP 112 Cb 0.22 -2.54 2.36 0.00 -1.45 0.00 0.00 42.92 41.51 3hqp s ASP 112 CO 0.31 -0.98 2.33 -0.65 0.13 0.00 0.00 175.17 176.31 3hqp h PRO 113 N 9.40 0.00 0.00 4.34 0.11 -1.96 -2.51 132.00 141.38 3hqp h PRO 113 Ca -0.32 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.76 3hqp h PRO 113 Cb 1.14 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 3hqp h PRO 113 CO 0.98 0.00 -0.13 0.00 -0.21 0.00 0.00 178.00 178.64 3hqp h ALA 114 N 1.93 1.54 -0.32 -0.75 0.00 -2.00 -2.70 119.26 116.97 3hqp h ALA 114 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3hqp h ALA 114 Cb 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3hqp h ALA 114 CO -0.00 0.16 0.00 1.19 0.00 0.00 0.00 179.25 180.60 3hqp n PHE 115 N -4.03 0.75 -0.03 0.00 3.01 -0.95 -4.42 117.46 111.79 3hqp n PHE 115 Ca -0.02 -0.30 -0.12 0.00 1.01 0.00 0.00 57.45 58.02 3hqp n PHE 115 Cb 0.21 -0.15 -0.07 0.00 -0.01 0.00 0.00 39.48 39.46 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 3.31 0.15 -0.04 4.37 0.00 -1.69 -3.18 119.26 122.18 3hqp h ALA 116 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3hqp h ALA 116 Cb 0.86 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.61 3hqp h ALA 116 CO 0.12 -0.17 0.00 -0.40 0.00 0.00 0.00 179.25 178.80 3hqp n ASP 117 N -4.81 2.16 -3.69 0.00 5.75 -1.26 -1.93 116.55 112.78 3hqp n ASP 117 Ca -0.06 -1.72 -0.29 0.00 -0.01 0.00 0.00 54.79 52.70 3hqp n ASP 117 Cb 0.20 -0.02 -0.15 0.00 -1.03 0.00 0.00 41.12 40.12 3hqp n ASP 117 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3hqp s LYS 118 N -1.97 0.58 0.06 0.11 1.02 -1.20 -4.78 119.74 113.56 3hqp s LYS 118 Ca 0.34 -0.85 0.03 0.00 0.02 0.00 0.00 55.97 55.51 3hqp s LYS 118 Cb 0.20 -1.81 -0.03 0.00 -0.52 0.00 0.00 37.83 35.68 3hqp s LYS 118 CO 0.32 -0.94 -0.10 0.20 -0.92 0.00 0.00 175.35 173.90 3hqp s GLY 119 N 1.77 0.70 0.32 -3.33 0.00 -0.96 -4.67 107.32 101.14 3hqp s GLY 119 Ca 0.08 -0.95 0.05 0.00 0.00 0.00 0.00 44.72 43.91 3hqp s GLY 119 CO -0.26 -1.00 0.20 -1.30 0.00 0.00 0.00 173.10 170.74 3hqp n THR 120 N 1.15 0.00 0.59 0.90 -2.24 0.28 -0.16 114.28 114.81 3hqp n THR 120 Ca -0.20 -2.12 0.09 0.00 -2.27 0.00 0.00 64.05 59.55 3hqp n THR 120 Cb 0.55 0.93 0.38 0.00 -2.10 0.00 0.00 70.33 70.10 3hqp n THR 120 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 3hqp n LYS 121 N -0.66 0.02 -0.04 -0.78 2.85 -1.26 -3.50 118.16 114.79 3hqp n LYS 121 Ca 0.02 0.21 -0.04 0.00 -1.05 0.00 0.00 58.31 57.45 3hqp n LYS 121 Cb 0.53 -1.53 -0.07 0.00 -0.65 0.00 0.00 35.03 33.31 3hqp n LYS 121 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 3hqp n ASP 122 N -1.56 2.71 -3.65 -5.58 8.00 -1.26 -4.69 116.55 110.52 3hqp n ASP 122 Ca 0.04 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.45 3hqp n ASP 122 Cb 0.21 0.81 -0.10 0.00 -0.02 0.00 0.00 41.12 42.02 3hqp n ASP 122 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3hqp s LYS 123 N -2.27 0.31 0.12 -1.24 2.20 -1.23 0.65 119.74 118.28 3hqp s LYS 123 Ca -0.04 1.01 -0.06 0.00 -0.36 0.00 0.00 55.97 56.51 3hqp s LYS 123 Cb 0.03 0.29 -0.02 0.00 -1.51 0.00 0.00 37.83 36.63 3hqp s LYS 123 CO 0.38 -0.26 0.17 -0.59 -0.36 0.00 0.00 175.35 174.69 3hqp s PHE 124 N 2.60 0.45 0.32 4.03 -0.71 -0.85 -0.55 117.98 123.27 3hqp s PHE 124 Ca -0.01 -0.85 -0.17 0.00 -1.04 0.00 0.00 56.93 54.86 3hqp s PHE 124 Cb -0.12 -0.19 -0.09 0.00 -1.21 0.00 0.00 43.02 41.41 3hqp s PHE 124 CO -0.13 -0.59 0.78 -0.47 -1.34 0.00 0.00 175.22 173.47 3hqp s TYR 125 N -3.95 3.42 -0.04 3.49 5.04 -1.26 -1.36 117.35 122.69 3hqp s TYR 125 Ca 0.14 1.32 -0.01 0.00 -2.44 0.00 0.00 57.07 56.09 3hqp s TYR 125 Cb 0.05 -2.61 0.03 0.00 0.35 0.00 0.00 41.96 39.78 3hqp s TYR 125 CO -0.04 0.10 0.02 0.42 -1.34 0.00 0.00 175.55 174.72 3hqp s ILE 126 N -1.93 0.12 -2.00 3.14 1.01 -0.55 -4.07 121.20 116.91 3hqp s ILE 126 Ca 0.54 0.20 0.23 0.00 0.00 0.00 0.00 60.65 61.61 3hqp s ILE 126 Cb -0.11 -0.27 0.65 0.00 0.01 0.00 0.00 42.46 42.73 3hqp s ILE 126 CO 0.17 0.17 1.83 -0.90 0.00 0.00 0.00 174.94 176.21 3hqp n ASP 127 N 4.67 0.00 -4.64 3.58 5.75 -0.90 -4.44 116.55 120.57 3hqp n ASP 127 Ca -0.16 -1.14 -0.43 0.00 -0.01 0.00 0.00 54.79 53.05 3hqp n ASP 127 Cb 0.50 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.56 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 -2.00 3.27 0.02 2.11 5.04 -1.26 -4.98 117.35 119.55 3hqp s TYR 128 Ca 0.34 1.23 -0.18 0.00 -2.44 0.00 0.00 57.07 56.03 3hqp s TYR 128 Cb 0.16 -3.30 -0.10 0.00 0.35 0.00 0.00 41.96 39.06 3hqp s TYR 128 CO 0.26 -0.54 1.07 1.96 -1.34 0.00 0.00 175.55 176.96 3hqp h GLN 129 N 7.74 -0.62 -2.08 4.97 1.08 -1.92 -3.24 115.11 121.03 3hqp h GLN 129 Ca -0.21 0.04 -0.42 0.00 -1.45 0.00 0.00 58.65 56.62 3hqp h GLN 129 Cb 1.07 0.14 -0.13 0.00 -0.05 0.00 0.00 27.48 28.52 3hqp h GLN 129 CO 0.95 -0.41 0.40 0.27 -0.95 0.00 0.00 178.83 179.08 3hqp n ASN 130 N -4.05 6.24 -0.09 1.46 6.94 -1.26 -4.48 115.26 120.02 3hqp n ASN 130 Ca -0.08 -2.93 -0.08 0.00 -0.02 0.00 0.00 54.58 51.47 3hqp n ASN 130 Cb 0.25 -1.32 0.07 0.00 -2.36 0.00 0.00 39.78 36.43 3hqp n ASN 130 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 3hqp h LEU 131 N 4.53 0.80 -1.28 -4.53 5.85 -1.97 -3.16 115.31 115.56 3hqp h LEU 131 Ca 0.36 -0.31 -0.05 0.00 0.84 0.00 0.00 57.88 58.73 3hqp h LEU 131 Cb 0.95 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 3hqp h LEU 131 CO 0.73 1.02 -0.22 0.28 -0.34 0.00 0.00 178.44 179.91 3hqp h SER 132 N 0.67 0.00 -0.22 1.25 0.02 -1.89 -2.42 113.55 110.97 3hqp h SER 132 Ca 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 3hqp h SER 132 Cb 0.78 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.32 3hqp h SER 132 CO 0.06 0.22 0.00 0.29 -1.14 0.00 0.00 176.83 176.27 3hqp n LYS 133 N -3.47 1.62 -0.01 3.45 5.02 -1.19 -4.19 118.16 119.39 3hqp n LYS 133 Ca -0.00 -0.95 -0.01 0.00 -2.02 0.00 0.00 58.31 55.32 3hqp n LYS 133 Cb 0.40 -1.29 -0.01 0.00 -0.02 0.00 0.00 35.03 34.11 3hqp n LYS 133 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3hqp n VAL 134 N 0.22 0.10 -3.96 -0.18 0.31 -0.94 -5.07 118.33 108.81 3hqp n VAL 134 Ca 0.12 -0.03 -0.32 0.00 -0.01 0.00 0.00 64.34 64.10 3hqp n VAL 134 Cb 0.25 -0.85 -0.05 0.00 -0.91 0.00 0.00 33.84 32.28 3hqp n VAL 134 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 3hqp s VAL 135 N -2.03 5.15 0.28 2.52 -7.23 -1.00 -5.09 120.40 113.00 3hqp s VAL 135 Ca -0.02 -0.43 0.06 0.00 -1.81 0.00 0.00 61.98 59.78 3hqp s VAL 135 Cb 0.01 -3.47 -0.06 0.00 0.56 0.00 0.00 36.38 33.42 3hqp s VAL 135 CO 0.04 0.19 -0.04 -0.13 -0.31 0.00 0.00 175.10 174.85 3hqp s ARG 136 N -2.30 1.54 -0.13 4.82 0.52 -1.26 -4.85 118.95 117.29 3hqp s ARG 136 Ca 0.31 -1.79 -0.33 0.00 -0.52 0.00 0.00 55.73 53.40 3hqp s ARG 136 Cb -0.13 -1.08 -0.10 0.00 0.52 0.00 0.00 34.95 34.16 3hqp s ARG 136 CO 0.24 0.00 1.99 -2.30 0.02 0.00 0.00 175.30 175.25 3hqp n PRO 137 N -0.58 2.07 0.00 3.54 -0.02 -1.26 -1.99 135.00 136.75 3hqp n PRO 137 Ca -0.05 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 3hqp n PRO 137 Cb 0.64 -2.75 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 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 4.94 0.91 3.76 -1.23 0.00 0.11 -4.99 105.19 108.69 3hqp n GLY 138 Ca 0.26 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.96 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 -1.10 4.61 -0.07 1.61 0.02 -0.84 -4.66 114.94 114.51 3hqp s ASN 139 Ca 0.00 1.95 -0.04 0.00 -1.02 0.00 0.00 52.86 53.75 3hqp s ASN 139 Cb 0.00 -2.54 -0.04 0.00 0.02 0.00 0.00 41.25 38.69 3hqp s ASN 139 CO 0.00 -1.96 0.11 -0.31 0.02 0.00 0.00 177.10 174.95 3hqp s TYR 140 N -2.61 3.44 -0.20 2.20 2.02 -1.26 -1.42 117.35 119.51 3hqp s TYR 140 Ca 0.65 0.37 -0.02 0.00 -0.37 0.00 0.00 57.07 57.69 3hqp s TYR 140 Cb -0.19 -1.85 -0.00 0.00 -0.40 0.00 0.00 41.96 39.51 3hqp s TYR 140 CO 0.50 0.63 -0.08 0.42 -1.57 0.00 0.00 175.55 175.44 3hqp s ILE 141 N -1.09 3.09 -0.13 2.71 1.01 0.17 -4.95 121.20 122.01 3hqp s ILE 141 Ca 0.18 -0.60 -0.14 0.00 0.00 0.00 0.00 60.65 60.10 3hqp s ILE 141 Cb -0.12 -2.37 -0.05 0.00 0.01 0.00 0.00 42.46 39.93 3hqp s ILE 141 CO 0.08 0.46 0.32 -0.31 0.00 0.00 0.00 174.94 175.49 3hqp s TYR 142 N 1.26 3.51 0.01 3.97 1.51 -1.20 -0.38 117.35 126.04 3hqp s TYR 142 Ca 0.03 0.67 0.06 0.00 -1.01 0.00 0.00 57.07 56.82 3hqp s TYR 142 Cb -0.14 -2.33 -0.02 0.00 -0.11 0.00 0.00 41.96 39.36 3hqp s TYR 142 CO -0.04 0.32 -0.18 0.42 -1.11 0.00 0.00 175.55 174.97 3hqp s ILE 143 N 0.17 1.39 -0.71 2.71 -1.09 0.20 -1.81 121.20 122.07 3hqp s ILE 143 Ca 0.18 -0.91 -0.02 0.00 -2.23 0.00 0.00 60.65 57.67 3hqp s ILE 143 Cb -0.14 -1.19 0.00 0.00 -1.58 0.00 0.00 42.46 39.55 3hqp s ILE 143 CO 0.06 0.26 0.68 -0.67 -1.23 0.00 0.00 174.94 174.04 3hqp n ASP 144 N 2.29 -7.66 -4.35 3.58 2.03 0.19 -1.18 116.55 111.45 3hqp n ASP 144 Ca -0.16 -0.05 -0.38 0.00 0.52 0.00 0.00 54.79 54.73 3hqp n ASP 144 Cb 0.54 -5.12 -0.06 0.00 -0.72 0.00 0.00 41.12 35.77 3hqp n ASP 144 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 3hqp n ASP 145 N -1.64 -2.00 0.00 1.67 8.00 -1.26 -1.56 116.55 119.77 3hqp n ASP 145 Ca -0.00 -1.14 0.00 0.00 0.71 0.00 0.00 54.79 54.36 3hqp n ASP 145 Cb 0.51 -2.17 0.00 0.00 -0.02 0.00 0.00 41.12 39.43 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 -1.44 0.52 0.21 0.44 0.00 -1.10 -4.81 105.19 99.02 3hqp n GLY 146 Ca 0.02 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.99 3hqp n GLY 146 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3hqp h ILE 147 N 0.00 1.31 -3.45 -0.61 2.04 -0.88 -3.43 117.51 112.48 3hqp h ILE 147 Ca 0.00 -1.54 -0.66 0.00 1.00 0.00 0.00 64.86 63.66 3hqp h ILE 147 Cb 0.16 1.61 -0.21 0.00 -0.74 0.00 0.00 36.82 37.63 3hqp h ILE 147 CO 0.00 0.47 -0.69 -0.22 0.00 0.00 0.00 178.15 177.71 3hqp s LEU 148 N -8.39 3.13 -0.07 1.44 2.96 -0.33 -4.99 118.68 112.44 3hqp s LEU 148 Ca -0.06 -0.12 0.04 0.00 -0.22 0.00 0.00 54.13 53.78 3hqp s LEU 148 Cb 0.13 -1.72 -0.00 0.00 0.50 0.00 0.00 46.19 45.10 3hqp s LEU 148 CO 0.80 0.25 -0.20 -0.63 -1.32 0.00 0.00 176.35 175.24 3hqp s ILE 149 N -0.12 1.71 -0.11 6.68 1.01 -1.26 0.58 121.20 129.68 3hqp s ILE 149 Ca 0.01 -0.85 0.02 0.00 0.00 0.00 0.00 60.65 59.84 3hqp s ILE 149 Cb -0.13 -1.47 -0.01 0.00 0.01 0.00 0.00 42.46 40.86 3hqp s ILE 149 CO 0.03 0.48 -0.19 -0.76 0.00 0.00 0.00 174.94 174.50 3hqp s LEU 150 N 0.16 2.37 -0.27 2.97 1.43 0.49 -2.55 118.68 123.29 3hqp s LEU 150 Ca -0.09 -0.46 -0.15 0.00 -1.03 0.00 0.00 54.13 52.40 3hqp s LEU 150 Cb -0.14 -1.50 -0.04 0.00 0.03 0.00 0.00 46.19 44.54 3hqp s LEU 150 CO 0.05 0.16 0.38 -1.58 0.23 0.00 0.00 176.35 175.58 3hqp s GLN 151 N 0.35 4.02 0.09 1.70 0.74 -0.86 0.41 119.66 126.12 3hqp s GLN 151 Ca -0.15 0.05 -0.31 0.00 0.05 0.00 0.00 55.36 55.00 3hqp s GLN 151 Cb -0.17 -3.65 -0.08 0.00 1.10 0.00 0.00 33.01 30.21 3hqp s GLN 151 CO 0.07 -0.27 1.52 0.08 -0.55 0.00 0.00 175.29 176.15 3hqp s VAL 152 N 2.05 3.15 -0.21 1.34 1.01 -0.51 -1.14 120.40 126.08 3hqp s VAL 152 Ca 0.15 0.70 -0.13 0.00 0.00 0.00 0.00 61.98 62.70 3hqp s VAL 152 Cb -0.16 -3.45 -0.09 0.00 0.00 0.00 0.00 36.38 32.68 3hqp s VAL 152 CO 0.10 0.02 -0.31 1.67 0.00 0.00 0.00 175.10 176.58 3hqp n GLN 153 N 4.84 0.49 -3.75 2.72 -0.06 0.82 0.08 117.38 122.52 3hqp n GLN 153 Ca 0.14 0.21 -0.10 0.00 -2.00 0.00 0.00 57.00 55.25 3hqp n GLN 153 Cb 0.41 -1.34 -0.05 0.00 -4.06 0.00 0.00 30.24 25.20 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 -6.80 -0.14 -0.33 1.69 1.04 -1.16 -4.66 113.70 103.33 3hqp s SER 154 Ca -0.31 -0.50 -0.20 0.00 0.48 0.00 0.00 55.95 55.42 3hqp s SER 154 Cb 0.10 0.47 -0.00 0.00 0.10 0.00 0.00 66.02 66.69 3hqp s SER 154 CO 0.41 -0.89 0.59 -1.00 0.98 0.00 0.00 173.24 173.33 3hqp s HIS 155 N -3.86 3.19 -0.04 5.02 3.76 -1.26 0.19 115.29 122.29 3hqp s HIS 155 Ca 0.07 0.40 -0.24 0.00 -0.15 0.00 0.00 55.06 55.14 3hqp s HIS 155 Cb 0.02 -3.01 -0.18 0.00 1.11 0.00 0.00 32.58 30.52 3hqp s HIS 155 CO -0.08 -0.53 1.08 0.93 -0.85 0.00 0.00 174.74 175.29 3hqp h GLU 156 N 8.35 -0.14 0.00 1.40 4.39 -1.54 -3.47 114.58 123.56 3hqp h GLU 156 Ca -0.27 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.44 3hqp h GLU 156 Cb 1.12 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.80 3hqp h GLU 156 CO 0.80 0.33 0.00 -0.40 -1.16 0.00 0.00 179.01 178.58 3hqp n ASP 157 N -4.91 0.57 0.19 1.42 5.68 -1.18 -4.99 116.55 113.33 3hqp n ASP 157 Ca -0.08 0.00 0.07 0.00 -0.50 0.00 0.00 54.79 54.27 3hqp n ASP 157 Cb 0.27 0.00 0.32 0.00 -1.14 0.00 0.00 41.12 40.57 3hqp n ASP 157 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 3hqp h GLU 158 N 0.00 0.00 0.00 0.11 4.81 -2.04 -3.37 114.58 114.09 3hqp h GLU 158 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3hqp h GLU 158 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 3hqp h GLU 158 CO 0.00 0.34 0.00 1.04 -0.73 0.00 0.00 179.01 179.66 3hqp n GLN 159 N -3.43 1.11 -4.79 1.92 6.02 -1.26 -4.93 