#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 0.61 -0.20 4.33 5.75 -2.06 -1.48 115.11 122.06 3hqp h GLN 2 Ca 0.00 -0.06 -0.12 0.00 -0.15 0.00 0.00 58.65 58.32 3hqp h GLN 2 Cb 0.00 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.42 3hqp h GLN 2 CO 0.00 0.47 -0.39 1.25 -2.65 0.00 0.00 178.83 177.50 3hqp h LEU 3 N 0.58 0.47 -0.97 -2.39 6.46 -2.07 -2.54 115.31 114.84 3hqp h LEU 3 Ca 0.16 -0.20 -0.05 0.00 -0.12 0.00 0.00 57.88 57.66 3hqp h LEU 3 Cb 0.03 -0.13 -0.01 0.00 -0.73 0.00 0.00 40.66 39.82 3hqp h LEU 3 CO -0.03 0.81 -0.26 0.00 -0.62 0.00 0.00 178.44 178.35 3hqp h ALA 4 N 1.21 0.99 -0.05 1.25 0.00 -2.00 -3.18 119.26 117.48 3hqp h ALA 4 Ca 0.03 -0.24 -0.19 0.00 0.00 0.00 0.00 54.91 54.52 3hqp h ALA 4 Cb 0.85 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 3hqp h ALA 4 CO 0.07 0.33 -0.79 1.25 0.00 0.00 0.00 179.25 180.10 3hqp h HIS 5 N 0.00 0.49 0.00 0.00 -0.00 -0.86 -3.26 115.15 111.52 3hqp h HIS 5 Ca -0.00 -0.24 -0.03 0.00 -0.00 0.00 0.00 60.37 60.10 3hqp h HIS 5 Cb 0.82 -0.07 -0.00 0.00 -0.00 0.00 0.00 27.41 28.16 3hqp h HIS 5 CO 0.00 1.01 -0.15 -0.91 -0.00 0.00 0.00 177.93 177.88 3hqp h ASN 6 N 0.23 0.00 1.00 3.26 2.35 -1.47 -2.63 115.58 118.31 3hqp h ASN 6 Ca -0.04 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.63 3hqp h ASN 6 Cb 1.39 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.74 3hqp h ASN 6 CO 0.13 0.15 -0.38 -0.07 -1.65 0.00 0.00 177.43 175.61 3hqp h LEU 7 N 0.00 0.00 0.00 1.61 3.38 -1.66 -3.18 115.31 115.46 3hqp h LEU 7 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3hqp h LEU 7 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 3hqp h LEU 7 CO 0.02 0.38 -0.62 0.35 0.09 0.00 0.00 178.44 178.66 3hqp n THR 8 N -3.44 0.27 -2.33 0.22 -2.24 -1.00 -4.93 114.28 100.83 3hqp n THR 8 Ca 0.00 -0.21 -0.33 0.00 -2.27 0.00 0.00 64.05 61.24 3hqp n THR 8 Cb 0.55 -0.04 -0.02 0.00 -2.10 0.00 0.00 70.33 68.72 3hqp n THR 8 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3hqp s LEU 9 N -3.94 3.69 0.01 3.22 1.43 -1.19 -5.08 118.68 116.82 3hqp s LEU 9 Ca 0.07 1.87 -0.03 0.00 -1.03 0.00 0.00 54.13 55.00 3hqp s LEU 9 Cb 0.14 -4.55 -0.01 0.00 0.03 0.00 0.00 46.19 41.81 3hqp s LEU 9 CO 0.72 -0.94 0.05 -0.55 0.23 0.00 0.00 176.35 175.86 3hqp s SER 10 N -2.37 0.14 0.26 2.29 0.15 -1.26 -5.03 113.70 107.88 3hqp s SER 10 Ca 0.65 -0.37 0.24 0.00 0.70 0.00 0.00 55.95 57.17 3hqp s SER 10 Cb -0.16 0.15 0.39 0.00 -1.71 0.00 0.00 66.02 64.69 3hqp s SER 10 CO 0.28 -0.33 1.47 0.16 1.20 0.00 0.00 173.24 176.01 3hqp h ILE 11 N 4.47 0.00 0.00 6.45 3.07 -2.01 -3.25 117.51 126.23 3hqp h ILE 11 Ca -0.31 -0.74 0.00 0.00 1.55 0.00 0.00 64.86 65.35 3hqp h ILE 11 Cb 1.20 1.54 0.00 0.00 -0.27 0.00 0.00 36.82 39.30 3hqp h ILE 11 CO 0.41 0.00 0.00 0.49 -1.05 0.00 0.00 178.15 178.00 3hqp n PHE 12 N -2.57 0.00 -2.57 0.16 3.72 -1.26 -4.83 117.46 110.12 3hqp n PHE 12 Ca 0.03 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.01 3hqp n PHE 12 Cb 0.49 -0.36 -0.03 0.00 -0.94 0.00 0.00 39.48 38.64 3hqp n PHE 12 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3hqp s ASP 13 N -2.71 7.17 0.52 4.37 1.01 -1.23 -5.03 116.67 120.76 3hqp s ASP 13 Ca 0.20 1.73 -0.21 0.00 0.71 0.00 0.00 52.55 54.98 3hqp s ASP 13 Cb 0.17 -2.56 -0.06 0.00 1.01 0.00 0.00 42.92 41.48 3hqp s ASP 13 CO 0.42 -0.47 1.19 -2.84 0.21 0.00 0.00 175.17 173.68 3hqp s PRO 14 N 1.81 3.40 0.60 8.23 0.02 -1.26 -5.03 135.00 142.76 3hqp s PRO 14 Ca 0.53 1.81 -0.15 0.00 0.02 0.00 0.00 61.00 63.22 3hqp s PRO 14 Cb -0.23 -2.18 -0.04 0.00 0.02 0.00 0.00 34.50 32.07 3hqp s PRO 14 CO 0.23 -0.86 1.04 0.14 -0.33 0.00 0.00 177.00 177.21 3hqp s VAL 15 N -1.57 4.08 0.39 3.83 -7.23 -1.26 -5.02 120.40 113.61 3hqp s VAL 15 Ca 0.70 0.90 -0.27 0.00 -1.81 0.00 0.00 61.98 61.51 3hqp s VAL 15 Cb -0.30 -3.49 -0.09 0.00 0.56 0.00 0.00 36.38 33.06 3hqp s VAL 15 CO 0.34 -0.66 1.31 0.00 -0.31 0.00 0.00 175.10 175.78 3hqp s ALA 16 N -2.66 3.33 -1.98 1.32 0.00 -1.26 -4.88 121.76 115.63 3hqp s ALA 16 Ca 0.61 1.24 0.00 0.00 0.00 0.00 0.00 51.96 53.81 3hqp s ALA 16 Cb -0.14 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.49 3hqp s ALA 16 CO 0.40 -0.78 0.30 0.27 0.00 0.00 0.00 175.76 175.96 3hqp n ASN 17 N 0.30 0.01 -3.97 0.00 2.04 -1.26 -4.61 115.26 107.77 3hqp n ASN 17 Ca 0.03 -0.61 -0.09 0.00 -0.44 0.00 0.00 54.58 53.46 3hqp n ASN 17 Cb 0.43 -0.00 -0.11 0.00 -2.53 0.00 0.00 39.78 37.57 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 -1.98 0.24 -0.25 -2.53 -0.85 -1.26 -5.10 117.35 105.62 3hqp s TYR 18 Ca 0.00 -0.51 -0.04 0.00 -0.52 0.00 0.00 57.07 56.00 3hqp s TYR 18 Cb 0.00 -0.18 0.01 0.00 0.38 0.00 0.00 41.96 42.17 3hqp s TYR 18 CO 0.00 -0.22 -0.02 0.50 -1.52 0.00 0.00 175.55 174.30 3hqp s ARG 19 N -1.62 3.09 0.09 -3.49 3.52 -1.26 -4.99 118.95 114.30 3hqp s ARG 19 Ca -0.14 -0.82 -0.08 0.00 -0.13 0.00 0.00 55.73 54.56 3hqp s ARG 19 Cb -0.08 -3.10 -0.20 0.00 -1.56 0.00 0.00 34.95 30.00 3hqp s ARG 19 CO -0.01 -0.34 1.20 0.00 -0.81 0.00 0.00 175.30 175.34 3hqp h ALA 20 N 8.11 0.18 -2.78 6.12 0.00 -1.92 -3.44 119.26 125.54 3hqp h ALA 20 Ca -0.35 -0.77 -0.51 0.00 0.00 0.00 0.00 54.91 53.27 3hqp h ALA 20 Cb 1.13 0.03 0.05 0.00 0.00 0.00 0.00 17.79 19.00 3hqp h ALA 20 CO 0.59 0.82 0.53 0.00 0.00 0.00 0.00 179.25 181.19 3hqp s ALA 21 N -3.02 3.23 -0.07 0.00 0.00 -1.26 -0.61 121.76 120.03 3hqp s ALA 21 Ca -0.06 1.04 0.02 0.00 0.00 0.00 0.00 51.96 52.95 3hqp s ALA 21 Cb 0.07 -3.40 -0.03 0.00 0.00 0.00 0.00 23.12 19.76 3hqp s ALA 21 CO 0.89 -0.55 -0.10 1.03 0.00 0.00 0.00 175.76 177.03 3hqp s ARG 22 N -2.15 2.72 -0.18 0.00 1.81 -0.83 -4.95 118.95 115.38 3hqp s ARG 22 Ca 0.55 -0.62 -0.06 0.00 -1.72 0.00 0.00 55.73 53.88 3hqp s ARG 22 Cb -0.33 -2.51 -0.03 0.00 -0.45 0.00 0.00 34.95 31.62 3hqp s ARG 22 CO 0.42 0.60 0.02 0.42 -0.68 0.00 0.00 175.30 176.08 3hqp s ILE 23 N -0.65 4.32 -0.21 1.52 1.01 -1.26 -1.15 121.20 124.78 3hqp s ILE 23 Ca 0.10 -0.20 -0.05 0.00 0.00 0.00 0.00 60.65 60.50 3hqp s ILE 23 Cb -0.11 -2.93 -0.02 0.00 0.01 0.00 0.00 42.46 39.41 3hqp s ILE 23 CO 0.01 0.46 -0.02 -0.63 0.00 0.00 0.00 174.94 174.77 3hqp s ILE 24 N 0.54 3.72 -0.01 2.92 1.01 -0.64 -1.71 121.20 127.02 3hqp s ILE 24 Ca 0.00 -0.39 0.03 0.00 0.00 0.00 0.00 60.65 60.29 3hqp s ILE 24 Cb -0.14 -2.69 -0.03 0.00 0.01 0.00 0.00 42.46 39.62 3hqp s ILE 24 CO 0.02 0.42 -0.06 0.00 0.00 0.00 0.00 174.94 175.32 3hqp s THR 26 N -0.98 5.14 -0.10 0.00 -4.23 -1.04 0.18 115.64 114.61 3hqp s THR 26 Ca 0.17 0.07 -0.01 0.00 -1.18 0.00 0.00 61.69 60.74 3hqp s THR 26 Cb -0.11 -3.62 -0.03 0.00 1.34 0.00 0.00 72.50 70.08 3hqp s THR 26 CO 0.07 0.03 -0.05 -0.63 -0.54 0.00 0.00 174.62 173.49 3hqp s ILE 27 N -1.67 3.81 0.00 2.99 -1.09 -0.62 -3.14 121.20 121.48 3hqp s ILE 27 Ca 0.42 -0.42 0.00 0.00 -2.23 0.00 0.00 60.65 58.42 3hqp s ILE 27 Cb -0.12 -2.60 0.00 0.00 -1.58 0.00 0.00 42.46 38.16 3hqp s ILE 27 CO 0.24 0.56 0.00 0.61 -1.23 0.00 0.00 174.94 175.12 3hqp n GLY 28 N 2.72 3.95 0.86 6.18 0.00 -1.23 -4.70 105.19 112.97 3hqp n GLY 28 Ca -0.18 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.15 3hqp n GLY 28 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3hqp n PRO 29 N 0.00 0.40 0.00 1.61 -0.02 -1.05 -2.91 135.00 133.03 3hqp n PRO 29 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3hqp n PRO 29 Cb 0.00 -1.27 0.00 0.00 -0.02 0.00 0.00 33.50 32.21 3hqp n PRO 29 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 3hqp n SER 30 N 0.66 1.05 -1.45 2.55 7.64 -1.11 -4.91 113.62 118.05 3hqp n SER 30 Ca 0.00 0.00 0.02 0.00 1.01 0.00 0.00 58.87 59.90 3hqp n SER 30 Cb 0.17 0.10 0.08 0.00 -1.01 0.00 0.00 64.21 63.55 3hqp n SER 30 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 3hqp n THR 31 N -0.85 1.01 0.08 0.44 -2.24 -1.14 -4.83 114.28 106.73 3hqp n THR 31 Ca 0.00 -2.16 -0.01 0.00 -2.27 0.00 0.00 64.05 59.62 3hqp n THR 31 Cb 0.11 0.51 -0.05 0.00 -2.10 0.00 0.00 70.33 68.80 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 1.30 0.00 -7.18 -0.78 4.15 -1.89 -3.39 115.11 107.32 3hqp h GLN 32 Ca -0.11 0.00 -0.51 0.00 0.77 0.00 0.00 58.65 58.81 3hqp h GLN 32 Cb 1.53 0.00 0.09 0.00 0.21 0.00 0.00 27.48 29.31 3hqp h GLN 32 CO 0.13 0.48 0.39 -1.54 -1.93 0.00 0.00 178.83 176.36 3hqp s SER 33 N -6.19 5.30 0.52 -0.69 1.04 -1.26 -4.83 113.70 107.58 3hqp s SER 33 Ca 0.00 2.01 0.28 0.00 0.48 0.00 0.00 55.95 58.73 3hqp s SER 33 Cb 0.08 -2.55 1.42 0.00 0.10 0.00 0.00 66.02 65.07 3hqp s SER 33 CO 0.79 -1.50 2.05 1.62 0.98 0.00 0.00 173.24 177.17 3hqp h VAL 34 N 0.30 0.51 -0.04 5.02 3.04 -1.90 -2.43 116.25 120.74 3hqp h VAL 34 Ca -0.47 -0.59 -0.02 0.00 -1.01 0.00 0.00 66.70 64.61 3hqp h VAL 34 Cb 1.25 1.39 -0.00 0.00 -2.01 0.00 0.00 31.29 31.92 3hqp h VAL 34 CO 0.55 0.12 -0.04 -0.08 -1.01 0.00 0.00 177.57 177.10 3hqp h GLU 35 N 0.00 0.10 0.00 4.17 4.57 -1.95 -2.93 114.58 118.55 3hqp h GLU 35 Ca -0.00 -0.06 -0.07 0.00 -1.18 0.00 0.00 59.36 58.05 3hqp h GLU 35 Cb 0.38 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.96 3hqp h GLU 35 CO 0.02 0.57 -0.34 0.00 -1.18 0.00 0.00 179.01 178.08 3hqp h ALA 36 N 0.53 1.03 -0.02 2.92 0.00 -1.86 -3.12 119.26 118.75 3hqp h ALA 36 Ca 0.01 -0.31 -0.21 0.00 0.00 0.00 0.00 54.91 54.40 3hqp h ALA 36 Cb 0.56 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 3hqp h ALA 36 CO 0.01 0.42 -0.87 -0.07 0.00 0.00 0.00 179.25 178.74 3hqp h LEU 37 N 0.00 0.44 -1.01 0.00 3.38 -1.50 -1.79 115.31 114.83 3hqp h LEU 37 Ca -0.00 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.60 3hqp h LEU 37 Cb 0.83 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.41 3hqp h LEU 37 CO 0.04 1.13 0.33 0.11 0.09 0.00 0.00 178.44 180.14 3hqp h LYS 38 N 0.21 1.03 0.00 1.13 1.57 -1.45 -0.20 116.57 118.86 3hqp h LYS 38 Ca -0.06 -0.15 -0.15 0.00 -1.87 0.00 0.00 60.65 58.42 3hqp h LYS 38 Cb 1.49 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 33.59 3hqp h LYS 38 CO 0.15 0.81 -0.71 0.78 -0.57 0.00 0.00 179.45 179.90 3hqp h GLY 39 N 1.08 0.00 1.51 3.86 0.00 -1.56 -2.68 103.07 105.29 3hqp h GLY 39 Ca 0.25 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.38 3hqp h GLY 39 CO -0.03 0.00 -0.79 -2.00 0.00 0.00 0.00 176.54 173.72 3hqp h LEU 40 N 0.00 0.57 -0.04 3.11 5.85 -0.90 -2.42 115.31 121.48 3hqp h LEU 40 Ca -0.01 -0.39 -0.21 0.00 0.84 0.00 0.00 57.88 58.11 3hqp h LEU 40 Cb 1.41 -0.17 0.01 0.00 0.37 0.00 0.00 40.66 42.29 3hqp h LEU 40 CO 0.09 1.16 -0.78 0.40 -0.34 0.00 0.00 178.44 178.97 3hqp h ILE 41 N 0.30 1.34 0.00 4.05 2.04 -1.12 -2.43 117.51 121.69 3hqp h ILE 41 Ca -0.05 -2.08 0.00 0.00 1.00 0.00 0.00 64.86 63.73 3hqp h ILE 41 Cb 1.39 2.36 0.00 0.00 -0.74 0.00 0.00 36.82 39.83 3hqp h ILE 41 CO 0.14 0.63 0.00 0.00 0.00 0.00 0.00 178.15 178.92 3hqp n GLN 42 N -4.04 0.04 0.03 2.37 6.02 -1.01 -2.14 117.38 118.65 3hqp n GLN 42 Ca -0.10 0.18 -0.10 0.00 -0.01 0.00 0.00 57.00 56.97 3hqp n GLN 42 Cb 0.75 -1.56 -0.13 0.00 1.02 0.00 0.00 30.24 30.32 3hqp n GLN 42 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.06 176.82 3hqp h SER 43 N 0.00 0.09 0.00 1.08 0.02 -1.46 -3.48 113.55 109.80 3hqp h SER 43 Ca 0.00 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 3hqp h SER 43 Cb 0.38 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.89 3hqp h SER 43 CO 0.00 1.10 0.00 0.61 -1.14 0.00 0.00 176.83 177.40 3hqp n GLY 44 N 1.50 -0.05 3.75 -3.77 0.00 -0.91 -4.16 105.19 101.55 3hqp n GLY 44 Ca -0.10 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 4.58 -0.01 1.61 0.00 -0.92 -4.18 119.30 120.38 3hqp s MET 45 Ca 0.00 1.80 0.01 0.00 0.00 0.00 0.00 55.69 57.50 3hqp s MET 45 Cb 0.00 -3.23 -0.01 0.00 0.00 0.00 0.00 34.83 31.59 3hqp s MET 45 CO 0.00 0.09 0.00 0.43 0.00 0.00 0.00 175.02 175.54 3hqp n SER 46 N 1.88 4.61 -4.07 1.11 7.64 -0.70 -4.73 113.62 119.36 3hqp n SER 46 Ca 0.01 -0.00 -0.25 0.00 1.01 0.00 0.00 58.87 59.64 3hqp n SER 46 Cb 0.45 0.43 -0.16 0.00 -1.01 0.00 0.00 64.21 63.92 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 -2.02 1.27 -0.25 0.44 1.01 -1.16 -1.59 120.40 118.10 3hqp s VAL 47 Ca -0.01 -0.59 -0.07 0.00 0.00 0.00 0.00 61.98 61.31 3hqp s VAL 47 Cb 0.00 -1.13 -0.03 0.00 0.00 0.00 0.00 36.38 35.23 3hqp s VAL 47 CO 0.04 0.38 0.07 0.00 0.00 0.00 0.00 175.10 175.59 3hqp s ALA 48 N 0.38 3.16 0.08 5.51 0.00 0.32 -1.50 121.76 129.70 3hqp s ALA 48 Ca -0.10 -1.13 -0.12 0.00 0.00 0.00 0.00 51.96 50.60 3hqp s ALA 48 Cb -0.14 -2.08 -0.06 0.00 0.00 0.00 0.00 23.12 20.85 3hqp s ALA 48 CO 0.03 -0.49 0.44 0.50 0.00 0.00 0.00 175.76 176.24 3hqp s ARG 49 N 1.61 3.86 -0.21 0.00 3.52 0.13 -1.49 118.95 126.37 3hqp s ARG 49 Ca 0.06 0.32 0.01 0.00 -0.13 0.00 0.00 55.73 56.00 3hqp s ARG 49 Cb -0.15 -3.04 0.05 0.00 -1.56 0.00 0.00 34.95 30.25 3hqp s ARG 49 CO 0.04 0.57 -0.09 -1.64 -0.81 0.00 0.00 175.30 173.37 3hqp s MET 50 N -1.70 1.95 -0.65 5.12 -1.94 -0.68 -1.59 119.30 119.81 3hqp s MET 50 Ca 0.32 -0.93 -0.26 0.00 -1.71 0.00 0.00 55.69 53.11 3hqp s MET 50 Cb -0.15 -2.50 0.04 0.00 2.01 0.00 0.00 34.83 34.23 3hqp s MET 50 CO 0.17 -0.48 1.16 1.21 -0.01 0.00 0.00 175.02 177.07 3hqp s ASN 51 N 1.37 6.27 0.00 3.03 3.84 -1.26 -1.11 114.94 127.08 3hqp s ASN 51 Ca -0.03 -0.35 0.00 0.00 0.21 0.00 0.00 52.86 52.69 3hqp s ASN 51 Cb -0.17 -2.52 0.00 0.00 -0.55 0.00 0.00 41.25 38.01 3hqp s ASN 51 CO -0.07 -1.58 0.64 0.49 -2.79 0.00 0.00 177.10 173.78 3hqp n PHE 52 N 8.57 0.00 0.60 0.43 3.01 -0.33 -1.38 117.46 128.35 3hqp n PHE 52 Ca 0.03 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.61 3hqp n PHE 52 Cb 0.48 -0.05 0.05 0.00 -0.01 0.00 0.00 39.48 39.95 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 -0.19 0.62 -4.34 4.37 7.64 -1.26 -4.48 113.62 115.98 3hqp n SER 53 Ca 0.00 -0.19 -0.28 0.00 1.01 0.00 0.00 58.87 59.40 3hqp n SER 53 Cb 0.12 0.71 -0.14 0.00 -1.01 0.00 0.00 64.21 63.89 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 -3.18 2.18 0.00 1.43 3.76 -0.48 -5.04 115.29 113.96 3hqp s HIS 54 Ca 0.04 -0.40 0.00 0.00 -0.15 0.00 0.00 55.06 54.56 3hqp s HIS 54 Cb 0.14 -1.25 0.00 0.00 1.11 0.00 0.00 32.58 32.58 3hqp s HIS 54 CO 0.79 0.19 0.00 0.41 -0.85 0.00 0.00 174.74 175.28 3hqp n GLY 55 N 1.45 0.47 1.74 -2.22 0.00 -1.26 -4.85 105.19 100.52 3hqp n GLY 55 Ca -0.18 -0.91 -0.08 0.00 0.00 0.00 0.00 46.02 44.86 3hqp n GLY 55 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3hqp n SER 56 N 3.37 -0.66 0.02 1.61 3.41 -1.26 -5.02 113.62 115.09 3hqp n SER 56 Ca 0.00 -2.01 -0.02 0.00 -0.26 0.00 0.00 58.87 56.58 3hqp n SER 56 Cb 0.00 1.26 0.24 0.00 -0.26 0.00 0.00 64.21 65.44 3hqp n SER 56 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 175.04 175.33 3hqp h HIS 57 N 1.53 0.51 0.03 7.33 -0.00 -1.99 -3.05 115.15 119.51 3hqp h HIS 57 Ca -0.14 -0.09 -0.24 0.00 -0.00 0.00 0.00 60.37 59.90 3hqp h HIS 57 Cb 0.62 -0.13 0.01 0.00 -0.00 0.00 0.00 27.41 27.90 3hqp h HIS 57 CO 0.00 0.63 -1.01 1.49 -0.00 0.00 0.00 177.93 179.03 3hqp h GLU 58 N 0.42 0.42 -0.18 2.45 4.81 -1.99 -2.64 114.58 117.87 3hqp h GLU 58 Ca 0.07 -0.49 -0.03 0.00 -0.13 0.00 0.00 59.36 58.79 3hqp h GLU 58 Cb 0.56 0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.09 3hqp h GLU 58 CO 0.04 1.15 -0.00 -0.92 -0.73 0.00 0.00 179.01 178.55 3hqp h TYR 59 N 0.22 0.34 0.00 0.92 3.20 -1.95 -2.96 116.97 116.73 3hqp h TYR 59 Ca -0.10 -0.06 -0.04 0.00 3.14 0.00 0.00 58.73 61.67 3hqp h TYR 59 Cb 1.67 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 39.84 3hqp h TYR 59 CO 0.07 0.53 -0.20 0.45 -1.64 0.00 0.00 178.16 177.36 3hqp h HIS 60 N 0.06 0.00 -0.66 -3.82 3.86 -1.62 -2.75 115.15 110.22 3hqp h HIS 60 Ca 0.05 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.24 3hqp h HIS 60 Cb 0.39 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.83 3hqp h HIS 60 CO 0.04 0.20 0.35 0.37 0.86 0.00 0.00 177.93 179.74 3hqp h GLN 61 N 0.00 0.94 -0.32 2.45 5.75 -1.31 -1.88 115.11 120.74 3hqp h GLN 61 Ca -0.00 -0.12 -0.07 0.00 -0.15 0.00 0.00 58.65 58.30 3hqp h GLN 61 Cb 0.44 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.80 3hqp h GLN 61 CO 0.03 0.72 -0.11 1.15 -2.65 0.00 0.00 178.83 177.97 3hqp h THR 62 N 0.91 1.23 -0.35 2.39 2.02 -1.36 -2.66 112.91 115.09 3hqp h THR 62 Ca 0.23 -1.03 -0.05 0.00 0.77 0.00 0.00 66.41 66.33 3hqp h THR 62 Cb 0.07 1.11 -0.01 0.00 -1.74 0.00 0.00 68.15 67.58 3hqp h THR 62 CO -0.03 0.34 0.02 0.74 0.37 0.00 0.00 175.52 176.96 3hqp h THR 63 N 0.50 1.25 -0.69 3.16 2.02 -1.39 -1.07 112.91 116.69 3hqp h THR 63 Ca 0.09 -0.92 0.05 0.00 0.77 0.00 0.00 66.41 66.40 3hqp h THR 63 Cb 0.50 1.16 -0.05 0.00 -1.74 0.00 0.00 68.15 68.02 3hqp h THR 63 CO 0.03 0.31 0.41 0.40 0.37 0.00 0.00 175.52 177.03 3hqp h ILE 64 N 0.43 1.03 -0.38 3.11 2.04 -1.18 -1.67 117.51 120.88 3hqp h ILE 64 Ca 0.10 -0.26 -0.14 0.00 1.00 0.00 0.00 64.86 65.56 3hqp h ILE 64 Cb 0.42 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.68 3hqp h ILE 64 CO 0.01 0.14 -0.31 0.78 0.00 0.00 0.00 178.15 178.78 3hqp h ASN 65 N 0.77 0.93 0.73 1.72 4.21 -1.38 -3.07 115.58 119.49 3hqp h ASN 65 Ca 0.29 -0.45 -0.06 0.00 1.21 0.00 0.00 56.30 57.29 3hqp h ASN 65 Cb 0.12 -0.26 -0.01 0.00 -1.12 0.00 0.00 38.32 37.05 3hqp h ASN 65 CO -0.15 1.18 -0.31 0.78 -1.29 0.00 0.00 177.43 177.64 3hqp h ASN 66 N 0.69 0.00 -0.01 5.81 2.35 -0.96 -2.61 115.58 120.85 3hqp h ASN 66 Ca 0.07 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.79 3hqp h ASN 66 Cb 0.89 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.26 3hqp h ASN 66 CO 0.08 0.31 -0.13 0.58 -1.65 0.00 0.00 177.43 176.62 3hqp h VAL 67 N 0.00 1.56 -0.01 2.81 2.07 -1.32 -2.68 116.25 118.69 3hqp h VAL 67 Ca -0.00 -1.84 -0.07 0.00 0.82 0.00 0.00 66.70 65.61 3hqp h VAL 67 Cb 0.76 2.75 -0.01 0.00 -1.52 0.00 0.00 31.29 33.27 3hqp h VAL 67 CO 0.04 0.49 -0.31 0.03 0.02 0.00 0.00 177.57 177.84 3hqp h ARG 68 N -0.60 0.02 -0.31 1.57 3.08 -1.56 0.74 114.38 117.32 3hqp h ARG 68 Ca -0.01 -0.01 -0.12 0.00 0.07 0.00 0.00 59.98 59.91 3hqp h ARG 68 Cb 0.87 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.92 3hqp h ARG 68 CO 0.03 0.33 -0.28 0.37 -1.07 0.00 0.00 179.97 179.34 3hqp h GLN 69 N 0.02 0.74 -0.31 0.04 4.15 -1.56 -1.68 115.11 116.51 3hqp h GLN 69 Ca -0.00 -0.38 -0.12 0.00 0.77 0.00 0.00 58.65 58.92 3hqp h GLN 69 Cb 0.57 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.25 3hqp h GLN 69 CO 0.04 1.00 -0.31 0.00 -1.93 0.00 0.00 178.83 177.64 3hqp h ALA 70 N 0.73 0.88 -0.10 3.38 0.00 -1.08 -2.46 119.26 120.60 3hqp h ALA 70 Ca 0.05 -0.40 -0.13 0.00 0.00 0.00 0.00 54.91 54.44 3hqp h ALA 70 Cb 0.85 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 3hqp h ALA 70 CO 0.07 0.63 -0.50 0.00 0.00 0.00 0.00 179.25 179.45 3hqp h ALA 71 N 1.10 0.96 0.01 0.00 0.00 -0.86 -3.02 119.26 117.44 3hqp h ALA 71 Ca 0.07 -0.48 -0.21 0.00 0.00 0.00 0.00 54.91 54.29 3hqp h ALA 71 Cb 0.81 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 3hqp h ALA 71 CO 0.07 0.66 -0.91 0.00 0.00 0.00 0.00 179.25 179.06 3hqp h ALA 72 N 1.26 0.45 -0.46 0.00 0.00 -1.22 -0.78 119.26 118.51 3hqp h ALA 72 Ca 0.01 -0.72 -0.13 0.00 0.00 0.00 0.00 54.91 54.07 3hqp h ALA 72 Cb 0.96 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 3hqp h ALA 72 CO 0.08 0.88 -0.22 0.93 0.00 0.00 0.00 179.25 180.93 3hqp h GLU 73 N 0.15 0.93 0.18 0.00 5.08 -1.43 -3.28 114.58 116.20 3hqp h GLU 73 Ca -0.06 -0.39 -0.36 0.00 -1.00 0.00 0.00 59.36 57.56 3hqp h GLU 73 Cb 1.55 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 30.77 3hqp h GLU 73 CO 0.15 1.05 -1.80 -0.07 -1.00 0.00 0.00 179.01 177.34 3hqp h LEU 74 N 0.80 0.59 0.00 1.33 3.38 -1.61 -3.50 115.31 116.31 3hqp h LEU 74 Ca 0.11 -0.94 0.00 0.00 0.09 0.00 0.00 57.88 57.13 3hqp h LEU 74 Cb 0.78 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.33 3hqp h LEU 74 CO 0.06 1.81 0.00 0.61 0.09 0.00 0.00 178.44 181.01 3hqp n GLY 75 N 1.89 0.62 3.07 0.83 0.00 -0.39 -5.12 105.19 106.08 3hqp n GLY 75 Ca -0.26 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.19 0.42 -0.45 1.61 -7.23 -0.62 -5.05 120.40 107.89 3hqp s VAL 76 Ca 0.00 -1.35 -0.18 0.00 -1.81 0.00 0.00 61.98 58.65 3hqp s VAL 76 Cb 0.00 -0.91 0.04 0.00 0.56 0.00 0.00 36.38 36.07 3hqp s VAL 76 CO 0.00 -0.62 0.49 0.20 -0.31 0.00 0.00 175.10 174.86 3hqp s ASN 77 N -2.09 6.20 -0.16 4.85 0.01 -1.26 -4.57 114.94 117.92 3hqp s ASN 77 Ca -0.04 -0.79 -0.03 0.00 -0.71 0.00 0.00 52.86 51.29 3hqp s ASN 77 Cb -0.04 -2.24 -0.02 0.00 0.41 0.00 0.00 41.25 39.36 3hqp s ASN 77 CO -0.03 -0.68 -0.05 -0.63 -1.51 0.00 0.00 177.10 174.21 3hqp s ILE 78 N 2.23 3.72 0.39 0.60 -1.09 -1.26 -4.67 121.20 121.12 3hqp s ILE 78 Ca 0.12 -0.41 -0.25 0.00 -2.23 0.00 0.00 60.65 57.88 3hqp s ILE 78 Cb -0.18 -2.63 -0.09 0.00 -1.58 0.00 0.00 42.46 37.98 3hqp s ILE 78 CO 0.13 0.49 1.08 0.00 -1.23 0.00 0.00 174.94 175.40 3hqp s ALA 79 N 0.52 3.13 -0.11 9.38 0.00 -0.62 -4.92 121.76 129.13 3hqp s ALA 79 Ca -0.04 0.78 0.03 0.00 0.00 0.00 0.00 51.96 52.72 3hqp s ALA 79 Cb -0.15 -3.30 -0.00 0.00 0.00 0.00 0.00 23.12 19.67 3hqp s ALA 79 CO 0.03 -0.28 -0.21 0.42 0.00 0.00 0.00 175.76 175.72 3hqp s ILE 80 N -1.55 2.31 0.01 0.00 1.01 -1.26 -0.52 121.20 121.19 3hqp s ILE 80 Ca 0.56 -0.93 0.06 0.00 0.00 0.00 0.00 60.65 60.35 3hqp s ILE 80 Cb -0.25 -1.91 -0.02 0.00 0.01 0.00 0.00 42.46 40.29 3hqp s ILE 80 CO 0.31 0.55 -0.19 0.00 0.00 0.00 0.00 174.94 175.61 3hqp s ALA 81 N 0.42 1.60 -0.30 9.38 0.00 -0.56 -1.57 121.76 130.73 3hqp s ALA 81 Ca -0.15 -0.90 -0.07 0.00 0.00 0.00 0.00 51.96 50.84 3hqp s ALA 81 Cb -0.17 -0.36 0.01 0.00 0.00 0.00 0.00 23.12 22.60 3hqp s ALA 81 CO 0.07 0.37 0.09 -1.17 0.00 0.00 0.00 175.76 175.12 3hqp s LEU 82 N -0.78 3.93 -0.70 0.00 0.20 -0.78 -1.69 118.68 118.87 3hqp s LEU 82 Ca 0.07 -0.78 -0.20 0.00 0.69 0.00 0.00 54.13 53.91 3hqp s LEU 82 Cb -0.08 -1.88 0.10 0.00 -0.43 0.00 0.00 46.19 43.91 3hqp s LEU 82 CO 0.00 -0.22 0.88 -0.62 -0.29 0.00 0.00 176.35 176.11 3hqp s ASP 83 N 1.48 6.30 0.66 3.68 -1.08 -0.27 0.01 116.67 127.46 3hqp s ASP 83 Ca 0.02 -1.48 -0.17 0.00 -0.52 0.00 0.00 52.55 50.41 3hqp s ASP 83 Cb -0.18 -2.36 0.00 0.00 -1.46 0.00 0.00 42.92 38.93 3hqp s ASP 83 CO 0.03 -1.19 1.20 -0.89 0.52 0.00 0.00 175.17 174.83 3hqp s THR 84 N 3.02 2.57 0.11 1.71 2.01 -1.15 -1.18 115.64 122.72 3hqp s THR 84 Ca 0.20 0.31 -0.21 0.00 0.31 0.00 0.00 61.69 62.29 3hqp s THR 84 Cb -0.17 -2.97 -0.10 0.00 0.01 0.00 0.00 72.50 69.27 3hqp s THR 84 CO 0.04 -0.12 1.75 0.11 -0.69 0.00 0.00 174.62 175.71 3hqp h LYS 85 N 0.28 0.11 0.00 4.92 1.57 -1.91 -3.33 116.57 118.20 3hqp h LYS 85 Ca -0.49 -0.01 0.13 0.00 -1.87 0.00 0.00 60.65 58.42 3hqp h LYS 85 Cb 1.29 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 33.54 3hqp h LYS 85 CO 0.53 0.07 -0.17 0.41 -0.57 0.00 0.00 179.45 179.72 3hqp n GLY 86 N -1.12 -1.86 3.26 3.86 0.00 -1.26 -4.15 105.19 103.92 3hqp n GLY 86 Ca -0.05 -1.28 -0.40 0.00 0.00 0.00 0.00 46.02 44.29 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 -2.10 1.30 -4.16 1.61 -0.04 -1.26 -4.89 135.00 125.46 3hqp n PRO 87 Ca 0.00 -1.87 -0.23 0.00 -0.04 0.00 0.00 63.50 61.37 3hqp n PRO 87 Cb 0.22 -3.07 -0.06 0.00 -0.04 0.00 0.00 33.50 30.55 3hqp n PRO 87 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 3hqp s GLU 88 N 5.65 2.52 -0.09 0.54 -1.05 -1.26 -4.96 118.70 120.05 3hqp s GLU 88 Ca 0.62 -1.34 0.04 0.00 -0.15 0.00 0.00 54.97 54.13 3hqp s GLU 88 Cb 0.11 -2.30 0.00 0.00 -0.44 0.00 0.00 34.13 31.50 3hqp s GLU 88 CO 0.15 0.29 -0.21 0.42 0.95 0.00 0.00 175.26 176.86 3hqp s ILE 89 N -2.30 1.80 0.39 1.83 1.01 -1.26 -5.01 121.20 117.66 3hqp s ILE 89 Ca 0.34 -0.87 0.04 0.00 0.00 0.00 0.00 60.65 60.16 3hqp s ILE 89 Cb -0.06 -1.57 -0.05 0.00 0.01 0.00 0.00 42.46 40.80 3hqp s ILE 89 CO 0.22 0.50 0.06 -0.13 0.00 0.00 0.00 174.94 175.60 3hqp s ARG 90 N 0.42 1.86 0.00 2.79 1.81 -1.26 -1.54 118.95 123.03 3hqp s ARG 90 Ca -0.17 -2.09 0.00 0.00 -1.72 0.00 0.00 55.73 51.74 3hqp s ARG 90 Cb -0.17 -1.03 0.00 0.00 -0.45 0.00 0.00 34.95 33.30 3hqp s ARG 90 CO 0.07 -0.27 0.00 0.25 -0.68 0.00 0.00 175.30 174.68 3hqp n THR 91 N -0.88 0.00 -2.53 0.02 -2.24 -0.62 -1.50 114.28 106.53 3hqp n THR 91 Ca -0.06 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 3hqp n THR 91 Cb 0.66 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.89 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 5.00 6.44 3.84 3.38 0.00 -0.95 -4.41 105.19 118.48 3hqp n GLY 92 Ca 0.00 -1.87 -0.32 0.00 0.00 0.00 0.00 46.02 43.82 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 1.47 3.20 -0.05 1.61 -0.21 -0.72 -0.03 119.66 124.93 3hqp s GLN 93 Ca 0.00 -0.47 0.05 0.00 0.02 0.00 0.00 55.36 54.96 3hqp s GLN 93 Cb 0.00 -2.93 -0.02 0.00 1.00 0.00 0.00 33.01 31.06 3hqp s GLN 93 CO 0.00 0.64 -0.19 -0.06 -2.12 0.00 0.00 175.29 173.55 3hqp s PHE 94 N -1.31 2.56 -0.08 0.91 0.08 -1.26 -3.54 117.98 115.34 3hqp s PHE 94 Ca 0.27 -0.39 -0.30 0.00 0.12 0.00 0.00 56.93 56.64 3hqp s PHE 94 Cb -0.12 -1.61 -0.04 0.00 -0.57 0.00 0.00 43.02 40.68 3hqp s PHE 94 CO 0.19 0.01 1.43 0.08 -0.10 0.00 0.00 175.22 176.83 3hqp s VAL 95 N -0.49 3.89 0.00 -0.44 1.01 -1.12 -2.52 120.40 120.73 3hqp s VAL 95 Ca 0.06 1.14 0.00 0.00 0.00 0.00 0.00 61.98 63.18 3hqp s VAL 95 Cb -0.12 -3.74 0.00 0.00 0.00 0.00 0.00 36.38 32.53 3hqp s VAL 95 CO 0.01 -0.07 0.00 0.61 0.00 0.00 0.00 175.10 175.65 3hqp n GLY 96 N 3.79 2.74 0.00 4.51 0.00 -1.26 -4.43 105.19 110.54 3hqp n GLY 96 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 3hqp n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hqp n GLY 97 N -0.02 2.26 3.31 -0.02 0.00 -1.05 -5.09 105.19 104.58 3hqp n GLY 97 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 3hqp n GLY 97 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3hqp s ASP 98 N -1.94 -0.22 -0.12 1.61 -4.77 -1.26 -3.68 116.67 106.29 3hqp s ASP 98 Ca 0.00 -0.24 0.03 0.00 -3.30 0.00 0.00 52.55 49.04 3hqp s ASP 98 Cb 0.00 0.44 0.00 0.00 -1.09 0.00 0.00 42.92 42.27 3hqp s ASP 98 CO 0.00 -0.77 -0.22 0.00 0.70 0.00 0.00 175.17 174.87 3hqp s ALA 99 N -3.33 2.24 -0.75 2.11 0.00 0.05 -4.78 121.76 117.29 3hqp s ALA 99 Ca 0.00 -1.01 -0.20 0.00 0.00 0.00 0.00 51.96 50.75 3hqp s ALA 99 Cb 0.01 -0.91 0.11 0.00 0.00 0.00 0.00 23.12 22.32 3hqp s ALA 99 CO -0.09 0.17 0.96 0.08 0.00 0.00 0.00 175.76 176.88 3hqp s VAL 100 N 0.52 4.64 -0.33 0.00 1.01 -1.26 -1.69 120.40 123.29 3hqp s VAL 100 Ca -0.14 -1.04 -0.25 0.00 0.00 0.00 0.00 61.98 60.55 3hqp s VAL 100 Cb -0.17 -4.67 0.01 0.00 0.00 0.00 0.00 36.38 31.55 3hqp s VAL 100 CO 0.05 -1.38 0.86 -0.04 0.00 0.00 0.00 175.10 174.59 3hqp s MET 101 N 3.08 3.94 -0.08 2.72 -1.94 -1.11 -4.83 119.30 121.07 3hqp s MET 101 Ca 0.23 0.64 -0.14 0.00 -1.71 0.00 0.00 55.69 54.72 3hqp s MET 101 Cb -0.14 -3.75 -0.05 0.00 2.01 0.00 0.00 34.83 32.90 3hqp s MET 101 CO 0.01 -0.78 0.35 -1.21 -0.01 0.00 0.00 175.02 173.37 3hqp s GLU 102 N 3.18 4.01 0.05 2.03 2.02 -1.26 -2.31 118.70 126.42 3hqp s GLU 102 Ca 0.36 0.25 -0.31 0.00 0.02 0.00 0.00 54.97 55.29 3hqp s GLU 102 Cb -0.13 -3.31 -0.06 0.00 0.10 0.00 0.00 34.13 30.73 3hqp s GLU 102 CO 0.14 0.50 1.30 0.50 0.02 0.00 0.00 175.26 177.72 3hqp s ARG 103 N -0.38 4.36 0.00 1.61 3.52 -1.26 -3.87 118.95 122.92 3hqp s ARG 103 Ca 0.21 1.89 0.00 0.00 -0.13 0.00 0.00 55.73 57.70 3hqp s ARG 103 Cb -0.15 -3.39 0.00 0.00 -1.56 0.00 0.00 34.95 29.85 3hqp s ARG 103 CO 0.09 -0.40 0.00 0.41 -0.81 0.00 0.00 175.30 174.59 3hqp n GLY 104 N 3.41 2.94 3.75 8.12 0.00 -1.08 -4.96 105.19 117.36 3hqp n GLY 104 Ca 0.11 -0.81 -0.41 0.00 0.00 0.00 0.00 46.02 44.91 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 0.00 3.44 0.20 4.61 0.00 -1.25 -4.70 121.76 124.05 3hqp s ALA 105 Ca 0.00 0.99 -0.30 0.00 0.00 0.00 0.00 51.96 52.65 3hqp s ALA 105 Cb 0.00 -3.40 -0.08 0.00 0.00 0.00 0.00 23.12 19.64 3hqp s ALA 105 CO 0.00 -0.35 0.99 -0.08 0.00 0.00 0.00 175.76 176.32 3hqp s THR 106 N -0.56 4.09 0.53 0.00 -1.32 -1.26 -3.95 115.64 113.17 3hqp s THR 106 Ca 0.50 1.93 0.04 0.00 -1.21 0.00 0.00 61.69 62.95 3hqp s THR 106 Cb -0.34 -4.23 0.02 0.00 -1.51 0.00 0.00 72.50 66.45 3hqp s THR 106 CO 0.40 0.39 0.28 0.00 -2.21 0.00 0.00 174.62 173.48 3hqp s TYR 108 N -2.81 0.39 -0.07 0.00 2.02 0.53 -2.05 117.35 115.36 3hqp s TYR 108 Ca 0.25 -0.06 0.04 0.00 -0.37 0.00 0.00 57.07 56.92 3hqp s TYR 108 Cb -0.01 -0.34 -0.02 0.00 -0.40 0.00 0.00 41.96 41.19 3hqp s TYR 108 CO 0.15 -0.07 -0.19 0.14 -1.57 0.00 0.00 175.55 174.01 3hqp s VAL 109 N 0.38 2.59 -0.00 0.71 -7.23 -0.99 -2.12 120.40 113.73 3hqp s VAL 109 Ca -0.04 -0.87 0.06 0.00 -1.81 0.00 0.00 61.98 59.32 3hqp s VAL 109 Cb -0.07 -2.00 -0.02 0.00 0.56 0.00 0.00 36.38 34.85 3hqp s VAL 109 CO -0.01 0.57 -0.20 0.28 -0.31 0.00 0.00 175.10 175.43 3hqp s THR 110 N -0.22 1.61 0.02 5.32 -1.32 -0.89 -1.24 115.64 118.92 3hqp s THR 110 Ca -0.01 -0.93 0.10 0.00 -1.21 0.00 0.00 61.69 59.64 3hqp s THR 110 Cb -0.13 -1.35 -0.11 0.00 -1.51 0.00 0.00 72.50 69.40 3hqp s THR 110 CO 0.03 0.40 1.34 0.74 -2.21 0.00 0.00 174.62 174.93 3hqp h THR 111 N 4.58 1.42 -2.10 5.08 2.02 -0.89 -3.00 112.91 120.02 3hqp h THR 111 Ca -0.39 -3.00 -0.59 0.00 0.77 0.00 0.00 66.41 63.20 3hqp h THR 111 Cb 1.14 2.70 0.02 0.00 -1.74 0.00 0.00 68.15 70.27 3hqp h THR 111 CO 0.47 0.81 1.18 -0.67 0.37 0.00 0.00 175.52 177.68 3hqp n ASP 112 N -3.31 3.64 0.00 4.18 4.64 -1.26 -4.87 116.55 119.57 3hqp n ASP 112 Ca 0.01 0.88 0.10 0.00 -1.38 0.00 0.00 54.79 54.40 3hqp n ASP 112 Cb 0.87 -1.43 0.60 0.00 -1.04 0.00 0.00 41.12 40.12 3hqp n ASP 112 CO 0.00 0.00 0.00 -2.65 -0.82 0.00 0.00 177.20 173.73 3hqp n PRO 113 N 7.14 0.70 0.23 -0.67 -0.02 -1.26 -3.31 135.00 137.80 3hqp n PRO 113 Ca 0.23 0.00 0.15 0.00 -2.02 0.00 0.00 63.50 61.86 3hqp n PRO 113 Cb 0.34 -1.45 0.58 0.00 -0.02 0.00 0.00 33.50 32.95 3hqp n PRO 113 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hqp h ALA 114 N 3.30 1.00 -0.84 3.55 0.00 -1.98 -3.00 119.26 121.29 3hqp h ALA 114 Ca 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.39 3hqp h ALA 114 Cb 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 17.79 17.54 3hqp h ALA 114 CO 0.00 0.00 0.66 1.19 0.00 0.00 0.00 179.25 181.10 3hqp n PHE 115 N -2.83 2.66 0.01 0.00 3.01 -1.21 -4.60 117.46 114.49 3hqp n PHE 115 Ca 0.01 -2.28 -0.18 0.00 1.01 0.00 0.00 57.45 56.01 3hqp n PHE 115 Cb 0.31 -1.12 -0.10 0.00 -0.01 0.00 0.00 39.48 38.56 