117.38 112.02 3hqp n GLN 159 Ca 0.00 -0.07 -0.33 0.00 -0.01 0.00 0.00 57.00 56.60 3hqp n GLN 159 Cb 0.52 -0.37 -0.12 0.00 1.02 0.00 0.00 30.24 31.29 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 -0.18 3.25 -0.08 5.09 2.01 -1.26 -2.28 115.64 122.18 3hqp s THR 160 Ca 0.00 -0.68 0.03 0.00 0.31 0.00 0.00 61.69 61.34 3hqp s THR 160 Cb 0.00 -2.30 0.01 0.00 0.01 0.00 0.00 72.50 70.22 3hqp s THR 160 CO 0.00 0.57 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.58 3hqp s LEU 161 N -0.82 1.79 0.12 4.42 1.43 -1.01 -1.30 118.68 123.30 3hqp s LEU 161 Ca 0.12 -0.39 -0.30 0.00 -1.03 0.00 0.00 54.13 52.53 3hqp s LEU 161 Cb -0.11 -1.04 -0.06 0.00 0.03 0.00 0.00 46.19 45.01 3hqp s LEU 161 CO 0.01 0.07 1.10 -0.70 0.23 0.00 0.00 176.35 177.06 3hqp s GLU 162 N 0.61 4.56 0.36 1.70 2.12 0.13 -2.36 118.70 125.82 3hqp s GLU 162 Ca -0.15 1.66 0.04 0.00 0.36 0.00 0.00 54.97 56.88 3hqp s GLU 162 Cb -0.16 -3.33 -0.05 0.00 0.26 0.00 0.00 34.13 30.84 3hqp s GLU 162 CO 0.05 -0.02 0.07 0.00 -0.54 0.00 0.00 175.26 174.82 3hqp s THR 164 N -3.21 1.15 -0.40 0.00 2.01 -0.30 -2.88 115.64 112.01 3hqp s THR 164 Ca 0.32 -0.46 -0.29 0.00 0.31 0.00 0.00 61.69 61.57 3hqp s THR 164 Cb 0.07 -1.07 0.02 0.00 0.01 0.00 0.00 72.50 71.54 3hqp s THR 164 CO 0.15 0.36 1.16 -0.69 -0.69 0.00 0.00 174.62 174.91 3hqp s VAL 165 N 0.85 4.27 -0.02 3.82 1.01 0.15 -2.02 120.40 128.46 3hqp s VAL 165 Ca -0.11 1.38 0.11 0.00 0.00 0.00 0.00 61.98 63.36 3hqp s VAL 165 Cb -0.15 -4.45 -0.09 0.00 0.00 0.00 0.00 36.38 31.68 3hqp s VAL 165 CO 0.01 -0.74 1.29 0.71 0.00 0.00 0.00 175.10 176.37 3hqp h THR 166 N 6.05 1.24 -3.63 3.92 1.35 -1.80 0.13 112.91 120.17 3hqp h THR 166 Ca -0.23 -2.80 -0.11 0.00 -0.55 0.00 0.00 66.41 62.72 3hqp h THR 166 Cb 1.07 2.60 -0.17 0.00 -1.73 0.00 0.00 68.15 69.92 3hqp h THR 166 CO 1.08 0.71 -0.41 0.54 -0.25 0.00 0.00 175.52 177.18 3hqp s ASN 167 N -6.51 0.07 -0.30 5.36 2.20 -1.26 -4.64 114.94 109.86 3hqp s ASN 167 Ca 0.02 -0.43 -0.29 0.00 -0.94 0.00 0.00 52.86 51.21 3hqp s ASN 167 Cb 0.09 0.28 0.01 0.00 -2.00 0.00 0.00 41.25 39.63 3hqp s ASN 167 CO 0.79 -0.57 1.17 -0.44 -2.94 0.00 0.00 177.10 175.11 3hqp s SER 168 N -2.19 6.84 -0.19 3.54 0.01 -1.26 -4.24 113.70 116.21 3hqp s SER 168 Ca -0.04 1.16 -0.18 0.00 1.31 0.00 0.00 55.95 58.20 3hqp s SER 168 Cb -0.00 -2.54 0.05 0.00 0.21 0.00 0.00 66.02 63.74 3hqp s SER 168 CO -0.05 -0.94 0.51 -2.28 0.41 0.00 0.00 173.24 170.89 3hqp s HIS 169 N 3.90 -0.56 -0.25 2.43 5.04 0.41 -4.95 115.29 121.31 3hqp s HIS 169 Ca 0.50 1.35 -0.11 0.00 -1.54 0.00 0.00 55.06 55.26 3hqp s HIS 169 Cb -0.15 0.19 -0.05 0.00 0.04 0.00 0.00 32.58 32.62 3hqp s HIS 169 CO 0.18 -0.28 0.20 0.99 -2.34 0.00 0.00 174.74 173.49 3hqp s THR 170 N 0.22 5.32 0.11 0.89 2.01 -1.26 -1.12 115.64 121.80 3hqp s THR 170 Ca -0.00 0.24 0.06 0.00 0.31 0.00 0.00 61.69 62.30 3hqp s THR 170 Cb -0.04 -3.54 -0.04 0.00 0.01 0.00 0.00 72.50 68.90 3hqp s THR 170 CO 0.01 0.30 -0.04 0.27 -0.69 0.00 0.00 174.62 174.47 3hqp s ILE 171 N 1.34 3.72 0.03 1.82 -4.36 -0.87 -4.98 121.20 117.91 3hqp s ILE 171 Ca 0.09 -1.17 0.00 0.00 -0.26 0.00 0.00 60.65 59.30 3hqp s ILE 171 Cb -0.14 -2.78 0.00 0.00 1.25 0.00 0.00 42.46 40.79 3hqp s ILE 171 CO 0.07 0.07 0.01 -1.20 0.24 0.00 0.00 174.94 174.14 3hqp n SER 172 N 0.49 1.44 -4.70 4.36 7.64 -1.26 -1.38 113.62 120.21 3hqp n SER 172 Ca -0.12 -1.11 -0.43 0.00 1.01 0.00 0.00 58.87 58.23 3hqp n SER 172 Cb 0.53 0.01 -0.01 0.00 -1.01 0.00 0.00 64.21 63.72 3hqp n SER 172 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 3hqp n ASP 173 N -1.65 2.89 -2.67 6.43 2.03 -1.22 -3.91 116.55 118.45 3hqp n ASP 173 Ca -0.01 1.20 -0.23 0.00 0.52 0.00 0.00 54.79 56.28 3hqp n ASP 173 Cb 0.04 -1.50 0.02 0.00 -0.72 0.00 0.00 41.12 38.96 3hqp n ASP 173 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 3hqp n ARG 174 N 0.70 -1.12 -2.92 -0.67 1.85 -0.62 -4.91 116.66 108.97 3hqp n ARG 174 Ca 0.05 0.90 -0.36 0.00 -1.00 0.00 0.00 57.85 57.43 3hqp n ARG 174 Cb 0.36 -1.25 -0.06 0.00 -1.05 0.00 0.00 32.46 30.46 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 -1.51 4.42 0.15 2.89 3.00 -1.25 -4.71 118.95 121.94 3hqp s ARG 175 Ca 0.22 1.12 -0.30 0.00 0.00 0.00 0.00 55.73 56.77 3hqp s ARG 175 Cb -0.02 -2.79 -0.07 0.00 0.00 0.00 0.00 34.95 32.06 3hqp s ARG 175 CO 0.50 0.31 1.18 0.20 0.00 0.00 0.00 175.30 177.48 3hqp s GLY 176 N -1.67 2.63 -0.06 -3.53 0.00 -1.26 -0.06 107.32 103.36 3hqp s GLY 176 Ca 0.48 0.89 0.05 0.00 0.00 0.00 0.00 44.72 46.14 3hqp s GLY 176 CO 0.22 1.87 -0.21 0.54 0.00 0.00 0.00 173.10 175.51 3hqp s VAL 177 N 0.23 1.79 -0.05 1.40 0.11 -0.62 -0.63 120.40 122.63 3hqp s VAL 177 Ca 0.54 -0.90 0.06 0.00 -2.93 0.00 0.00 61.98 58.74 3hqp s VAL 177 Cb -0.31 -1.54 -0.02 0.00 -1.53 0.00 0.00 36.38 32.99 3hqp s VAL 177 CO 0.34 0.50 -0.23 0.20 -3.33 0.00 0.00 175.10 172.58 3hqp s ASN 178 N 0.06 3.26 -0.59 3.54 0.01 -0.75 -4.33 114.94 116.14 3hqp s ASN 178 Ca -0.08 -0.45 0.04 0.00 -0.71 0.00 0.00 52.86 51.67 3hqp s ASN 178 Cb -0.14 -0.78 0.15 0.00 0.41 0.00 0.00 41.25 40.89 3hqp s ASN 178 CO 0.04 0.27 0.36 -0.76 -1.51 0.00 0.00 177.10 175.51 3hqp s LEU 179 N -0.31 4.32 0.11 0.60 2.01 -1.26 -3.23 118.68 120.92 3hqp s LEU 179 Ca 0.01 -3.36 -0.31 0.00 0.01 0.00 0.00 54.13 50.48 3hqp s LEU 179 Cb -0.13 -1.55 -0.09 0.00 0.01 0.00 0.00 46.19 44.44 3hqp s LEU 179 CO 0.02 -0.17 1.54 -2.84 1.01 0.00 0.00 176.35 175.92 3hqp s PRO 180 N -0.75 4.24 -0.95 1.29 0.02 -1.26 -3.50 135.00 134.08 3hqp s PRO 180 Ca 0.21 2.26 -0.01 0.00 0.02 0.00 0.00 61.00 63.47 3hqp s PRO 180 Cb -0.15 -3.33 -0.02 0.00 0.02 0.00 0.00 34.50 31.02 3hqp s PRO 180 CO -0.08 -0.60 0.81 0.41 -0.33 0.00 0.00 177.00 177.20 3hqp n GLY 181 N 3.76 -0.39 0.00 0.52 0.00 -1.26 -4.95 105.19 102.86 3hqp n GLY 181 Ca 0.14 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.29 3hqp n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hqp n ASP 183 N -1.08 -7.63 -4.61 0.00 4.64 -1.26 -4.94 116.55 101.66 3hqp n ASP 183 Ca 0.00 0.03 -0.43 0.00 -1.38 0.00 0.00 54.79 53.01 3hqp n ASP 183 Cb 0.01 -5.06 -0.02 0.00 -1.04 0.00 0.00 41.12 35.01 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 -2.87 4.08 -0.81 5.18 -7.23 -1.26 -4.92 120.40 112.57 3hqp s VAL 184 Ca 0.07 1.14 -0.06 0.00 -1.81 0.00 0.00 61.98 61.32 3hqp s VAL 184 Cb -0.02 -4.32 -0.05 0.00 0.56 0.00 0.00 36.38 32.55 3hqp s VAL 184 CO 0.77 -0.74 2.96 -0.67 -0.31 0.00 0.00 175.10 177.11 3hqp n ASP 185 N 8.15 7.06 -4.80 4.85 -0.08 -1.26 -4.93 116.55 125.54 3hqp n ASP 185 Ca 0.15 -2.84 -0.36 0.00 -1.51 0.00 0.00 54.79 50.22 3hqp n ASP 185 Cb 0.48 -1.39 -0.06 0.00 2.34 0.00 0.00 41.12 42.48 3hqp n ASP 185 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 3hqp s LEU 186 N -1.02 4.30 0.79 -2.67 1.43 -1.26 -5.04 118.68 115.21 3hqp s LEU 186 Ca 0.63 1.64 -0.13 0.00 -1.03 0.00 0.00 54.13 55.24 3hqp s LEU 186 Cb 0.27 -3.89 0.07 0.00 0.03 0.00 0.00 46.19 42.67 3hqp s LEU 186 CO -0.09 -0.05 1.17 -2.16 0.23 0.00 0.00 176.35 175.44 3hqp s PRO 187 N -2.14 1.85 0.08 1.29 0.04 -1.26 -4.95 135.00 129.90 3hqp s PRO 187 Ca 0.48 1.61 -0.28 0.00 0.04 0.00 0.00 61.00 62.85 3hqp s PRO 187 Cb -0.17 -1.81 -0.17 0.00 0.04 0.00 0.00 34.50 32.39 3hqp s PRO 187 CO 0.22 -2.03 1.67 0.00 0.04 0.00 0.00 177.00 176.90 3hqp h ALA 188 N -0.85 -0.51 -3.44 8.56 0.00 -1.98 -3.40 119.26 117.65 3hqp h ALA 188 Ca -0.46 -0.11 -0.58 0.00 0.00 0.00 0.00 54.91 53.77 3hqp h ALA 188 Cb 1.28 0.21 -0.39 0.00 0.00 0.00 0.00 17.79 18.88 3hqp h ALA 188 CO 0.48 -0.79 -0.77 0.54 0.00 0.00 0.00 179.25 178.71 3hqp s VAL 189 N -6.11 1.11 1.05 0.00 0.11 -1.26 -4.54 120.40 110.75 3hqp s VAL 189 Ca -0.16 -1.06 -0.15 0.00 -2.93 0.00 0.00 61.98 57.69 3hqp s VAL 189 Cb 0.05 -1.54 0.21 0.00 -1.53 0.00 0.00 36.38 33.57 3hqp s VAL 189 CO 0.64 -0.24 1.13 -0.94 -3.33 0.00 0.00 175.10 172.35 3hqp s SER 190 N 1.57 2.28 0.37 3.54 1.04 -1.26 -4.83 113.70 116.41 3hqp s SER 190 Ca -0.01 0.87 0.13 0.00 0.48 0.00 0.00 55.95 57.42 3hqp s SER 190 Cb -0.18 -1.33 0.73 0.00 0.10 0.00 0.00 66.02 65.33 3hqp s SER 190 CO -0.10 -3.31 1.83 0.00 0.98 0.00 0.00 173.24 172.64 3hqp h ALA 191 N -2.02 1.37 -0.09 5.32 0.00 -2.00 -2.33 119.26 119.51 3hqp h ALA 191 Ca -0.50 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 53.99 3hqp h ALA 191 Cb 1.31 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.05 3hqp h ALA 191 CO 0.50 0.46 -0.28 0.87 0.00 0.00 0.00 179.25 180.80 3hqp h LYS 192 N 0.00 0.34 -0.53 0.00 1.57 -2.01 -3.31 116.57 112.62 3hqp h LYS 192 Ca -0.00 -0.25 -0.01 0.00 -1.87 0.00 0.00 60.65 58.52 3hqp h LYS 192 Cb 0.66 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.99 3hqp h LYS 192 CO 0.05 0.87 0.31 -0.44 -0.57 0.00 0.00 179.45 179.67 3hqp h ASP 193 N -0.13 0.64 0.50 0.86 3.32 -1.87 -2.31 116.42 117.43 3hqp h ASP 193 Ca -0.01 -0.04 -0.04 0.00 0.02 0.00 0.00 57.03 56.97 3hqp h ASP 193 Cb 0.90 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.29 3hqp h ASP 193 CO 0.06 0.50 -0.18 -0.09 -1.72 0.00 0.00 179.24 177.81 3hqp h ARG 194 N 0.74 0.00 0.05 3.56 2.43 -1.51 -0.50 114.38 119.14 3hqp h ARG 194 Ca 0.19 0.00 -0.22 0.00 -0.81 0.00 0.00 59.98 59.14 3hqp h ARG 194 Cb -0.01 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 29.56 3hqp h ARG 194 CO -0.03 0.18 -0.90 0.28 -1.51 0.00 0.00 179.97 177.99 3hqp h VAL 195 N 0.00 1.37 -0.35 0.20 2.07 -1.51 -2.59 116.25 115.43 3hqp h VAL 195 Ca -0.00 -2.28 -0.03 0.00 0.82 0.00 0.00 66.70 65.21 3hqp h VAL 195 Cb 0.48 2.65 -0.01 0.00 -1.52 0.00 0.00 31.29 32.89 3hqp h VAL 195 CO 0.02 0.68 0.10 0.44 0.02 0.00 0.00 177.57 178.83 3hqp h ASP 196 N 0.07 0.52 -0.28 0.57 3.32 -1.26 0.12 116.42 119.49 3hqp h ASP 196 Ca -0.13 -0.22 -0.06 0.00 0.02 0.00 0.00 57.03 56.65 3hqp h ASP 196 Cb 1.60 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 41.00 3hqp h ASP 196 CO 0.17 0.60 -0.00 -0.07 -1.72 0.00 0.00 179.24 178.23 3hqp h LEU 197 N 0.42 0.57 -0.85 1.55 3.38 -1.22 -0.40 115.31 118.76 3hqp h LEU 197 Ca 0.11 -0.12 -0.10 0.00 0.09 0.00 0.00 57.88 57.86 3hqp h LEU 197 Cb 0.27 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3hqp h LEU 197 CO -0.00 0.65 -0.23 -0.61 0.09 0.00 0.00 178.44 178.33 3hqp h GLN 198 N 0.58 0.60 0.07 1.13 5.75 -1.16 -2.55 115.11 119.52 3hqp h GLN 198 Ca 0.12 -0.23 -0.00 0.00 -0.15 0.00 0.00 58.65 58.39 3hqp h GLN 198 Cb 0.37 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 28.89 3hqp h GLN 198 CO 0.01 0.78 -0.03 0.35 -2.65 0.00 0.00 178.83 177.29 3hqp h PHE 199 N 0.53 -0.08 -0.98 3.99 3.57 -0.03 -2.45 116.94 121.48 3hqp h PHE 199 Ca 0.08 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.65 3hqp h PHE 199 Cb 0.68 0.03 -0.07 0.00 2.79 0.00 0.00 35.95 39.38 3hqp h PHE 199 CO 0.03 0.22 0.63 0.78 -2.23 0.00 0.00 178.31 177.73 3hqp h GLY 200 N -0.38 1.52 0.90 2.40 0.00 -1.09 -0.66 103.07 105.75 3hqp h GLY 200 Ca -0.01 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 46.84 3hqp h GLY 200 CO 0.01 0.29 0.09 -2.08 0.00 0.00 0.00 176.54 174.86 3hqp h VAL 201 N 1.12 1.20 -0.85 4.60 2.07 -1.46 0.14 116.25 123.06 3hqp h VAL 201 Ca 0.44 -0.64 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 3hqp h VAL 201 Cb 0.23 1.08 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 3hqp h VAL 201 CO -0.19 0.21 0.52 -0.33 0.02 0.00 0.00 177.57 177.80 3hqp h GLU 202 N 0.30 1.16 0.00 1.57 5.08 -0.96 -2.58 114.58 119.15 3hqp h GLU 202 Ca 0.09 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3hqp h GLU 202 Cb 0.24 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3hqp h GLU 202 CO -0.00 0.81 -0.20 1.04 -1.00 0.00 0.00 179.01 179.66 3hqp n GLN 203 N -4.43 0.03 -2.79 2.33 1.13 -0.30 -4.96 117.38 108.38 3hqp n GLN 203 Ca 0.09 0.01 -0.09 0.00 -1.94 0.00 0.00 57.00 55.07 3hqp n GLN 203 Cb 0.05 -1.52 0.04 0.00 0.11 0.00 0.00 30.24 28.92 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 1.48 0.08 3.75 1.08 0.00 0.33 -5.02 105.19 106.89 3hqp n GLY 204 Ca 0.06 -0.19 -0.32 0.00 0.00 0.00 0.00 46.02 45.56 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 -3.18 2.98 -0.00 1.61 -7.23 -0.29 -4.98 120.40 109.31 3hqp s VAL 205 Ca 0.07 0.40 0.02 0.00 -1.81 0.00 0.00 61.98 60.65 3hqp s VAL 205 Cb -0.03 -2.87 -0.26 0.00 0.56 0.00 0.00 36.38 33.79 3hqp s VAL 205 CO 0.36 -0.33 0.82 0.44 -0.31 0.00 0.00 175.10 176.08 3hqp h ASP 206 N -0.57 0.25 -5.06 4.85 3.32 -1.69 -3.46 116.42 114.07 3hqp h ASP 206 Ca -0.46 -0.39 -0.06 0.00 0.02 0.00 0.00 57.03 56.15 3hqp h ASP 206 Cb 1.25 -0.08 -0.15 0.00 0.22 0.00 0.00 39.33 40.58 3hqp h ASP 206 CO 0.51 1.33 -0.09 0.00 -1.72 0.00 0.00 179.24 179.26 3hqp s MET 207 N -2.62 1.00 -0.17 3.56 0.23 -1.14 -2.48 119.30 117.69 3hqp s MET 207 Ca -0.08 -0.56 -0.00 0.00 -1.03 0.00 0.00 55.69 54.02 3hqp s MET 207 Cb 0.07 0.44 0.00 0.00 -1.53 0.00 0.00 34.83 33.82 3hqp s MET 207 CO 0.83 -0.37 -0.14 0.42 -2.03 0.00 