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 1.57 0.15 0.00 4.37 0.00 -1.81 -3.37 119.26 120.17 3hqp h ALA 116 Ca 0.52 -0.60 -0.36 0.00 0.00 0.00 0.00 54.91 54.47 3hqp h ALA 116 Cb 1.52 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 19.27 3hqp h ALA 116 CO 1.18 0.52 -2.29 -0.40 0.00 0.00 0.00 179.25 178.26 3hqp n ASP 117 N -4.06 0.12 -4.59 0.00 5.75 -1.26 -1.76 116.55 110.76 3hqp n ASP 117 Ca -0.10 0.06 -0.35 0.00 -0.01 0.00 0.00 54.79 54.39 3hqp n ASP 117 Cb 0.74 0.86 -0.10 0.00 -1.03 0.00 0.00 41.12 41.59 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 -2.52 3.91 -0.30 0.11 1.02 -1.26 -4.43 119.74 116.27 3hqp s LYS 118 Ca -0.09 -0.36 -0.20 0.00 0.02 0.00 0.00 55.97 55.33 3hqp s LYS 118 Cb 0.06 -3.32 0.20 0.00 -0.52 0.00 0.00 37.83 34.26 3hqp s LYS 118 CO 0.83 0.10 1.33 0.20 -0.92 0.00 0.00 175.35 176.89 3hqp s GLY 119 N 0.86 0.50 0.00 -3.33 0.00 -1.23 -4.64 107.32 99.49 3hqp s GLY 119 Ca 0.05 3.69 0.00 0.00 0.00 0.00 0.00 44.72 48.46 3hqp s GLY 119 CO 0.03 2.41 0.00 -1.30 0.00 0.00 0.00 173.10 174.23 3hqp n THR 120 N 2.45 0.00 0.26 0.90 -2.24 -1.06 -2.80 114.28 111.79 3hqp n THR 120 Ca -0.14 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 61.78 3hqp n THR 120 Cb 0.57 0.00 0.70 0.00 -2.10 0.00 0.00 70.33 69.49 3hqp n THR 120 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 3hqp h LYS 121 N 0.00 0.00 0.03 -0.78 2.10 -1.94 -3.24 116.57 112.74 3hqp h LYS 121 Ca 0.00 0.00 -0.33 0.00 -2.00 0.00 0.00 60.65 58.32 3hqp h LYS 121 Cb 0.00 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 31.28 3hqp h LYS 121 CO 0.00 0.11 -1.99 -0.25 -2.00 0.00 0.00 179.45 175.32 3hqp n ASP 122 N -3.41 1.03 -3.47 7.07 8.00 -1.26 -4.68 116.55 119.83 3hqp n ASP 122 Ca -0.01 0.23 -0.15 0.00 0.71 0.00 0.00 54.79 55.57 3hqp n ASP 122 Cb 0.28 -0.02 -0.12 0.00 -0.02 0.00 0.00 41.12 41.25 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 -2.56 0.23 0.30 -1.24 2.20 -1.22 -0.35 119.74 117.10 3hqp s LYS 123 Ca -0.12 0.34 0.02 0.00 -0.36 0.00 0.00 55.97 55.86 3hqp s LYS 123 Cb 0.07 -0.91 -0.05 0.00 -1.51 0.00 0.00 37.83 35.44 3hqp s LYS 123 CO 0.80 -0.62 0.11 -0.59 -0.36 0.00 0.00 175.35 174.68 3hqp s PHE 124 N 2.40 1.65 -0.01 4.03 -0.71 -0.90 -2.57 117.98 121.86 3hqp s PHE 124 Ca 0.08 -1.21 0.00 0.00 -1.04 0.00 0.00 56.93 54.77 3hqp s PHE 124 Cb -0.15 -0.98 -0.04 0.00 -1.21 0.00 0.00 43.02 40.64 3hqp s PHE 124 CO -0.13 -0.33 0.04 -0.47 -1.34 0.00 0.00 175.22 173.00 3hqp s TYR 125 N -3.59 3.20 -0.11 3.49 5.04 -1.26 -2.10 117.35 122.03 3hqp s TYR 125 Ca 0.36 0.16 -0.00 0.00 -2.44 0.00 0.00 57.07 55.15 3hqp s TYR 125 Cb 0.07 -1.72 0.02 0.00 0.35 0.00 0.00 41.96 40.68 3hqp s TYR 125 CO 0.15 0.51 -0.08 0.42 -1.34 0.00 0.00 175.55 175.22 3hqp s ILE 126 N -1.12 1.01 -0.24 3.14 1.01 -1.14 -2.23 121.20 121.63 3hqp s ILE 126 Ca 0.21 -0.29 -0.03 0.00 0.00 0.00 0.00 60.65 60.53 3hqp s ILE 126 Cb -0.12 -1.02 -0.00 0.00 0.01 0.00 0.00 42.46 41.33 3hqp s ILE 126 CO 0.11 0.36 2.74 -0.90 0.00 0.00 0.00 174.94 177.25 3hqp n ASP 127 N 4.83 5.99 -4.85 3.58 5.68 -0.56 -4.62 116.55 126.60 3hqp n ASP 127 Ca -0.13 -2.87 -0.32 0.00 -0.50 0.00 0.00 54.79 50.96 3hqp n ASP 127 Cb 0.50 -1.23 -0.06 0.00 -1.14 0.00 0.00 41.12 39.20 3hqp n ASP 127 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 3hqp s TYR 128 N -0.77 3.39 0.10 2.11 5.04 -1.26 -4.73 117.35 121.24 3hqp s TYR 128 Ca 0.47 0.23 -0.26 0.00 -2.44 0.00 0.00 57.07 55.07 3hqp s TYR 128 Cb 0.28 -1.74 -0.11 0.00 0.35 0.00 0.00 41.96 40.75 3hqp s TYR 128 CO -0.08 0.58 1.67 1.96 -1.34 0.00 0.00 175.55 178.33 3hqp h GLN 129 N 3.58 -0.36 -1.48 4.97 1.08 -1.94 -3.38 115.11 117.57 3hqp h GLN 129 Ca -0.47 0.02 -0.46 0.00 -1.45 0.00 0.00 58.65 56.29 3hqp h GLN 129 Cb 1.17 0.08 -0.33 0.00 -0.05 0.00 0.00 27.48 28.36 3hqp h GLN 129 CO 0.68 -0.24 -0.95 0.27 -0.95 0.00 0.00 178.83 177.64 3hqp n ASN 130 N -5.31 -0.55 0.16 1.46 6.94 -1.26 -4.95 115.26 111.75 3hqp n ASN 130 Ca -0.07 -2.90 0.03 0.00 -0.02 0.00 0.00 54.58 51.62 3hqp n ASN 130 Cb 0.22 0.01 0.24 0.00 -2.36 0.00 0.00 39.78 37.89 3hqp n ASN 130 CO 0.00 0.00 0.00 0.17 -1.03 0.00 0.00 177.26 176.40 3hqp h LEU 131 N 3.87 0.00 -1.45 -4.53 -0.00 -1.96 -2.87 115.31 108.37 3hqp h LEU 131 Ca 0.02 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.88 3hqp h LEU 131 Cb 0.93 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.59 3hqp h LEU 131 CO 0.42 0.49 -0.10 0.28 -0.00 0.00 0.00 178.44 179.53 3hqp h SER 132 N 0.00 0.00 -0.01 0.17 0.02 -1.89 -1.55 113.55 110.28 3hqp h SER 132 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3hqp h SER 132 Cb 1.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.58 3hqp h SER 132 CO 0.06 0.10 -0.02 0.29 -1.14 0.00 0.00 176.83 176.13 3hqp n LYS 133 N -3.28 1.88 -0.12 3.45 5.02 -1.09 -4.30 118.16 119.71 3hqp n LYS 133 Ca -0.00 -1.32 -0.26 0.00 -2.02 0.00 0.00 58.31 54.71 3hqp n LYS 133 Cb 0.33 -1.47 -0.09 0.00 -0.02 0.00 0.00 35.03 33.78 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 0.59 1.36 -2.95 -0.18 0.31 -0.85 -5.03 118.33 111.58 3hqp n VAL 134 Ca 0.17 -0.35 -0.32 0.00 -0.01 0.00 0.00 64.34 63.83 3hqp n VAL 134 Cb 0.45 -1.81 -0.05 0.00 -0.91 0.00 0.00 33.84 31.52 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 -2.45 4.70 0.26 2.52 -7.23 -0.64 -5.10 120.40 112.44 3hqp s VAL 135 Ca -0.34 0.87 0.08 0.00 -1.81 0.00 0.00 61.98 60.78 3hqp s VAL 135 Cb 0.13 -3.67 -0.05 0.00 0.56 0.00 0.00 36.38 33.35 3hqp s VAL 135 CO 0.44 -0.36 -0.12 -0.13 -0.31 0.00 0.00 175.10 174.61 3hqp s ARG 136 N -3.42 1.52 -0.66 4.82 0.52 -1.26 -4.87 118.95 115.60 3hqp s ARG 136 Ca 0.54 -1.72 -0.26 0.00 -0.52 0.00 0.00 55.73 53.77 3hqp s ARG 136 Cb -0.10 -1.32 -0.11 0.00 0.52 0.00 0.00 34.95 33.94 3hqp s ARG 136 CO 0.24 0.16 2.42 -2.30 0.02 0.00 0.00 175.30 175.84 3hqp n PRO 137 N -0.53 0.76 0.00 3.54 -0.02 -1.26 -2.18 135.00 135.31 3hqp n PRO 137 Ca -0.06 -0.48 0.00 0.00 -2.02 0.00 0.00 63.50 60.93 3hqp n PRO 137 Cb 0.62 -3.58 0.00 0.00 -0.02 0.00 0.00 33.50 30.51 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 6.46 -0.40 3.95 -1.23 0.00 0.79 -4.94 105.19 109.81 3hqp n GLY 138 Ca 0.43 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.25 3hqp n GLY 138 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hqp s ASN 139 N -0.31 5.76 -0.13 1.61 0.02 -0.92 -4.83 114.94 116.14 3hqp s ASN 139 Ca 0.00 -0.28 -0.08 0.00 -1.02 0.00 0.00 52.86 51.49 3hqp s ASN 139 Cb 0.00 -1.17 -0.04 0.00 0.02 0.00 0.00 41.25 40.06 3hqp s ASN 139 CO 0.00 -0.39 0.14 -0.31 0.02 0.00 0.00 177.10 176.56 3hqp s TYR 140 N -2.21 3.57 -0.25 2.20 2.02 -1.26 -1.31 117.35 120.12 3hqp s TYR 140 Ca 0.43 0.50 -0.01 0.00 -0.37 0.00 0.00 57.07 57.63 3hqp s TYR 140 Cb -0.08 -1.98 0.03 0.00 -0.40 0.00 0.00 41.96 39.53 3hqp s TYR 140 CO 0.30 0.67 -0.07 0.42 -1.57 0.00 0.00 175.55 175.29 3hqp s ILE 141 N -0.81 2.76 -0.47 2.71 1.01 0.49 -4.96 121.20 121.93 3hqp s ILE 141 Ca 0.14 -1.08 -0.20 0.00 0.00 0.00 0.00 60.65 59.50 3hqp s ILE 141 Cb -0.12 -2.41 0.04 0.00 0.01 0.00 0.00 42.46 39.98 3hqp s ILE 141 CO 0.03 0.20 0.65 -0.31 0.00 0.00 0.00 174.94 175.51 3hqp s TYR 142 N 1.30 3.04 -0.09 3.97 1.51 -1.20 -1.64 117.35 124.25 3hqp s TYR 142 Ca -0.00 -0.23 -0.05 0.00 -1.01 0.00 0.00 57.07 55.78 3hqp s TYR 142 Cb -0.17 -3.45 -0.04 0.00 -0.11 0.00 0.00 41.96 38.20 3hqp s TYR 142 CO -0.05 -0.96 0.11 0.42 -1.11 0.00 0.00 175.55 173.96 3hqp s ILE 143 N 2.82 5.18 -0.80 2.71 -1.09 0.12 -1.19 121.20 128.95 3hqp s ILE 143 Ca 0.20 0.01 -0.02 0.00 -2.23 0.00 0.00 60.65 58.61 3hqp s ILE 143 Cb -0.16 -3.28 -0.02 0.00 -1.58 0.00 0.00 42.46 37.42 3hqp s ILE 143 CO 0.16 0.55 0.74 -0.67 -1.23 0.00 0.00 174.94 174.49 3hqp n ASP 144 N 1.79 -7.18 -4.17 3.58 2.03 0.74 -1.44 116.55 111.91 3hqp n ASP 144 Ca -0.18 -0.27 -0.35 0.00 0.52 0.00 0.00 54.79 54.51 3hqp n ASP 144 Cb 0.54 -5.08 -0.02 0.00 -0.72 0.00 0.00 41.12 35.84 3hqp n ASP 144 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 3hqp n ASP 145 N -2.20 -3.37 0.00 1.67 9.92 -1.22 -2.04 116.55 119.31 3hqp n ASP 145 Ca -0.02 -0.98 0.00 0.00 -0.53 0.00 0.00 54.79 53.26 3hqp n ASP 145 Cb 0.54 -2.92 0.00 0.00 -0.64 0.00 0.00 41.12 38.10 3hqp n ASP 145 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3hqp n GLY 146 N -1.46 2.68 0.13 0.44 0.00 -1.22 -4.78 105.19 100.98 3hqp n GLY 146 Ca 0.05 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.97 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 1.15 -3.68 -0.61 2.04 -1.38 -3.40 117.51 111.62 3hqp h ILE 147 Ca 0.00 -0.43 -0.62 0.00 1.00 0.00 0.00 64.86 64.80 3hqp h ILE 147 Cb 0.00 0.99 -0.15 0.00 -0.74 0.00 0.00 36.82 36.92 3hqp h ILE 147 CO 0.00 0.15 -0.39 -0.22 0.00 0.00 0.00 178.15 177.69 3hqp s LEU 148 N -9.90 4.08 -0.13 1.44 2.96 -0.52 -4.94 118.68 111.67 3hqp s LEU 148 Ca -0.13 0.19 0.03 0.00 -0.22 0.00 0.00 54.13 53.99 3hqp s LEU 148 Cb 0.08 -2.25 0.01 0.00 0.50 0.00 0.00 46.19 44.52 3hqp s LEU 148 CO 0.71 -0.05 -0.22 -0.63 -1.32 0.00 0.00 176.35 174.84 3hqp s ILE 149 N 1.53 2.09 0.04 6.68 1.01 -1.26 0.12 121.20 131.42 3hqp s ILE 149 Ca 0.11 -0.98 0.06 0.00 0.00 0.00 0.00 60.65 59.84 3hqp s ILE 149 Cb -0.15 -1.82 -0.03 0.00 0.01 0.00 0.00 42.46 40.46 3hqp s ILE 149 CO 0.08 0.55 -0.11 -0.76 0.00 0.00 0.00 174.94 174.70 3hqp s LEU 150 N 0.66 2.95 -0.11 2.97 1.43 -0.65 -2.24 118.68 123.69 3hqp s LEU 150 Ca -0.11 -0.31 0.02 0.00 -1.03 0.00 0.00 54.13 52.71 3hqp s LEU 150 Cb -0.16 -1.73 -0.01 0.00 0.03 0.00 0.00 46.19 44.32 3hqp s LEU 150 CO 0.02 0.24 -0.19 -1.58 0.23 0.00 0.00 176.35 175.07 3hqp s GLN 151 N -1.65 3.13 -0.15 1.70 0.74 -1.01 -0.38 119.66 122.04 3hqp s GLN 151 Ca 0.18 -0.79 -0.29 0.00 0.05 0.00 0.00 55.36 54.50 3hqp s GLN 151 Cb -0.11 -2.43 -0.02 0.00 1.10 0.00 0.00 33.01 31.55 3hqp s GLN 151 CO 0.09 0.23 1.28 0.08 -0.55 0.00 0.00 175.29 176.41 3hqp s VAL 152 N 0.26 4.25 -0.14 1.34 1.01 -0.42 -1.74 120.40 124.95 3hqp s VAL 152 Ca -0.13 1.51 -0.10 0.00 0.00 0.00 0.00 61.98 63.25 3hqp s VAL 152 Cb -0.17 -3.97 -0.06 0.00 0.00 0.00 0.00 36.38 32.18 3hqp s VAL 152 CO 0.07 -0.13 -0.03 1.56 0.00 0.00 0.00 175.10 176.58 3hqp h GLN 153 N 8.23 0.00 -3.27 2.72 7.50 -1.54 0.22 115.11 128.98 3hqp h GLN 153 Ca -0.27 0.00 -0.02 0.00 0.50 0.00 0.00 58.65 58.86 3hqp h GLN 153 Cb 1.11 0.00 -0.10 0.00 0.05 0.00 0.00 27.48 28.54 3hqp h GLN 153 CO 0.96 0.21 0.05 -1.54 -1.50 0.00 0.00 178.83 177.02 3hqp s SER 154 N -5.90 -0.28 -0.09 1.46 1.04 -1.26 -4.53 113.70 104.14 3hqp s SER 154 Ca -0.14 -0.45 -0.21 0.00 0.48 0.00 0.00 55.95 55.63 3hqp s SER 154 Cb 0.02 0.59 -0.04 0.00 0.10 0.00 0.00 66.02 66.69 3hqp s SER 154 CO 0.26 -1.06 0.60 -1.00 0.98 0.00 0.00 173.24 173.02 3hqp s HIS 155 N -3.87 3.55 -0.18 5.02 3.76 -1.26 -2.62 115.29 119.69 3hqp s HIS 155 Ca 0.09 1.08 -0.18 0.00 -0.15 0.00 0.00 55.06 55.90 3hqp s HIS 155 Cb -0.01 -2.69 -0.14 0.00 1.11 0.00 0.00 32.58 30.84 3hqp s HIS 155 CO -0.03 0.12 0.13 0.93 -0.85 0.00 0.00 174.74 175.04 3hqp h GLU 156 N 6.75 0.00 0.00 1.40 5.08 -1.93 -3.49 114.58 122.39 3hqp h GLU 156 Ca -0.41 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 3hqp h GLU 156 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 3hqp h GLU 156 CO 0.75 0.69 0.00 -0.40 -1.00 0.00 0.00 179.01 179.05 3hqp n ASP 157 N -4.51 0.00 -0.10 1.42 3.85 -1.24 -5.06 116.55 110.91 3hqp n ASP 157 Ca -0.23 0.00 -0.14 0.00 -0.71 0.00 0.00 54.79 53.71 3hqp n ASP 157 Cb 0.53 0.00 -0.14 0.00 -1.35 0.00 0.00 41.12 40.16 3hqp n ASP 157 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.20 177.40 3hqp n GLU 158 N 0.00 0.68 -0.05 0.11 2.13 -1.26 -4.65 120.64 117.60 3hqp n GLU 158 Ca 0.00 0.10 0.02 0.00 0.66 0.00 0.00 57.16 57.94 3hqp n GLU 158 Cb 0.00 -1.56 0.05 0.00 0.27 0.00 0.00 31.44 30.20 3hqp n GLU 158 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 3hqp n GLN 159 N -3.02 2.76 -4.32 5.31 6.02 -1.26 -4.82 117.38 118.05 3hqp n GLN 159 Ca -0.36 -1.76 -0.20 0.00 -0.01 0.00 0.00 57.00 54.67 3hqp n GLN 159 Cb 1.08 -1.13 -0.16 0.00 1.02 0.00 0.00 30.24 31.05 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 -1.29 0.69 0.10 5.09 2.01 -1.26 -0.26 115.64 120.71 3hqp s THR 160 Ca 0.09 -0.29 0.10 0.00 0.31 0.00 0.00 61.69 61.89 3hqp s THR 160 Cb 0.06 -0.63 -0.04 0.00 0.01 0.00 0.00 72.50 71.91 3hqp s THR 160 CO 0.03 0.22 -0.23 -0.76 -0.69 0.00 0.00 174.62 173.19 3hqp s LEU 161 N 0.30 2.43 -0.24 4.42 1.43 -0.37 -3.33 118.68 123.32 3hqp s LEU 161 Ca -0.04 -0.62 -0.12 0.00 -1.03 0.00 0.00 54.13 52.31 3hqp s LEU 161 Cb -0.09 -1.36 -0.05 0.00 0.03 0.00 0.00 46.19 44.72 3hqp s LEU 161 CO 0.00 0.21 0.23 -0.70 0.23 0.00 0.00 176.35 176.33 3hqp s GLU 162 N -1.82 4.08 0.02 1.70 2.12 -1.08 -2.34 118.70 121.39 3hqp s GLU 162 Ca 0.15 -0.14 0.06 0.00 0.36 0.00 0.00 54.97 55.40 3hqp s GLU 162 Cb -0.10 -3.56 -0.02 0.00 0.26 0.00 0.00 34.13 30.71 3hqp s GLU 162 CO 0.06 -0.01 -0.18 0.00 -0.54 0.00 0.00 175.26 174.60 3hqp s THR 164 N -0.67 3.93 0.01 0.00 2.01 -0.71 -0.72 115.64 119.49 3hqp s THR 164 Ca 0.06 -0.33 -0.30 0.00 0.31 0.00 0.00 61.69 61.42 3hqp s THR 164 Cb -0.08 -2.76 -0.05 0.00 0.01 0.00 0.00 72.50 69.62 3hqp s THR 164 CO 0.01 0.45 1.32 -0.69 -0.69 0.00 0.00 174.62 175.02 3hqp s VAL 165 N 0.79 3.83 -0.07 3.82 1.01 -1.25 -2.40 120.40 126.13 3hqp s VAL 165 Ca -0.00 1.24 0.14 0.00 0.00 0.00 0.00 61.98 63.36 3hqp s VAL 165 Cb -0.14 -3.80 -0.20 0.00 0.00 0.00 0.00 36.38 32.24 3hqp s VAL 165 CO 0.02 0.03 0.73 0.71 0.00 0.00 0.00 175.10 176.59 3hqp h THR 166 N 4.80 0.75 -3.74 3.92 1.35 -1.80 -2.86 112.91 115.33 3hqp h THR 166 Ca -0.38 -2.48 -0.17 0.00 -0.55 0.00 0.00 66.41 62.83 3hqp h THR 166 Cb 1.18 2.30 -0.22 0.00 -1.73 0.00 0.00 68.15 69.69 3hqp h THR 166 CO 0.88 0.43 -0.61 0.54 -0.25 0.00 0.00 175.52 176.50 3hqp s ASN 167 N -6.00 0.11 -0.21 5.36 2.20 -1.26 -4.84 114.94 110.29 3hqp s ASN 167 Ca -0.04 -0.29 -0.29 0.00 -0.94 0.00 0.00 52.86 51.30 3hqp s ASN 167 Cb 0.08 0.15 -0.01 0.00 -2.00 0.00 0.00 41.25 39.47 3hqp s ASN 167 CO 0.82 -0.28 1.29 -0.44 -2.94 0.00 0.00 177.10 175.54 3hqp s SER 168 N -1.19 6.84 -0.23 3.54 0.01 -1.26 -4.44 113.70 116.96 3hqp s SER 168 Ca -0.13 1.53 -0.17 0.00 1.31 0.00 0.00 55.95 58.49 3hqp s SER 168 Cb -0.08 -2.54 0.06 0.00 0.21 0.00 0.00 66.02 63.68 3hqp s SER 168 CO 0.00 -0.88 0.59 -2.28 0.41 0.00 0.00 173.24 171.07 3hqp s HIS 169 N 3.85 -0.76 -0.17 2.43 5.04 -0.98 -4.98 115.29 119.72 3hqp s HIS 169 Ca 0.56 1.69 -0.21 0.00 -1.54 0.00 0.00 55.06 55.56 3hqp s HIS 169 Cb -0.20 0.35 -0.03 0.00 0.04 0.00 0.00 32.58 32.74 3hqp s HIS 169 CO 0.18 -0.38 0.61 0.99 -2.34 0.00 0.00 174.74 173.79 3hqp s THR 170 N 0.90 5.06 -0.01 0.89 2.01 -1.26 -2.77 115.64 120.46 3hqp s THR 170 Ca -0.05 1.17 0.04 0.00 0.31 0.00 0.00 61.69 63.16 3hqp s THR 170 Cb -0.05 -3.93 -0.03 0.00 0.01 0.00 0.00 72.50 68.50 3hqp s THR 170 CO -0.08 0.17 -0.11 0.27 -0.69 0.00 0.00 174.62 174.18 3hqp s ILE 171 N 1.52 3.29 0.57 1.82 -4.36 -0.68 -4.95 121.20 118.40 3hqp s ILE 171 Ca 0.29 -0.84 0.00 0.00 -0.26 0.00 0.00 60.65 59.84 3hqp s ILE 171 Cb -0.16 -2.38 0.11 0.00 1.25 0.00 0.00 42.46 41.28 3hqp s ILE 171 CO 0.11 0.45 0.78 -1.20 0.24 