0.00 175.02 173.73 3hqp s ILE 208 N -3.22 2.70 -0.84 3.16 -1.09 0.13 -1.07 121.20 120.98 3hqp s ILE 208 Ca -0.01 -0.75 -0.21 0.00 -2.23 0.00 0.00 60.65 57.46 3hqp s ILE 208 Cb 0.01 -2.15 0.10 0.00 -1.58 0.00 0.00 42.46 38.83 3hqp s ILE 208 CO -0.08 0.50 1.10 -0.36 -1.23 0.00 0.00 174.94 174.87 3hqp s PHE 209 N 0.97 2.89 -0.17 3.97 0.08 0.11 -0.24 117.98 125.59 3hqp s PHE 209 Ca -0.02 -1.02 -0.29 0.00 0.12 0.00 0.00 56.93 55.72 3hqp s PHE 209 Cb -0.15 -4.33 -0.00 0.00 -0.57 0.00 0.00 43.02 37.97 3hqp s PHE 209 CO -0.02 -1.60 1.07 0.00 -0.10 0.00 0.00 175.22 174.57 3hqp s ALA 210 N 3.44 3.59 0.28 5.36 0.00 -0.37 -1.47 121.76 132.58 3hqp s ALA 210 Ca 0.30 0.30 -0.17 0.00 0.00 0.00 0.00 51.96 52.39 3hqp s ALA 210 Cb -0.09 -3.52 -0.09 0.00 0.00 0.00 0.00 23.12 19.42 3hqp s ALA 210 CO -0.02 -0.92 0.74 -1.12 0.00 0.00 0.00 175.76 174.44 3hqp s SER 211 N 1.28 6.92 -1.41 0.00 0.01 -1.26 -0.44 113.70 118.80 3hqp s SER 211 Ca 0.47 1.37 -0.01 0.00 1.31 0.00 0.00 55.95 59.09 3hqp s SER 211 Cb -0.17 -2.40 0.00 0.00 0.21 0.00 0.00 66.02 63.65 3hqp s SER 211 CO 0.12 -0.10 0.39 0.49 0.41 0.00 0.00 173.24 174.54 3hqp n PHE 212 N 0.13 -1.61 -2.32 2.43 3.72 -1.25 -4.39 117.46 114.17 3hqp n PHE 212 Ca 0.01 0.72 -0.43 0.00 -0.05 0.00 0.00 57.45 57.70 3hqp n PHE 212 Cb 0.52 -3.64 -0.02 0.00 -0.94 0.00 0.00 39.48 35.40 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 -3.99 4.08 -0.09 4.37 -1.09 -1.07 -4.75 121.20 118.67 3hqp s ILE 213 Ca 0.02 1.33 0.08 0.00 -2.23 0.00 0.00 60.65 59.85 3hqp s ILE 213 Cb -0.01 -3.86 -0.11 0.00 -1.58 0.00 0.00 42.46 36.90 3hqp s ILE 213 CO 0.90 -0.09 0.04 -2.11 -1.23 0.00 0.00 174.94 172.44 3hqp n ARG 214 N 6.43 2.47 -3.97 2.79 1.85 -1.26 -4.29 116.66 120.67 3hqp n ARG 214 Ca 0.14 -0.01 -0.09 0.00 -1.00 0.00 0.00 57.85 56.90 3hqp n ARG 214 Cb 0.44 -1.23 -0.08 0.00 -1.05 0.00 0.00 32.46 30.54 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 -4.10 0.23 0.26 2.89 1.04 -1.26 -4.32 113.70 108.43 3hqp s SER 215 Ca -0.04 -0.86 -0.03 0.00 0.48 0.00 0.00 55.95 55.50 3hqp s SER 215 Cb 0.03 0.32 0.34 0.00 0.10 0.00 0.00 66.02 66.80 3hqp s SER 215 CO 0.37 -0.73 1.84 0.00 0.98 0.00 0.00 173.24 175.71 3hqp h ALA 216 N 2.83 1.21 -0.54 5.32 0.00 -1.89 -2.74 119.26 123.45 3hqp h ALA 216 Ca -0.34 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.37 3hqp h ALA 216 Cb 1.19 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 3hqp h ALA 216 CO 0.58 0.58 0.17 1.49 0.00 0.00 0.00 179.25 182.07 3hqp h GLU 217 N 0.99 0.80 -0.68 0.00 4.81 -1.96 -2.26 114.58 116.27 3hqp h GLU 217 Ca 0.23 -0.14 -0.03 0.00 -0.13 0.00 0.00 59.36 59.29 3hqp h GLU 217 Cb 0.17 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.39 3hqp h GLU 217 CO -0.02 0.69 0.30 0.37 -0.73 0.00 0.00 179.01 179.61 3hqp h GLN 218 N 0.78 0.98 -0.85 1.92 4.15 -1.91 0.75 115.11 120.93 3hqp h GLN 218 Ca 0.18 -0.15 -0.02 0.00 0.77 0.00 0.00 58.65 59.43 3hqp h GLN 218 Cb 0.22 -0.18 -0.04 0.00 0.21 0.00 0.00 27.48 27.70 3hqp h GLN 218 CO -0.01 0.78 0.44 0.28 -1.93 0.00 0.00 178.83 178.39 3hqp h VAL 219 N 0.97 1.26 -0.10 2.39 2.07 -1.26 -1.58 116.25 119.99 3hqp h VAL 219 Ca 0.23 -0.68 -0.05 0.00 0.82 0.00 0.00 66.70 67.02 3hqp h VAL 219 Cb 0.15 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.04 3hqp h VAL 219 CO -0.03 0.30 -0.17 1.23 0.02 0.00 0.00 177.57 178.92 3hqp h GLY 220 N 1.20 0.17 1.57 2.17 0.00 -0.81 -2.21 103.07 105.16 3hqp h GLY 220 Ca 0.30 -0.10 -0.09 0.00 0.00 0.00 0.00 47.33 47.43 3hqp h GLY 220 CO -0.04 0.10 -0.23 -0.55 0.00 0.00 0.00 176.54 175.82 3hqp h ASP 221 N 0.15 0.51 -0.11 0.19 3.32 0.04 -0.83 116.42 119.69 3hqp h ASP 221 Ca 0.03 -0.17 -0.05 0.00 0.02 0.00 0.00 57.03 56.86 3hqp h ASP 221 Cb 0.40 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.81 3hqp h ASP 221 CO 0.03 0.74 -0.13 0.58 -1.72 0.00 0.00 179.24 178.73 3hqp h VAL 222 N 0.45 1.37 -0.56 -1.35 2.07 -0.95 -2.08 116.25 115.20 3hqp h VAL 222 Ca 0.07 -1.32 -0.07 0.00 0.82 0.00 0.00 66.70 66.20 3hqp h VAL 222 Cb 0.64 1.99 -0.02 0.00 -1.52 0.00 0.00 31.29 32.38 3hqp h VAL 222 CO 0.05 0.38 0.08 -0.09 0.02 0.00 0.00 177.57 178.01 3hqp h ARG 223 N -0.13 0.91 -0.78 1.57 2.43 -1.35 0.28 114.38 117.31 3hqp h ARG 223 Ca 0.01 -0.22 0.00 0.00 -0.81 0.00 0.00 59.98 58.96 3hqp h ARG 223 Cb 0.67 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 30.06 3hqp h ARG 223 CO 0.03 0.85 0.50 0.87 -1.51 0.00 0.00 179.97 180.71 3hqp h LYS 224 N 0.86 1.04 -0.13 0.20 1.57 -1.19 -2.73 116.57 116.18 3hqp h LYS 224 Ca 0.18 -0.08 -0.13 0.00 -1.87 0.00 0.00 60.65 58.75 3hqp h LYS 224 Cb 0.39 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 3hqp h LYS 224 CO 0.01 0.71 -0.47 0.00 -0.57 0.00 0.00 179.45 179.12 3hqp h ALA 225 N 1.27 0.95 -0.41 3.86 0.00 -0.63 -3.14 119.26 121.16 3hqp h ALA 225 Ca 0.28 -0.46 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 3hqp h ALA 225 Cb -0.09 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3hqp h ALA 225 CO -0.06 0.65 0.08 -0.07 0.00 0.00 0.00 179.25 179.85 3hqp h LEU 226 N 0.27 0.57 -0.05 0.00 3.38 -0.19 -3.44 115.31 115.85 3hqp h LEU 226 Ca 0.02 -0.09 0.04 0.00 0.09 0.00 0.00 57.88 57.94 3hqp h LEU 226 Cb 0.94 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.52 3hqp h LEU 226 CO 0.08 0.58 -0.09 0.61 0.09 0.00 0.00 178.44 179.71 3hqp n GLY 227 N -0.97 -1.85 0.33 0.83 0.00 -1.05 -3.91 105.19 98.57 3hqp n GLY 227 Ca 0.02 -1.46 -0.01 0.00 0.00 0.00 0.00 46.02 44.57 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 -0.16 0.93 -0.04 1.61 0.11 -1.91 -2.81 132.00 129.73 3hqp h PRO 228 Ca -0.01 -0.11 -0.01 0.00 0.11 0.00 0.00 66.00 65.99 3hqp h PRO 228 Cb 0.15 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 31.08 3hqp h PRO 228 CO 0.00 0.70 -0.01 -0.22 -0.21 0.00 0.00 178.00 178.26 3hqp h LYS 229 N 0.93 0.05 -1.24 1.05 3.11 -2.00 -3.13 116.57 115.33 3hqp h LYS 229 Ca 0.23 -0.00 -0.56 0.00 -2.81 0.00 0.00 60.65 57.51 3hqp h LYS 229 Cb 0.06 -0.01 -0.42 0.00 -1.00 0.00 0.00 32.23 30.86 3hqp h LYS 229 CO -0.03 0.06 -0.79 0.41 -2.81 0.00 0.00 179.45 176.29 3hqp n GLY 230 N -1.44 5.75 0.14 5.01 0.00 -1.06 -4.75 105.19 108.83 3hqp n GLY 230 Ca -0.02 -2.61 0.05 0.00 0.00 0.00 0.00 46.02 43.43 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 2.49 0.00 -0.00 1.61 0.11 -1.54 -3.19 114.38 113.86 3hqp h ARG 231 Ca 0.28 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.36 3hqp h ARG 231 Cb 1.12 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.20 3hqp h ARG 231 CO 0.79 0.31 -0.00 -0.25 0.10 0.00 0.00 179.97 180.92 3hqp n ASP 232 N -3.07 0.01 -4.72 0.08 9.92 -1.26 -4.79 116.55 112.71 3hqp n ASP 232 Ca -0.00 -0.31 -0.42 0.00 -0.53 0.00 0.00 54.79 53.53 3hqp n ASP 232 Cb 0.70 -0.23 -0.03 0.00 -0.64 0.00 0.00 41.12 40.92 3hqp n ASP 232 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 3hqp s ILE 233 N -2.46 4.15 0.02 0.53 1.01 -1.21 -5.01 121.20 118.23 3hqp s ILE 233 Ca 0.32 1.63 -0.26 0.00 0.00 0.00 0.00 60.65 62.34 3hqp s ILE 233 Cb 0.21 -4.04 -0.05 0.00 0.01 0.00 0.00 42.46 38.59 3hqp s ILE 233 CO 0.44 0.17 0.79 -0.04 0.00 0.00 0.00 174.94 176.31 3hqp s MET 234 N 0.61 4.50 -0.39 2.79 -1.94 -1.03 -4.92 119.30 118.92 3hqp s MET 234 Ca 0.54 1.09 -0.16 0.00 -1.71 0.00 0.00 55.69 55.46 3hqp s MET 234 Cb -0.28 -3.39 0.01 0.00 2.01 0.00 0.00 34.83 33.18 3hqp s MET 234 CO 0.31 0.20 0.38 0.42 -0.01 0.00 0.00 175.02 176.32 3hqp s ILE 235 N 0.24 5.15 -0.44 2.53 1.01 -1.26 0.20 121.20 128.63 3hqp s ILE 235 Ca 0.40 -0.28 -0.12 0.00 0.00 0.00 0.00 60.65 60.65 3hqp s ILE 235 Cb -0.20 -3.94 0.07 0.00 0.01 0.00 0.00 42.46 38.40 3hqp s ILE 235 CO 0.23 -0.29 0.31 -0.63 0.00 0.00 0.00 174.94 174.56 3hqp s ILE 236 N 2.01 4.70 0.03 2.92 -1.09 0.67 -0.84 121.20 129.60 3hqp s ILE 236 Ca 0.10 -1.20 -0.30 0.00 -2.23 0.00 0.00 60.65 57.02 3hqp s ILE 236 Cb -0.17 -3.82 -0.05 0.00 -1.58 0.00 0.00 42.46 36.84 3hqp s ILE 236 CO 0.12 -0.51 1.12 0.00 -1.23 0.00 0.00 174.94 174.44 3hqp s LYS 238 N 1.13 4.09 -0.39 0.00 1.02 0.42 -0.96 119.74 125.04 3hqp s LYS 238 Ca 0.56 0.34 -0.21 0.00 0.02 0.00 0.00 55.97 56.68 3hqp s LYS 238 Cb -0.26 -3.64 0.01 0.00 -0.52 0.00 0.00 37.83 33.42 3hqp s LYS 238 CO 0.28 -0.33 0.65 0.42 -0.92 0.00 0.00 175.35 175.45 3hqp s ILE 239 N 2.23 4.85 0.00 2.17 -1.09 -0.41 -2.61 121.20 126.34 3hqp s ILE 239 Ca 0.22 0.41 0.00 0.00 -2.23 0.00 0.00 60.65 59.05 3hqp s ILE 239 Cb -0.16 -4.14 0.00 0.00 -1.58 0.00 0.00 42.46 36.59 3hqp s ILE 239 CO 0.09 -0.44 0.33 -1.84 -1.23 0.00 0.00 174.94 171.85 3hqp n GLU 240 N 6.17 0.00 -4.29 2.79 0.28 -1.26 -1.84 120.64 122.48 3hqp n GLU 240 Ca -0.01 -0.33 -0.16 0.00 -0.16 0.00 0.00 57.16 56.50 3hqp n GLU 240 Cb 0.48 -0.37 -0.10 0.00 1.43 0.00 0.00 31.44 32.88 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 0.00 1.00 0.09 -1.84 4.22 -1.26 -2.93 114.94 114.21 3hqp s ASN 241 Ca 0.00 -1.40 -0.26 0.00 -2.14 0.00 0.00 52.86 49.06 3hqp s ASN 241 Cb 0.00 0.23 -0.14 0.00 1.28 0.00 0.00 41.25 42.62 3hqp s ASN 241 CO 0.00 -0.77 1.70 -0.74 -2.04 0.00 0.00 177.10 175.25 3hqp h HIS 242 N 2.42 -0.31 0.00 1.54 -0.00 -1.95 -2.84 115.15 114.02 3hqp h HIS 242 Ca -0.37 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.99 3hqp h HIS 242 Cb 1.25 0.11 0.00 0.00 -0.00 0.00 0.00 27.41 28.77 3hqp h HIS 242 CO 0.48 -0.19 0.00 -0.56 -0.00 0.00 0.00 177.93 177.67 3hqp h GLN 243 N -0.29 0.00 -0.29 5.26 3.07 -1.95 -2.67 115.11 118.24 3hqp h GLN 243 Ca -0.01 0.00 -0.10 0.00 0.09 0.00 0.00 58.65 58.63 3hqp h GLN 243 Cb 0.25 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.80 3hqp h GLN 243 CO 0.01 0.00 -0.23 0.78 0.09 0.00 0.00 178.83 179.48 3hqp h GLY 244 N 3.09 0.59 1.24 0.06 0.00 -1.69 -1.04 103.07 105.32 3hqp h GLY 244 Ca 0.00 -0.48 -0.18 0.00 0.00 0.00 0.00 47.33 46.67 3hqp h GLY 244 CO 0.00 0.44 -0.56 -2.08 0.00 0.00 0.00 176.54 174.33 3hqp h VAL 245 N 0.48 1.29 -0.32 4.60 2.07 -1.37 -3.15 116.25 119.85 3hqp h VAL 245 Ca 0.07 -1.76 -0.16 0.00 0.82 0.00 0.00 66.70 65.67 3hqp h VAL 245 Cb 0.66 1.68 -0.01 0.00 -1.52 0.00 0.00 31.29 32.10 3hqp h VAL 245 CO 0.05 0.57 -0.44 -0.61 0.02 0.00 0.00 177.57 177.16 3hqp h GLN 246 N 0.60 0.82 -0.72 1.57 4.15 -1.29 -2.97 115.11 117.28 3hqp h GLN 246 Ca 0.01 -0.46 0.00 0.00 0.77 0.00 0.00 58.65 58.97 3hqp h GLN 246 Cb 1.15 0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.87 3hqp h GLN 246 CO 0.12 1.09 0.00 0.09 -1.93 0.00 0.00 178.83 178.20 3hqp n ASN 247 N -4.03 4.04 -0.36 -0.69 4.13 -0.42 -4.65 115.26 113.28 3hqp n ASN 247 Ca -0.03 -2.59 0.10 0.00 1.68 0.00 0.00 54.58 53.75 3hqp n ASN 247 Cb 0.56 -0.61 0.29 0.00 -1.54 0.00 0.00 39.78 38.48 3hqp n ASN 247 CO 0.00 0.00 0.00 -0.29 0.28 0.00 0.00 177.26 177.25 3hqp h ILE 248 N 2.62 0.80 0.15 2.41 6.09 -1.47 -0.68 117.51 127.42 3hqp h ILE 248 Ca 0.00 -0.30 -0.01 0.00 -1.37 0.00 0.00 64.86 63.19 3hqp h ILE 248 Cb 1.44 -0.14 0.00 0.00 0.47 0.00 0.00 36.82 38.59 3hqp h ILE 248 CO 0.31 0.16 -0.07 0.44 -3.07 0.00 0.00 178.15 175.92 3hqp h ASP 249 N 0.86 -0.17 -0.06 2.19 3.32 -1.87 0.13 116.42 120.83 3hqp h ASP 249 Ca 0.54 -0.18 -0.08 0.00 0.02 0.00 0.00 57.03 57.33 3hqp h ASP 249 Cb 0.72 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.30 3hqp h ASP 249 CO -0.33 0.09 -0.20 0.77 -1.72 0.00 0.00 179.24 177.84 3hqp h SER 250 N -0.42 0.44 0.34 6.45 4.64 -1.86 -2.53 113.55 120.60 3hqp h SER 250 Ca -0.02 -0.13 -0.02 0.00 -0.47 0.00 0.00 61.79 61.15 3hqp h SER 250 Cb 0.34 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 3hqp h SER 250 CO 0.03 0.65 -0.16 0.40 -0.87 0.00 0.00 176.83 176.88 3hqp h ILE 251 N 0.41 0.67 -0.70 0.95 2.04 -1.04 -3.09 117.51 116.76 3hqp h ILE 251 Ca 0.07 -0.41 0.13 0.00 1.00 0.00 0.00 64.86 65.64 3hqp h ILE 251 Cb 0.58 0.89 -0.09 0.00 -0.74 0.00 0.00 36.82 37.45 3hqp h ILE 251 CO 0.04 0.08 0.23 0.40 0.00 0.00 0.00 178.15 178.90 3hqp h ILE 252 N -0.69 0.65 0.00 -0.67 2.04 -0.63 -0.79 117.51 117.42 3hqp h ILE 252 Ca -0.05 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.69 3hqp h ILE 252 Cb 0.48 0.25 0.00 0.00 -0.74 0.00 0.00 36.82 36.81 3hqp h ILE 252 CO 0.08 0.07 0.00 1.05 0.00 0.00 0.00 178.15 179.34 3hqp h GLU 253 N 0.37 0.00 0.06 2.37 4.11 -1.50 -2.90 114.58 117.08 3hqp h GLU 253 Ca 0.38 0.00 -0.34 0.00 0.07 0.00 0.00 59.36 59.46 3hqp h GLU 253 Cb 0.56 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.78 3hqp h GLU 253 CO -0.40 0.00 -1.98 0.39 0.07 0.00 0.00 179.01 177.09 3hqp n GLU 254 N -2.51 0.70 -1.51 1.06 -0.58 -0.58 -4.99 120.64 112.23 3hqp n GLU 254 Ca 0.02 0.24 -0.29 0.00 -0.42 0.00 0.00 57.16 56.71 3hqp n GLU 254 Cb 0.27 -1.71 0.15 0.00 -0.57 0.00 0.00 31.44 29.59 3hqp n GLU 254 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3hqp s SER 255 N -6.54 3.17 0.00 1.62 1.04 -0.41 -4.98 113.70 107.61 3hqp s SER 255 Ca -0.16 0.87 0.23 0.00 0.48 0.00 0.00 55.95 57.36 3hqp s SER 255 Cb 0.07 -1.36 0.17 0.00 0.10 0.00 0.00 66.02 65.00 3hqp s SER 255 CO 0.78 -2.75 1.21 0.47 0.98 0.00 0.00 173.24 173.93 3hqp n ASP 256 N -3.88 2.85 0.00 7.02 9.92 -0.02 -4.97 116.55 127.47 3hqp n ASP 256 Ca 0.08 -1.92 0.00 0.00 -0.53 0.00 0.00 54.79 52.42 3hqp n ASP 256 Cb 0.59 0.03 0.00 0.00 -0.64 0.00 0.00 41.12 41.10 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 1.29 0.08 3.06 0.44 0.00 -1.21 -4.17 105.19 104.68 3hqp n GLY 257 Ca 0.13 -1.13 -0.18 0.00 0.00 0.00 0.00 46.02 44.84 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 0.79 -0.14 -0.61 -1.09 -0.51 -1.34 121.20 116.30 3hqp s ILE 258 Ca 0.00 -0.64 -0.01 0.00 -2.23 0.00 0.00 60.65 57.77 3hqp s ILE 258 Cb 0.00 -0.70 -0.02 0.00 -1.58 0.00 0.00 42.46 40.16 3hqp s ILE 258 CO 0.00 0.06 -0.12 -0.32 -1.23 0.00 0.00 174.94 173.33 3hqp s MET 259 N -0.65 3.40 -0.91 2.79 -2.45 -0.14 -0.76 119.30 120.59 3hqp s MET 259 Ca 0.01 -0.67 -0.23 0.00 -1.25 0.00 0.00 55.69 53.55 3hqp s MET 259 Cb -0.05 -2.67 0.06 0.00 1.25 0.00 0.00 34.83 33.42 3hqp s MET 259 CO 0.00 0.20 1.31 0.08 1.05 0.00 0.00 175.02 177.66 3hqp s VAL 260 N 0.40 4.06 -1.35 10.11 1.01 0.15 -1.29 120.40 133.49 3hqp s VAL 260 Ca -0.10 -0.62 -0.12 0.00 0.00 0.00 0.00 61.98 61.14 3hqp s VAL 260 Cb -0.16 -4.94 0.11 0.00 0.00 0.00 0.00 36.38 31.39 3hqp s VAL 260 CO 0.05 -1.80 1.97 0.00 0.00 0.00 0.00 175.10 175.32 3hqp n ALA 261 N 8.46 5.16 0.31 5.51 0.00 -0.77 -2.42 120.51 136.76 3hqp n ALA 261 Ca 0.21 -4.10 0.19 0.00 0.00 0.00 0.00 53.44 49.75 3hqp n ALA 261 Cb 0.50 -3.27 1.04 0.00 0.00 0.00 0.00 19.45 17.73 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 6.12 0.00 0.66 0.00 3.08 -1.82 -1.95 114.38 120.46 3hqp h ARG 262 Ca 0.46 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.48 3hqp h ARG 262 Cb 0.67 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.73 3hqp h ARG 262 CO 1.69 0.00 -0.32 0.78 -1.07 0.00 0.00 179.97 181.05 3hqp h GLY 263 N 0.00 -0.92 1.64 0.04 0.00 -1.85 0.21 103.07 102.19 3hqp h GLY 263 Ca 0.01 0.34 -0.12 0.00 0.00 0.00 0.00 47.33 47.56 3hqp h GLY 263 CO -0.00 -0.34 -0.38 -0.55 0.00 0.00 0.00 176.54 175.27 3hqp h ASP 264 N -0.95 0.43 -0.54 0.19 3.32 -1.82 -3.19 116.42 113.86 3hqp h ASP 264 Ca -0.09 -0.18 -0.07 0.00 0.02 0.00 0.00 57.03 56.72 3hqp h ASP 264 Cb 0.68 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.09 3hqp h ASP 264 CO 0.15 0.77 0.08 0.25 -1.72 0.00 0.00 179.24 178.78 3hqp h LEU 265 N 0.34 0.86 0.00 1.55 6.46 -1.23 -2.28 115.31 121.01 3hqp h LEU 265 Ca 0.03 -0.26 0.00 0.00 -0.12 0.00 0.00 57.88 57.53 3hqp h LEU 265 Cb 0.83 -0.23 0.00 0.00 -0.73 0.00 0.00 40.66 40.53 3hqp h LEU 265 CO 0.07 0.91 0.00 0.61 -0.62 0.00 0.00 178.44 179.41 3hqp n GLY 266 N -0.53 -0.54 0.15 3.75 0.00 0.73 -1.52 105.19 107.23 3hqp n GLY 266 Ca 0.02 -0.08 -0.10 0.00 0.00 0.00 0.00 46.02 45.86 3hqp n GLY 266 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3hqp n VAL 267 N -1.09 0.75 0.03 1.61 0.31 -1.14 -4.13 118.33 114.68 3hqp n VAL 267 Ca 0.10 -0.27 -0.03 0.00 -0.01 0.00 0.00 64.34 64.13 3hqp n VAL 267 Cb 0.07 -1.09 0.21 0.00 -0.91 0.00 0.00 33.84 32.12 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 -0.09 0.43 -6.10 5.55 4.57 -1.09 -3.43 114.58 114.42 3hqp h GLU 268 Ca -0.30 -0.17 -0.60 0.00 -1.18 0.00 0.00 59.36 57.11 3hqp h GLU 268 Cb 1.43 -0.02 -0.13 0.00 -0.16 0.00 0.00 28.75 29.87 3hqp h GLU 268 CO -0.08 0.68 -0.70 0.96 -1.18 0.00 0.00 179.01 178.69 3hqp s ILE 269 N -4.43 2.54 0.40 2.32 -4.36 -0.58 -4.73 121.20 112.36 3hqp s ILE 269 Ca -0.06 -2.23 -0.25 0.00 -0.26 0.00 0.00 60.65 57.85 3hqp s ILE 269 Cb 0.14 -2.54 -0.11 0.00 1.25 0.00 0.00 42.46 41.20 3hqp s ILE 269 CO 0.79 -0.31 1.06 -2.65 0.24 0.00 0.00 174.94 174.06 3hqp n PRO 270 N -0.75 1.46 0.02 0.37 -0.02 -1.26 -4.53 135.00 130.29 3hqp n PRO 270 Ca -0.05 0.52 -0.01 0.00 -2.02 0.00 0.00 63.50 61.95 3hqp n PRO 270 Cb 0.61 -2.08 0.28 0.00 -0.02 0.00 0.00 33.50 32.30 3hqp n PRO 270 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hqp h ALA 271 N 1.70 1.32 0.00 3.55 0.00 -1.91 -1.97 119.26 121.95 3hqp h ALA 271 Ca -0.44 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.22 3hqp h ALA 271 Cb 1.33 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 3hqp h ALA 271 CO 0.58 0.46 -0.03 1.05 0.00 0.00 0.00 179.25 181.31 3hqp h GLU 272 N 0.43 0.00 0.00 0.00 9.09 -1.93 -2.97 114.58 119.21 3hqp h GLU 272 Ca 0.09 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.50 3hqp h GLU 272 Cb 0.43 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.53 3hqp h GLU 272 CO 0.02 0.03 0.00 1.63 0.05 0.00 0.00 179.01 180.74 3hqp n LYS 273 N -3.12 0.17 0.19 1.06 4.76 -0.74 -3.44 118.16 117.03 3hqp n LYS 273 Ca 0.01 0.20 0.04 0.00 -2.87 0.00 0.00 58.31 55.69 3hqp n LYS 273 Cb 0.37 -1.73 0.37 0.00 -1.84 0.00 0.00 35.03 32.20 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 1.15 -0.23 -0.18 2.07 -1.58 -1.67 116.25 115.81 3hqp h VAL 274 Ca 0.00 -1.36 -0.02 0.00 0.82 0.00 0.00 66.70 66.14 3hqp h VAL 274 Cb 0.59 1.76 -0.01 0.00 -1.52 0.00 0.00 31.29 32.11 3hqp h VAL 274 CO 0.00 0.37 0.06 0.58 0.02 0.00 0.00 177.57 178.60 3hqp h VAL 275 N 0.00 1.20 -0.20 2.57 2.07 -1.77 0.16 116.25 120.29 3hqp h VAL 275 Ca -0.00 -0.66 -0.05 0.00 0.82 0.00 0.00 66.70 66.80 3hqp h VAL 275 Cb 0.73 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 3hqp h VAL 275 CO 0.05 0.21 -0.09 0.58 0.02 0.00 0.00 177.57 178.34 3hqp h VAL 276 N 0.19 1.30 -1.00 2.57 2.07 -1.72 -1.94 116.25 117.72 3hqp h VAL 276 Ca 0.07 -1.13 0.11 0.00 0.82 0.00 0.00 66.70 66.57 3hqp h VAL 276 Cb 0.26 1.63 -0.08 0.00 -1.52 0.00 0.00 31.29 31.58 3hqp h VAL 276 CO -0.00 0.34 0.63 0.00 0.02 0.00 0.00 177.57 178.57 3hqp h ALA 277 N 0.71 1.50 -0.21 1.67 0.00 -1.26 -0.93 119.26 120.73 3hqp h ALA 277 Ca 0.05 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 3hqp h ALA 277 Cb 0.57 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3hqp h ALA 277 CO 0.03 0.25 0.01 0.37 0.00 0.00 0.00 179.25 179.91 3hqp h GLN 278 N 1.02 0.37 -0.69 0.00 4.15 -0.77 -1.26 115.11 117.92 3hqp h GLN 278 Ca 0.49 -0.12 0.03 0.00 0.77 0.00 0.00 58.65 59.83 3hqp h GLN 278 Cb 0.45 -0.04 -0.05 0.00 0.21 0.00 0.00 27.48 28.06 3hqp h GLN 278 CO -0.26 0.56 0.43 0.87 -1.93 0.00 0.00 178.83 178.50 3hqp h LYS 279 N 0.14 0.81 0.40 1.69 1.57 -0.80 -2.27 116.57 118.11 3hqp h LYS 279 Ca 0.06 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 3hqp h LYS 279 Cb 0.38 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.52 3hqp h LYS 279 CO 0.01 0.53 -0.19 0.82 -0.57 0.00 0.00 179.45 180.05 3hqp h ILE 280 N 0.83 0.55 -0.61 1.86 2.04 -1.13 -2.76 117.51 118.28 3hqp h ILE 280 Ca 0.28 -0.47 -0.02 0.00 1.00 0.00 0.00 64.86 65.65 3hqp h ILE 280 Cb 0.04 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 36.85 3hqp h ILE 280 CO -0.12 0.08 0.30 -0.07 0.00 0.00 0.00 178.15 178.35 3hqp h LEU 281 N -0.83 0.79 0.55 1.44 3.38 -1.19 0.01 115.31 119.47 3hqp h LEU 281 Ca -0.05 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.76 3hqp h LEU 281 Cb 0.54 -0.20 0.01 0.00 0.09 0.00 0.00 40.66 41.09 3hqp h LEU 281 CO 0.09 0.69 -0.27 0.40 0.09 0.00 0.00 178.44 179.45 3hqp h ILE 282 N 0.84 0.46 -0.30 1.22 2.04 -1.52 -1.79 117.51 118.46 3hqp h ILE 282 Ca 0.21 -0.01 0.03 0.00 1.00 0.00 0.00 64.86 66.09 3hqp h ILE 282 Cb 0.10 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 36.62 3hqp h ILE 282 CO -0.03 0.00 0.11 0.28 0.00 0.00 0.00 178.15 178.51 3hqp h SER 283 N -0.75 0.12 -0.73 1.72 0.02 -1.22 0.11 113.55 112.82 3hqp h SER 283 Ca -0.08 0.03 0.14 0.00 -0.84 0.00 0.00 61.79 61.04 3hqp h SER 283 Cb 0.57 0.01 -0.09 0.00 0.14 0.00 0.00 62.40 63.03 3hqp h SER 283 CO 0.12 0.11 0.28 0.11 -1.14 0.00 0.00 176.83 176.31 3hqp h LYS 284 N 0.24 0.41 -0.40 3.45 1.57 -0.99 -0.45 116.57 120.40 3hqp h LYS 284 Ca 0.13 -0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 58.81 3hqp h LYS 284 Cb 0.09 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 3hqp h LYS 284 CO -0.13 0.27 -0.06 0.00 -0.57 0.00 0.00 179.45 178.96 3hqp h ASN 286 N 0.57 0.62 -0.43 0.00 -0.26 0.10 0.85 115.58 117.04 3hqp h ASN 286 Ca 0.11 0.05 -0.11 0.00 -0.56 0.00 0.00 56.30 55.78 3hqp h ASN 286 Cb 0.57 -0.07 -0.02 0.00 -1.06 0.00 0.00 38.32 37.74 3hqp h ASN 286 CO 0.03 0.36 -0.14 0.58 -1.06 0.00 0.00 177.43 177.21 3hqp h VAL 287 N 0.75 1.27 0.00 2.81 2.07 -0.99 -2.90 116.25 119.25 3hqp h VAL 287 Ca 0.37 -1.26 -0.02 0.00 0.82 0.00 0.00 66.70 66.62 3hqp h VAL 287 Cb 0.33 1.04 -0.00 0.00 -1.52 0.00 0.00 31.29 31.14 3hqp h VAL 287 CO -0.24 0.44 -0.08 0.00 0.02 0.00 0.00 177.57 177.71 3hqp h ALA 288 N 1.04 0.98 -1.89 1.67 0.00 -0.69 -3.48 119.26 116.89 3hqp h ALA 288 Ca 0.12 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 3hqp h ALA 288 Cb 0.67 -0.01 0.03 0.00 0.00 0.00 0.00 17.79 18.47 3hqp h ALA 288 CO 0.05 0.10 -0.14 0.41 0.00 0.00 0.00 179.25 179.66 3hqp n GLY 289 N 0.53 0.58 3.19 0.00 0.00 0.22 -5.07 105.19 104.64 3hqp n GLY 289 Ca 0.02 -0.50 -0.28 0.00 0.00 0.00 0.00 46.02 45.26 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 -5.16 1.90 0.32 1.61 1.02 -0.76 -4.83 119.74 113.84 3hqp s LYS 290 Ca 0.11 -0.72 -0.28 0.00 0.02 0.00 0.00 55.97 55.11 3hqp s LYS 290 Cb -0.05 -1.70 -0.13 0.00 -0.52 0.00 0.00 37.83 35.43 3hqp s LYS 290 CO 0.14 0.35 1.15 -0.35 -0.92 0.00 0.00 175.35 175.72 3hqp n PRO 291 N 2.89 1.73 -4.44 -1.68 -0.04 -1.26 -4.39 135.00 127.82 3hqp n PRO 291 Ca -0.17 0.61 -0.21 0.00 -0.04 0.00 0.00 63.50 63.69 3hqp n PRO 291 Cb 0.53 -2.09 -0.15 0.00 -0.04 0.00 0.00 33.50 31.74 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 -1.08 0.86 -0.14 0.52 0.11 -1.26 -1.42 120.40 117.99 3hqp s VAL 292 Ca 0.57 -0.40 0.01 0.00 -2.93 0.00 0.00 61.98 59.22 3hqp s VAL 292 Cb -0.63 -0.76 -0.01 0.00 -1.53 0.00 0.00 36.38 33.45 3hqp s VAL 292 CO 0.61 0.26 -0.15 -0.63 -3.33 0.00 0.00 175.10 171.86 3hqp s ILE 293 N 0.16 2.78 -0.14 7.04 1.01 0.06 -1.30 121.20 130.81 3hqp s ILE 293 Ca -0.03 -0.75 -0.17 0.00 0.00 0.00 0.00 60.65 59.70 3hqp s ILE 293 Cb -0.09 -2.16 -0.04 0.00 0.01 0.00 0.00 42.46 40.18 3hqp s ILE 293 CO 0.01 0.52 0.43 0.00 0.00 0.00 0.00 174.94 175.91 3hqp s ALA 295 N 0.75 1.53 0.09 0.00 0.00 -1.02 -2.02 121.76 121.10 3hqp s ALA 295 Ca 0.23 -1.62 0.00 0.00 0.00 0.00 0.00 51.96 50.57 3hqp s ALA 295 Cb -0.15 0.39 0.00 0.00 0.00 0.00 0.00 23.12 23.37 3hqp s ALA 295 CO 0.09 -0.24 0.00 2.41 0.00 0.00 0.00 175.76 178.02 3hqp n THR 296 N -0.29 -7.75 -1.78 0.00 -1.04 -1.26 -3.80 114.28 98.36 3hqp n THR 296 Ca -0.07 1.69 -0.12 0.00 -2.04 0.00 0.00 64.05 63.51 3hqp n THR 296 Cb 0.63 -3.84 -0.03 0.00 -1.82 0.00 0.00 70.33 65.27 3hqp n THR 296 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3hqp n GLN 297 N 0.94 -0.89 0.03 -2.82 6.02 -1.26 -4.72 117.38 114.67 3hqp n GLN 297 Ca 0.00 0.75 -0.13 0.00 -0.01 0.00 0.00 57.00 57.62 3hqp n GLN 297 Cb 0.00 -4.84 -0.01 0.00 1.02 0.00 0.00 30.24 26.41 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 0.53 -0.75 -1.09 2.86 -1.87 -3.29 114.93 111.32 3hqp h MET 298 Ca -0.26 -0.44 -0.40 0.00 -2.06 0.00 0.00 59.70 56.53 3hqp h MET 298 Cb 0.99 0.10 -0.41 0.00 0.06 0.00 0.00 31.60 32.33 3hqp h MET 298 CO 0.35 1.07 -0.99 1.28 1.06 0.00 0.00 176.91 179.68 3hqp n LEU 299 N -3.86 3.00 -0.24 1.22 4.77 -1.26 -4.61 117.00 116.02 3hqp n LEU 299 Ca -0.05 -3.94 0.03 0.00 -0.03 0.00 0.00 56.01 52.02 3hqp n LEU 299 Cb 0.73 0.10 0.12 0.00 -2.33 0.00 0.00 43.42 42.04 3hqp n LEU 299 CO 0.50 1.60 0.80 -0.08 -1.33 0.00 0.00 177.39 178.88 3hqp h GLU 300 N 2.53 0.08 0.00 3.23 4.57 -1.97 -1.01 114.58 122.00 3hqp h GLU 300 Ca 0.08 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.26 3hqp h GLU 300 Cb 1.30 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.87 3hqp h GLU 300 CO 0.49 0.05 0.00 0.66 -1.18 0.00 0.00 179.01 179.03 3hqp h SER 301 N 0.08 0.00 0.05 1.04 4.64 -1.93 -1.59 113.55 115.84 3hqp h SER 301 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 3hqp h SER 301 Cb 0.63 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.72 3hqp h SER 301 CO -0.64 0.00 -0.00 0.23 -0.87 0.00 0.00 176.83 175.55 3hqp n MET 302 N -2.33 0.96 0.24 4.77 2.81 -0.38 -0.85 117.12 122.33 3hqp n MET 302 Ca 0.01 -0.02 0.09 0.00 -1.81 0.00 0.00 57.70 55.97 3hqp n MET 302 Cb 0.17 -1.50 0.58 0.00 -0.71 0.00 0.00 33.22 31.76 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 0.05 0.84 0.00 2.03 2.02 -1.42 -3.36 112.91 113.06 3hqp h THR 303 Ca 0.00 -0.74 -0.04 0.00 0.77 0.00 0.00 66.41 66.40 3hqp h THR 303 Cb 0.03 1.