0.00 0.00 174.94 175.32 3hqp n SER 172 N 1.80 1.09 -4.74 4.36 7.64 -1.26 -0.77 113.62 121.73 3hqp n SER 172 Ca -0.16 -1.91 -0.37 0.00 1.01 0.00 0.00 58.87 57.44 3hqp n SER 172 Cb 0.52 -0.50 0.05 0.00 -1.01 0.00 0.00 64.21 63.27 3hqp n SER 172 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 3hqp s ASP 173 N -4.19 4.94 -0.65 6.43 1.11 -1.24 -4.06 116.67 119.01 3hqp s ASP 173 Ca 0.52 2.57 -0.06 0.00 0.18 0.00 0.00 52.55 55.75 3hqp s ASP 173 Cb -0.03 -2.61 0.01 0.00 1.07 0.00 0.00 42.92 41.35 3hqp s ASP 173 CO 0.34 -1.77 0.43 -2.11 1.18 0.00 0.00 175.17 173.25 3hqp n ARG 174 N -1.62 -0.92 -3.28 8.23 1.85 0.96 -4.95 116.66 116.94 3hqp n ARG 174 Ca 0.14 0.35 -0.34 0.00 -1.00 0.00 0.00 57.85 57.00 3hqp n ARG 174 Cb 0.48 -1.50 -0.06 0.00 -1.05 0.00 0.00 32.46 30.33 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 -4.78 3.99 0.18 2.89 3.00 -1.26 -4.66 118.95 118.32 3hqp s ARG 175 Ca 0.09 0.54 -0.30 0.00 0.00 0.00 0.00 55.73 56.06 3hqp s ARG 175 Cb -0.05 -2.75 -0.08 0.00 0.00 0.00 0.00 34.95 32.08 3hqp s ARG 175 CO 0.64 0.36 1.18 0.20 0.00 0.00 0.00 175.30 177.67 3hqp s GLY 176 N -1.98 2.71 -0.14 -3.53 0.00 -1.26 -1.58 107.32 101.53 3hqp s GLY 176 Ca 0.45 0.92 0.01 0.00 0.00 0.00 0.00 44.72 46.10 3hqp s GLY 176 CO 0.20 1.81 -0.17 0.54 0.00 0.00 0.00 173.10 175.47 3hqp s VAL 177 N -0.08 1.76 -0.09 1.40 0.11 -0.59 -0.18 120.40 122.72 3hqp s VAL 177 Ca 0.52 -0.78 -0.02 0.00 -2.93 0.00 0.00 61.98 58.78 3hqp s VAL 177 Cb -0.32 -1.60 -0.03 0.00 -1.53 0.00 0.00 36.38 32.90 3hqp s VAL 177 CO 0.36 0.49 -0.01 0.20 -3.33 0.00 0.00 175.10 172.81 3hqp s ASN 178 N 1.13 5.10 -0.50 3.54 0.01 -0.33 -4.39 114.94 119.50 3hqp s ASN 178 Ca -0.02 0.08 0.04 0.00 -0.71 0.00 0.00 52.86 52.25 3hqp s ASN 178 Cb -0.14 -1.48 0.13 0.00 0.41 0.00 0.00 41.25 40.17 3hqp s ASN 178 CO -0.06 0.34 0.25 -0.76 -1.51 0.00 0.00 177.10 175.36 3hqp s LEU 179 N -0.68 4.02 0.30 0.60 2.01 -1.26 -3.23 118.68 120.43 3hqp s LEU 179 Ca 0.11 -2.91 -0.27 0.00 0.01 0.00 0.00 54.13 51.07 3hqp s LEU 179 Cb -0.12 -1.52 -0.10 0.00 0.01 0.00 0.00 46.19 44.46 3hqp s LEU 179 CO 0.02 -0.24 0.95 -2.84 1.01 0.00 0.00 176.35 175.24 3hqp s PRO 180 N -0.12 4.66 -0.62 1.29 0.02 -1.26 -4.01 135.00 134.96 3hqp s PRO 180 Ca 0.17 1.38 -0.01 0.00 0.02 0.00 0.00 61.00 62.56 3hqp s PRO 180 Cb -0.25 -2.94 0.00 0.00 0.02 0.00 0.00 34.50 31.32 3hqp s PRO 180 CO -0.00 0.34 0.12 0.41 -0.33 0.00 0.00 177.00 177.54 3hqp n GLY 181 N 0.84 0.14 0.00 0.52 0.00 -1.26 -4.92 105.19 100.51 3hqp n GLY 181 Ca 0.01 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.53 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 -1.54 -7.30 -4.72 0.00 4.64 -1.26 -4.92 116.55 101.45 3hqp n ASP 183 Ca 0.00 0.37 -0.42 0.00 -1.38 0.00 0.00 54.79 53.36 3hqp n ASP 183 Cb 0.30 -4.92 -0.03 0.00 -1.04 0.00 0.00 41.12 35.42 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 -2.56 2.68 -1.15 5.18 -7.23 -1.26 -4.90 120.40 111.15 3hqp s VAL 184 Ca 0.18 0.48 -0.21 0.00 -1.81 0.00 0.00 61.98 60.61 3hqp s VAL 184 Cb -0.05 -3.31 0.03 0.00 0.56 0.00 0.00 36.38 33.61 3hqp s VAL 184 CO 0.68 0.04 1.70 -0.62 -0.31 0.00 0.00 175.10 176.59 3hqp s ASP 185 N 1.17 6.28 -0.00 4.85 2.15 -1.26 -4.92 116.67 124.94 3hqp s ASP 185 Ca 0.70 -1.82 0.02 0.00 0.43 0.00 0.00 52.55 51.88 3hqp s ASP 185 Cb -0.43 -2.58 -0.01 0.00 -0.30 0.00 0.00 42.92 39.61 3hqp s ASP 185 CO 0.31 -1.73 -0.07 -0.76 -0.17 0.00 0.00 175.17 172.76 3hqp s LEU 186 N 6.09 2.01 0.44 -1.34 1.43 -1.26 -5.00 118.68 121.06 3hqp s LEU 186 Ca 0.55 -0.12 -0.25 0.00 -1.03 0.00 0.00 54.13 53.28 3hqp s LEU 186 Cb 0.01 -0.34 -0.08 0.00 0.03 0.00 0.00 46.19 45.81 3hqp s LEU 186 CO 0.02 0.08 1.31 -2.16 0.23 0.00 0.00 176.35 175.83 3hqp s PRO 187 N -0.16 3.78 0.23 1.29 0.04 -1.26 -4.94 135.00 133.98 3hqp s PRO 187 Ca 0.02 2.16 -0.07 0.00 0.04 0.00 0.00 61.00 63.15 3hqp s PRO 187 Cb -0.03 -2.62 0.20 0.00 0.04 0.00 0.00 34.50 32.09 3hqp s PRO 187 CO -0.00 -0.65 1.85 0.00 0.04 0.00 0.00 177.00 178.24 3hqp h ALA 188 N 2.37 1.14 -3.50 8.56 0.00 -2.00 -3.39 119.26 122.44 3hqp h ALA 188 Ca -0.50 -0.13 -0.33 0.00 0.00 0.00 0.00 54.91 53.95 3hqp h ALA 188 Cb 1.26 -0.36 -0.34 0.00 0.00 0.00 0.00 17.79 18.35 3hqp h ALA 188 CO 0.61 0.65 -0.74 0.54 0.00 0.00 0.00 179.25 180.31 3hqp s VAL 189 N -5.85 0.13 0.50 0.00 0.11 -1.26 -4.61 120.40 109.42 3hqp s VAL 189 Ca -0.13 0.11 0.04 0.00 -2.93 0.00 0.00 61.98 59.08 3hqp s VAL 189 Cb 0.17 -0.23 -0.00 0.00 -1.53 0.00 0.00 36.38 34.78 3hqp s VAL 189 CO 0.83 0.13 0.19 -0.94 -3.33 0.00 0.00 175.10 171.97 3hqp s SER 190 N 1.02 4.36 0.39 3.54 1.04 -1.26 -4.99 113.70 117.80 3hqp s SER 190 Ca -0.10 -1.39 0.11 0.00 0.48 0.00 0.00 55.95 55.06 3hqp s SER 190 Cb -0.13 0.27 0.79 0.00 0.10 0.00 0.00 66.02 67.04 3hqp s SER 190 CO -0.02 -0.88 1.90 0.00 0.98 0.00 0.00 173.24 175.22 3hqp h ALA 191 N 1.15 1.50 -0.42 5.32 0.00 -2.00 -0.45 119.26 124.36 3hqp h ALA 191 Ca -0.41 -0.24 -0.14 0.00 0.00 0.00 0.00 54.91 54.12 3hqp h ALA 191 Cb 1.30 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 3hqp h ALA 191 CO 0.67 0.36 -0.30 0.87 0.00 0.00 0.00 179.25 180.86 3hqp h LYS 192 N 0.13 0.93 -0.03 0.00 1.57 -2.00 -2.98 116.57 114.19 3hqp h LYS 192 Ca 0.02 -0.44 -0.20 0.00 -1.87 0.00 0.00 60.65 58.17 3hqp h LYS 192 Cb 0.45 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.74 3hqp h LYS 192 CO 0.03 1.09 -0.82 -0.44 -0.57 0.00 0.00 179.45 178.74 3hqp h ASP 193 N 0.78 0.43 0.19 0.86 3.32 -1.84 -2.95 116.42 117.21 3hqp h ASP 193 Ca 0.09 -0.31 -0.17 0.00 0.02 0.00 0.00 57.03 56.65 3hqp h ASP 193 Cb 0.87 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.29 3hqp h ASP 193 CO 0.08 1.08 -0.64 -0.09 -1.72 0.00 0.00 179.24 177.95 3hqp h ARG 194 N 0.21 0.43 -0.14 3.56 2.43 -1.13 -1.46 114.38 118.28 3hqp h ARG 194 Ca -0.05 -0.31 -0.15 0.00 -0.81 0.00 0.00 59.98 58.66 3hqp h ARG 194 Cb 1.43 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 31.02 3hqp h ARG 194 CO 0.14 0.92 -0.57 0.28 -1.51 0.00 0.00 179.97 179.23 3hqp h VAL 195 N 0.31 1.34 -0.36 0.20 2.07 -1.60 -1.36 116.25 116.86 3hqp h VAL 195 Ca -0.01 -1.86 -0.01 0.00 0.82 0.00 0.00 66.70 65.64 3hqp h VAL 195 Cb 1.18 1.86 -0.02 0.00 -1.52 0.00 0.00 31.29 32.80 3hqp h VAL 195 CO 0.11 0.57 0.19 0.44 0.02 0.00 0.00 177.57 178.90 3hqp h ASP 196 N 0.33 0.45 -0.03 0.57 3.32 -1.32 -2.14 116.42 117.59 3hqp h ASP 196 Ca 0.00 -0.09 -0.13 0.00 0.02 0.00 0.00 57.03 56.83 3hqp h ASP 196 Cb 1.10 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.52 3hqp h ASP 196 CO 0.10 0.41 -0.40 -0.07 -1.72 0.00 0.00 179.24 177.56 3hqp h LEU 197 N 0.45 0.58 -0.83 1.55 3.38 -1.21 -2.38 115.31 116.85 3hqp h LEU 197 Ca 0.12 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 3hqp h LEU 197 Cb 0.07 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 3hqp h LEU 197 CO -0.02 0.92 0.45 -0.61 0.09 0.00 0.00 178.44 179.27 3hqp h GLN 198 N 0.45 1.15 -0.42 1.13 5.75 -1.16 -2.25 115.11 119.76 3hqp h GLN 198 Ca 0.04 -0.14 -0.07 0.00 -0.15 0.00 0.00 58.65 58.34 3hqp h GLN 198 Cb 0.90 -0.23 -0.02 0.00 1.07 0.00 0.00 27.48 29.20 3hqp h GLN 198 CO 0.08 0.85 -0.02 0.35 -2.65 0.00 0.00 178.83 177.44 3hqp h PHE 199 N 1.15 0.73 -0.72 3.99 3.57 -1.23 -2.64 116.94 121.79 3hqp h PHE 199 Ca 0.29 -0.10 -0.06 0.00 3.53 0.00 0.00 57.97 61.63 3hqp h PHE 199 Cb 0.03 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.54 3hqp h PHE 199 CO 0.01 0.70 0.21 0.78 -2.23 0.00 0.00 178.31 177.77 3hqp h GLY 200 N 0.94 1.20 0.97 2.40 0.00 -0.89 -1.90 103.07 105.78 3hqp h GLY 200 Ca 0.13 -0.72 -0.11 0.00 0.00 0.00 0.00 47.33 46.63 3hqp h GLY 200 CO 0.02 0.67 -0.26 -2.08 0.00 0.00 0.00 176.54 174.89 3hqp h VAL 201 N 1.07 1.30 -0.53 4.60 2.07 -1.32 0.79 116.25 124.22 3hqp h VAL 201 Ca 0.23 -1.42 -0.06 0.00 0.82 0.00 0.00 66.70 66.27 3hqp h VAL 201 Cb 0.32 1.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 3hqp h VAL 201 CO -0.01 0.46 0.10 -0.33 0.02 0.00 0.00 177.57 177.81 3hqp h GLU 202 N 0.45 0.83 0.00 1.57 5.08 -1.35 -2.87 114.58 118.28 3hqp h GLU 202 Ca 0.05 -0.18 -0.19 0.00 -1.00 0.00 0.00 59.36 58.04 3hqp h GLU 202 Cb 0.82 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.93 3hqp h GLU 202 CO 0.07 0.77 -1.17 1.96 -1.00 0.00 0.00 179.01 179.64 3hqp h GLN 203 N 0.79 0.00 -1.72 2.33 1.08 -1.37 -3.49 115.11 112.73 3hqp h GLN 203 Ca 0.17 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.37 3hqp h GLN 203 Cb 0.34 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.77 3hqp h GLN 203 CO 0.00 0.55 0.00 0.41 -0.95 0.00 0.00 178.83 178.85 3hqp n GLY 204 N 1.38 0.60 3.77 3.46 0.00 0.17 -5.06 105.19 109.51 3hqp n GLY 204 Ca -0.06 -0.38 -0.37 0.00 0.00 0.00 0.00 46.02 45.21 3hqp n GLY 204 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hqp s VAL 205 N -2.57 3.28 0.11 1.61 -7.23 -0.62 -4.96 120.40 110.01 3hqp s VAL 205 Ca 0.00 0.94 0.12 0.00 -1.81 0.00 0.00 61.98 61.23 3hqp s VAL 205 Cb 0.00 -3.47 -0.04 0.00 0.56 0.00 0.00 36.38 33.44 3hqp s VAL 205 CO 0.00 -0.03 1.49 0.44 -0.31 0.00 0.00 175.10 176.69 3hqp h ASP 206 N 2.07 0.00 -5.06 4.85 3.32 -1.65 -3.45 116.42 116.49 3hqp h ASP 206 Ca -0.49 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.52 3hqp h ASP 206 Cb 1.24 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 40.66 3hqp h ASP 206 CO 0.60 0.67 -0.00 0.00 -1.72 0.00 0.00 179.24 178.79 3hqp s MET 207 N -3.17 1.13 -0.09 3.56 0.23 -1.20 -2.85 119.30 116.91 3hqp s MET 207 Ca 0.01 -0.65 0.03 0.00 -1.03 0.00 0.00 55.69 54.05 3hqp s MET 207 Cb 0.10 0.50 -0.01 0.00 -1.53 0.00 0.00 34.83 33.89 3hqp s MET 207 CO 0.76 -0.46 -0.19 0.42 -2.03 0.00 0.00 175.02 173.52 3hqp s ILE 208 N -3.79 2.53 -1.05 3.16 -1.09 0.65 -1.87 121.20 119.75 3hqp s ILE 208 Ca 0.03 -0.88 -0.05 0.00 -2.23 0.00 0.00 60.65 57.52 3hqp s ILE 208 Cb 0.01 -1.99 0.28 0.00 -1.58 0.00 0.00 42.46 39.19 3hqp s ILE 208 CO -0.12 0.56 1.22 0.49 -1.23 0.00 0.00 174.94 175.85 3hqp n PHE 209 N 3.14 3.72 -2.01 3.97 3.72 0.10 -0.48 117.46 129.63 3hqp n PHE 209 Ca -0.18 -3.37 -0.42 0.00 -0.05 0.00 0.00 57.45 53.43 3hqp n PHE 209 Cb 0.52 -1.37 -0.03 0.00 -0.94 0.00 0.00 39.48 37.67 3hqp n PHE 209 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3hqp s ALA 210 N -2.05 3.62 0.31 4.37 0.00 -1.00 -2.92 121.76 124.09 3hqp s ALA 210 Ca 0.31 0.94 -0.18 0.00 0.00 0.00 0.00 51.96 53.03 3hqp s ALA 210 Cb -0.01 -3.74 -0.09 0.00 0.00 0.00 0.00 23.12 19.27 3hqp s ALA 210 CO 0.00 -1.39 0.79 -1.12 0.00 0.00 0.00 175.76 174.04 3hqp s SER 211 N 3.33 6.94 -1.41 0.00 0.01 -1.25 -0.98 113.70 120.33 3hqp s SER 211 Ca 0.73 1.44 -0.08 0.00 1.31 0.00 0.00 55.95 59.35 3hqp s SER 211 Cb -0.33 -2.43 0.04 0.00 0.21 0.00 0.00 66.02 63.51 3hqp s SER 211 CO 0.29 -0.15 0.94 0.49 0.41 0.00 0.00 173.24 175.23 3hqp n PHE 212 N -0.00 -2.28 -2.25 2.43 3.72 -1.23 -4.25 117.46 113.60 3hqp n PHE 212 Ca 0.02 0.91 -0.43 0.00 -0.05 0.00 0.00 57.45 57.90 3hqp n PHE 212 Cb 0.52 -4.38 -0.02 0.00 -0.94 0.00 0.00 39.48 34.66 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 -3.42 3.89 -0.06 4.37 -1.09 -1.08 -4.73 121.20 119.09 3hqp s ILE 213 Ca 0.40 1.01 0.19 0.00 -2.23 0.00 0.00 60.65 60.02 3hqp s ILE 213 Cb -0.20 -3.89 -0.28 0.00 -1.58 0.00 0.00 42.46 36.51 3hqp s ILE 213 CO 0.80 -0.36 0.35 -2.11 -1.23 0.00 0.00 174.94 172.39 3hqp n ARG 214 N 7.47 0.69 -3.94 2.79 1.85 -1.26 -4.50 116.66 119.77 3hqp n ARG 214 Ca 0.17 -0.14 -0.09 0.00 -1.00 0.00 0.00 57.85 56.79 3hqp n ARG 214 Cb 0.46 -1.45 -0.05 0.00 -1.05 0.00 0.00 32.46 30.36 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 -4.40 -0.09 0.48 2.89 1.04 -1.26 -4.18 113.70 108.18 3hqp s SER 215 Ca -0.07 -0.82 0.21 0.00 0.48 0.00 0.00 55.95 55.75 3hqp s SER 215 Cb 0.11 0.54 1.21 0.00 0.10 0.00 0.00 66.02 67.97 3hqp s SER 215 CO 0.78 -1.05 2.01 0.00 0.98 0.00 0.00 173.24 175.96 3hqp h ALA 216 N 2.33 1.41 -0.06 5.32 0.00 -1.87 -2.54 119.26 123.85 3hqp h ALA 216 Ca -0.28 -0.16 -0.13 0.00 0.00 0.00 0.00 54.91 54.34 3hqp h ALA 216 Cb 1.25 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 3hqp h ALA 216 CO 0.40 0.22 -0.55 1.49 0.00 0.00 0.00 179.25 180.81 3hqp h GLU 217 N 0.00 0.18 0.00 0.00 4.81 -1.96 -2.93 114.58 114.67 3hqp h GLU 217 Ca -0.00 -0.11 -0.08 0.00 -0.13 0.00 0.00 59.36 59.04 3hqp h GLU 217 Cb 0.39 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.76 3hqp h GLU 217 CO 0.02 0.68 -0.40 0.37 -0.73 0.00 0.00 179.01 178.95 3hqp h GLN 218 N 0.14 0.00 -0.05 1.92 4.15 -1.86 -0.35 115.11 119.06 3hqp h GLN 218 Ca 0.00 0.00 -0.11 0.00 0.77 0.00 0.00 58.65 59.31 3hqp h GLN 218 Cb 1.01 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.68 3hqp h GLN 218 CO 0.08 0.40 -0.48 0.28 -1.93 0.00 0.00 178.83 177.18 3hqp h VAL 219 N 0.00 1.35 0.00 2.39 2.07 -1.51 -2.19 116.25 118.36 3hqp h VAL 219 Ca -0.00 -1.69 -0.02 0.00 0.82 0.00 0.00 66.70 65.81 3hqp h VAL 219 Cb 0.72 1.85 -0.00 0.00 -1.52 0.00 0.00 31.29 32.34 3hqp h VAL 219 CO 0.05 0.49 -0.10 1.23 0.02 0.00 0.00 177.57 179.26 3hqp h GLY 220 N 1.40 0.00 1.35 2.17 0.00 -1.16 -2.10 103.07 104.72 3hqp h GLY 220 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.12 3hqp h GLY 220 CO 0.07 0.00 -0.81 -0.55 0.00 0.00 0.00 176.54 175.25 3hqp h ASP 221 N 0.00 0.76 0.00 0.19 3.32 -0.52 -2.11 116.42 118.05 3hqp h ASP 221 Ca -0.00 -0.52 -0.21 0.00 0.02 0.00 0.00 57.03 56.32 3hqp h ASP 221 Cb 0.83 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.16 3hqp h ASP 221 CO 0.01 1.30 -0.76 0.58 -1.72 0.00 0.00 179.24 178.65 3hqp h VAL 222 N 0.41 1.31 -0.57 -1.35 2.07 -1.39 -2.57 116.25 114.16 3hqp h VAL 222 Ca -0.06 -2.03 -0.04 0.00 0.82 0.00 0.00 66.70 65.39 3hqp h VAL 222 Cb 1.43 2.03 -0.02 0.00 -1.52 0.00 0.00 31.29 33.20 3hqp h VAL 222 CO 0.16 0.63 0.21 -0.09 0.02 0.00 0.00 177.57 178.50 3hqp h ARG 223 N 0.44 0.87 0.00 1.57 2.43 -1.42 -2.22 114.38 116.04 3hqp h ARG 223 Ca -0.04 -0.17 -0.08 0.00 -0.81 0.00 0.00 59.98 58.88 3hqp h ARG 223 Cb 1.37 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.77 3hqp h ARG 223 CO 0.15 0.76 -0.37 0.87 -1.51 0.00 0.00 179.97 179.86 3hqp h LYS 224 N 0.79 0.00 0.00 0.20 1.57 -1.43 -3.12 116.57 114.58 3hqp h LYS 224 Ca 0.19 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.89 3hqp h LYS 224 Cb 0.23 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 3hqp h LYS 224 CO -0.01 0.37 -0.39 0.00 -0.57 0.00 0.00 179.45 178.85 3hqp h ALA 225 N 1.63 0.76 -0.02 3.86 0.00 -1.23 -3.27 119.26 120.99 3hqp h ALA 225 Ca -0.00 -0.36 -0.17 0.00 0.00 0.00 0.00 54.91 54.38 3hqp h ALA 225 Cb 0.97 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 3hqp h ALA 225 CO 0.05 0.49 -0.74 -0.07 0.00 0.00 0.00 179.25 178.98 3hqp h LEU 226 N 0.00 0.17 0.00 0.00 3.38 -1.34 -3.42 115.31 114.09 3hqp h LEU 226 Ca -0.00 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.85 3hqp h LEU 226 Cb 1.26 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.96 3hqp h LEU 226 CO 0.05 0.85 0.00 0.61 0.09 0.00 0.00 178.44 180.04 3hqp n GLY 227 N 0.57 -1.22 0.23 0.83 0.00 -1.22 -3.23 105.19 101.15 3hqp n GLY 227 Ca -0.02 -1.61 0.07 0.00 0.00 0.00 0.00 46.02 44.46 3hqp n GLY 227 