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.87 3hqp h THR 303 CO 0.00 0.19 -1.14 -1.22 0.37 0.00 0.00 175.52 173.71 3hqp n TYR 304 N -3.88 0.00 -4.25 3.16 4.02 -0.87 -2.02 117.16 113.32 3hqp n TYR 304 Ca -0.02 0.00 -0.27 0.00 -0.01 0.00 0.00 57.90 57.60 3hqp n TYR 304 Cb 0.28 -0.10 -0.09 0.00 -0.02 0.00 0.00 39.34 39.41 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 -3.62 4.44 0.20 7.72 0.02 -0.03 -4.92 114.94 118.75 3hqp s ASN 305 Ca -0.02 -0.49 0.21 0.00 -1.02 0.00 0.00 52.86 51.54 3hqp s ASN 305 Cb 0.01 -0.83 0.89 0.00 0.02 0.00 0.00 41.25 41.33 3hqp s ASN 305 CO 0.07 0.11 1.64 -0.81 0.02 0.00 0.00 177.10 178.13 3hqp n PRO 306 N 0.10 0.14 -4.15 -0.60 -0.04 -1.26 -4.27 135.00 124.92 3hqp n PRO 306 Ca -0.11 0.40 -0.16 0.00 -0.04 0.00 0.00 63.50 63.59 3hqp n PRO 306 Cb 0.55 -1.79 -0.14 0.00 -0.04 0.00 0.00 33.50 32.08 3hqp n PRO 306 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3hqp s ARG 307 N -3.25 0.42 0.84 0.54 0.52 -1.26 -4.93 118.95 111.83 3hqp s ARG 307 Ca 0.04 -0.22 -0.12 0.00 -0.52 0.00 0.00 55.73 54.92 3hqp s ARG 307 Cb 0.09 -0.40 0.10 0.00 0.52 0.00 0.00 34.95 35.26 3hqp s ARG 307 CO 0.34 0.11 1.13 -1.25 0.02 0.00 0.00 175.30 175.66 3hqp s PRO 308 N -0.21 1.70 0.67 3.54 0.04 -1.26 -4.68 135.00 134.80 3hqp s PRO 308 Ca 0.01 0.34 -0.11 0.00 0.04 0.00 0.00 61.00 61.28 3hqp s PRO 308 Cb -0.02 -1.90 -0.01 0.00 0.04 0.00 0.00 34.50 32.61 3hqp s PRO 308 CO -0.00 -1.82 1.07 0.95 0.04 0.00 0.00 177.00 177.24 3hqp s THR 309 N -3.33 3.97 0.40 1.26 -4.23 -1.26 -4.94 115.64 107.51 3hqp s THR 309 Ca 0.62 0.64 0.07 0.00 -1.18 0.00 0.00 61.69 61.84 3hqp s THR 309 Cb -0.13 -3.62 0.23 0.00 1.34 0.00 0.00 72.50 70.31 3hqp s THR 309 CO 0.52 -0.84 2.00 0.03 -0.54 0.00 0.00 174.62 175.80 3hqp h ARG 310 N -0.54 0.46 -0.38 3.99 2.47 -2.00 -1.68 114.38 116.71 3hqp h ARG 310 Ca -0.45 -0.05 -0.10 0.00 -1.26 0.00 0.00 59.98 58.12 3hqp h ARG 310 Cb 1.23 -0.09 -0.02 0.00 -1.65 0.00 0.00 29.97 29.44 3hqp h ARG 310 CO 0.63 0.39 -0.17 0.00 0.56 0.00 0.00 179.97 181.37 3hqp h ALA 311 N 1.69 0.99 -0.25 0.04 0.00 -1.99 -2.53 119.26 117.21 3hqp h ALA 311 Ca 0.12 -0.34 -0.17 0.00 0.00 0.00 0.00 54.91 54.52 3hqp h ALA 311 Cb 0.09 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 3hqp h ALA 311 CO -0.01 0.60 -0.53 0.93 0.00 0.00 0.00 179.25 180.24 3hqp h GLU 312 N 0.63 0.73 -0.49 0.00 5.08 -1.58 0.34 114.58 119.29 3hqp h GLU 312 Ca 0.10 -0.45 -0.03 0.00 -1.00 0.00 0.00 59.36 57.98 3hqp h GLU 312 Cb 0.64 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.92 3hqp h GLU 312 CO 0.05 1.08 0.20 0.28 -1.00 0.00 0.00 179.01 179.61 3hqp h VAL 313 N 0.57 1.21 -0.62 3.13 2.07 -1.40 -2.72 116.25 118.49 3hqp h VAL 313 Ca 0.02 -0.63 -0.02 0.00 0.82 0.00 0.00 66.70 66.88 3hqp h VAL 313 Cb 1.10 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 31.56 3hqp h VAL 313 CO 0.11 0.24 0.30 -1.28 0.02 0.00 0.00 177.57 176.96 3hqp h SER 314 N 0.65 0.80 -0.43 0.57 0.87 -1.30 -2.63 113.55 112.08 3hqp h SER 314 Ca 0.16 -0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 3hqp h SER 314 Cb 0.18 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 61.91 3hqp h SER 314 CO -0.01 0.70 0.28 -0.78 -0.53 0.00 0.00 176.83 176.49 3hqp h ASP 315 N 0.84 0.49 -0.39 6.23 3.58 -0.80 -1.29 116.42 125.09 3hqp h ASP 315 Ca 0.21 -0.01 -0.06 0.00 0.42 0.00 0.00 57.03 57.59 3hqp h ASP 315 Cb 0.11 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.02 3hqp h ASP 315 CO -0.03 0.36 0.00 0.58 -2.88 0.00 0.00 179.24 177.27 3hqp h VAL 316 N 0.58 1.26 -0.71 2.25 2.07 -1.46 -2.38 116.25 117.86 3hqp h VAL 316 Ca 0.16 -1.00 -0.02 0.00 0.82 0.00 0.00 66.70 66.66 3hqp h VAL 316 Cb -0.07 1.14 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 3hqp h VAL 316 CO -0.03 0.33 0.37 0.00 0.02 0.00 0.00 177.57 178.26 3hqp h ALA 317 N 0.88 0.92 0.00 1.67 0.00 -1.32 -3.01 119.26 118.39 3hqp h ALA 317 Ca 0.11 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 3hqp h ALA 317 Cb 0.47 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3hqp h ALA 317 CO 0.02 0.45 -0.42 -0.91 0.00 0.00 0.00 179.25 178.39 3hqp h ASN 318 N 0.99 0.00 -0.66 0.00 2.35 -1.13 -1.75 115.58 115.38 3hqp h ASN 318 Ca 0.25 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.96 3hqp h ASN 318 Cb 0.07 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.41 3hqp h ASN 318 CO -0.04 0.42 0.27 0.00 -1.65 0.00 0.00 177.43 176.43 3hqp h ALA 319 N 1.58 1.19 0.14 -0.83 0.00 -1.30 0.43 119.26 120.47 3hqp h ALA 319 Ca -0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 3hqp h ALA 319 Cb 1.00 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.52 3hqp h ALA 319 CO 0.05 0.59 -0.07 0.28 0.00 0.00 0.00 179.25 180.11 3hqp h VAL 320 N 0.99 1.01 -0.95 0.00 2.07 -1.40 -1.48 116.25 116.49 3hqp h VAL 320 Ca 0.23 -0.69 0.13 0.00 0.82 0.00 0.00 66.70 67.19 3hqp h VAL 320 Cb 0.19 1.43 -0.08 0.00 -1.52 0.00 0.00 31.29 31.32 3hqp h VAL 320 CO -0.02 0.16 0.60 -0.26 0.02 0.00 0.00 177.57 178.07 3hqp h PHE 321 N -0.52 0.99 -0.74 1.57 0.04 -1.15 -0.69 116.94 116.44 3hqp h PHE 321 Ca -0.02 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.78 3hqp h PHE 321 Cb 0.41 -0.31 -0.04 0.00 2.20 0.00 0.00 35.95 38.21 3hqp h PHE 321 CO 0.03 0.38 0.47 -0.91 -0.60 0.00 0.00 178.31 177.69 3hqp h ASN 322 N 0.85 0.87 0.00 2.17 -0.26 -0.01 -3.47 115.58 115.74 3hqp h ASN 322 Ca 0.47 -0.03 0.00 0.00 -0.56 0.00 0.00 56.30 56.18 3hqp h ASN 322 Cb 0.58 -0.22 0.00 0.00 -1.06 0.00 0.00 38.32 37.63 3hqp h ASN 322 CO -0.23 0.65 0.00 0.61 -1.06 0.00 0.00 177.43 177.39 3hqp n GLY 323 N -1.36 1.83 3.77 2.83 0.00 -0.26 -4.63 105.19 107.37 3hqp n GLY 323 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 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 3.39 0.03 4.61 0.00 -0.63 -4.89 121.76 122.28 3hqp s ALA 324 Ca 0.00 1.28 -0.20 0.00 0.00 0.00 0.00 51.96 53.04 3hqp s ALA 324 Cb 0.00 -3.50 -0.16 0.00 0.00 0.00 0.00 23.12 19.46 3hqp s ALA 324 CO 0.00 -0.77 1.27 -0.44 0.00 0.00 0.00 175.76 175.82 3hqp h ASP 325 N 3.00 0.47 -4.34 0.00 5.19 -1.51 -3.45 116.42 115.77 3hqp h ASP 325 Ca -0.49 -0.57 -0.48 0.00 -0.62 0.00 0.00 57.03 54.87 3hqp h ASP 325 Cb 1.24 -0.13 -0.22 0.00 0.18 0.00 0.00 39.33 40.39 3hqp h ASP 325 CO 0.64 0.95 -0.80 0.00 -3.12 0.00 0.00 179.24 176.91 3hqp s VAL 327 N -1.13 2.06 0.06 0.00 -7.23 -0.59 -1.56 120.40 112.00 3hqp s VAL 327 Ca 0.02 -1.10 0.09 0.00 -1.81 0.00 0.00 61.98 59.18 3hqp s VAL 327 Cb -0.10 -1.71 -0.03 0.00 0.56 0.00 0.00 36.38 35.10 3hqp s VAL 327 CO 0.03 0.58 -0.23 -0.32 -0.31 0.00 0.00 175.10 174.84 3hqp s MET 328 N -0.53 1.83 -0.08 4.82 1.75 -0.86 -1.51 119.30 124.73 3hqp s MET 328 Ca 0.08 -1.10 0.03 0.00 -1.25 0.00 0.00 55.69 53.44 3hqp s MET 328 Cb -0.11 -2.04 -0.02 0.00 2.84 0.00 0.00 34.83 35.51 3hqp s MET 328 CO -0.00 0.51 -0.18 -0.51 -0.65 0.00 0.00 175.02 174.19 3hqp s LEU 329 N -1.45 2.49 0.00 4.11 1.43 0.35 -4.29 118.68 121.32 3hqp s LEU 329 Ca 0.13 -0.36 0.00 0.00 -1.03 0.00 0.00 54.13 52.87 3hqp s LEU 329 Cb -0.10 -1.51 0.00 0.00 0.03 0.00 0.00 46.19 44.61 3hqp s LEU 329 CO 0.04 0.24 0.00 -1.20 0.23 0.00 0.00 176.35 175.66 3hqp n SER 330 N 3.01 0.00 0.08 2.29 7.64 -1.26 -2.32 113.62 123.06 3hqp n SER 330 Ca -0.18 0.00 0.08 0.00 1.01 0.00 0.00 58.87 59.78 3hqp n SER 330 Cb 0.52 0.00 0.36 0.00 -1.01 0.00 0.00 64.21 64.08 3hqp n SER 330 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3hqp n GLY 331 N 4.25 -0.89 0.21 0.23 0.00 -1.26 -0.96 105.19 106.77 3hqp n GLY 331 Ca 0.00 0.08 -0.05 0.00 0.00 0.00 0.00 46.02 46.05 3hqp n GLY 331 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3hqp h GLU 332 N 0.00 0.38 0.00 1.61 3.07 -1.88 -2.66 114.58 115.10 3hqp h GLU 332 Ca 0.00 -0.20 -0.15 0.00 -0.50 0.00 0.00 59.36 58.51 3hqp h GLU 332 Cb 0.13 0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 28.02 3hqp h GLU 332 CO 0.00 0.75 -1.75 0.25 -1.40 0.00 0.00 179.01 176.86 3hqp n THR 333 N -4.00 0.56 -0.08 1.13 -2.24 -0.84 -3.58 114.28 105.23 3hqp n THR 333 Ca -0.02 -0.44 -0.13 0.00 -2.27 0.00 0.00 64.05 61.19 3hqp n THR 333 Cb 0.52 -0.40 -0.05 0.00 -2.10 0.00 0.00 70.33 68.30 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 0.79 0.35 0.00 6.98 0.00 -0.95 -3.36 119.26 123.06 3hqp h ALA 334 Ca -0.22 -0.33 -0.10 0.00 0.00 0.00 0.00 54.91 54.26 3hqp h ALA 334 Cb 1.38 -0.08 -0.20 0.00 0.00 0.00 0.00 17.79 18.88 3hqp h ALA 334 CO 0.01 0.24 -0.71 0.36 0.00 0.00 0.00 179.25 179.16 3hqp n LYS 335 N -4.45 0.00 -2.42 0.00 2.85 -1.13 -1.90 118.16 111.12 3hqp n LYS 335 Ca -0.04 -1.42 -0.25 0.00 -1.05 0.00 0.00 58.31 55.55 3hqp n LYS 335 Cb 0.38 -0.12 0.04 0.00 -0.65 0.00 0.00 35.03 34.68 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 -1.42 1.65 0.00 2.58 0.00 -1.02 -4.93 107.32 104.19 3hqp s GLY 336 Ca 0.17 -0.86 0.23 0.00 0.00 0.00 0.00 44.72 44.25 3hqp s GLY 336 CO -0.08 -0.56 1.17 0.28 0.00 0.00 0.00 173.10 173.91 3hqp n LYS 337 N -2.61 0.44 -3.05 2.90 5.02 -0.86 -4.51 118.16 115.49 3hqp n LYS 337 Ca 0.06 -0.33 -0.20 0.00 -2.02 0.00 0.00 58.31 55.81 3hqp n LYS 337 Cb 0.59 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 34.08 3hqp n LYS 337 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3hqp n TYR 338 N -0.99 1.40 -0.37 2.13 4.01 -1.26 -4.97 117.16 117.11 3hqp n TYR 338 Ca 0.07 -3.75 -0.03 0.00 -0.16 0.00 0.00 57.90 54.03 3hqp n TYR 338 Cb 0.37 -0.42 0.10 0.00 -0.31 0.00 0.00 39.34 39.08 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 2.98 1.30 -0.09 -0.72 0.13 -1.79 -1.13 132.00 132.68 3hqp h PRO 339 Ca 0.10 -0.10 -0.11 0.00 -0.87 0.00 0.00 66.00 65.03 3hqp h PRO 339 Cb 0.86 -0.29 0.00 0.00 0.13 0.00 0.00 31.00 31.71 3hqp h PRO 339 CO 0.60 0.88 -0.36 -0.91 -0.23 0.00 0.00 178.00 177.98 3hqp h ASN 340 N 1.33 0.47 -0.94 1.44 2.35 -1.93 -3.15 115.58 115.15 3hqp h ASN 340 Ca 0.35 -0.63 0.04 0.00 -0.55 0.00 0.00 56.30 55.52 3hqp h ASN 340 Cb -0.12 -0.14 -0.06 0.00 0.05 0.00 0.00 38.32 38.06 3hqp h ASN 340 CO -0.07 1.02 0.62 -0.33 -1.65 0.00 0.00 177.43 177.02 3hqp h GLU 341 N -0.05 1.13 -0.19 0.81 3.07 -1.92 -0.55 114.58 116.87 3hqp h GLU 341 Ca -0.02 -0.07 -0.06 0.00 -0.50 0.00 0.00 59.36 58.72 3hqp h GLU 341 Cb 1.00 -0.25 -0.01 0.00 -0.84 0.00 0.00 28.75 28.65 3hqp h GLU 341 CO 0.08 0.75 -0.09 -0.24 -1.40 0.00 0.00 179.01 178.10 3hqp h VAL 342 N 1.16 1.31 -0.10 3.13 3.04 -1.29 -1.31 116.25 122.19 3hqp h VAL 342 Ca 0.38 -1.15 -0.08 0.00 -1.01 0.00 0.00 66.70 64.84 3hqp h VAL 342 Cb 0.05 1.65 -0.01 0.00 -2.01 0.00 0.00 31.29 30.97 3hqp h VAL 342 CO -0.12 0.35 -0.31 0.58 -1.01 0.00 0.00 177.57 177.05 3hqp h VAL 343 N 0.10 1.26 -0.44 1.51 2.07 -1.47 -1.58 116.25 117.70 3hqp h VAL 343 Ca 0.04 -1.23 -0.09 0.00 0.82 0.00 0.00 66.70 66.25 3hqp h VAL 343 Cb 0.58 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 3hqp h VAL 343 CO 0.03 0.37 -0.08 1.56 0.02 0.00 0.00 177.57 179.46 3hqp h GLN 344 N 0.16 0.84 -0.15 1.57 4.20 -0.97 -2.34 115.11 118.41 3hqp h GLN 344 Ca 0.02 -0.31 -0.01 0.00 0.06 0.00 0.00 58.65 58.41 3hqp h GLN 344 Cb 0.64 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.36 3hqp h GLN 344 CO 0.05 0.94 0.05 1.88 -0.67 0.00 0.00 178.83 181.07 3hqp h TYR 345 N 0.67 0.24 -0.37 2.96 0.05 -0.98 -2.37 116.97 117.18 3hqp h TYR 345 Ca 0.12 -0.02 0.06 0.00 0.05 0.00 0.00 58.73 58.94 3hqp h TYR 345 Cb 0.61 -0.07 -0.06 0.00 1.01 0.00 0.00 36.73 38.22 3hqp h TYR 345 CO 0.05 0.34 0.01 1.98 -1.05 0.00 0.00 178.16 179.49 3hqp h MET 346 N 0.07 0.10 -1.00 4.88 4.05 -1.27 0.18 114.93 121.94 3hqp h MET 346 Ca 0.05 -0.01 0.02 0.00 -0.28 0.00 0.00 59.70 59.49 3hqp h MET 346 Cb 0.21 -0.02 -0.05 0.00 -0.80 0.00 0.00 31.60 30.94 3hqp h MET 346 CO -0.00 0.07 0.66 0.00 0.23 0.00 0.00 176.91 177.87 3hqp h ALA 347 N 1.32 1.29 -0.19 0.39 0.00 -1.41 0.72 119.26 121.39 3hqp h ALA 347 Ca 0.18 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 3hqp h ALA 347 Cb 0.24 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3hqp h ALA 347 CO -0.29 0.61 -0.34 -0.09 0.00 0.00 0.00 179.25 179.13 3hqp h ARG 348 N 1.31 0.39 0.16 0.00 2.43 -0.72 -1.12 114.38 116.84 3hqp h ARG 348 Ca 0.38 -0.17 -0.28 0.00 -0.81 0.00 0.00 59.98 59.11 3hqp h ARG 348 Cb -0.09 -0.01 0.03 0.00 -0.42 0.00 0.00 29.97 29.48 3hqp h ARG 348 CO -0.10 0.69 -1.18 0.82 -1.51 0.00 0.00 179.97 178.69 3hqp h ILE 349 N 0.33 1.35 -0.30 1.20 2.04 -0.54 -2.76 117.51 118.83 3hqp h ILE 349 Ca 0.04 -2.52 0.04 0.00 1.00 0.00 0.00 64.86 63.42 3hqp h ILE 349 Cb 0.77 2.92 -0.04 0.00 -0.74 0.00 0.00 36.82 39.73 3hqp h ILE 349 CO 0.06 0.75 0.06 0.00 0.00 0.00 0.00 178.15 179.02 3hqp h LEU 351 N 0.17 1.05 -0.39 0.00 6.46 -1.29 -1.23 115.31 120.07 3hqp h LEU 351 Ca 0.14 -0.11 -0.16 0.00 -0.12 0.00 0.00 57.88 57.63 3hqp h LEU 351 Cb 0.15 -0.27 -0.01 0.00 -0.73 0.00 0.00 40.66 39.80 3hqp h LEU 351 CO -0.18 0.87 -0.39 -0.08 -0.62 0.00 0.00 178.44 178.04 3hqp h GLU 352 N 1.15 0.94 -0.50 1.25 4.57 -1.17 -2.78 114.58 118.06 3hqp h GLU 352 Ca 0.28 -0.50 -0.10 0.00 -1.18 0.00 0.00 59.36 57.86 3hqp h GLU 352 Cb 0.09 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.68 3hqp h GLU 352 CO -0.04 1.16 -0.10 0.00 -1.18 0.00 0.00 179.01 178.84 3hqp h ALA 353 N 0.78 0.88 -0.84 2.92 0.00 -0.78 -2.74 119.26 119.48 3hqp h ALA 353 Ca 0.06 -0.33 0.07 0.00 0.00 0.00 0.00 54.91 54.70 3hqp h ALA 353 Cb 0.99 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.52 3hqp h ALA 353 CO 0.10 0.64 0.51 0.37 0.00 0.00 0.00 179.25 180.87 3hqp h GLN 354 N 0.82 0.89 -0.76 0.00 4.15 -1.19 -0.44 115.11 118.58 3hqp h GLN 354 Ca 0.13 -0.05 0.15 0.00 0.77 0.00 0.00 58.65 59.65 3hqp h GLN 354 Cb 0.63 -0.20 -0.10 0.00 0.21 0.00 0.00 27.48 28.02 3hqp h GLN 354 CO 0.04 0.59 0.29 0.77 -1.93 0.00 0.00 178.83 178.59 3hqp h SER 355 N 0.91 0.25 0.59 -0.69 0.02 -1.19 -1.83 113.55 111.60 3hqp h SER 355 Ca 0.37 0.12 0.00 0.00 -0.84 0.00 0.00 61.79 61.44 3hqp h SER 355 Cb 0.21 0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.85 3hqp h SER 355 CO -0.19 0.08 -0.49 0.00 -1.14 0.00 0.00 176.83 175.09 3hqp n ALA 356 N -2.53 3.37 -2.08 3.77 0.00 -0.89 -4.87 120.51 117.28 3hqp n ALA 356 Ca 0.15 -0.32 -0.42 0.00 0.00 0.00 0.00 53.44 52.85 3hqp n ALA 356 Cb 0.44 -1.15 -0.03 0.00 0.00 0.00 0.00 19.45 18.71 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 -3.18 4.39 -0.99 0.00 2.96 -0.22 -4.97 118.68 116.67 3hqp s LEU 357 Ca 0.10 2.38 -0.13 0.00 -0.22 0.00 0.00 54.13 56.27 3hqp s LEU 357 Cb 0.17 -3.60 0.23 0.00 0.50 0.00 0.00 46.19 43.49 3hqp s LEU 357 CO 0.69 -0.60 1.01 0.21 -1.32 0.00 0.00 176.35 176.34 3hqp s ASN 358 N 0.71 7.00 0.49 3.68 3.84 -1.26 -4.90 114.94 124.51 3hqp s ASN 358 Ca 0.61 -3.02 0.26 0.00 0.21 0.00 0.00 52.86 50.92 3hqp s ASN 358 Cb -0.37 -2.25 1.27 0.00 -0.55 0.00 0.00 41.25 39.36 3hqp s ASN 358 CO 0.35 -0.53 1.99 -0.33 -2.79 0.00 0.00 177.10 175.79 3hqp h GLU 359 N 7.38 0.00 -0.15 0.43 3.07 -1.92 -2.07 114.58 121.32 3hqp h GLU 359 Ca 0.16 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.98 3hqp h GLU 359 Cb 0.96 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.86 3hqp h GLU 359 CO 0.94 0.16 -0.08 -0.92 -1.40 0.00 0.00 179.01 177.71 3hqp h TYR 360 N 0.00 0.36 -0.49 4.33 3.20 -1.90 0.16 116.97 122.63 3hqp h TYR 360 Ca -0.00 -0.09 -0.03 0.00 3.14 0.00 0.00 58.73 61.75 3hqp h TYR 360 Cb 0.47 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.63 3hqp h TYR 360 CO 0.00 0.64 0.20 0.28 -1.64 0.00 0.00 178.16 177.64 3hqp h VAL 361 N -0.02 1.21 -0.44 1.81 2.07 -1.93 -1.05 116.25 117.90 3hqp h VAL 361 Ca 0.03 -0.63 0.09 0.00 0.82 0.00 0.00 66.70 67.01 3hqp h VAL 361 Cb 0.55 0.72 -0.09 0.00 -1.52 0.00 0.00 31.29 30.95 3hqp h VAL 361 CO 0.02 0.24 -0.15 0.15 0.02 0.00 0.00 177.57 177.85 3hqp h PHE 362 N 0.64 -0.35 -0.29 1.57 -0.00 -1.29 0.32 116.94 117.55 3hqp h PHE 362 Ca 0.16 0.04 0.02 0.00 -0.00 0.00 0.00 57.97 58.20 3hqp h PHE 362 Cb 0.18 0.22 -0.03 0.00 -0.00 0.00 0.00 35.95 36.33 3hqp h PHE 362 CO 0.00 -0.23 0.14 0.35 -0.00 0.00 0.00 178.31 178.57 3hqp h PHE 363 N -0.05 0.26 -0.40 0.41 3.57 -0.31 -2.09 116.94 118.32 3hqp h PHE 363 Ca 0.21 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.69 3hqp h PHE 363 Cb 0.38 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.03 3hqp h PHE 363 CO -0.41 0.14 0.13 -0.91 -2.23 0.00 0.00 178.31 175.02 3hqp h ASN 364 N 0.29 0.58 -0.62 0.41 2.35 -0.80 -1.44 115.58 116.35 3hqp h ASN 364 Ca 0.12 -0.20 0.03 0.00 -0.55 0.00 0.00 56.30 55.70 3hqp h ASN 364 Cb 0.05 -0.15 -0.04 0.00 0.05 0.00 0.00 38.32 38.23 3hqp h ASN 364 CO -0.09 0.63 0.38 0.28 -1.65 0.00 0.00 177.43 176.97 3hqp h SER 365 N 0.50 0.61 -0.53 5.81 0.02 -0.81 -1.53 113.55 117.62 3hqp h SER 365 Ca 0.13 0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 60.98 3hqp h SER 365 Cb 0.25 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.65 3hqp h SER 365 CO -0.00 0.42 -0.08 0.40 -1.14 0.00 0.00 176.83 176.42 3hqp h ILE 366 N 0.73 1.27 -0.59 3.27 2.04 -1.32 -3.10 117.51 119.81 3hqp h ILE 366 Ca 0.25 -1.22 0.04 0.00 1.00 0.00 0.00 64.86 64.93 3hqp h ILE 366 Cb 0.05 0.98 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 3hqp h ILE 366 CO -0.11 0.43 0.35 0.50 0.00 0.00 0.00 178.15 179.31 3hqp h LYS 367 N 0.85 0.65 0.00 2.37 3.64 -0.76 -2.63 116.57 120.70 3hqp h LYS 367 Ca 0.14 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.44 3hqp h LYS 367 Cb 0.64 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.30 3hqp h LYS 367 CO 0.04 0.43 -0.17 0.87 -2.27 0.00 0.00 179.45 178.36 3hqp h LYS 368 N 0.67 0.00 -0.64 1.90 6.56 -1.24 -3.18 116.57 120.64 3hqp h LYS 368 Ca 0.25 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.84 3hqp h LYS 368 Cb 0.07 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.73 3hqp h LYS 368 CO -0.12 0.17 0.00 1.28 -2.06 0.00 0.00 179.45 178.71 3hqp n LEU 369 N -4.00 4.38 -4.85 2.94 4.77 -0.99 -4.91 117.00 114.35 3hqp n LEU 369 Ca -0.02 -2.22 -0.34 0.00 -0.03 0.00 0.00 56.01 53.40 3hqp n LEU 369 Cb 0.25 -0.57 -0.06 0.00 -2.33 0.00 0.00 43.42 40.71 3hqp n LEU 369 CO 0.34 0.66 -0.20 -1.10 -1.33 0.00 0.00 177.39 175.76 3hqp s GLN 370 N -2.01 3.30 0.16 3.23 -1.52 -1.20 -5.06 119.66 116.55 3hqp s GLN 370 Ca 0.44 -0.34 -0.31 0.00 -1.95 0.00 0.00 55.36 53.20 3hqp s GLN 370 Cb 0.30 -3.02 -0.09 0.00 -0.22 0.00 0.00 33.01 29.97 3hqp s GLN 370 CO 0.19 0.69 1.48 -1.58 -0.25 0.00 0.00 175.29 175.82 3hqp s HIS 371 N -1.20 3.12 -0.16 0.91 5.65 -1.26 -4.99 115.29 117.36 3hqp s HIS 371 Ca 0.23 0.81 -0.06 0.00 0.25 0.00 0.00 55.06 56.29 3hqp s HIS 371 Cb -0.12 -3.82 -0.04 0.00 -1.18 0.00 0.00 32.58 27.42 3hqp s HIS 371 CO 0.13 -2.91 0.04 0.42 -0.65 0.00 0.00 174.74 171.77 3hqp s ILE 372 N 0.92 4.63 0.37 0.89 1.01 -1.26 -3.13 121.20 124.64 3hqp s ILE 372 Ca 0.66 -0.10 -0.24 0.00 0.00 0.00 0.00 60.65 60.97 3hqp s ILE 372 Cb -0.41 -3.06 -0.10 0.00 0.01 0.00 0.00 42.46 38.91 3hqp s ILE 372 CO 0.33 0.50 0.99 -2.16 0.00 0.00 0.00 174.94 174.60 3hqp s PRO 373 N 0.10 4.35 0.65 2.79 0.04 -1.26 -5.18 135.00 136.50 3hqp s PRO 373 Ca 0.04 1.38 -0.11 0.00 0.04 0.00 0.00 61.00 62.35 3hqp s PRO 373 Cb -0.12 -2.60 -0.02 0.00 0.04 0.00 0.00 34.50 31.79 3hqp s PRO 373 CO 0.01 0.05 1.04 -1.64 0.04 0.00 0.00 177.00 176.51 3hqp s MET 374 N -2.40 3.33 0.67 4.56 -1.94 -1.18 -5.07 119.30 117.27 3hqp s MET 374 Ca 0.55 0.81 -0.13 0.00 -1.71 0.00 0.00 55.69 55.21 3hqp s MET 374 Cb -0.19 -2.04 0.00 0.00 2.01 0.00 0.00 34.83 34.61 3hqp s MET 374 CO 0.24 -0.78 1.07 -1.54 -0.01 0.00 0.00 175.02 174.00 3hqp s SER 375 N -4.05 5.31 0.24 3.03 1.04 -1.26 -4.85 113.70 113.16 3hqp s SER 375 Ca 0.56 1.77 -0.04 0.00 0.48 0.00 0.00 55.95 58.72 3hqp s SER 375 Cb -0.12 -2.52 0.42 0.00 0.10 0.00 0.00 66.02 63.90 3hqp s SER 375 CO 0.54 -1.49 1.78 0.00 0.98 0.00 0.00 173.24 175.05 3hqp h ALA 376 N -0.32 1.13 -0.06 5.32 0.00 -1.97 -1.08 119.26 122.27 3hqp h ALA 376 Ca -0.45 0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.38 3hqp h ALA 376 Cb 1.22 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 3hqp h ALA 376 CO 0.56 -0.03 -0.60 0.38 0.00 0.00 0.00 179.25 179.56 3hqp h ASP 377 N 0.65 0.24 -0.17 0.00 2.03 -1.93 -1.06 116.42 116.18 3hqp h ASP 377 Ca 0.40 -0.14 -0.20 0.00 -0.73 0.00 0.00 57.03 56.37 3hqp h ASP 377 Cb 0.47 -0.07 0.01 0.00 -0.83 0.00 0.00 39.33 38.90 3hqp h ASP 377 CO -0.30 0.78 -0.67 -0.08 -1.03 0.00 0.00 179.24 177.95 3hqp h GLU 378 N 0.16 0.75 -0.69 4.15 4.81 -1.78 -2.65 114.58 119.33 3hqp h GLU 378 Ca -0.01 -0.58 -0.00 0.00 -0.13 0.00 0.00 59.36 58.64 3hqp h GLU 378 Cb 1.09 0.11 -0.03 0.00 0.63 0.00 0.00 28.75 30.55 3hqp h GLU 378 CO 0.09 1.20 0.43 0.00 -0.73 0.00 0.00 179.01 180.00 3hqp h ALA 379 N 0.56 0.88 -0.31 2.92 0.00 -1.11 -0.45 119.26 121.76 3hqp h ALA 379 Ca -0.03 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 54.86 3hqp h ALA 379 Cb 1.29 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 18.75 3hqp h ALA 379 CO 0.14 0.34 -0.03 0.28 0.00 0.00 0.00 179.25 179.98 3hqp h VAL 380 N 0.94 0.74 -0.39 0.00 2.07 -1.21 -0.71 116.25 117.70 3hqp h VAL 380 Ca 0.25 -0.02 -0.03 0.00 0.82 0.00 0.00 66.70 67.72 3hqp h VAL 380 Cb -0.05 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 3hqp h VAL 380 CO -0.05 0.01 0.14 0.00 0.02 0.00 0.00 177.57 177.69 3hqp h SER 382 N 0.48 0.62 0.88 0.00 0.87 -0.91 -2.31 113.55 113.19 3hqp h SER 382 Ca 0.13 -0.08 -0.14 0.00 -1.23 0.00 0.00 61.79 60.47 3hqp h SER 382 Cb 0.23 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.01 3hqp h SER 382 CO -0.01 0.53 -0.65 0.28 -0.53 0.00 0.00 176.83 176.45 3hqp h SER 383 N 0.67 0.00 -0.31 6.23 0.02 -1.07 -2.31 113.55 116.78 3hqp h SER 383 Ca 0.18 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.10 3hqp h SER 383 Cb 0.04 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 3hqp h SER 383 CO -0.03 0.65 0.09 0.00 -1.14 0.00 0.00 176.83 176.40 3hqp h ALA 384 N 1.35 0.41 -0.88 3.77 0.00 -0.91 -0.91 119.26 122.09 3hqp h ALA 384 Ca -0.01 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3hqp h ALA 384 Cb 1.26 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 3hqp h ALA 384 CO 0.08 0.05 0.55 0.28 0.00 0.00 0.00 179.25 180.22 3hqp h VAL 385 N 0.35 1.24 -0.47 0.00 2.07 -1.36 -1.70 116.25 116.38 3hqp h VAL 385 Ca 0.10 -0.48 0.03 0.00 0.82 0.00 0.00 66.70 67.17 3hqp h VAL 385 Cb 0.26 -0.03 -0.04 0.00 -1.52 0.00 0.00 31.29 29.96 3hqp h VAL 385 CO -0.00 0.24 0.25 -1.13 0.02 0.00 0.00 177.57 176.95 3hqp h ASN 386 N 1.21 0.37 -0.38 0.57 -0.73 -1.08 -2.19 115.58 113.35 3hqp h ASN 386 Ca 0.32 0.02 0.05 0.00 1.87 0.00 0.00 56.30 58.56 3hqp h ASN 386 Cb -0.09 -0.05 -0.05 0.00 0.27 0.00 0.00 38.32 38.40 3hqp h ASN 386 CO -0.06 0.26 0.09 0.28 -0.37 0.00 0.00 177.43 177.63 3hqp h SER 387 N 0.49 0.05 -0.43 1.15 0.02 -0.70 -1.28 113.55 112.86 3hqp h SER 387 Ca 0.20 0.06 0.08 0.00 -0.84 0.00 0.00 61.79 61.29 3hqp h SER 387 Cb 0.09 0.07 -0.09 0.00 0.14 0.00 0.00 62.40 62.60 3hqp h SER 387 CO -0.13 0.06 -0.30 0.58 -1.14 0.00 0.00 176.83 175.90 3hqp h VAL 388 N 0.23 0.25 -0.67 2.27 2.07 -0.85 0.14 116.25 119.69 3hqp h VAL 388 Ca 0.18 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.63 3hqp h VAL 388 Cb 0.19 0.25 -0.03 0.00 -1.52 0.00 0.00 31.29 30.19 3hqp h VAL 388 CO -0.22 0.00 0.17 1.88 0.02 0.00 0.00 177.57 179.42 3hqp h TYR 389 N -0.22 1.10 -0.09 1.57 0.05 -1.07 0.25 116.97 118.56 3hqp h TYR 389 Ca 0.19 -0.12 -0.14 0.00 0.05 0.00 0.00 58.73 58.71 3hqp h TYR 389 Cb 0.52 -0.31 -0.01 0.00 1.01 0.00 0.00 36.73 37.94 3hqp h TYR 389 CO -0.53 0.90 -0.55 0.93 -1.05 0.00 0.00 178.16 177.85 3hqp h GLU 390 N 1.01 0.28 -0.00 4.88 5.08 -0.71 -3.27 114.58 121.83 3hqp h GLU 390 Ca 0.21 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3hqp h GLU 390 Cb 0.34 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.61 3hqp h GLU 390 CO -0.00 0.76 -0.72 -2.37 -1.00 0.00 0.00 179.01 175.68 3hqp n THR 391 N -3.92 0.00 -3.75 1.13 5.66 0.46 -4.98 114.28 108.88 3hqp n THR 391 Ca -0.02 -0.14 -0.27 0.00 -3.05 0.00 0.00 64.05 60.57 3hqp n THR 391 Cb 0.59 1.07 0.05 0.00 -1.55 0.00 0.00 70.33 70.49 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 -0.99 -6.73 -1.82 1.09 5.02 0.82 -4.95 118.16 110.61 3hqp n LYS 392 Ca 0.05 0.71 -0.40 0.00 -2.02 0.00 0.00 58.31 56.65 3hqp n LYS 392 Cb 0.33 -5.69 0.01 0.00 -0.02 0.00 0.00 35.03 29.66 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 -3.30 3.28 -1.26 7.82 0.00 -0.90 -4.88 121.76 122.52 3hqp s ALA 393 Ca 0.63 1.46 0.20 0.00 0.00 0.00 0.00 51.96 54.25 3hqp s ALA 393 Cb -0.30 -3.58 -0.14 0.00 0.00 0.00 0.00 23.12 19.09 3hqp s ALA 393 CO 0.78 -1.15 0.90 1.63 0.00 0.00 0.00 175.76 177.92 3hqp n LYS 394 N -0.09 0.77 -3.78 0.00 5.02 -1.15 -4.76 118.16 114.18 3hqp n LYS 394 Ca 0.04 -0.32 -0.10 0.00 -2.02 0.00 0.00 58.31 55.91 3hqp n LYS 394 Cb 0.42 -1.43 -0.05 0.00 -0.02 0.00 0.00 35.03 33.95 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 -2.68 -0.67 0.02 7.82 0.00 -1.26 -4.21 121.76 120.77 3hqp s ALA 395 Ca 0.11 -0.37 0.03 0.00 0.00 0.00 0.00 51.96 51.72 3hqp s ALA 395 Cb 0.16 0.81 -0.01 0.00 0.00 0.00 0.00 23.12 24.08 3hqp s ALA 395 CO 0.72 -0.73 -0.08 1.41 0.00 0.00 0.00 175.76 177.08 3hqp s MET 396 N -3.88 0.61 -0.11 0.00 1.75 -0.87 -2.56 119.30 114.24 3hqp s MET 396 Ca 0.10 -0.48 0.02 0.00 -1.25 0.00 0.00 55.69 54.08 3hqp s MET 396 Cb 0.01 -0.54 0.01 0.00 2.84 0.00 0.00 34.83 37.15 3hqp s MET 396 CO -0.04 0.13 -0.18 0.08 -0.65 0.00 0.00 175.02 174.37 3hqp s VAL 397 N -0.63 1.66 -0.08 10.11 1.01 -0.09 -0.17 120.40 132.21 3hqp s VAL 397 Ca -0.01 -0.76 0.02 0.00 0.00 0.00 0.00 61.98 61.24 3hqp s VAL 397 Cb -0.06 -1.49 0.01 0.00 0.00 0.00 0.00 36.38 34.85 3hqp s VAL 397 CO 0.00 0.47 -0.15 0.68 0.00 0.00 0.00 175.10 176.11 3hqp s VAL 398 N 0.78 1.36 -0.23 2.92 -7.23 -0.09 -0.65 120.40 117.26 3hqp s VAL 398 Ca -0.10 -0.59 -0.23 0.00 -1.81 0.00 0.00 61.98 59.24 3hqp s VAL 398 Cb -0.16 -1.23 -0.01 0.00 0.56 0.00 0.00 36.38 35.54 3hqp s VAL 398 CO 0.01 0.41 0.76 -0.76 -0.31 0.00 0.00 175.10 175.21 3hqp s LEU 399 N 0.74 4.10 -0.16 1.32 1.43 -1.10 -0.45 118.68 