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3hqp h PRO 228 N 0.00 0.00 0.00 1.61 0.11 -1.92 -1.93 132.00 129.87 3hqp h PRO 228 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3hqp h PRO 228 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3hqp h PRO 228 CO 0.00 0.18 0.00 0.87 -0.21 0.00 0.00 178.00 178.84 3hqp h LYS 229 N 0.00 0.00 -0.78 1.05 1.79 -2.01 -3.28 116.57 113.34 3hqp h LYS 229 Ca -0.00 0.00 -0.52 0.00 -2.18 0.00 0.00 60.65 57.95 3hqp h LYS 229 Cb 0.36 0.00 -0.30 0.00 -1.58 0.00 0.00 32.23 30.71 3hqp h LYS 229 CO 0.02 0.00 0.12 0.41 -1.08 0.00 0.00 179.45 178.92 3hqp n GLY 230 N 1.07 5.72 0.08 3.86 0.00 -0.73 -4.59 105.19 110.60 3hqp n GLY 230 Ca 0.04 -2.09 0.12 0.00 0.00 0.00 0.00 46.02 44.10 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 1.76 0.00 -0.01 1.61 0.11 -1.61 -3.30 114.38 112.94 3hqp h ARG 231 Ca 0.46 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.54 3hqp h ARG 231 Cb 1.41 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.49 3hqp h ARG 231 CO 1.03 0.00 -0.04 -0.25 0.10 0.00 0.00 179.97 180.82 3hqp n ASP 232 N -2.23 0.77 -4.68 0.08 8.00 -1.26 -4.85 116.55 112.39 3hqp n ASP 232 Ca 0.03 -1.11 -0.37 0.00 0.71 0.00 0.00 54.79 54.05 3hqp n ASP 232 Cb 0.46 -0.01 -0.09 0.00 -0.02 0.00 0.00 41.12 41.46 3hqp n ASP 232 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3hqp s ILE 233 N -2.13 5.31 0.41 0.53 1.01 -1.24 -4.98 121.20 120.11 3hqp s ILE 233 Ca 0.39 0.37 -0.24 0.00 0.00 0.00 0.00 60.65 61.17 3hqp s ILE 233 Cb 0.21 -3.58 -0.08 0.00 0.01 0.00 0.00 42.46 39.02 3hqp s ILE 233 CO 0.39 0.33 1.12 -0.04 0.00 0.00 0.00 174.94 176.74 3hqp s MET 234 N 1.02 4.03 -0.39 2.79 -1.94 -1.13 -4.90 119.30 118.79 3hqp s MET 234 Ca 0.12 1.70 -0.01 0.00 -1.71 0.00 0.00 55.69 55.79 3hqp s MET 234 Cb -0.14 -2.57 0.11 0.00 2.01 0.00 0.00 34.83 34.24 3hqp s MET 234 CO 0.05 -0.30 0.16 0.42 -0.01 0.00 0.00 175.02 175.34 3hqp s ILE 235 N -1.53 3.02 -0.42 2.53 1.01 -1.26 -0.25 121.20 124.30 3hqp s ILE 235 Ca 0.59 -2.12 -0.18 0.00 0.00 0.00 0.00 60.65 58.93 3hqp s ILE 235 Cb -0.27 -3.10 0.02 0.00 0.01 0.00 0.00 42.46 39.12 3hqp s ILE 235 CO 0.34 -0.66 0.49 -0.63 0.00 0.00 0.00 174.94 174.48 3hqp s ILE 236 N 1.08 5.02 0.04 2.92 -1.09 0.37 -2.27 121.20 127.27 3hqp s ILE 236 Ca 0.09 -0.18 -0.30 0.00 -2.23 0.00 0.00 60.65 58.03 3hqp s ILE 236 Cb -0.22 -4.07 -0.04 0.00 -1.58 0.00 0.00 42.46 36.55 3hqp s ILE 236 CO -0.05 -0.45 1.02 0.00 -1.23 0.00 0.00 174.94 174.23 3hqp s LYS 238 N 0.78 4.19 -0.37 0.00 1.02 -0.15 -0.58 119.74 124.61 3hqp s LYS 238 Ca 0.52 0.58 -0.12 0.00 0.02 0.00 0.00 55.97 56.96 3hqp s LYS 238 Cb -0.23 -3.59 0.01 0.00 -0.52 0.00 0.00 37.83 33.50 3hqp s LYS 238 CO 0.29 -0.26 0.24 0.42 -0.92 0.00 0.00 175.35 175.11 3hqp s ILE 239 N 2.00 4.92 0.00 2.17 -1.09 -0.56 -2.62 121.20 126.01 3hqp s ILE 239 Ca 0.28 -0.63 0.02 0.00 -2.23 0.00 0.00 60.65 58.08 3hqp s ILE 239 Cb -0.16 -3.68 0.03 0.00 -1.58 0.00 0.00 42.46 37.07 3hqp s ILE 239 CO 0.10 -0.19 0.76 -1.84 -1.23 0.00 0.00 174.94 172.54 3hqp n GLU 240 N 5.07 0.00 -4.17 2.79 0.28 -1.26 -2.92 120.64 120.42 3hqp n GLU 240 Ca -0.12 -0.56 -0.15 0.00 -0.16 0.00 0.00 57.16 56.17 3hqp n GLU 240 Cb 0.47 -0.12 -0.07 0.00 1.43 0.00 0.00 31.44 33.15 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 -0.56 0.87 0.08 -1.84 2.20 -1.26 -3.57 114.94 110.85 3hqp s ASN 241 Ca 0.02 -1.49 -0.27 0.00 -0.94 0.00 0.00 52.86 50.18 3hqp s ASN 241 Cb 0.03 0.55 -0.17 0.00 -2.00 0.00 0.00 41.25 39.65 3hqp s ASN 241 CO -0.01 -1.08 1.67 -0.74 -2.94 0.00 0.00 177.10 174.00 3hqp h HIS 242 N 2.27 -0.35 0.00 1.54 -0.00 -1.95 -3.02 115.15 113.63 3hqp h HIS 242 Ca -0.29 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.07 3hqp h HIS 242 Cb 1.24 0.12 0.00 0.00 -0.00 0.00 0.00 27.41 28.77 3hqp h HIS 242 CO 1.15 -0.21 0.00 -0.56 -0.00 0.00 0.00 177.93 178.32 3hqp h GLN 243 N -0.40 0.00 -0.40 5.26 3.07 -1.97 -3.02 115.11 117.66 3hqp h GLN 243 Ca -0.04 0.00 -0.12 0.00 0.09 0.00 0.00 58.65 58.58 3hqp h GLN 243 Cb 0.30 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.85 3hqp h GLN 243 CO 0.06 0.00 -0.23 0.78 0.09 0.00 0.00 178.83 179.53 3hqp h GLY 244 N 4.23 0.88 1.35 0.06 0.00 -1.69 -1.56 103.07 106.33 3hqp h GLY 244 Ca 0.00 -0.76 -0.22 0.00 0.00 0.00 0.00 47.33 46.35 3hqp h GLY 244 CO 0.00 0.69 -0.81 -2.08 0.00 0.00 0.00 176.54 174.35 3hqp h VAL 245 N 0.70 1.32 0.00 4.60 2.07 -1.53 -3.21 116.25 120.21 3hqp h VAL 245 Ca 0.09 -2.09 -0.08 0.00 0.82 0.00 0.00 66.70 65.44 3hqp h VAL 245 Cb 0.76 2.10 -0.01 0.00 -1.52 0.00 0.00 31.29 32.61 3hqp h VAL 245 CO 0.06 0.65 -0.40 -0.61 0.02 0.00 0.00 177.57 177.29 3hqp h GLN 246 N 0.42 0.00 -0.61 1.57 4.15 -1.39 -2.77 115.11 116.48 3hqp h GLN 246 Ca -0.06 0.00 -0.20 0.00 0.77 0.00 0.00 58.65 59.17 3hqp h GLN 246 Cb 1.42 0.00 -0.12 0.00 0.21 0.00 0.00 27.48 28.99 3hqp h GLN 246 CO 0.15 0.40 0.19 0.09 -1.93 0.00 0.00 178.83 177.74 3hqp n ASN 247 N -3.94 4.16 -0.35 -0.69 3.02 -0.60 -4.76 115.26 112.10 3hqp n ASN 247 Ca -0.02 -3.32 0.02 0.00 -0.03 0.00 0.00 54.58 51.24 3hqp n ASN 247 Cb 0.45 -0.70 0.17 0.00 -0.61 0.00 0.00 39.78 39.08 3hqp n ASN 247 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 3hqp h ILE 248 N 2.07 1.06 -0.90 2.41 6.09 -1.49 -2.50 117.51 124.26 3hqp h ILE 248 Ca 0.24 -0.37 0.02 0.00 -1.37 0.00 0.00 64.86 63.38 3hqp h ILE 248 Cb 2.10 -0.12 -0.05 0.00 0.47 0.00 0.00 36.82 39.22 3hqp h ILE 248 CO 0.62 0.20 0.59 0.44 -3.07 0.00 0.00 178.15 176.93 3hqp h ASP 249 N 1.08 1.01 1.32 2.19 5.19 -1.86 -1.22 116.42 124.13 3hqp h ASP 249 Ca 0.42 -0.02 -0.11 0.00 -0.62 0.00 0.00 57.03 56.70 3hqp h ASP 249 Cb 0.20 -0.25 -0.02 0.00 0.18 0.00 0.00 39.33 39.44 3hqp h ASP 249 CO -0.18 0.72 -0.52 0.77 -3.12 0.00 0.00 179.24 176.92 3hqp h SER 250 N 1.19 0.00 -0.13 6.45 4.64 -1.90 -3.24 113.55 120.57 3hqp h SER 250 Ca 0.34 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.44 3hqp h SER 250 Cb -0.10 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 61.99 3hqp h SER 250 CO -0.08 0.52 -0.74 0.40 -0.87 0.00 0.00 176.83 176.05 3hqp h ILE 251 N 0.00 1.28 -0.31 0.95 2.04 -0.94 -3.14 117.51 117.39 3hqp h ILE 251 Ca -0.01 -1.95 -0.10 0.00 1.00 0.00 0.00 64.86 63.80 3hqp h ILE 251 Cb 1.31 1.94 -0.01 0.00 -0.74 0.00 0.00 36.82 39.32 3hqp h ILE 251 CO 0.07 0.62 -0.22 0.40 0.00 0.00 0.00 178.15 179.02 3hqp h ILE 252 N 0.54 1.26 -0.83 -0.67 2.04 -1.34 -1.76 117.51 116.74 3hqp h ILE 252 Ca -0.04 -1.25 -0.03 0.00 1.00 0.00 0.00 64.86 64.54 3hqp h ILE 252 Cb 1.37 1.26 -0.04 0.00 -0.74 0.00 0.00 36.82 38.67 3hqp h ILE 252 CO 0.15 0.41 0.41 -0.08 0.00 0.00 0.00 178.15 179.04 3hqp h GLU 253 N 0.53 1.19 0.14 2.37 4.57 -1.58 -3.19 114.58 118.60 3hqp h GLU 253 Ca 0.08 -0.17 -0.31 0.00 -1.18 0.00 0.00 59.36 57.78 3hqp h GLU 253 Cb 0.66 -0.22 0.00 0.00 -0.16 0.00 0.00 28.75 29.04 3hqp h GLU 253 CO 0.05 0.91 -1.50 0.93 -1.18 0.00 0.00 179.01 178.21 3hqp h GLU 254 N 1.17 0.30 -7.64 1.92 4.39 -1.49 -3.47 114.58 109.76 3hqp h GLU 254 Ca 0.29 -0.51 -0.47 0.00 0.34 0.00 0.00 59.36 59.01 3hqp h GLU 254 Cb 0.10 0.19 0.11 0.00 -0.10 0.00 0.00 28.75 29.05 3hqp h GLU 254 CO -0.04 1.19 0.41 -1.54 -1.16 0.00 0.00 179.01 177.87 3hqp s SER 255 N -7.10 4.31 -0.13 1.42 1.04 -0.67 -4.99 113.70 107.57 3hqp s SER 255 Ca -0.09 0.73 0.16 0.00 0.48 0.00 0.00 55.95 57.23 3hqp s SER 255 Cb 0.06 -1.17 0.57 0.00 0.10 0.00 0.00 66.02 65.58 3hqp s SER 255 CO 0.87 -2.02 1.49 0.47 0.98 0.00 0.00 173.24 175.02 3hqp n ASP 256 N -3.39 4.17 0.00 7.02 9.92 -0.96 -4.90 116.55 128.42 3hqp n ASP 256 Ca 0.09 -2.64 0.00 0.00 -0.53 0.00 0.00 54.79 51.71 3hqp n ASP 256 Cb 0.61 -0.51 0.00 0.00 -0.64 0.00 0.00 41.12 40.58 3hqp n ASP 256 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3hqp n GLY 257 N 0.29 1.56 3.05 0.44 0.00 -1.26 -4.29 105.19 104.99 3hqp n GLY 257 Ca 0.21 -1.13 -0.16 0.00 0.00 0.00 0.00 46.02 44.95 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 0.68 -0.07 -0.61 -1.09 -0.71 -2.29 121.20 115.10 3hqp s ILE 258 Ca 0.00 -0.78 0.05 0.00 -2.23 0.00 0.00 60.65 57.69 3hqp s ILE 258 Cb 0.00 -0.65 -0.01 0.00 -1.58 0.00 0.00 42.46 40.22 3hqp s ILE 258 CO 0.00 -0.10 -0.24 -0.32 -1.23 0.00 0.00 174.94 173.05 3hqp s MET 259 N -0.97 2.69 -1.00 2.79 -2.45 0.25 -1.06 119.30 119.55 3hqp s MET 259 Ca -0.03 -0.88 -0.15 0.00 -1.25 0.00 0.00 55.69 53.38 3hqp s MET 259 Cb -0.07 -2.22 0.18 0.00 1.25 0.00 0.00 34.83 33.97 3hqp s MET 259 CO 0.00 0.34 1.13 0.08 1.05 0.00 0.00 175.02 177.63 3hqp s VAL 260 N -0.06 5.14 -1.21 10.11 1.01 0.12 -1.49 120.40 134.01 3hqp s VAL 260 Ca -0.06 -2.24 -0.20 0.00 0.00 0.00 0.00 61.98 59.47 3hqp s VAL 260 Cb -0.15 -4.73 0.04 0.00 0.00 0.00 0.00 36.38 31.54 3hqp s VAL 260 CO 0.05 -1.40 1.72 0.00 0.00 0.00 0.00 175.10 175.47 3hqp s ALA 261 N 1.42 2.90 0.34 5.51 0.00 -1.15 -2.34 121.76 128.44 3hqp s ALA 261 Ca 0.32 -2.61 0.13 0.00 0.00 0.00 0.00 51.96 49.80 3hqp s ALA 261 Cb -0.06 -4.63 0.67 0.00 0.00 0.00 0.00 23.12 19.10 3hqp s ALA 261 CO -0.07 -3.72 1.78 0.00 0.00 0.00 0.00 175.76 173.75 3hqp h ARG 262 N 8.51 0.00 0.40 0.00 3.08 -1.84 -1.83 114.38 122.71 3hqp h ARG 262 Ca 0.35 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.39 3hqp h ARG 262 Cb 0.91 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.94 3hqp h ARG 262 CO 1.41 0.42 -0.38 0.78 -1.07 0.00 0.00 179.97 181.12 3hqp h GLY 263 N 1.32 -0.91 1.73 0.04 0.00 -1.85 0.52 103.07 103.92 3hqp h GLY 263 Ca -0.00 0.43 -0.14 0.00 0.00 0.00 0.00 47.33 47.62 3hqp h GLY 263 CO 0.05 -0.32 -0.58 -0.55 0.00 0.00 0.00 176.54 175.15 3hqp h ASP 264 N -0.80 0.31 -0.63 0.19 3.32 -1.87 -3.23 116.42 113.72 3hqp h ASP 264 Ca -0.03 -0.17 -0.09 0.00 0.02 0.00 0.00 57.03 56.75 3hqp h ASP 264 Cb 0.70 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.14 3hqp h ASP 264 CO -0.05 0.83 0.04 0.25 -1.72 0.00 0.00 179.24 178.58 3hqp h LEU 265 N 0.21 1.06 -0.16 1.55 6.46 -1.12 -2.77 115.31 120.54 3hqp h LEU 265 Ca -0.00 -0.29 0.00 0.00 -0.12 0.00 0.00 57.88 57.47 3hqp h LEU 265 Cb 1.08 -0.28 0.00 0.00 -0.73 0.00 0.00 40.66 40.73 3hqp h LEU 265 CO 0.09 1.09 0.00 0.61 -0.62 0.00 0.00 178.44 179.61 3hqp n GLY 266 N -0.47 -0.88 0.14 3.75 0.00 0.18 -0.88 105.19 107.03 3hqp n GLY 266 Ca 0.03 -0.01 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.63 1.50 0.08 1.61 0.31 -1.14 -4.01 118.33 115.05 3hqp n VAL 267 Ca 0.02 -0.44 0.03 0.00 -0.01 0.00 0.00 64.34 63.93 3hqp n VAL 267 Cb 0.12 -1.72 0.40 0.00 -0.91 0.00 0.00 33.84 31.74 3hqp n VAL 267 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3hqp h GLU 268 N -0.66 0.34 -6.70 5.55 4.39 -1.34 -3.44 114.58 112.72 3hqp h GLU 268 Ca -0.66 -0.06 -0.65 0.00 0.34 0.00 0.00 59.36 58.33 3hqp h GLU 268 Cb 1.70 -0.06 -0.22 0.00 -0.10 0.00 0.00 28.75 30.08 3hqp h GLU 268 CO -0.31 0.37 -0.86 -1.50 -1.16 0.00 0.00 179.01 175.55 3hqp s ILE 269 N -4.99 2.13 0.21 3.13 1.10 -0.06 -4.72 121.20 118.00 3hqp s ILE 269 Ca -0.06 -1.73 -0.32 0.00 -0.51 0.00 0.00 60.65 58.02 3hqp s ILE 269 Cb 0.16 -1.90 -0.14 0.00 0.15 0.00 0.00 42.46 40.73 3hqp s ILE 269 CO 0.73 0.04 1.38 -2.65 -2.11 0.00 0.00 174.94 172.33 3hqp n PRO 270 N 0.90 1.84 -0.20 3.50 -0.02 -1.26 -4.44 135.00 135.31 3hqp n PRO 270 Ca -0.18 0.66 0.22 0.00 -2.02 0.00 0.00 63.50 62.17 3hqp n PRO 270 Cb 0.53 -2.30 0.59 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 4.31 2.41 0.00 3.55 0.00 -1.92 -0.27 119.26 127.34 3hqp h ALA 271 Ca -0.45 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.38 3hqp h ALA 271 Cb 1.29 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 3hqp h ALA 271 CO 0.77 -0.67 -0.41 1.05 0.00 0.00 0.00 179.25 179.98 3hqp h GLU 272 N 0.26 0.00 0.00 0.00 9.09 -1.94 -2.96 114.58 119.03 3hqp h GLU 272 Ca 0.44 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.85 3hqp h GLU 272 Cb 1.30 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.40 3hqp h GLU 272 CO -0.11 0.41 0.00 1.63 0.05 0.00 0.00 179.01 180.99 3hqp n LYS 273 N -3.60 0.22 -0.16 1.06 4.76 -0.11 -3.67 118.16 116.65 3hqp n LYS 273 Ca -0.00 0.32 -0.09 0.00 -2.87 0.00 0.00 58.31 55.66 3hqp n LYS 273 Cb 0.52 -1.83 -0.00 0.00 -1.84 0.00 0.00 35.03 31.88 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 1.24 -0.73 -0.18 2.07 -1.56 -0.35 116.25 116.74 3hqp h VAL 274 Ca 0.00 -0.86 -0.05 0.00 0.82 0.00 0.00 66.70 66.61 3hqp h VAL 274 Cb 0.54 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.19 3hqp h VAL 274 CO 0.00 0.30 0.26 0.58 0.02 0.00 0.00 177.57 178.73 3hqp h VAL 275 N 0.62 1.25 -0.10 2.57 2.07 -1.75 0.49 116.25 121.40 3hqp h VAL 275 Ca 0.14 -0.83 -0.02 0.00 0.82 0.00 0.00 66.70 66.82 3hqp h VAL 275 Cb 0.35 0.41 -0.00 0.00 -1.52 0.00 0.00 31.29 30.53 3hqp h VAL 275 CO 0.00 0.33 -0.00 0.58 0.02 0.00 0.00 177.57 178.50 3hqp h VAL 276 N 1.06 1.26 -0.99 2.57 2.07 -1.70 -2.77 116.25 117.76 3hqp h VAL 276 Ca 0.24 -0.81 0.02 0.00 0.82 0.00 0.00 66.70 66.96 3hqp h VAL 276 Cb 0.25 1.61 -0.05 0.00 -1.52 0.00 0.00 31.29 31.58 3hqp h VAL 276 CO -0.01 0.23 0.65 0.00 0.02 0.00 0.00 177.57 178.46 3hqp h ALA 277 N 0.73 1.31 -0.79 1.67 0.00 -0.83 -1.81 119.26 119.53 3hqp h ALA 277 Ca 0.03 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.90 3hqp h ALA 277 Cb 0.36 -0.39 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 3hqp h ALA 277 CO 0.01 0.62 0.52 0.37 0.00 0.00 0.00 179.25 180.77 3hqp h GLN 278 N 1.32 1.00 -0.52 0.00 4.15 -0.86 -0.51 115.11 119.68 3hqp h GLN 278 Ca 0.37 -0.06 -0.11 0.00 0.77 0.00 0.00 58.65 59.62 3hqp h GLN 278 Cb -0.11 -0.23 -0.02 0.00 0.21 0.00 0.00 27.48 27.34 3hqp h GLN 278 CO -0.09 0.66 -0.10 0.87 -1.93 0.00 0.00 178.83 178.24 3hqp h LYS 279 N 1.03 0.99 -0.15 1.69 1.57 -1.05 -2.41 116.57 118.24 3hqp h LYS 279 Ca 0.30 -0.37 -0.05 0.00 -1.87 0.00 0.00 60.65 58.66 3hqp h LYS 279 Cb -0.05 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.20 3hqp h LYS 279 CO -0.08 1.04 -0.12 0.82 -0.57 0.00 0.00 179.45 180.55 3hqp h ILE 280 N 0.85 1.33 -0.19 1.86 2.04 -0.98 -2.66 117.51 119.76 3hqp h ILE 280 Ca 0.14 -1.23 -0.01 0.00 1.00 0.00 0.00 64.86 64.75 3hqp h ILE 280 Cb 0.66 1.82 -0.01 0.00 -0.74 0.00 0.00 36.82 38.55 3hqp h ILE 280 CO 0.05 0.36 0.07 -0.07 0.00 0.00 0.00 178.15 178.56 3hqp h LEU 281 N -0.01 0.27 0.07 1.44 3.38 -1.14 -2.35 115.31 116.96 3hqp h LEU 281 Ca 0.03 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 3hqp h LEU 281 Cb 0.62 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.31 3hqp h LEU 281 CO 0.03 0.37 -0.03 0.40 0.09 0.00 0.00 178.44 179.30 3hqp h ILE 282 N 0.15 1.02 -0.88 1.22 2.04 -1.52 -2.97 117.51 116.57 3hqp h ILE 282 Ca 0.06 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.61 3hqp h ILE 282 Cb 0.19 1.23 -0.04 0.00 -0.74 0.00 0.00 36.82 37.46 3hqp h ILE 282 CO -0.00 0.08 0.55 0.28 0.00 0.00 0.00 178.15 179.05 3hqp h SER 283 N -0.23 1.04 0.18 1.72 0.02 -1.50 -2.27 113.55 112.51 3hqp h SER 283 Ca -0.01 -0.05 -0.03 0.00 -0.84 0.00 0.00 61.79 60.85 3hqp h SER 283 Cb 0.20 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 62.48 3hqp h SER 283 CO 0.02 0.78 -0.16 0.11 -1.14 0.00 0.00 176.83 176.43 3hqp h LYS 284 N 1.20 0.00 0.00 3.45 1.57 -1.42 -1.73 116.57 119.63 3hqp h LYS 284 Ca 0.32 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 59.02 3hqp h LYS 284 Cb -0.08 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 3hqp h LYS 284 CO -0.06 0.16 -0.36 0.00 -0.57 0.00 0.00 179.45 178.62 3hqp h ASN 286 N 0.00 0.59 0.31 0.00 -0.26 -0.79 -0.84 115.58 114.58 3hqp h ASN 286 Ca -0.00 -0.40 -0.24 0.00 -0.56 0.00 0.00 56.30 55.10 3hqp h ASN 286 Cb 1.24 -0.18 0.01 0.00 -1.06 0.00 0.00 38.32 38.33 3hqp h ASN 286 CO 0.05 1.16 -0.98 0.58 -1.06 0.00 0.00 177.43 177.17 3hqp h VAL 287 N 0.33 1.39 -0.02 2.81 2.07 -1.51 -3.27 116.25 118.05 3hqp h VAL 287 Ca -0.04 -2.46 -0.14 0.00 0.82 0.00 0.00 66.70 64.88 3hqp h VAL 287 Cb 1.36 2.45 -0.02 0.00 -1.52 0.00 0.00 31.29 33.56 3hqp h VAL 287 CO 0.14 0.74 -0.65 0.00 0.02 0.00 0.00 177.57 177.81 3hqp h ALA 288 N 0.68 0.89 0.00 1.67 0.00 -1.48 -3.48 119.26 117.54 3hqp h ALA 288 Ca -0.09 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.23 3hqp h ALA 288 Cb 1.62 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.32 3hqp h ALA 288 CO 0.17 0.80 0.00 0.41 0.00 0.00 0.00 179.25 180.63 3hqp n GLY 289 N 0.35 0.59 3.65 0.00 0.00 -0.39 -5.07 105.19 104.31 3hqp n GLY 289 Ca -0.02 -0.70 -0.33 0.00 0.00 0.00 0.00 46.02 44.97 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 -1.29 2.71 0.51 1.61 1.02 -0.77 -4.73 119.74 118.80 3hqp s LYS 290 Ca 0.00 -0.64 -0.23 0.00 0.02 0.00 0.00 55.97 55.13 3hqp s LYS 290 Cb 0.00 -2.61 -0.07 0.00 -0.52 0.00 0.00 37.83 34.63 3hqp s LYS 290 CO 0.00 0.62 1.32 -2.30 -0.92 0.00 0.00 175.35 174.08 3hqp n PRO 291 N 1.54 1.78 -4.45 -1.68 -0.02 -1.26 -4.47 135.00 126.44 3hqp n PRO 291 Ca -0.15 0.65 -0.22 0.00 -2.02 0.00 0.00 63.50 61.76 3hqp n PRO 291 Cb 0.53 -2.51 -0.16 0.00 -0.02 0.00 0.00 33.50 31.34 3hqp n PRO 291 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3hqp s VAL 292 N -1.27 0.89 -0.13 -1.45 0.11 -1.26 -1.74 120.40 115.55 3hqp s VAL 292 Ca 0.68 -0.40 0.01 0.00 -2.93 0.00 0.00 61.98 59.34 3hqp s VAL 292 Cb -0.44 -0.80 -0.01 0.00 -1.53 0.00 0.00 36.38 33.60 3hqp s VAL 292 CO 0.52 0.28 -0.16 -0.63 -3.33 0.00 0.00 175.10 171.79 3hqp s ILE 293 N 0.30 2.78 0.06 7.04 1.01 -0.22 -1.78 121.20 130.39 3hqp s ILE 293 Ca -0.06 -0.76 -0.20 0.00 0.00 0.00 0.00 60.65 59.64 3hqp s ILE 293 Cb -0.10 -2.15 -0.06 0.00 0.01 0.00 0.00 42.46 40.15 3hqp s ILE 293 CO 0.01 0.53 0.60 0.00 0.00 0.00 0.00 174.94 176.08 3hqp s ALA 295 N -0.87 0.73 0.49 0.00 0.00 -0.99 -1.98 121.76 119.14 3hqp s ALA 295 Ca 0.30 -1.29 0.00 0.00 0.00 0.00 0.00 51.96 50.97 3hqp s ALA 295 Cb -0.20 0.28 0.00 0.00 0.00 0.00 0.00 23.12 23.21 3hqp s ALA 295 CO 0.19 -0.33 0.00 -2.37 0.00 0.00 0.00 175.76 173.25 3hqp n THR 296 N 0.03 -5.44 -1.22 0.00 5.66 -1.25 -3.80 114.28 108.25 3hqp n THR 296 Ca -0.12 2.51 -0.08 0.00 -3.05 0.00 0.00 64.05 63.31 3hqp n THR 296 Cb 0.61 -3.39 -0.03 0.00 -1.55 0.00 0.00 70.33 65.97 3hqp n THR 296 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3hqp n GLN 297 N -0.48 -1.60 -2.68 1.09 6.02 -1.26 -4.74 117.38 113.73 3hqp n GLN 297 Ca 0.00 0.74 -0.43 0.00 -0.01 0.00 0.00 57.00 57.30 3hqp n GLN 297 Cb 0.00 -5.06 -0.02 0.00 1.02 0.00 0.00 30.24 26.18 3hqp n GLN 297 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 3hqp s MET 298 N -2.52 4.21 -1.21 -1.09 -1.94 -1.26 -3.42 119.30 112.07 3hqp s MET 298 Ca 0.00 1.26 -0.07 0.00 -1.71 0.00 0.00 55.69 55.16 3hqp s MET 298 Cb 0.00 -3.66 0.01 0.00 2.01 0.00 0.00 34.83 33.19 3hqp s MET 298 CO 0.00 -0.68 1.05 1.28 -0.01 0.00 0.00 175.02 176.67 3hqp n LEU 299 N 6.40 -3.31 -0.34 -0.03 4.77 -1.26 -4.86 117.00 118.37 3hqp n LEU 299 Ca 0.11 -0.49 0.01 0.00 -0.03 0.00 0.00 56.01 55.61 3hqp n LEU 299 Cb 0.46 -2.79 0.17 0.00 -2.33 0.00 0.00 43.42 38.94 3hqp n LEU 299 CO 0.53 0.57 1.27 -0.08 -1.33 0.00 0.00 177.39 178.36 3hqp h GLU 300 N -2.38 1.18 0.00 3.23 4.57 -1.97 -2.58 114.58 116.63 3hqp h GLU 300 Ca -0.51 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 57.60 3hqp h GLU 300 Cb 1.33 -0.27 0.00 0.00 -0.16 0.00 0.00 28.75 29.65 3hqp h GLU 300 CO 0.50 0.78 0.00 -1.13 -1.18 0.00 0.00 179.01 177.98 3hqp n SER 301 N -4.44 0.14 -0.17 1.04 3.41 -1.26 -2.85 113.62 109.50 3hqp n SER 301 Ca 0.13 0.53 0.07 0.00 -0.26 0.00 0.00 58.87 59.34 3hqp n SER 301 Cb 0.10 -0.56 0.37 0.00 -0.26 0.00 0.00 64.21 63.85 3hqp n SER 301 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3hqp n MET 302 N -1.65 1.22 0.24 4.33 2.81 -0.97 -1.57 117.12 121.54 3hqp n MET 302 Ca 0.04 -0.34 0.12 0.00 -1.81 0.00 0.00 57.70 55.72 3hqp n MET 302 Cb 0.23 -1.25 0.55 0.00 -0.71 0.00 0.00 33.22 32.04 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 0.64 0.41 0.00 2.03 2.02 -1.71 -3.36 112.91 112.94 3hqp h THR 303 Ca 0.00 -0.90 0.00 0.00 0.77 0.00 0.00 66.41 66.28 3hqp h THR 303 Cb 0.14 1.66 0.00 0.00 -1.74 0.00 0.00 68.15 68.21 3hqp h THR 303 CO 0.00 0.15 -0.59 -1.22 0.37 0.00 0.00 175.52 174.23 3hqp n TYR 304 N -3.34 0.00 -4.53 3.16 4.02 -1.14 -0.93 117.16 114.40 3hqp n TYR 304 Ca 0.00 0.00 -0.32 0.00 -0.01 0.00 0.00 57.90 57.57 3hqp n TYR 304 Cb 0.38 0.00 -0.11 0.00 -0.02 0.00 0.00 39.34 39.59 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 -1.50 4.44 0.36 7.72 0.02 -0.61 -4.97 114.94 120.41 3hqp s ASN 305 Ca 0.00 -0.19 0.27 0.00 -1.02 0.00 0.00 52.86 51.92 3hqp s ASN 305 Cb 0.00 -0.99 1.12 0.00 0.02 0.00 0.00 41.25 41.41 3hqp s ASN 305 CO 0.00 0.29 1.81 1.55 0.02 0.00 0.00 177.10 180.76 3hqp h PRO 306 N 4.61 0.00 -3.97 -0.60 0.13 -1.88 -3.38 132.00 126.92 3hqp h PRO 306 Ca -0.48 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.50 3hqp h PRO 306 Cb 1.16 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.11 3hqp h PRO 306 CO 0.52 0.00 -0.64 -0.98 -0.23 0.00 0.00 178.00 176.67 3hqp s ARG 307 N -3.44 0.45 0.61 0.86 1.70 -1.26 -4.87 118.95 113.00 3hqp s ARG 307 Ca 0.03 -0.77 -0.03 0.00 -0.47 0.00 0.00 55.73 54.49 3hqp s ARG 307 Cb 0.09 0.17 0.04 0.00 -0.57 0.00 0.00 34.95 34.68 3hqp s ARG 307 CO 0.44 -0.09 0.88 -1.25 -1.08 0.00 0.00 175.30 174.21 3hqp s PRO 308 N -2.28 2.44 0.79 3.89 0.04 -1.26 -4.71 135.00 133.90 3hqp s PRO 308 Ca -0.08 -0.49 -0.12 0.00 0.04 0.00 0.00 61.00 60.35 3hqp s PRO 308 Cb -0.04 -2.34 0.07 0.00 0.04 0.00 0.00 34.50 32.23 3hqp s PRO 308 CO -0.04 -0.92 1.16 0.95 0.04 0.00 0.00 177.00 178.19 3hqp s THR 309 N -2.98 2.32 0.35 1.26 -4.23 -1.26 -4.94 115.64 106.16 3hqp s THR 309 Ca 0.58 0.09 0.07 0.00 -1.18 0.00 0.00 61.69 61.25 3hqp s THR 309 Cb -0.10 -3.10 0.13 0.00 1.34 0.00 0.00 72.50 70.77 3hqp s THR 309 CO 0.42 -0.13 1.86 0.03 -0.54 0.00 0.00 174.62 176.25 3hqp h ARG 310 N -0.97 0.33 -0.36 3.99 2.47 -2.00 -2.73 114.38 115.11 3hqp h ARG 310 Ca -0.46 -0.09 -0.08 0.00 -1.26 0.00 0.00 59.98 58.09 3hqp h ARG 310 Cb 1.31 -0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 29.58 3hqp h ARG 310 CO 0.65 0.48 -0.12 0.00 0.56 0.00 0.00 179.97 181.55 3hqp h ALA 311 N 1.54 1.13 -0.03 0.04 0.00 -1.99 -2.56 119.26 117.39 3hqp h ALA 311 Ca 0.06 -0.29 -0.20 0.00 0.00 0.00 0.00 54.91 54.47 3hqp h ALA 311 Cb 0.45 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.10 3hqp h ALA 311 CO 0.03 0.55 -0.78 0.93 0.00 0.00 0.00 179.25 179.97 3hqp h GLU 312 N 0.57 0.58 -0.06 0.00 5.08 -1.88 -0.89 114.58 117.98 3hqp h GLU 312 Ca 0.10 -0.59 0.02 0.00 -1.00 0.00 0.00 59.36 57.89 3hqp h GLU 312 Cb 0.54 0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.93 3hqp h GLU 312 CO 0.03 1.20 -0.03 0.28 -1.00 0.00 0.00 179.01 179.49 3hqp h VAL 313 N 0.19 0.90 -0.85 3.13 2.07 -1.53 -1.55 116.25 118.60 3hqp h VAL 313 Ca -0.09 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.50 3hqp h VAL 313 Cb 1.45 0.90 -0.07 0.00 -1.52 0.00 0.00 31.29 32.05 3hqp h VAL 313 CO 0.16 0.00 0.52 -1.28 0.02 0.00 0.00 177.57 176.98 3hqp h SER 314 N -0.03 0.79 -0.53 0.57 0.87 -1.47 -1.38 113.55 112.37 3hqp h SER 314 Ca 0.04 0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.61 3hqp h SER 314 Cb 0.08 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 61.88 3hqp h SER 314 CO -0.08 0.49 0.28 -0.78 -0.53 0.00 0.00 176.83 176.21 3hqp h ASP 315 N 0.92 0.68 -0.48 6.23 3.58 -0.79 0.25 116.42 126.81 3hqp h ASP 315 Ca 0.38 -0.11 -0.13 0.00 0.42 0.00 0.00 57.03 57.60 3hqp h ASP 315 Cb 0.23 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 41.10 3hqp h ASP 315 CO -0.20 0.59 -0.20 0.58 -2.88 0.00 0.00 179.24 177.14 3hqp h VAL 316 N 0.71 1.27 -0.13 2.25 2.07 -0.94 -2.30 116.25 119.18 3hqp h VAL 316 Ca 0.18 -1.36 -0.05 0.00 0.82 0.00 0.00 66.70 66.30 3hqp h VAL 316 Cb 0.08 1.13 -0.00 0.00 -1.52 0.00 0.00 31.29 30.97 3hqp h VAL 316 CO -0.03 0.47 -0.09 0.00 0.02 0.00 0.00 177.57 177.94 3hqp h ALA 317 N 0.87 0.19 0.00 1.67 0.00 -1.11 -3.18 119.26 117.69 3hqp h ALA 317 Ca 0.11 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 3hqp h ALA 317 Cb 0.77 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 3hqp h ALA 317 CO 0.06 0.02 -0.18 -0.91 0.00 0.00 0.00 179.25 178.24 3hqp h ASN 318 N -0.07 0.00 -0.43 0.00 2.35 -0.98 -0.98 115.58 115.48 3hqp h ASN 318 Ca 0.03 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.75 3hqp h ASN 318 Cb 0.59 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.94 3hqp h ASN 318 CO 0.03 0.18 0.20 0.00 -1.65 0.00 0.00 177.43 176.19 3hqp h ALA 319 N 1.82 1.47 -0.04 -0.83 0.00 -1.39 0.22 119.26 120.50 3hqp h ALA 319 Ca -0.00 -0.12 -0.16 0.00 0.00 0.00 0.00 54.91 54.62 3hqp h ALA 319 Cb 0.44 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.05 3hqp h ALA 319 CO 0.02 0.42 -0.61 0.28 0.00 0.00 0.00 179.25 179.35 3hqp h VAL 320 N 0.67 1.39 -0.82 0.00 2.07 -1.21 -2.33 116.25 116.02 3hqp h VAL 320 Ca 0.16 -2.01 0.04 0.00 0.82 0.00 0.00 66.70 65.71 3hqp h VAL 320 Cb 0.12 2.43 -0.05 0.00 -1.52 0.00 0.00 31.29 32.27 3hqp h VAL 320 CO -0.02 0.60 0.54 -0.26 0.02 0.00 0.00 177.57 178.44 3hqp h PHE 321 N 0.03 0.97 -0.28 1.57 0.04 -1.14 -1.09 116.94 117.04 3hqp h PHE 321 Ca -0.07 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.72 3hqp h PHE 321 Cb 1.30 -0.32 -0.01 0.00 2.20 0.00 0.00 35.95 39.11 3hqp h PHE 321 CO 0.13 0.56 0.13 -0.91 -0.60 0.00 0.00 178.31 177.63 3hqp h ASN 322 N 1.00 0.33 0.00 2.17 -0.26 -0.99 -3.47 115.58 114.37 3hqp h ASN 322 Ca 0.33 -0.02 0.00 0.00 -0.56 0.00 0.00 56.30 56.05 3hqp h ASN 322 Cb 0.05 -0.08 0.00 0.00 -1.06 0.00 0.00 38.32 37.22 3hqp h ASN 322 CO -0.10 0.29 0.00 0.61 -1.06 0.00 0.00 177.43 177.17 3hqp n GLY 323 N -1.36 1.73 3.75 2.83 0.00 -0.41 -4.56 105.19 107.17 3hqp n GLY 323 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 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 3.35 0.06 4.61 0.00 -0.89 -4.89 121.76 122.01 3hqp s ALA 324 Ca 0.00 0.55 -0.18 0.00 0.00 0.00 0.00 51.96 52.33 3hqp s ALA 324 Cb 0.00 -3.16 -0.12 0.00 0.00 0.00 0.00 23.12 19.84 3hqp s ALA 324 CO 0.00 0.20 1.38 -0.44 0.00 0.00 0.00 175.76 176.89 3hqp h ASP 325 N 4.39 0.51 -4.23 0.00 5.19 -1.68 -3.44 116.42 117.15 3hqp h ASP 325 Ca -0.45 -0.47 -0.43 0.00 -0.62 0.00 0.00 57.03 55.06 3hqp h ASP 325 Cb 1.20 -0.14 -0.20 0.00 0.18 0.00 0.00 39.33 40.37 3hqp h ASP 325 CO 0.68 0.87 -0.77 0.00 -3.12 0.00 0.00 179.24 176.90 3hqp s VAL 327 N -1.71 1.72 -0.06 0.00 -7.23 -0.30 -2.05 120.40 110.77 3hqp s VAL 327 Ca 0.04 -0.84 0.03 0.00 -1.81 0.00 0.00 61.98 59.41 3hqp s VAL 327 Cb -0.07 -1.50 -0.02 0.00 0.56 0.00 0.00 36.38 35.35 3hqp s VAL 327 CO 0.03 0.48 -0.15 -0.32 -0.31 0.00 0.00 175.10 174.83 3hqp s MET 328 N 0.32 2.63 -0.27 4.82 0.00 -0.84 -1.62 119.30 124.35 3hqp s MET 328 Ca -0.14 -0.72 -0.09 0.00 0.00 0.00 0.00 55.69 54.75 3hqp s MET 328 Cb -0.16 -2.39 -0.03 0.00 0.00 0.00 0.00 34.83 32.25 3hqp s MET 328 CO 0.06 0.54 0.12 -0.51 0.00 0.00 0.00 175.02 175.22 3hqp s LEU 329 N -0.51 3.70 0.00 4.11 1.43 0.02 -3.88 118.68 123.55 3hqp s LEU 329 Ca 0.07 -0.19 0.00 0.00 -1.03 0.00 0.00 54.13 52.98 3hqp s LEU 329 Cb -0.12 -1.99 0.00 0.00 0.03 0.00 0.00 46.19 44.11 3hqp s LEU 329 CO 0.01 -0.06 0.00 -1.20 0.23 0.00 0.00 176.35 175.33 3hqp n SER 330 N 4.97 0.00 0.13 2.29 7.64 -1.26 -2.49 113.62 124.90 3hqp n SER 330 Ca -0.15 0.00 0.12 0.00 1.01 0.00 0.00 58.87 59.85 3hqp n SER 330 Cb 0.51 0.00 0.49 0.00 -1.01 0.00 0.00 64.21 64.20 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 3.60 -1.26 0.23 0.23 0.00 -1.26 -2.73 105.19 104.00 3hqp n GLY 331 Ca 0.00 0.09 -0.06 0.00 0.00 0.00 0.00 46.02 46.04 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 0.54 0.00 1.61 3.07 -1.90 -2.80 114.58 115.09 3hqp h GLU 332 Ca 0.00 -0.26 -0.27 0.00 -0.50 0.00 0.00 59.36 58.33 3hqp h GLU 332 Cb 0.35 -0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 28.20 3hqp h GLU 332 CO 0.00 0.83 -2.22 0.25 -1.40 0.00 0.00 179.01 176.47 3hqp n THR 333 N -4.04 1.08 0.31 1.13 -2.24 -1.19 -3.41 114.28 105.91 3hqp n THR 333 Ca -0.01 -0.77 -0.15 0.00 -2.27 0.00 0.00 64.05 60.85 3hqp n THR 333 Cb 0.50 -0.40 -0.07 0.00 -2.10 0.00 0.00 70.33 68.25 3hqp n THR 333 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hqp h ALA 334 N 1.24 -0.81 -1.00 6.98 0.00 -1.46 -3.38 119.26 120.83 3hqp h ALA 334 Ca -0.40 -0.20 -0.45 0.00 0.00 0.00 0.00 54.91 53.86 3hqp h ALA 334 Cb 1.93 0.31 -0.41 0.00 0.00 0.00 0.00 17.79 19.62 3hqp h ALA 334 CO 0.03 -0.81 -0.96 0.36 0.00 0.00 0.00 179.25 177.87 3hqp n LYS 335 N -5.34 2.48 -4.01 0.00 2.85 -1.06 -2.53 118.16 110.56 3hqp n LYS 335 Ca -0.11 -3.88 -0.22 0.00 -1.05 0.00 0.00 58.31 53.04 3hqp n LYS 335 Cb 0.35 -1.84 -0.03 0.00 -0.65 0.00 0.00 35.03 32.86 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 -3.48 1.37 0.05 2.58 0.00 -1.22 -4.94 107.32 101.67 3hqp s GLY 336 Ca 0.39 -1.24 0.08 0.00 0.00 0.00 0.00 44.72 43.94 3hqp s GLY 336 CO -0.05 -1.27 1.01 0.50 0.00 0.00 0.00 173.10 173.30 3hqp h LYS 337 N 1.48 0.02 -2.49 2.90 1.57 -1.28 -3.41 116.57 115.37 3hqp h LYS 337 Ca -0.50 -0.04 -0.60 0.00 -1.87 0.00 0.00 60.65 57.64 3hqp h LYS 337 Cb 1.22 0.01 -0.41 0.00 0.08 0.00 0.00 32.23 33.14 3hqp h LYS 337 CO 0.62 0.82 -0.69 0.66 -0.57 0.00 0.00 179.45 180.30 3hqp n TYR 338 N -3.24 2.59 0.08 -1.35 4.01 -1.26 -4.94 117.16 113.05 3hqp n TYR 338 Ca -0.08 -4.06 -0.08 0.00 -0.16 0.00 0.00 57.90 53.52 3hqp n TYR 338 Cb 0.99 -0.48 0.02 0.00 -0.31 0.00 0.00 39.34 39.57 3hqp n TYR 338 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 3hqp h PRO 339 N 4.70 0.25 0.05 -0.72 0.11 -1.80 -2.58 132.00 132.02 3hqp h PRO 339 Ca 0.17 -0.24 -0.23 0.00 0.11 0.00 0.00 66.00 65.81 3hqp h PRO 339 Cb 0.74 0.06 -0.00 0.00 0.11 0.00 0.00 31.00 31.91 3hqp h PRO 339 CO 0.71 0.93 -1.05 -0.91 -0.21 0.00 0.00 178.00 177.47 3hqp h ASN 340 N 0.16 0.34 0.57 -2.05 2.35 -1.92 -3.23 115.58 111.79 3hqp h ASN 340 Ca -0.04 -0.32 -0.18 0.00 -0.55 0.00 0.00 56.30 55.22 3hqp h ASN 340 Cb 1.40 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 39.65 3hqp h ASN 340 CO 0.13 1.18 -0.79 -0.33 -1.65 0.00 0.00 177.43 175.97 3hqp h GLU 341 N 0.10 0.17 -0.06 0.81 3.07 -1.94 -2.72 114.58 114.01 3hqp h GLU 341 Ca -0.08 -0.16 -0.17 0.00 -0.50 0.00 0.00 59.36 58.45 3hqp h GLU 341 Cb 1.73 0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 29.67 3hqp h GLU 341 CO 0.17 0.87 -0.70 -0.24 -1.40 0.00 0.00 179.01 177.70 3hqp h VAL 342 N 0.10 1.41 0.00 3.13 3.04 -1.56 -2.63 116.25 119.75 3hqp h VAL 342 Ca -0.03 -2.17 -0.26 0.00 -1.01 0.00 0.00 66.70 63.23 3hqp h VAL 342 Cb 1.38 2.14 0.02 0.00 -2.01 0.00 0.00 31.29 32.82 3hqp h VAL 342 CO 0.12 0.64 -1.04 0.58 -1.01 0.00 0.00 177.57 176.86 3hqp h VAL 343 N 0.20 1.29 -0.54 1.51 2.07 -1.59 -2.71 116.25 116.47 3hqp h VAL 343 Ca -0.02 -2.27 -0.02 0.00 0.82 0.00 0.00 66.70 65.21 3hqp h VAL 343 Cb 1.26 2.39 -0.02 0.00 -1.52 0.00 0.00 31.29 33.39 3hqp h VAL 343 CO 0.11 0.70 0.27 1.56 0.02 0.00 0.00 177.57 180.23 3hqp h GLN 344 N 0.38 0.78 -0.21 1.57 4.20 -1.50 0.04 115.11 120.36 3hqp h GLN 344 Ca -0.13 -0.11 -0.01 0.00 0.06 0.00 0.00 58.65 58.46 3hqp h GLN 344 Cb 1.69 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 29.32 3hqp h GLN 344 CO 0.20 0.64 0.09 1.88 -0.67 0.00 0.00 178.83 180.97 3hqp h TYR 345 N 0.73 0.32 -0.87 2.96 0.05 -1.55 -1.02 116.97 117.58 3hqp h TYR 345 Ca 0.19 -0.02 0.05 0.00 0.05 0.00 0.00 58.73 59.00 3hqp h TYR 345 Cb 0.11 -0.10 -0.06 0.00 1.01 0.00 0.00 36.73 37.69 3hqp h TYR 345 CO -0.01 0.34 0.55 1.98 -1.05 0.00 0.00 178.16 179.98 3hqp h MET 346 N 0.20 1.00 -0.55 4.88 4.05 -1.28 0.45 114.93 123.68 3hqp h MET 346 Ca 0.07 -0.06 -0.07 0.00 -0.28 0.00 0.00 59.70 59.37 3hqp h MET 346 Cb 0.15 -0.23 -0.02 0.00 -0.80 0.00 0.00 31.60 30.70 3hqp h MET 346 CO -0.01 0.66 0.07 0.00 0.23 0.00 0.00 176.91 177.87 3hqp h ALA 347 N 1.39 1.11 -0.38 0.39 0.00 -0.87 -1.80 119.26 119.09 3hqp h ALA 347 Ca 0.37 -0.24 -0.15 0.00 0.00 0.00 0.00 54.91 54.89 3hqp h ALA 347 Cb 0.11 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3hqp h ALA 347 CO -0.15 0.58 -0.34 -0.09 0.00 0.00 0.00 179.25 179.25 3hqp h ARG 348 N 0.83 0.88 -0.38 0.00 2.43 -0.06 -2.11 114.38 115.97 3hqp h ARG 348 Ca 0.17 -0.43 -0.10 0.00 -0.81 0.00 0.00 59.98 58.81 3hqp h ARG 348 Cb 0.39 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 3hqp h ARG 348 CO 0.01 1.08 -0.16 0.82 -1.51 0.00 0.00 179.97 180.21 3hqp h ILE 349 N 0.73 1.28 -0.86 1.20 2.04 -0.90 -2.62 117.51 118.39 3hqp h ILE 349 Ca 0.07 -1.28 -0.02 0.00 1.00 0.00 0.00 64.86 64.64 3hqp h ILE 349 Cb 0.91 1.30 -0.04 0.00 -0.74 0.00 0.00 36.82 38.25 3hqp h ILE 349 CO 0.08 0.42 0.46 0.00 0.00 0.00 0.00 178.15 179.12 3hqp h LEU 351 N 1.20 0.89 -0.25 0.00 3.38 -1.36 -2.14 115.31 117.02 3hqp h LEU 351 Ca 0.30 -0.08 -0.14 0.00 0.09 0.00 0.00 57.88 58.05 3hqp h LEU 351 Cb 0.04 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 3hqp h LEU 351 CO -0.05 0.71 -0.38 -0.08 0.09 0.00 0.00 178.44 178.73 3hqp h GLU 352 N 0.99 0.70 0.00 1.13 4.57 -0.95 -2.95 114.58 118.08 3hqp h GLU 352 Ca 0.25 -0.42 -0.07 0.00 -1.18 0.00 0.00 59.36 57.94 3hqp h GLU 352 Cb 0.01 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.63 3hqp h GLU 352 CO -0.04 1.04 -0.34 0.00 -1.18 0.00 0.00 179.01 178.49 3hqp h ALA 353 N 0.65 1.38 -0.72 2.92 0.00 -0.64 -2.68 119.26 120.17 3hqp h ALA 353 Ca 0.02 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.56 3hqp h ALA 353 Cb 0.98 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 3hqp h ALA 353 CO 0.09 0.43 0.22 0.37 0.00 0.00 0.00 179.25 180.35 3hqp h GLN 354 N 0.00 1.12 -0.33 0.00 4.15 -1.29 -1.30 115.11 117.46 3hqp h GLN 354 Ca -0.00 -0.24 -0.09 0.00 0.77 0.00 0.00 58.65 59.08 3hqp h GLN 354 Cb 0.63 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 28.14 3hqp h GLN 354 CO 0.04 0.95 -0.19 0.77 -1.93 0.00 0.00 178.83 178.48 3hqp h SER 355 N 1.07 0.61 1.02 -0.69 0.02 -1.31 -2.97 113.55 111.30 3hqp h SER 355 Ca 0.23 -0.19 -0.18 0.00 -0.84 0.00 0.00 61.79 60.81 3hqp h SER 355 Cb 0.31 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.66 3hqp h SER 355 CO -0.01 0.80 -0.85 0.00 -1.14 0.00 0.00 176.83 175.64 3hqp h ALA 356 N 1.25 0.51 -2.71 3.77 0.00 -1.38 -3.46 119.26 117.23 3hqp h ALA 356 Ca 0.09 -0.77 -0.53 0.00 0.00 0.00 0.00 54.91 53.70 3hqp h ALA 356 Cb 0.63 -0.14 0.06 0.00 0.00 0.00 0.00 17.79 18.34 3hqp h ALA 356 CO 0.04 1.06 0.85 -1.17 0.00 0.00 0.00 179.25 180.04 3hqp s LEU 357 N -6.80 4.37 -0.66 0.00 2.96 -0.50 -4.95 118.68 113.09 3hqp s LEU 357 Ca 0.01 2.74 -0.24 0.00 -0.22 0.00 0.00 54.13 56.42 3hqp s LEU 357 Cb 0.10 -3.62 0.06 0.00 0.50 0.00 0.00 46.19 43.23 3hqp s LEU 357 CO 0.80 -0.82 1.03 0.21 -1.32 0.00 0.00 176.35 176.25 3hqp s ASN 358 N 0.70 6.20 0.16 3.68 3.84 -1.26 -4.91 114.94 123.35 3hqp s ASN 358 Ca 0.65 -0.75 -0.11 0.00 0.21 0.00 0.00 52.86 52.86 3hqp s ASN 358 Cb -0.45 -2.45 0.04 0.00 -0.55 0.00 0.00 41.25 37.84 3hqp s ASN 358 CO 0.40 -1.49 1.61 -0.33 -2.79 0.00 0.00 177.10 174.50 3hqp h GLU 359 N 9.62 0.98 -0.51 0.43 3.07 -1.91 -2.86 114.58 123.40 3hqp h GLU 359 Ca -0.28 -0.32 -0.12 0.00 -0.50 0.00 0.00 59.36 58.13 3hqp h GLU 359 Cb 1.07 -0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 28.88 3hqp h GLU 359 CO 1.19 0.99 -0.16 -0.92 -1.40 0.00 0.00 179.01 178.71 3hqp h TYR 360 N 0.86 1.15 -0.07 4.33 3.20 -1.91 -2.01 116.97 122.52 3hqp h TYR 360 Ca 0.15 -0.26 -0.17 0.00 3.14 0.00 0.00 58.73 61.60 3hqp h TYR 360 Cb 0.56 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.55 3hqp h TYR 360 CO 0.04 1.08 -0.68 0.28 -1.64 0.00 0.00 178.16 177.24 3hqp h VAL 361 N 0.89 1.39 -0.31 1.81 2.07 -1.97 -2.59 116.25 117.54 3hqp h VAL 361 Ca 0.13 -2.11 -0.01 0.00 0.82 0.00 0.00 66.70 65.53 3hqp h VAL 361 Cb 0.74 2.08 -0.01 0.00 -1.52 0.00 0.00 31.29 32.58 3hqp h VAL 361 CO 0.06 0.63 0.14 0.15 0.02 0.00 0.00 177.57 178.57 3hqp h PHE 362 N 0.22 0.45 -0.81 1.57 -0.00 -1.37 -0.17 116.94 116.84 3hqp h PHE 362 Ca -0.02 -0.02 0.00 0.00 -0.00 0.00 0.00 57.97 57.93 3hqp h PHE 362 Cb 1.23 -0.14 -0.04 0.00 -0.00 0.00 0.00 35.95 37.00 3hqp h PHE 362 CO 0.03 0.41 0.52 0.35 -0.00 0.00 0.00 178.31 179.62 3hqp h PHE 363 N 0.36 1.03 -0.13 0.41 3.57 -1.36 -2.55 116.94 118.27 3hqp h PHE 363 Ca 0.11 0.02 -0.18 0.00 3.53 0.00 0.00 57.97 61.44 3hqp h PHE 363 Cb 0.13 -0.35 -0.00 0.00 2.79 0.00 0.00 35.95 38.52 3hqp h PHE 363 CO -0.02 0.66 -0.68 -0.91 -2.23 0.00 0.00 178.31 175.14 3hqp h ASN 364 N 1.10 0.62 -0.49 0.41 2.35 -1.28 -2.15 115.58 116.14 3hqp h ASN 364 Ca 0.29 -0.38 -0.04 0.00 -0.55 0.00 0.00 56.30 55.63 3hqp h ASN 364 Cb -0.10 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.07 3hqp h ASN 364 CO -0.06 1.12 0.14 0.28 -1.65 0.00 0.00 177.43 177.26 3hqp h SER 365 N 0.38 0.72 -0.10 5.81 0.02 -0.91 -2.06 113.55 117.41 3hqp h SER 365 Ca -0.02 -0.21 -0.03 0.00 -0.84 0.00 0.00 61.79 60.69 3hqp h SER 365 Cb 1.25 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 63.60 3hqp h SER 365 CO 0.12 0.74 -0.04 0.40 -1.14 0.00 0.00 176.83 176.92 3hqp h ILE 366 N 0.66 1.31 -0.87 3.27 2.04 -1.49 -2.87 117.51 119.55 3hqp h ILE 366 Ca 0.16 -1.02 0.11 0.00 1.00 0.00 0.00 64.86 65.10 3hqp h ILE 366 Cb 0.28 1.77 -0.08 0.00 -0.74 0.00 0.00 36.82 38.06 3hqp h ILE 366 CO -0.00 0.29 0.51 0.50 0.00 0.00 0.00 178.15 179.45 3hqp h LYS 367 N -0.13 0.80 0.00 2.37 3.64 -1.35 -2.14 116.57 119.75 3hqp h LYS 367 Ca 0.02 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.32 3hqp h LYS 367 Cb 0.48 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 3hqp h LYS 367 CO 0.01 0.53 -0.19 0.87 -2.27 0.00 0.00 179.45 178.41 3hqp h LYS 368 N 0.82 0.00 -0.53 1.90 6.56 -1.36 -3.15 116.57 120.81 3hqp h LYS 368 Ca 0.43 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 60.02 3hqp h LYS 368 Cb 0.43 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.09 3hqp h LYS 368 CO -0.27 0.19 0.00 1.28 -2.06 0.00 0.00 179.45 178.59 3hqp n LEU 369 N -3.28 2.87 -4.87 2.94 4.77 -0.81 -4.92 117.00 113.70 3hqp n LEU 369 Ca 0.01 -1.44 -0.32 0.00 -0.03 0.00 0.00 56.01 54.23 3hqp n LEU 369 Cb 0.45 -0.37 -0.05 0.00 -2.33 0.00 0.00 43.42 41.12 3hqp n LEU 369 CO 0.33 0.66 0.23 -1.10 -1.33 0.00 0.00 177.39 176.17 3hqp s GLN 370 N -1.42 3.83 -0.03 3.23 -1.52 -1.19 -5.06 119.66 117.49 3hqp s GLN 370 Ca 0.34 0.31 -0.30 0.00 -1.95 0.00 0.00 55.36 53.76 3hqp s GLN 370 Cb 0.19 -2.66 -0.03 0.00 -0.22 0.00 0.00 33.01 30.29 3hqp s GLN 370 CO 0.22 0.32 1.05 -1.58 -0.25 0.00 0.00 175.29 175.05 3hqp s HIS 371 N -1.79 3.52 -0.17 0.91 5.65 -1.26 -5.05 115.29 117.10 3hqp s HIS 371 Ca 0.47 1.54 -0.07 0.00 0.25 0.00 0.00 55.06 57.24 3hqp s HIS 371 Cb -0.11 -3.23 -0.04 0.00 -1.18 0.00 0.00 32.58 28.02 3hqp s HIS 371 CO 0.21 -0.45 0.08 0.42 -0.65 0.00 0.00 174.74 174.35 3hqp s ILE 372 N 1.48 4.94 0.53 0.89 -1.09 -1.26 -3.47 121.20 123.22 3hqp s ILE 372 Ca 0.52 0.02 -0.19 0.00 -2.23 0.00 0.00 60.65 58.77 3hqp s ILE 372 Cb -0.22 -3.21 -0.07 0.00 -1.58 0.00 0.00 42.46 37.38 3hqp s ILE 372 CO 0.24 0.48 1.06 -2.16 -1.23 0.00 0.00 174.94 173.34 3hqp s PRO 373 N 0.13 3.59 0.38 2.79 0.04 -1.26 -5.19 135.00 135.48 3hqp s PRO 373 Ca 0.06 1.36 -0.01 0.00 0.04 0.00 0.00 61.00 62.45 3hqp s PRO 373 Cb -0.12 -2.06 -0.03 0.00 0.04 0.00 0.00 34.50 32.32 3hqp s PRO 373 CO 0.00 -0.61 0.61 -1.64 0.04 0.00 0.00 177.00 175.41 3hqp s MET 374 N -3.48 3.50 0.67 4.56 -1.94 -1.23 -5.11 119.30 116.28 3hqp s MET 374 Ca 0.67 -0.19 -0.12 0.00 -1.71 0.00 0.00 55.69 54.34 3hqp s MET 374 Cb -0.17 -2.58 -0.00 0.00 2.01 0.00 0.00 34.83 34.08 3hqp s MET 374 CO 0.26 0.05 1.06 -1.54 -0.01 0.00 0.00 175.02 174.84 3hqp s SER 375 N -4.06 5.47 0.45 3.03 1.04 -1.26 -4.85 113.70 113.53 3hqp s SER 375 Ca 0.42 1.66 0.11 0.00 0.48 0.00 0.00 55.95 58.62 3hqp s SER 375 Cb -0.10 -2.50 1.03 0.00 0.10 0.00 0.00 66.02 64.55 3hqp s SER 375 CO 0.38 -1.38 2.07 0.00 0.98 0.00 0.00 173.24 175.30 3hqp h ALA 376 N -0.47 1.88 -0.14 5.32 0.00 -1.99 -0.94 119.26 122.91 3hqp h ALA 376 Ca -0.44 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3hqp h ALA 376 Cb 1.21 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 3hqp h ALA 376 CO 0.57 0.09 0.09 0.22 0.00 0.00 0.00 179.25 180.22 3hqp h ASP 377 N 0.35 0.17 0.14 0.00 -0.00 -1.93 -2.82 116.42 112.32 3hqp h ASP 377 Ca 0.13 -0.01 -0.30 0.00 -0.00 0.00 0.00 57.03 56.85 3hqp h ASP 377 Cb 0.10 -0.04 0.03 0.00 -0.00 0.00 0.00 39.33 39.42 3hqp h ASP 377 CO -0.03 0.13 -1.27 -0.08 -0.00 0.00 0.00 179.24 177.99 3hqp h GLU 378 N 0.19 0.61 -0.51 0.28 4.81 -1.76 -3.29 114.58 114.90 3hqp h GLU 378 Ca 0.05 -0.85 -0.06 0.00 -0.13 0.00 0.00 59.36 58.38 3hqp h GLU 378 Cb -0.01 0.29 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 3hqp h GLU 378 CO -0.01 1.39 0.09 0.00 -0.73 0.00 0.00 179.01 179.75 3hqp h ALA 379 N 0.26 1.19 -0.83 2.92 0.00 -1.27 -1.00 119.26 120.53 3hqp h ALA 379 Ca -0.20 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.51 3hqp h ALA 379 Cb 1.95 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 19.49 3hqp h ALA 379 CO 0.24 0.54 0.54 0.28 0.00 0.00 0.00 179.25 180.86 3hqp h VAL 380 N 0.77 1.18 -0.16 0.00 2.07 -1.59 -0.36 116.25 118.14 3hqp h VAL 380 Ca 0.16 -0.37 -0.21 0.00 0.82 0.00 0.00 66.70 67.11 3hqp h VAL 380 Cb 0.34 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.11 3hqp h VAL 380 CO 0.00 0.20 -0.71 0.00 0.02 0.00 0.00 177.57 177.08 3hqp h SER 382 N 0.50 1.12 1.38 0.00 0.87 -0.90 -2.11 113.55 114.41 3hqp h SER 382 Ca -0.03 -0.12 -0.13 0.00 -1.23 0.00 0.00 61.79 60.28 3hqp h SER 382 Cb 1.32 -0.29 -0.02 0.00 -0.44 0.00 0.00 62.40 62.98 3hqp h SER 382 CO 0.14 0.92 -0.62 0.28 -0.53 0.00 0.00 176.83 177.02 3hqp h SER 383 N 1.24 0.00 -0.60 6.23 0.02 -1.07 -2.79 113.55 116.59 3hqp h SER 383 Ca 0.31 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 61.19 3hqp h SER 383 Cb 0.07 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.58 3hqp h SER 383 CO -0.05 0.62 0.12 0.00 -1.14 0.00 0.00 176.83 176.38 3hqp h ALA 384 N 1.38 0.79 -0.03 3.77 0.00 -0.72 0.00 119.26 124.45 3hqp h ALA 384 Ca -0.01 -0.24 -0.18 0.00 0.00 0.00 0.00 54.91 54.48 3hqp h ALA 384 Cb 1.47 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 3hqp h ALA 384 CO 0.08 0.52 -0.78 0.28 0.00 0.00 0.00 179.25 179.35 3hqp h VAL 385 N 0.88 1.44 -0.80 0.00 2.07 -1.47 -2.96 116.25 115.41 3hqp h VAL 385 Ca 0.18 -2.36 0.01 0.00 0.82 0.00 0.00 66.70 65.35 3hqp h VAL 385 Cb 0.39 2.28 -0.04 0.00 -1.52 0.00 0.00 31.29 32.40 3hqp h VAL 385 CO 0.01 0.69 0.52 -1.13 0.02 0.00 0.00 177.57 177.68 3hqp h ASN 386 N 0.16 0.92 -0.85 0.57 -0.00 -1.19 -2.35 115.58 112.84 3hqp h ASN 386 Ca -0.03 -0.03 0.02 0.00 -0.00 0.00 0.00 56.30 56.26 3hqp h ASN 386 Cb 1.37 -0.23 -0.04 0.00 -0.00 0.00 0.00 38.32 39.41 3hqp h ASN 386 CO 0.12 0.67 0.56 0.28 -0.00 0.00 0.00 177.43 179.06 3hqp h SER 387 N 1.08 0.95 0.01 1.15 0.02 -0.97 -2.55 113.55 113.23 3hqp h SER 387 Ca 0.29 -0.02 0.03 0.00 -0.84 0.00 0.00 61.79 61.25 3hqp h SER 387 Cb -0.12 -0.23 -0.04 0.00 0.14 0.00 0.00 62.40 62.15 3hqp h SER 387 CO -0.06 0.68 -0.25 0.58 -1.14 0.00 0.00 176.83 176.64 3hqp h VAL 388 N 1.12 0.44 -0.28 2.27 2.07 -1.26 0.75 116.25 121.36 3hqp h VAL 388 Ca 0.32 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.77 3hqp h VAL 388 Cb -0.09 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.11 3hqp h VAL 388 CO -0.08 0.00 -0.11 1.88 0.02 0.00 0.00 177.57 179.27 3hqp h TYR 389 N -0.39 0.50 -0.31 1.57 0.05 -1.50 0.11 116.97 117.00 3hqp h TYR 389 Ca 0.06 -0.07 -0.16 0.00 0.05 0.00 0.00 58.73 58.61 3hqp h TYR 389 Cb 0.47 -0.14 -0.01 0.00 1.01 0.00 0.00 36.73 38.06 3hqp h TYR 389 CO -0.28 0.57 -0.43 0.93 -1.05 0.00 0.00 178.16 177.90 3hqp h GLU 390 N 0.43 0.78 -0.01 4.88 5.08 -0.99 -3.29 114.58 121.46 3hqp h GLU 390 Ca 0.08 -0.42 0.00 0.00 -1.00 0.00 0.00 59.36 58.02 3hqp h GLU 390 Cb 0.46 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.73 3hqp h GLU 390 CO 0.03 1.05 -0.48 -2.37 -1.00 0.00 0.00 179.01 176.23 3hqp n THR 391 N -4.03 0.00 -3.58 1.13 5.66 0.21 -4.99 114.28 108.69 3hqp n THR 391 Ca -0.02 -0.26 -0.20 0.00 -3.05 0.00 0.00 64.05 60.52 3hqp n THR 391 Cb 0.56 1.22 0.07 0.00 -1.55 0.00 0.00 70.33 70.62 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 -0.18 -6.17 -2.28 1.09 5.02 0.32 -4.92 118.16 111.04 3hqp n LYS 392 Ca 0.08 0.75 -0.38 0.00 -2.02 0.00 0.00 58.31 56.74 3hqp n LYS 392 Cb 0.42 -5.62 -0.02 0.00 -0.02 0.00 0.00 35.03 29.79 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 -3.45 3.18 -1.57 7.82 0.00 -0.79 -4.84 121.76 122.10 3hqp s ALA 393 Ca 0.13 0.99 0.20 0.00 0.00 0.00 0.00 51.96 53.27 3hqp s ALA 393 Cb -0.06 -3.39 -0.06 0.00 0.00 0.00 0.00 23.12 19.61 3hqp s ALA 393 CO 0.76 -0.54 0.95 1.63 0.00 0.00 0.00 175.76 178.56 3hqp n LYS 394 N 0.13 1.22 -3.87 0.00 5.02 -1.23 -4.74 118.16 114.69 3hqp n LYS 394 Ca 0.04 -0.67 -0.09 0.00 -2.02 0.00 0.00 58.31 55.56 3hqp n LYS 394 Cb 0.46 -1.40 -0.06 0.00 -0.02 0.00 0.00 35.03 34.02 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 -2.40 -0.41 -0.14 7.82 0.00 -1.26 -4.25 121.76 121.11 3hqp s ALA 395 Ca 0.14 -0.60 -0.05 0.00 0.00 0.00 0.00 51.96 51.45 3hqp s ALA 395 Cb 0.16 0.86 0.06 0.00 0.00 0.00 0.00 23.12 24.20 3hqp s ALA 395 CO 0.58 -0.72 0.29 1.41 0.00 0.00 0.00 175.76 177.32 3hqp s MET 396 N -3.93 0.20 -0.22 0.00 1.75 -1.01 -3.49 119.30 112.60 3hqp s MET 396 Ca 0.14 0.76 -0.06 0.00 -1.25 0.00 0.00 55.69 55.28 3hqp s MET 396 Cb 0.01 0.01 -0.02 0.00 2.84 0.00 0.00 34.83 37.67 3hqp s MET 396 CO -0.01 -0.25 