124.55 3hqp s LEU 399 Ca -0.12 0.96 -0.06 0.00 -1.03 0.00 0.00 54.13 53.88 3hqp s LEU 399 Cb -0.16 -3.09 0.08 0.00 0.03 0.00 0.00 46.19 43.05 3hqp s LEU 399 CO 0.03 -0.44 0.35 -0.55 0.23 0.00 0.00 176.35 175.97 3hqp s SER 400 N 1.32 -0.02 -0.12 2.29 0.15 -1.10 -4.87 113.70 111.35 3hqp s SER 400 Ca 0.33 0.81 0.11 0.00 0.70 0.00 0.00 55.95 57.90 3hqp s SER 400 Cb -0.16 1.01 -0.24 0.00 -1.71 0.00 0.00 66.02 64.93 3hqp s SER 400 CO 0.09 -0.23 0.38 0.59 1.20 0.00 0.00 173.24 175.27 3hqp n ASN 401 N 5.26 0.82 0.00 5.45 3.02 -1.26 -4.18 115.26 124.38 3hqp n ASN 401 Ca -0.09 0.22 0.11 0.00 -0.03 0.00 0.00 54.58 54.79 3hqp n ASN 401 Cb 0.50 0.15 -0.13 0.00 -0.61 0.00 0.00 39.78 39.69 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 -3.02 0.05 0.00 3.41 -2.24 -1.26 -4.55 114.28 106.67 3hqp n THR 402 Ca -0.26 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.16 3hqp n THR 402 Cb 1.08 0.22 0.00 0.00 -2.10 0.00 0.00 70.33 69.54 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 1.32 1.74 0.17 3.38 0.00 -1.26 -4.93 105.19 105.61 3hqp n GLY 403 Ca -0.01 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.96 3hqp n GLY 403 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3hqp h ARG 404 N 3.49 0.05 -0.34 1.61 3.08 -1.93 -2.40 114.38 117.93 3hqp h ARG 404 Ca 0.00 -0.00 -0.16 0.00 0.07 0.00 0.00 59.98 59.89 3hqp h ARG 404 Cb 0.00 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 3hqp h ARG 404 CO 0.00 0.03 -0.41 0.77 -1.07 0.00 0.00 179.97 179.29 3hqp h SER 405 N 0.05 0.90 -0.57 7.04 0.02 -1.93 -2.37 113.55 116.69 3hqp h SER 405 Ca 0.20 -0.42 -0.04 0.00 -0.84 0.00 0.00 61.79 60.69 3hqp h SER 405 Cb 0.30 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.57 3hqp h SER 405 CO -0.39 1.19 0.19 0.00 -1.14 0.00 0.00 176.83 176.68 3hqp h ALA 406 N 0.85 0.74 0.00 3.77 0.00 -1.85 -1.98 119.26 120.79 3hqp h ALA 406 Ca 0.05 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.67 3hqp h ALA 406 Cb 0.98 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 3hqp h ALA 406 CO 0.09 0.40 -0.46 0.00 0.00 0.00 0.00 179.25 179.28 3hqp h ARG 407 N 0.79 0.00 -0.12 0.00 3.08 -1.42 -1.67 114.38 115.04 3hqp h ARG 407 Ca 0.18 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.09 3hqp h ARG 407 Cb 0.27 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 3hqp h ARG 407 CO -0.01 0.46 -0.56 1.25 -1.07 0.00 0.00 179.97 180.05 3hqp h LEU 408 N 0.00 0.39 0.04 3.04 5.85 -1.14 -1.83 115.31 121.67 3hqp h LEU 408 Ca -0.00 -0.21 -0.13 0.00 0.84 0.00 0.00 57.88 58.38 3hqp h LEU 408 Cb 0.84 -0.11 0.01 0.00 0.37 0.00 0.00 40.66 41.77 3hqp h LEU 408 CO 0.06 0.87 -0.51 0.58 -0.34 0.00 0.00 178.44 179.10 3hqp h VAL 409 N 0.27 1.52 -0.92 1.05 2.07 -1.20 -3.28 116.25 115.76 3hqp h VAL 409 Ca 0.00 -2.20 0.11 0.00 0.82 0.00 0.00 66.70 65.43 3hqp h VAL 409 Cb 1.06 2.89 -0.07 0.00 -1.52 0.00 0.00 31.29 33.66 3hqp h VAL 409 CO 0.09 0.62 0.59 0.00 0.02 0.00 0.00 177.57 178.89 3hqp h ALA 410 N 0.20 1.64 -1.30 1.67 0.00 -1.35 -1.38 119.26 118.74 3hqp h ALA 410 Ca -0.08 0.01 0.38 0.00 0.00 0.00 0.00 54.91 55.22 3hqp h ALA 410 Cb 1.30 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.84 3hqp h ALA 410 CO 0.10 0.15 0.93 -0.22 0.00 0.00 0.00 179.25 180.21 3hqp h LYS 411 N 0.88 0.01 -0.27 0.00 3.64 -1.38 0.02 116.57 119.47 3hqp h LYS 411 Ca 0.44 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.82 3hqp h LYS 411 Cb 0.49 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.30 3hqp h LYS 411 CO -0.20 0.01 0.00 0.66 -2.27 0.00 0.00 179.45 177.64 3hqp n TYR 412 N -4.16 0.33 -3.46 1.91 4.01 -0.52 -4.98 117.16 110.30 3hqp n TYR 412 Ca 0.28 -0.17 -0.17 0.00 -0.16 0.00 0.00 57.90 57.69 3hqp n TYR 412 Cb 1.35 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 40.40 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 1.22 -1.40 -1.50 -0.72 5.12 -0.01 -4.33 116.66 115.03 3hqp n ARG 413 Ca 0.18 0.95 -0.30 0.00 -1.93 0.00 0.00 57.85 56.74 3hqp n ARG 413 Cb 0.55 -4.33 0.08 0.00 -1.16 0.00 0.00 32.46 27.61 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 -4.51 2.25 -0.46 5.56 0.04 -1.26 -4.55 135.00 132.07 3hqp s PRO 414 Ca 0.17 0.78 0.02 0.00 0.04 0.00 0.00 61.00 62.01 3hqp s PRO 414 Cb -0.05 -1.93 0.52 0.00 0.04 0.00 0.00 34.50 33.08 3hqp s PRO 414 CO 0.82 -1.54 1.88 0.27 0.04 0.00 0.00 177.00 178.48 3hqp n ASN 415 N -3.40 4.97 -4.09 6.66 6.94 -1.26 -4.88 115.26 120.19 3hqp n ASN 415 Ca 0.07 -3.48 -0.08 0.00 -0.02 0.00 0.00 54.58 51.07 3hqp n ASN 415 Cb 0.55 -0.87 -0.10 0.00 -2.36 0.00 0.00 39.78 37.01 3hqp n ASN 415 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3hqp s PRO 417 N -3.97 3.94 -0.30 0.00 0.02 -1.26 -4.87 135.00 128.55 3hqp s PRO 417 Ca 0.14 2.04 -0.13 0.00 0.02 0.00 0.00 61.00 63.08 3hqp s PRO 417 Cb 0.07 -2.69 -0.03 0.00 0.02 0.00 0.00 34.50 31.87 3hqp s PRO 417 CO -0.05 -0.48 0.25 0.42 -0.33 0.00 0.00 177.00 176.82 3hqp s ILE 418 N -1.32 5.27 -0.45 2.83 1.01 -0.54 -2.06 121.20 125.94 3hqp s ILE 418 Ca 0.58 0.09 -0.16 0.00 0.00 0.00 0.00 60.65 61.17 3hqp s ILE 418 Cb -0.35 -3.65 0.05 0.00 0.01 0.00 0.00 42.46 38.52 3hqp s ILE 418 CO 0.45 0.11 0.37 -0.69 0.00 0.00 0.00 174.94 175.19 3hqp s VAL 419 N 1.83 5.23 -0.33 2.92 1.01 0.76 -0.35 120.40 131.46 3hqp s VAL 419 Ca 0.08 -0.89 -0.18 0.00 0.00 0.00 0.00 61.98 60.99 3hqp s VAL 419 Cb -0.16 -4.07 -0.01 0.00 0.00 0.00 0.00 36.38 32.14 3hqp s VAL 419 CO 0.11 -0.49 0.52 0.00 0.00 0.00 0.00 175.10 175.23 3hqp s VAL 421 N 2.39 4.87 0.10 0.00 1.01 0.40 0.55 120.40 129.72 3hqp s VAL 421 Ca 0.19 -0.03 0.10 0.00 0.00 0.00 0.00 61.98 62.24 3hqp s VAL 421 Cb -0.15 -4.19 -0.04 0.00 0.00 0.00 0.00 36.38 31.99 3hqp s VAL 421 CO 0.13 -0.60 -0.24 0.28 0.00 0.00 0.00 175.10 174.66 3hqp s THR 422 N 2.71 2.41 -2.30 3.92 -1.32 0.66 -2.73 115.64 118.99 3hqp s THR 422 Ca 0.20 -1.58 0.28 0.00 -1.21 0.00 0.00 61.69 59.38 3hqp s THR 422 Cb -0.15 -2.05 0.53 0.00 -1.51 0.00 0.00 72.50 69.32 3hqp s THR 422 CO 0.17 0.17 1.77 0.35 -2.21 0.00 0.00 174.62 174.87 3hqp n THR 423 N 1.11 0.00 -4.73 5.08 -2.24 -1.26 0.04 114.28 112.27 3hqp n THR 423 Ca -0.17 -0.20 -0.25 0.00 -2.27 0.00 0.00 64.05 61.16 3hqp n THR 423 Cb 0.53 0.36 -0.16 0.00 -2.10 0.00 0.00 70.33 68.96 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 -2.10 1.78 0.26 -0.78 0.52 -1.26 -4.72 118.95 112.64 3hqp s ARG 424 Ca 0.36 -0.53 0.06 0.00 -0.52 0.00 0.00 55.73 55.10 3hqp s ARG 424 Cb 0.21 -1.50 0.33 0.00 0.52 0.00 0.00 34.95 34.51 3hqp s ARG 424 CO 0.37 0.14 1.61 1.25 0.02 0.00 0.00 175.30 178.70 3hqp h LEU 425 N 6.57 0.24 -0.97 2.53 5.85 -1.95 -2.83 115.31 124.76 3hqp h LEU 425 Ca -0.31 -0.12 -0.09 0.00 0.84 0.00 0.00 57.88 58.20 3hqp h LEU 425 Cb 1.18 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.13 3hqp h LEU 425 CO 0.48 0.73 -0.24 -0.61 -0.34 0.00 0.00 178.44 178.46 3hqp h GLN 426 N 0.17 0.47 -0.65 1.25 4.15 -1.97 -2.40 115.11 116.12 3hqp h GLN 426 Ca 0.00 -0.17 -0.06 0.00 0.77 0.00 0.00 58.65 59.19 3hqp h GLN 426 Cb 1.01 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 28.64 3hqp h GLN 426 CO 0.08 0.68 0.16 1.15 -1.93 0.00 0.00 178.83 178.97 3hqp h THR 427 N 0.42 1.25 -0.77 2.39 2.02 -1.81 0.36 112.91 116.77 3hqp h THR 427 Ca 0.06 -0.92 0.03 0.00 0.77 0.00 0.00 66.41 66.36 3hqp h THR 427 Cb 0.64 0.58 -0.05 0.00 -1.74 0.00 0.00 68.15 67.58 3hqp h THR 427 CO 0.05 0.35 0.49 0.00 0.37 0.00 0.00 175.52 176.78 3hqp h ARG 429 N 0.96 0.20 -0.17 0.00 3.08 -1.14 -3.34 114.38 113.96 3hqp h ARG 429 Ca 0.31 -0.15 -0.03 0.00 0.07 0.00 0.00 59.98 60.18 3hqp h ARG 429 Cb 0.02 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 3hqp h ARG 429 CO -0.11 0.78 -0.02 1.96 -1.07 0.00 0.00 179.97 181.51 3hqp h GLN 430 N -0.35 0.24 0.00 0.04 4.20 -0.18 -1.35 115.11 117.71 3hqp h GLN 430 Ca -0.01 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.67 3hqp h GLN 430 Cb 0.80 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.54 3hqp h GLN 430 CO 0.04 0.28 0.00 1.28 -0.67 0.00 0.00 178.83 179.76 3hqp n LEU 431 N -4.38 0.00 0.00 1.46 4.77 -0.75 -3.31 117.00 114.79 3hqp n LEU 431 Ca -0.00 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.09 3hqp n LEU 431 Cb 0.18 0.00 0.50 0.00 -2.33 0.00 0.00 43.42 41.77 3hqp n LEU 431 CO 0.36 0.00 0.87 0.59 -1.33 0.00 0.00 177.39 177.88 3hqp n ASN 432 N -0.74 0.00 -1.05 -1.43 4.13 -0.51 -2.30 115.26 113.35 3hqp n ASN 432 Ca 0.10 0.48 0.11 0.00 1.68 0.00 0.00 54.58 56.95 3hqp n ASN 432 Cb 0.04 -0.49 0.20 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 -1.49 0.54 -3.85 2.41 -5.35 -1.21 -4.78 119.36 105.63 3hqp n ILE 433 Ca 0.06 -0.77 -0.36 0.00 -0.27 0.00 0.00 62.75 61.41 3hqp n ILE 433 Cb 0.27 0.93 -0.11 0.00 -1.74 0.00 0.00 39.64 38.99 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 -1.35 4.55 0.35 7.28 2.01 -0.97 -4.59 115.64 122.90 3hqp s THR 434 Ca 0.35 -0.10 -0.29 0.00 0.31 0.00 0.00 61.69 61.97 3hqp s THR 434 Cb 0.21 -3.10 -0.11 0.00 0.01 0.00 0.00 72.50 69.51 3hqp s THR 434 CO 0.29 0.37 1.41 -1.58 -0.69 0.00 0.00 174.62 174.41 3hqp s GLN 435 N 1.19 4.23 -0.33 4.92 -0.44 -1.26 -3.75 119.66 124.22 3hqp s GLN 435 Ca 0.05 2.39 0.00 0.00 -2.50 0.00 0.00 55.36 55.30 3hqp s GLN 435 Cb -0.14 -3.03 0.00 0.00 -1.64 0.00 0.00 33.01 28.20 3hqp s GLN 435 CO 0.04 -0.37 0.00 0.41 0.50 0.00 0.00 175.29 175.86 3hqp n GLY 436 N 0.78 0.58 3.31 2.59 0.00 0.01 -4.87 105.19 107.58 3hqp n GLY 436 Ca 0.01 -0.29 -0.32 0.00 0.00 0.00 0.00 46.02 45.42 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 -1.90 2.51 -0.09 1.61 1.01 -1.25 -1.47 120.40 120.82 3hqp s VAL 437 Ca 0.00 -0.88 0.04 0.00 0.00 0.00 0.00 61.98 61.14 3hqp s VAL 437 Cb 0.00 -1.98 -0.01 0.00 0.00 0.00 0.00 36.38 34.39 3hqp s VAL 437 CO 0.00 0.55 -0.23 -1.61 0.00 0.00 0.00 175.10 173.82 3hqp s GLU 438 N 0.08 2.94 0.15 2.72 2.02 0.53 -4.92 118.70 122.21 3hqp s GLU 438 Ca -0.09 -0.86 -0.04 0.00 0.02 0.00 0.00 54.97 54.00 3hqp s GLU 438 Cb -0.15 -2.30 -0.05 0.00 0.10 0.00 0.00 34.13 31.72 3hqp s GLU 438 CO 0.06 0.25 0.37 -1.12 0.02 0.00 0.00 175.26 174.84 3hqp s SER 439 N 0.18 6.48 -0.07 -0.19 0.01 -1.26 0.26 113.70 119.12 3hqp s SER 439 Ca -0.13 0.57 0.02 0.00 1.31 0.00 0.00 55.95 57.72 3hqp s SER 439 Cb -0.16 -2.08 0.02 0.00 0.21 0.00 0.00 66.02 64.00 3hqp s SER 439 CO 0.07 0.05 -0.11 -0.69 0.41 0.00 0.00 173.24 172.97 3hqp s VAL 440 N -1.67 1.07 -0.15 3.43 1.01 0.19 -4.88 120.40 119.39 3hqp s VAL 440 Ca 0.41 -0.43 -0.23 0.00 0.00 0.00 0.00 61.98 61.73 3hqp s VAL 440 Cb -0.12 -0.99 -0.02 0.00 0.00 0.00 0.00 36.38 35.24 3hqp s VAL 440 CO 0.25 0.34 0.72 0.12 0.00 0.00 0.00 175.10 176.53 3hqp s PHE 441 N 0.78 3.44 -0.33 5.22 5.36 -1.26 -0.25 117.98 130.95 3hqp s PHE 441 Ca -0.12 1.13 -0.05 0.00 -0.96 0.00 0.00 56.93 56.92 3hqp s PHE 441 Cb -0.15 -2.87 0.05 0.00 -0.34 0.00 0.00 43.02 39.70 3hqp s PHE 441 CO 0.02 -0.13 0.08 0.12 -1.46 0.00 0.00 175.22 173.86 3hqp s PHE 442 N 1.69 3.29 -1.04 10.12 5.36 0.11 -4.93 117.98 132.57 3hqp s PHE 442 Ca 0.34 -1.65 -0.23 0.00 -0.96 0.00 0.00 56.93 54.44 3hqp s PHE 442 Cb -0.17 -2.32 0.01 0.00 -0.34 0.00 0.00 43.02 40.20 3hqp s PHE 442 CO 0.13 -0.78 1.70 0.34 -1.46 0.00 0.00 175.22 175.15 3hqp s ASP 443 N 1.42 5.97 0.32 6.13 2.15 -1.26 -4.27 116.67 127.13 3hqp s ASP 443 Ca -0.02 -1.38 0.24 0.00 0.43 0.00 0.00 52.55 51.82 3hqp s ASP 443 Cb -0.20 -2.57 1.17 0.00 -0.30 0.00 0.00 42.92 41.02 3hqp s ASP 443 CO 0.01 -2.02 1.72 0.00 -0.17 0.00 0.00 175.17 174.72 3hqp h ALA 444 N 9.93 1.00 0.72 3.66 0.00 -1.85 -0.61 119.26 132.12 3hqp h ALA 444 Ca 0.21 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 3hqp h ALA 444 Cb 0.98 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.78 3hqp h ALA 444 CO 1.34 0.00 -0.35 -0.44 0.00 0.00 0.00 179.25 179.81 3hqp h ASP 445 N 0.00 -0.82 0.69 0.00 5.19 -1.86 -2.81 116.42 116.81 3hqp h ASP 445 Ca 0.00 0.03 -0.03 0.00 -0.62 0.00 0.00 57.03 56.40 3hqp h ASP 445 Cb 0.14 0.21 -0.01 0.00 0.18 0.00 0.00 39.33 39.86 3hqp h ASP 445 CO 0.00 -0.52 -1.34 2.29 -3.12 0.00 0.00 179.24 176.55 3hqp n LYS 446 N -5.00 0.62 0.02 3.56 2.85 -1.09 -4.26 118.16 114.85 3hqp n LYS 446 Ca -0.12 0.06 0.11 0.00 -1.05 0.00 0.00 58.31 57.31 3hqp n LYS 446 Cb 0.38 -1.74 -0.10 0.00 -0.65 0.00 0.00 35.03 32.92 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 -2.61 0.37 0.00 -5.58 4.77 -0.26 -5.09 117.00 108.60 3hqp n LEU 447 Ca -0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 3hqp n LEU 447 Cb 0.61 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.68 3hqp n LEU 447 CO 0.42 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 3hqp n GLY 448 N 1.29 2.43 0.22 -0.72 0.00 -1.06 -4.82 105.19 102.54 3hqp n GLY 448 Ca -0.01 -1.98 0.08 0.00 0.00 0.00 0.00 46.02 44.11 3hqp n GLY 448 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 3hqp h HIS 449 N 0.00 0.00 -5.67 1.61 3.86 -1.94 -3.39 115.15 109.63 3hqp h HIS 449 Ca 0.00 0.00 -0.30 0.00 -1.16 0.00 0.00 60.37 58.91 3hqp h HIS 449 Cb 0.00 0.00 0.17 0.00 1.06 0.00 0.00 27.41 28.64 3hqp h HIS 449 CO 0.00 0.24 -0.87 -3.47 0.86 0.00 0.00 177.93 174.69 3hqp n ASP 450 N -3.78 -5.84 0.29 2.45 2.03 -1.26 -4.91 116.55 105.52 3hqp n ASP 450 Ca -0.01 -0.78 0.18 0.00 0.52 0.00 0.00 54.79 54.69 3hqp n ASP 450 Cb 0.34 -4.74 0.78 0.00 -0.72 0.00 0.00 41.12 36.77 3hqp n ASP 450 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 3hqp h GLU 451 N -1.35 0.00 -0.22 -0.67 9.09 -2.02 -2.48 114.58 116.93 3hqp h GLU 451 Ca -0.62 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.79 3hqp h GLU 451 Cb 1.33 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.43 3hqp h GLU 451 CO 0.46 0.02 0.00 0.41 0.05 0.00 0.00 179.01 179.95 3hqp n GLY 452 N -0.21 0.82 4.69 1.06 0.00 -1.26 -4.90 105.19 105.39 3hqp n GLY 452 Ca -0.00 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.46 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 0.81 0.00 -0.33 1.61 4.76 -0.94 -4.81 118.16 119.27 3hqp n LYS 453 Ca 0.17 0.00 0.09 0.00 -2.87 0.00 0.00 58.31 55.70 3hqp n LYS 453 Cb 0.45 -3.01 0.26 0.00 -1.84 0.00 0.00 35.03 30.89 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 0.31 0.73 -0.18 1.97 3.07 -1.93 -2.30 114.58 116.26 3hqp h GLU 454 Ca 0.00 -0.04 -0.22 0.00 -0.50 0.00 0.00 59.36 58.60 3hqp h GLU 454 Cb 0.00 -0.16 0.01 0.00 -0.84 0.00 0.00 28.75 27.75 3hqp h GLU 454 CO 0.00 0.48 -0.74 0.45 -1.40 0.00 0.00 179.01 177.81 3hqp h HIS 455 N 0.75 1.09 -0.22 4.33 3.86 -1.92 -2.48 115.15 120.55 3hqp h HIS 455 Ca 0.51 -0.46 -0.16 0.00 -1.16 0.00 0.00 60.37 59.09 3hqp h HIS 455 Cb 0.69 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 28.99 3hqp h HIS 455 CO -0.04 1.30 -0.52 0.00 0.86 0.00 0.00 177.93 179.53 3hqp h ARG 456 N 0.56 0.63 -0.04 2.45 3.08 -1.86 -2.50 114.38 116.71 3hqp h ARG 456 Ca -0.04 -0.38 -0.00 0.00 0.07 0.00 0.00 59.98 59.63 3hqp h ARG 456 Cb 1.36 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 31.45 3hqp h ARG 456 CO 0.15 0.99 0.02 0.28 -1.07 0.00 0.00 179.97 180.35 3hqp h VAL 457 N 0.49 1.07 -0.03 2.04 2.07 -1.47 -1.91 116.25 118.52 3hqp h VAL 457 Ca 0.02 -0.20 0.01 0.00 0.82 0.00 0.00 66.70 67.35 3hqp h VAL 457 Cb 1.07 1.13 -0.00 0.00 -1.52 0.00 0.00 31.29 31.97 3hqp h VAL 457 CO 0.10 0.06 0.03 0.00 0.02 0.00 0.00 177.57 177.78 3hqp h ALA 458 N 0.94 1.69 0.06 1.67 0.00 -1.37 -0.85 119.26 121.40 3hqp h ALA 458 Ca 0.01 -0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.67 3hqp h ALA 458 Cb 0.07 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3hqp h ALA 458 CO -0.00 -0.04 -1.21 0.00 0.00 0.00 0.00 179.25 178.00 3hqp h ALA 459 N 1.97 0.27 -0.22 0.00 0.00 -1.14 -2.37 119.26 117.77 3hqp h ALA 459 Ca 0.01 -0.96 -0.10 0.00 0.00 0.00 0.00 54.91 53.86 3hqp h ALA 459 Cb 0.07 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 3hqp h ALA 459 CO -0.00 1.15 -0.26 0.78 0.00 0.00 0.00 179.25 180.92 3hqp h GLY 460 N 2.33 0.61 1.33 0.00 0.00 -0.46 -2.11 103.07 104.76 3hqp h GLY 460 Ca -0.10 -0.65 -0.08 0.00 0.00 0.00 0.00 47.33 46.50 3hqp h GLY 460 CO 0.16 0.58 -0.02 -2.08 0.00 0.00 0.00 176.54 175.18 3hqp h VAL 461 N 0.24 1.25 -0.40 4.60 2.07 -1.27 -1.60 116.25 121.14 3hqp h VAL 461 Ca 0.03 -1.04 -0.16 0.00 0.82 0.00 0.00 66.70 66.35 3hqp h VAL 461 Cb 0.82 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 3hqp h VAL 461 CO 0.06 0.37 -0.36 -0.08 0.02 0.00 0.00 177.57 177.58 3hqp h GLU 462 N 0.75 0.95 0.25 1.57 4.57 -1.43 0.66 114.58 121.90 3hqp h GLU 462 Ca 0.14 -0.49 0.01 0.00 -1.18 0.00 0.00 59.36 57.84 3hqp h GLU 462 Cb 0.48 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.06 3hqp h GLU 462 CO 0.02 1.15 -0.29 0.35 -1.18 0.00 0.00 179.01 179.06 3hqp h PHE 463 N 0.78 -0.78 -0.53 0.92 3.57 -1.22 0.84 116.94 120.52 3hqp h PHE 463 Ca 0.07 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.61 3hqp h PHE 463 Cb 0.96 0.31 -0.03 0.00 2.79 0.00 0.00 35.95 39.97 3hqp h PHE 463 CO 0.06 -0.41 0.35 0.00 -2.23 0.00 0.00 178.31 176.08 3hqp h ALA 464 N 0.03 1.73 -0.06 2.41 0.00 -1.25 0.00 119.26 122.12 3hqp h ALA 464 Ca -0.00 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3hqp h ALA 464 Cb 0.55 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 3hqp h ALA 464 CO -0.09 0.21 0.03 0.87 0.00 0.00 0.00 179.25 180.28 3hqp h LYS 465 N 0.62 0.09 0.00 0.00 1.79 -0.58 -0.21 116.57 118.27 3hqp h LYS 465 Ca 0.21 -0.01 -0.06 0.00 -2.18 0.00 0.00 60.65 58.61 3hqp h LYS 465 Cb 0.08 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.71 3hqp h LYS 465 CO -0.05 0.18 -0.27 0.66 -1.08 0.00 0.00 179.45 178.89 3hqp h SER 466 N -0.03 0.00 1.40 0.86 4.64 -0.04 -2.25 113.55 118.14 3hqp h SER 466 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 3hqp h SER 466 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 3hqp h SER 466 CO -0.00 0.27 -0.16 0.11 -0.87 0.00 0.00 176.83 176.18 3hqp h LYS 467 N 0.00 0.00 0.00 4.77 1.79 -1.02 -3.48 116.57 118.64 3hqp h LYS 467 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3hqp h LYS 467 Cb 0.73 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.38 3hqp h LYS 467 CO 0.03 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 178.81 3hqp n GLY 468 N 1.29 0.56 0.17 3.86 0.00 -0.85 -4.97 105.19 105.25 3hqp n GLY 468 Ca 0.05 -0.77 -0.20 0.00 0.00 0.00 0.00 46.02 45.09 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 0.91 -4.02 1.61 0.05 -1.27 -3.46 116.97 110.79 3hqp h TYR 469 Ca 0.00 -0.53 -0.49 0.00 0.05 0.00 0.00 58.73 57.76 3hqp h TYR 469 Cb 0.00 -0.09 -0.24 0.00 1.01 0.00 0.00 36.73 37.42 3hqp h TYR 469 CO 0.00 1.37 -0.81 0.14 -1.05 0.00 0.00 178.16 177.82 3hqp s VAL 470 N -3.12 1.35 0.48 -2.88 -7.23 -1.15 -4.69 120.40 103.15 3hqp s VAL 470 Ca -0.11 -1.23 0.04 0.00 -1.81 0.00 0.00 61.98 58.88 3hqp s VAL 470 Cb 0.05 -1.23 -0.02 0.00 0.56 0.00 0.00 36.38 35.75 3hqp s VAL 470 CO 0.90 -0.02 0.14 -1.10 -0.31 0.00 0.00 175.10 174.71 3hqp s GLN 471 N -1.45 2.18 0.24 4.82 1.11 -1.26 -4.34 119.66 120.96 3hqp s GLN 471 Ca 0.03 -2.13 -0.31 0.00 0.01 0.00 0.00 55.36 52.95 3hqp s GLN 471 Cb -0.09 -1.79 -0.12 0.00 -1.01 0.00 0.00 33.01 30.00 3hqp s GLN 471 CO 0.02 -0.32 1.59 2.41 0.01 0.00 0.00 175.29 179.00 3hqp n THR 472 N -1.33 0.57 -0.05 -0.19 -1.04 -1.26 -2.26 114.28 108.72 3hqp n THR 472 Ca -0.09 -0.14 0.00 0.00 -2.04 0.00 0.00 64.05 61.78 3hqp n THR 472 Cb 0.66 -1.80 0.00 0.00 -1.82 0.00 0.00 70.33 67.37 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 2.84 0.96 3.86 3.41 0.00 0.74 -5.00 105.19 112.01 3hqp n GLY 473 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.72 5.52 0.08 1.61 1.01 -0.96 -4.76 116.67 116.45 3hqp s ASP 474 Ca 0.00 1.28 -0.08 0.00 0.71 0.00 0.00 52.55 54.46 3hqp s ASP 474 Cb 0.00 -2.15 -0.06 0.00 1.01 0.00 0.00 42.92 41.73 3hqp s ASP 474 CO 0.00 -1.31 0.37 -0.31 0.21 0.00 0.00 175.17 174.13 3hqp s TYR 475 N -3.25 3.56 -0.04 4.23 2.02 -1.26 -0.74 117.35 121.86 3hqp s TYR 475 Ca 0.58 0.69 -0.01 0.00 -0.37 0.00 0.00 57.07 57.95 3hqp s TYR 475 Cb -0.12 -2.09 0.03 0.00 -0.40 0.00 0.00 41.96 39.38 3hqp s TYR 475 CO 0.53 0.52 0.04 0.00 -1.57 0.00 0.00 175.55 175.07 3hqp s VAL 477 N 1.84 4.91 -0.15 0.00 1.01 -1.06 -2.03 120.40 124.91 3hqp s VAL 477 Ca 0.01 1.45 -0.01 0.00 0.00 0.00 0.00 61.98 63.43 3hqp s VAL 477 Cb -0.12 -4.06 -0.01 0.00 0.00 0.00 0.00 36.38 32.18 3hqp s VAL 477 CO -0.03 0.01 -0.11 -0.69 0.00 0.00 0.00 175.10 174.28 3hqp s VAL 478 N 2.37 3.10 -0.15 2.92 1.01 0.35 -0.92 120.40 129.09 3hqp s VAL 478 Ca 0.33 -0.63 -0.00 0.00 0.00 0.00 0.00 61.98 61.69 3hqp s VAL 478 Cb -0.16 -2.33 -0.01 0.00 0.00 0.00 0.00 36.38 33.89 3hqp s VAL 478 CO 0.10 0.50 -0.14 -0.63 0.00 0.00 0.00 175.10 174.93 3hqp s ILE 479 N 0.62 2.80 0.04 2.22 1.01 0.17 -1.28 121.20 126.78 3hqp s ILE 479 Ca -0.07 -0.73 -0.09 0.00 0.00 0.00 0.00 60.65 59.77 3hqp s ILE 479 Cb -0.15 -2.18 0.03 0.00 0.01 0.00 0.00 42.46 40.16 3hqp s ILE 479 CO 0.03 0.51 0.41 0.00 0.00 0.00 0.00 174.94 175.89 3hqp n HIS 480 N 3.94 -0.65 -2.26 3.97 1.44 -1.07 -2.70 115.22 117.89 3hqp n HIS 480 Ca -0.19 -0.40 -0.28 0.00 -2.01 0.00 0.00 57.72 54.84 3hqp n HIS 480 Cb 0.52 0.19 0.02 0.00 0.12 0.00 0.00 29.99 30.84 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 -1.38 3.21 1.00 1.59 0.00 -1.26 -1.60 121.76 123.32 3hqp s ALA 481 Ca 0.09 -0.48 -0.05 0.00 0.00 0.00 0.00 51.96 51.52 3hqp s ALA 481 Cb -0.01 -2.76 0.07 0.00 0.00 0.00 0.00 23.12 20.41 3hqp s ALA 481 CO 0.01 -0.75 0.38 -0.40 0.00 0.00 0.00 175.76 175.00 3hqp n ASP 482 N -2.62 -0.04 0.00 0.00 5.68 -1.26 -4.83 116.55 113.48 3hqp n ASP 482 Ca 0.04 -1.11 0.06 0.00 -0.50 0.00 0.00 54.79 53.28 3hqp n ASP 482 Cb 0.56 -0.29 0.35 0.00 -1.14 0.00 0.00 41.12 40.61 3hqp n ASP 482 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 3hqp n HIS 483 N -2.56 0.00 -0.04 2.11 8.25 -1.26 -3.85 115.22 117.87 3hqp n HIS 483 Ca 0.05 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.41 3hqp n HIS 483 Cb 0.17 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.24 3hqp n HIS 483 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 3hqp n LYS 484 N -0.70 0.20 -1.97 -0.41 4.81 -1.26 -5.07 118.16 113.75 3hqp n LYS 484 Ca 0.09 0.09 -0.41 0.00 -0.87 0.00 0.00 58.31 57.21 3hqp n LYS 484 Cb 0.04 -0.83 -0.01 0.00 0.02 0.00 0.00 35.03 34.25 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 -2.19 2.42 0.03 3.15 1.01 -1.25 -5.04 120.40 118.53 3hqp s VAL 485 Ca -0.13 0.42 0.05 0.00 0.00 0.00 0.00 61.98 62.33 3hqp s VAL 485 Cb 0.05 -3.27 -0.02 0.00 0.00 0.00 0.00 36.38 33.14 3hqp s VAL 485 CO 0.16 0.10 -0.16 -0.54 0.00 0.00 0.00 175.10 174.66 3hqp s LYS 486 N -1.79 1.12 0.00 2.72 -0.14 -1.26 -4.73 119.74 115.66 3hqp s LYS 486 Ca 0.51 -0.74 0.00 0.00 -1.36 0.00 0.00 55.97 54.39 3hqp s LYS 486 Cb -0.43 -1.14 0.00 0.00 -1.68 0.00 0.00 37.83 34.58 3hqp s LYS 486 CO 0.56 0.29 0.00 0.41 -0.76 0.00 0.00 175.35 175.86 3hqp n GLY 487 N 2.12 2.66 3.72 -3.33 0.00 -1.26 -5.03 105.19 104.07 3hqp n GLY 487 Ca -0.17 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.57 0.21 -0.34 1.61 -0.85 -1.26 -5.09 117.35 109.05 3hqp s TYR 488 Ca 0.00 -0.66 -0.16 0.00 -0.52 0.00 0.00 57.07 55.73 3hqp s TYR 488 Cb 0.00 0.48 -0.01 0.00 0.38 0.00 0.00 41.96 42.81 3hqp s TYR 488 CO 0.00 -1.23 0.39 0.00 -1.52 0.00 0.00 175.55 173.19 3hqp s ALA 489 N -3.46 3.50 -2.58 9.51 0.00 -1.26 -4.37 121.76 123.10 3hqp s ALA 489 Ca 0.18 -1.15 0.22 0.00 0.00 0.00 0.00 51.96 51.21 3hqp s ALA 489 Cb -0.03 -2.85 0.14 0.00 0.00 0.00 0.00 23.12 20.37 3hqp s ALA 489 CO 0.10 -1.08 1.16 0.27 0.00 0.00 0.00 175.76 176.22 3hqp n ASN 490 N 5.45 2.66 -4.07 0.00 2.04 -1.23 -4.30 115.26 115.81 3hqp n ASN 490 Ca -0.08 -1.83 -0.17 0.00 -0.44 0.00 0.00 54.58 52.06 3hqp n ASN 490 Cb 0.49 0.09 -0.13 0.00 -2.53 0.00 0.00 39.78 37.70 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 -1.91 0.68 -0.01 -3.83 0.74 -0.63 -4.90 119.66 109.80 3hqp s GLN 491 Ca 0.24 -0.62 0.04 0.00 0.05 0.00 0.00 55.36 55.07 3hqp s GLN 491 Cb 0.18 -0.60 -0.01 0.00 1.10 0.00 0.00 33.01 33.68 3hqp s GLN 491 CO 0.32 0.14 -0.14 0.99 -0.55 0.00 0.00 175.29 176.05 3hqp s THR 492 N -0.86 1.09 0.00 -0.34 2.01 -1.26 -2.59 115.64 113.69 3hqp s THR 492 Ca -0.02 -0.61 0.00 0.00 0.31 0.00 0.00 61.69 61.37 3hqp s THR 492 Cb -0.07 -0.91 -0.00 0.00 0.01 0.00 0.00 72.50 71.53 3hqp s THR 492 CO 0.01 0.29 -0.00 0.00 -0.69 0.00 0.00 174.62 174.22 3hqp s ARG 493 N -0.36 0.04 -0.36 4.92 1.70 -0.41 -5.01 118.95 119.47 3hqp s ARG 493 Ca 0.05 -0.02 -0.14 0.00 -0.47 0.00 0.00 55.73 55.14 3hqp s ARG 493 Cb -0.05 -0.03 -0.00 0.00 -0.57 0.00 0.00 34.95 34.29 3hqp s ARG 493 CO -0.00 0.01 0.31 0.42 -1.08 0.00 0.00 175.30 174.95 3hqp s ILE 494 N -0.03 5.23 0.05 4.99 1.01 -1.26 -0.50 121.20 130.68 3hqp s ILE 494 Ca -0.00 -0.26 0.08 0.00 0.00 0.00 0.00 60.65 60.47 3hqp s ILE 494 Cb -0.00 -3.83 -0.03 0.00 0.01 0.00 0.00 42.46 38.61 3hqp s ILE 494 CO -0.00 -0.14 -0.21 -1.48 0.00 0.00 0.00 174.94 173.11 3hqp s LEU 495 N 1.83 2.47 -0.24 2.97 0.05 -0.86 -4.96 118.68 119.95 3hqp s LEU 495 Ca 0.08 -0.49 -0.27 0.00 0.05 0.00 0.00 54.13 53.50 3hqp s LEU 495 Cb -0.17 -1.44 0.00 0.00 -2.05 0.00 0.00 46.19 42.53 3hqp s LEU 495 CO 0.11 0.25 0.97 -0.22 -0.55 0.00 0.00 176.35 176.91 3hqp s LEU 496 N -1.41 4.09 0.21 1.48 2.96 -1.26 -1.76 118.68 122.98 3hqp s LEU 496 Ca 0.14 1.24 -0.29 0.00 -0.22 0.00 0.00 54.13 55.01 3hqp s LEU 496 Cb -0.10 -3.41 -0.08 0.00 0.50 0.00 0.00 46.19 43.09 3hqp s LEU 496 CO 0.04 -0.62 0.89 0.68 -1.32 0.00 0.00 176.35 176.02 3hqp s VAL 497 N 3.09 4.19 -2.39 1.68 -7.23 0.08 -4.91 120.40 114.91 3hqp s VAL 497 Ca 0.41 1.97 0.19 0.00 -1.81 0.00 0.00 61.98 62.74 3hqp s VAL 497 Cb -0.15 -4.27 0.15 0.00 0.56 0.00 0.00 36.38 32.67 3hqp s VAL 497 CO 0.07 0.50 1.10 -0.62 -0.31 0.00 0.00 175.10 175.84