0.02 0.08 -0.65 0.00 0.00 175.02 174.21 3hqp s VAL 397 N 2.16 3.99 0.07 10.11 1.01 -0.65 -0.26 120.40 136.83 3hqp s VAL 397 Ca -0.02 -0.29 0.10 0.00 0.00 0.00 0.00 61.98 61.77 3hqp s VAL 397 Cb -0.11 -2.84 -0.03 0.00 0.00 0.00 0.00 36.38 33.40 3hqp s VAL 397 CO -0.09 0.39 -0.26 0.68 0.00 0.00 0.00 175.10 175.82 3hqp s VAL 398 N 1.34 2.22 -0.22 2.92 -7.23 -0.80 -1.24 120.40 117.40 3hqp s VAL 398 Ca 0.04 -1.48 -0.10 0.00 -1.81 0.00 0.00 61.98 58.63 3hqp s VAL 398 Cb -0.15 -1.90 -0.05 0.00 0.56 0.00 0.00 36.38 34.84 3hqp s VAL 398 CO 0.01 0.29 0.13 -0.76 -0.31 0.00 0.00 175.10 174.46 3hqp s LEU 399 N -1.49 4.08 -0.19 1.32 1.43 -1.24 -1.44 118.68 121.16 3hqp s LEU 399 Ca 0.13 0.13 -0.08 0.00 -1.03 0.00 0.00 54.13 53.28 3hqp s LEU 399 Cb -0.10 -2.07 0.08 0.00 0.03 0.00 0.00 46.19 44.12 3hqp s LEU 399 CO 0.03 0.11 0.42 -0.55 0.23 0.00 0.00 176.35 176.60 3hqp s SER 400 N 0.75 -0.35 -0.09 2.29 0.15 -1.15 -4.86 113.70 110.44 3hqp s SER 400 Ca 0.07 0.95 -0.05 0.00 0.70 0.00 0.00 55.95 57.62 3hqp s SER 400 Cb -0.13 1.11 -0.02 0.00 -1.71 0.00 0.00 66.02 65.28 3hqp s SER 400 CO 0.02 -0.22 -0.11 0.78 1.20 0.00 0.00 173.24 174.91 3hqp h ASN 401 N 7.76 0.00 -4.14 5.45 -0.26 -1.98 -3.36 115.58 119.04 3hqp h ASN 401 Ca -0.24 0.00 -0.47 0.00 -0.56 0.00 0.00 56.30 55.03 3hqp h ASN 401 Cb 1.14 0.00 0.01 0.00 -1.06 0.00 0.00 38.32 38.41 3hqp h ASN 401 CO 0.19 0.46 0.35 0.42 -1.06 0.00 0.00 177.43 177.79 3hqp s THR 402 N -1.75 4.53 -2.00 2.81 -4.23 -1.26 -4.54 115.64 109.20 3hqp s THR 402 Ca -0.09 1.22 0.11 0.00 -1.18 0.00 0.00 61.69 61.76 3hqp s THR 402 Cb 0.01 -3.70 0.31 0.00 1.34 0.00 0.00 72.50 70.46 3hqp s THR 402 CO 0.13 -0.62 1.08 0.61 -0.54 0.00 0.00 174.62 175.28 3hqp n GLY 403 N -1.42 -0.39 0.17 3.99 0.00 -1.26 -4.00 105.19 102.28 3hqp n GLY 403 Ca 0.06 -0.07 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 3hqp n GLY 403 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3hqp h ARG 404 N 0.00 0.52 -0.04 1.61 3.08 -1.98 -1.87 114.38 115.71 3hqp h ARG 404 Ca 0.00 -0.21 -0.12 0.00 0.07 0.00 0.00 59.98 59.72 3hqp h ARG 404 Cb 0.00 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 3hqp h ARG 404 CO 0.00 0.76 -0.53 0.77 -1.07 0.00 0.00 179.97 179.89 3hqp h SER 405 N 0.25 0.11 -0.08 7.04 0.02 -1.93 -1.47 113.55 117.49 3hqp h SER 405 Ca 0.06 -0.06 -0.18 0.00 -0.84 0.00 0.00 61.79 60.78 3hqp h SER 405 Cb 0.58 -0.03 -0.00 0.00 0.14 0.00 0.00 62.40 63.09 3hqp h SER 405 CO 0.03 0.63 -0.58 0.00 -1.14 0.00 0.00 176.83 175.77 3hqp h ALA 406 N 1.38 0.58 0.00 3.77 0.00 -1.80 -2.80 119.26 120.39 3hqp h ALA 406 Ca -0.00 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.38 3hqp h ALA 406 Cb 0.97 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.68 3hqp h ALA 406 CO 0.07 0.69 0.00 0.00 0.00 0.00 0.00 179.25 180.02 3hqp h ARG 407 N 0.51 0.00 0.00 0.00 3.08 -1.21 -2.47 114.38 114.30 3hqp h ARG 407 Ca 0.00 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 59.87 3hqp h ARG 407 Cb 1.15 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.17 3hqp h ARG 407 CO 0.12 0.00 -0.91 1.25 -1.07 0.00 0.00 179.97 179.36 3hqp h LEU 408 N 0.00 0.00 0.03 3.04 5.85 -1.20 -2.37 115.31 120.66 3hqp h LEU 408 Ca 0.00 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.63 3hqp h LEU 408 Cb 0.79 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.83 3hqp h LEU 408 CO 0.00 0.86 -0.37 0.58 -0.34 0.00 0.00 178.44 179.17 3hqp h VAL 409 N 0.00 1.57 0.00 1.05 2.07 -1.43 -3.30 116.25 116.21 3hqp h VAL 409 Ca -0.02 -2.16 -0.03 0.00 0.82 0.00 0.00 66.70 65.31 3hqp h VAL 409 Cb 1.67 2.95 -0.00 0.00 -1.52 0.00 0.00 31.29 34.39 3hqp h VAL 409 CO 0.11 0.59 -0.13 0.00 0.02 0.00 0.00 177.57 178.17 3hqp h ALA 410 N 0.18 1.50 -0.97 1.67 0.00 -1.55 -2.57 119.26 117.53 3hqp h ALA 410 Ca -0.05 -0.11 0.14 0.00 0.00 0.00 0.00 54.91 54.88 3hqp h ALA 410 Cb 1.18 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.86 3hqp h ALA 410 CO 0.07 0.16 0.59 -0.22 0.00 0.00 0.00 179.25 179.85 3hqp h LYS 411 N 0.00 0.86 -0.42 0.00 3.64 -1.50 -2.24 116.57 116.91 3hqp h LYS 411 Ca -0.00 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 3hqp h LYS 411 Cb 0.28 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 3hqp h LYS 411 CO 0.02 0.57 0.00 0.66 -2.27 0.00 0.00 179.45 178.42 3hqp n TYR 412 N -4.69 0.54 -3.55 1.91 4.01 -0.97 -4.99 117.16 109.42 3hqp n TYR 412 Ca 0.19 -0.24 -0.17 0.00 -0.16 0.00 0.00 57.90 57.52 3hqp n TYR 412 Cb 0.41 -0.05 0.00 0.00 -0.31 0.00 0.00 39.34 39.39 3hqp n TYR 412 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3hqp n ARG 413 N 0.46 -1.44 -1.51 -0.72 5.12 -0.84 -4.40 116.66 113.33 3hqp n ARG 413 Ca 0.12 0.99 -0.29 0.00 -1.93 0.00 0.00 57.85 56.73 3hqp n ARG 413 Cb 0.35 -3.51 0.16 0.00 -1.16 0.00 0.00 32.46 28.30 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 -4.36 0.73 -0.21 5.56 0.04 -1.26 -4.44 135.00 131.05 3hqp s PRO 414 Ca 0.02 0.17 0.15 0.00 0.04 0.00 0.00 61.00 61.38 3hqp s PRO 414 Cb -0.01 -1.80 0.77 0.00 0.04 0.00 0.00 34.50 33.49 3hqp s PRO 414 CO 0.85 -2.45 1.69 0.27 0.04 0.00 0.00 177.00 177.39 3hqp n ASN 415 N -3.92 5.33 -4.08 6.66 6.94 -1.26 -4.95 115.26 119.98 3hqp n ASN 415 Ca 0.08 -2.85 -0.07 0.00 -0.02 0.00 0.00 54.58 51.72 3hqp n ASN 415 Cb 0.59 -0.65 -0.10 0.00 -2.36 0.00 0.00 39.78 37.27 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 -3.63 2.70 -0.37 0.00 0.02 -1.26 -4.85 135.00 127.61 3hqp s PRO 417 Ca 0.04 1.95 -0.07 0.00 0.02 0.00 0.00 61.00 62.94 3hqp s PRO 417 Cb 0.06 -1.88 0.06 0.00 0.02 0.00 0.00 34.50 32.76 3hqp s PRO 417 CO -0.09 -1.45 0.16 0.42 -0.33 0.00 0.00 177.00 175.71 3hqp s ILE 418 N -1.51 3.84 -0.57 2.83 1.01 -0.85 -2.39 121.20 123.56 3hqp s ILE 418 Ca 0.80 -1.30 -0.22 0.00 0.00 0.00 0.00 60.65 59.93 3hqp s ILE 418 Cb -0.34 -3.27 0.06 0.00 0.01 0.00 0.00 42.46 38.92 3hqp s ILE 418 CO 0.37 -0.32 0.83 -0.69 0.00 0.00 0.00 174.94 175.13 3hqp s VAL 419 N 1.38 4.56 -0.15 2.92 1.01 0.64 -0.54 120.40 130.20 3hqp s VAL 419 Ca 0.01 -0.23 -0.16 0.00 0.00 0.00 0.00 61.98 61.59 3hqp s VAL 419 Cb -0.21 -4.50 -0.04 0.00 0.00 0.00 0.00 36.38 31.63 3hqp s VAL 419 CO 0.02 -1.11 0.39 0.00 0.00 0.00 0.00 175.10 174.40 3hqp s VAL 421 N 0.75 4.01 -0.06 0.00 1.01 -0.52 0.35 120.40 125.95 3hqp s VAL 421 Ca 0.21 -1.12 0.05 0.00 0.00 0.00 0.00 61.98 61.12 3hqp s VAL 421 Cb -0.14 -3.30 -0.01 0.00 0.00 0.00 0.00 36.38 32.94 3hqp s VAL 421 CO 0.07 -0.24 -0.22 0.28 0.00 0.00 0.00 175.10 174.99 3hqp s THR 422 N 1.43 1.82 0.21 3.92 -1.32 -0.01 -2.96 115.64 118.73 3hqp s THR 422 Ca -0.00 -0.92 0.08 0.00 -1.21 0.00 0.00 61.69 59.64 3hqp s THR 422 Cb -0.20 -1.55 -0.10 0.00 -1.51 0.00 0.00 72.50 69.14 3hqp s THR 422 CO 0.03 0.51 1.48 0.71 -2.21 0.00 0.00 174.62 175.14 3hqp h THR 423 N 5.23 1.53 -3.61 5.08 1.35 -1.73 -2.34 112.91 118.42 3hqp h THR 423 Ca -0.31 -2.58 -0.51 0.00 -0.55 0.00 0.00 66.41 62.46 3hqp h THR 423 Cb 1.18 2.40 -0.02 0.00 -1.73 0.00 0.00 68.15 69.98 3hqp h THR 423 CO 0.47 0.74 0.38 -0.13 -0.25 0.00 0.00 175.52 176.73 3hqp s ARG 424 N -3.29 4.72 0.14 4.72 3.00 -1.26 -4.70 118.95 122.27 3hqp s ARG 424 Ca -0.01 1.51 0.08 0.00 0.00 0.00 0.00 55.73 57.30 3hqp s ARG 424 Cb 0.11 -3.34 -0.17 0.00 0.00 0.00 0.00 34.95 31.56 3hqp s ARG 424 CO 0.79 0.26 1.30 1.25 0.00 0.00 0.00 175.30 178.90 3hqp h LEU 425 N 5.17 0.00 -0.61 2.53 5.85 -1.96 -3.24 115.31 123.05 3hqp h LEU 425 Ca -0.44 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.15 3hqp h LEU 425 Cb 1.21 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.23 3hqp h LEU 425 CO 0.71 0.95 -0.31 -0.61 -0.34 0.00 0.00 178.44 178.84 3hqp h GLN 426 N 0.00 0.76 -0.68 1.25 4.15 -1.98 -3.00 115.11 115.61 3hqp h GLN 426 Ca -0.01 -0.35 -0.03 0.00 0.77 0.00 0.00 58.65 59.03 3hqp h GLN 426 Cb 1.72 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 29.37 3hqp h GLN 426 CO 0.12 0.97 0.29 1.15 -1.93 0.00 0.00 178.83 179.43 3hqp h THR 427 N 0.64 1.23 -0.97 2.39 2.02 -1.87 0.33 112.91 116.67 3hqp h THR 427 Ca 0.07 -0.69 0.16 0.00 0.77 0.00 0.00 66.41 66.71 3hqp h THR 427 Cb 0.84 0.40 -0.09 0.00 -1.74 0.00 0.00 68.15 67.57 3hqp h THR 427 CO 0.07 0.28 0.61 0.00 0.37 0.00 0.00 175.52 176.86 3hqp h ARG 429 N 0.81 0.39 0.00 0.00 3.08 -1.47 -3.36 114.38 113.83 3hqp h ARG 429 Ca 0.51 -0.66 -0.01 0.00 0.07 0.00 0.00 59.98 59.90 3hqp h ARG 429 Cb 0.73 0.25 -0.00 0.00 0.08 0.00 0.00 29.97 31.03 3hqp h ARG 429 CO -0.29 1.32 -0.03 1.96 -1.07 0.00 0.00 179.97 181.86 3hqp h GLN 430 N 0.05 0.00 -0.04 0.04 4.20 -0.55 -1.48 115.11 117.33 3hqp h GLN 430 Ca -0.33 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.38 3hqp h GLN 430 Cb 2.05 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.83 3hqp h GLN 430 CO 0.17 0.03 0.00 1.28 -0.67 0.00 0.00 178.83 179.64 3hqp n LEU 431 N -3.25 0.87 0.00 1.46 4.77 -0.45 -3.67 117.00 116.73 3hqp n LEU 431 Ca -0.01 -0.32 0.10 0.00 -0.03 0.00 0.00 56.01 55.75 3hqp n LEU 431 Cb 0.19 -0.03 0.49 0.00 -2.33 0.00 0.00 43.42 41.75 3hqp n LEU 431 CO 0.25 0.16 0.84 0.59 -1.33 0.00 0.00 177.39 177.91 3hqp n ASN 432 N -0.27 0.00 -1.27 -1.43 3.02 -0.56 -1.99 115.26 112.76 3hqp n ASN 432 Ca 0.19 0.33 0.12 0.00 -0.03 0.00 0.00 54.58 55.19 3hqp n ASN 432 Cb 0.23 -0.43 0.28 0.00 -0.61 0.00 0.00 39.78 39.25 3hqp n ASN 432 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 3hqp n ILE 433 N -1.43 0.81 -4.24 2.41 -5.35 -1.24 -4.71 119.36 105.60 3hqp n ILE 433 Ca 0.07 -0.90 -0.34 0.00 -0.27 0.00 0.00 62.75 61.30 3hqp n ILE 433 Cb 0.23 0.69 -0.13 0.00 -1.74 0.00 0.00 39.64 38.69 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 -1.18 3.84 0.35 7.28 2.01 -0.84 -4.65 115.64 122.45 3hqp s THR 434 Ca 0.45 -0.36 -0.28 0.00 0.31 0.00 0.00 61.69 61.80 3hqp s THR 434 Cb 0.24 -2.71 -0.11 0.00 0.01 0.00 0.00 72.50 69.94 3hqp s THR 434 CO 0.33 0.46 1.41 -1.58 -0.69 0.00 0.00 174.62 174.54 3hqp s GLN 435 N 0.71 4.23 0.00 4.92 -0.44 -1.26 -3.77 119.66 124.05 3hqp s GLN 435 Ca -0.01 2.40 0.00 0.00 -2.50 0.00 0.00 55.36 55.25 3hqp s GLN 435 Cb -0.14 -3.02 0.00 0.00 -1.64 0.00 0.00 33.01 28.21 3hqp s GLN 435 CO 0.02 -0.38 0.00 0.41 0.50 0.00 0.00 175.29 175.85 3hqp n GLY 436 N 0.70 2.88 3.74 2.59 0.00 0.22 -4.83 105.19 110.48 3hqp n GLY 436 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.79 4.90 -0.12 1.61 1.01 -1.25 -2.00 120.40 123.76 3hqp s VAL 437 Ca 0.00 1.42 0.01 0.00 0.00 0.00 0.00 61.98 63.42 3hqp s VAL 437 Cb 0.00 -4.02 0.02 0.00 0.00 0.00 0.00 36.38 32.38 3hqp s VAL 437 CO 0.00 0.35 -0.15 -1.61 0.00 0.00 0.00 175.10 173.68 3hqp s GLU 438 N 0.19 2.25 0.15 2.72 2.02 0.29 -4.89 118.70 121.43 3hqp s GLU 438 Ca 0.35 -0.57 -0.11 0.00 0.02 0.00 0.00 54.97 54.67 3hqp s GLU 438 Cb -0.19 -1.95 -0.07 0.00 0.10 0.00 0.00 34.13 32.03 3hqp s GLU 438 CO 0.19 -0.10 0.49 -1.12 0.02 0.00 0.00 175.26 174.74 3hqp s SER 439 N 1.10 6.68 -0.09 -0.19 0.01 -1.26 -0.66 113.70 119.30 3hqp s SER 439 Ca -0.04 0.91 -0.00 0.00 1.31 0.00 0.00 55.95 58.12 3hqp s SER 439 Cb -0.14 -2.22 0.02 0.00 0.21 0.00 0.00 66.02 63.89 3hqp s SER 439 CO -0.04 0.07 -0.06 -0.69 0.41 0.00 0.00 173.24 172.93 3hqp s VAL 440 N -1.57 0.81 0.03 3.43 1.01 0.16 -4.91 120.40 119.35 3hqp s VAL 440 Ca 0.40 -0.18 -0.30 0.00 0.00 0.00 0.00 61.98 61.89 3hqp s VAL 440 Cb -0.13 -0.85 -0.04 0.00 0.00 0.00 0.00 36.38 35.36 3hqp s VAL 440 CO 0.20 0.32 1.03 0.12 0.00 0.00 0.00 175.10 176.77 3hqp s PHE 441 N 1.56 3.63 -0.25 5.22 5.36 -1.26 -0.83 117.98 131.41 3hqp s PHE 441 Ca 0.01 1.62 0.01 0.00 -0.96 0.00 0.00 56.93 57.60 3hqp s PHE 441 Cb -0.13 -3.18 0.07 0.00 -0.34 0.00 0.00 43.02 39.43 3hqp s PHE 441 CO -0.05 -0.28 -0.02 0.12 -1.46 0.00 0.00 175.22 173.53 3hqp s PHE 442 N 0.87 2.32 0.16 10.12 5.36 -0.88 -4.92 117.98 131.00 3hqp s PHE 442 Ca 0.53 -1.79 -0.31 0.00 -0.96 0.00 0.00 56.93 54.40 3hqp s PHE 442 Cb -0.23 -1.67 -0.09 0.00 -0.34 0.00 0.00 43.02 40.69 3hqp s PHE 442 CO 0.29 -0.79 1.43 0.34 -1.46 0.00 0.00 175.22 175.02 3hqp s ASP 443 N 1.42 6.76 0.00 6.13 2.15 -1.26 -4.14 116.67 127.72 3hqp s ASP 443 Ca -0.02 2.45 0.25 0.00 0.43 0.00 0.00 52.55 55.66 3hqp s ASP 443 Cb -0.19 -2.60 0.45 0.00 -0.30 0.00 0.00 42.92 40.29 3hqp s ASP 443 CO -0.09 -0.68 1.37 0.00 -0.17 0.00 0.00 175.17 175.61 3hqp n ALA 444 N 3.54 3.53 -0.03 3.66 0.00 -1.26 -3.54 120.51 126.40 3hqp n ALA 444 Ca 0.11 -0.43 -0.16 0.00 0.00 0.00 0.00 53.44 52.95 3hqp n ALA 444 Cb 0.41 -1.05 -0.14 0.00 0.00 0.00 0.00 19.45 18.68 3hqp n ALA 444 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3hqp n ASP 445 N -1.02 1.53 -0.05 0.00 8.00 -1.26 -2.53 116.55 121.21 3hqp n ASP 445 Ca 0.08 0.19 0.11 0.00 0.71 0.00 0.00 54.79 55.88 3hqp n ASP 445 Cb 0.35 -0.37 -0.00 0.00 -0.02 0.00 0.00 41.12 41.08 3hqp n ASP 445 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 3hqp n LYS 446 N -3.25 0.13 0.00 -1.24 2.85 -1.26 -4.56 118.16 110.83 3hqp n LYS 446 Ca -0.30 -0.10 0.00 0.00 -1.05 0.00 0.00 58.31 56.86 3hqp n LYS 446 Cb 1.05 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.93 3hqp n LYS 446 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 3hqp n LEU 447 N -1.35 0.00 0.00 -5.58 4.77 -1.23 -5.11 117.00 108.50 3hqp n LEU 447 Ca 0.05 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 3hqp n LEU 447 Cb 0.34 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 3hqp n LEU 447 CO 0.39 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 3hqp n GLY 448 N 1.79 -1.99 0.19 -0.72 0.00 -1.05 -4.72 105.19 98.69 3hqp n GLY 448 Ca 0.00 -2.20 0.02 0.00 0.00 0.00 0.00 46.02 43.84 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 0.03 -5.45 1.61 3.86 -1.94 -3.39 115.15 109.86 3hqp h HIS 449 Ca 0.00 -0.01 -0.36 0.00 -1.16 0.00 0.00 60.37 58.84 3hqp h HIS 449 Cb 0.00 -0.01 0.13 0.00 1.06 0.00 0.00 27.41 28.59 3hqp h HIS 449 CO 0.00 0.39 -0.63 -3.47 0.86 0.00 0.00 177.93 175.08 3hqp n ASP 450 N -4.10 -5.87 -4.71 2.45 2.03 -1.26 -4.98 116.55 100.11 3hqp n ASP 450 Ca -0.02 -0.50 -0.42 0.00 0.52 0.00 0.00 54.79 54.37 3hqp n ASP 450 Cb 0.41 -4.68 -0.03 0.00 -0.72 0.00 0.00 41.12 36.10 3hqp n ASP 450 CO 0.00 0.00 0.00 -1.83 -1.92 0.00 0.00 177.20 173.45 3hqp s GLU 451 N -6.17 4.38 0.00 -0.67 1.03 -1.26 -2.32 118.70 113.69 3hqp s GLU 451 Ca 0.52 1.85 0.00 0.00 0.03 0.00 0.00 54.97 57.37 3hqp s GLU 451 Cb -0.23 -3.38 0.00 0.00 -0.80 0.00 0.00 34.13 29.72 3hqp s GLU 451 CO 0.67 -0.36 0.00 0.41 -1.33 0.00 0.00 175.26 174.65 3hqp n GLY 452 N 3.35 1.38 3.36 -3.83 0.00 -1.26 -4.91 105.19 103.28 3hqp n GLY 452 Ca 0.10 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.11 -1.67 -0.11 1.61 4.76 -0.98 -4.97 118.16 116.68 3hqp n LYS 453 Ca 0.00 0.89 -0.15 0.00 -2.87 0.00 0.00 58.31 56.18 3hqp n LYS 453 Cb 0.00 -5.09 -0.11 0.00 -1.84 0.00 0.00 35.03 28.00 3hqp n LYS 453 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 3hqp n GLU 454 N -3.11 0.58 0.06 1.97 4.71 -1.26 -4.49 120.64 119.10 3hqp n GLU 454 Ca -0.08 0.13 0.11 0.00 -0.01 0.00 0.00 57.16 57.31 3hqp n GLU 454 Cb 0.59 -1.45 -0.05 0.00 -1.01 0.00 0.00 31.44 29.52 3hqp n GLU 454 CO 0.00 0.00 0.00 0.72 0.09 0.00 0.00 177.13 177.94 3hqp n HIS 455 N -3.14 0.58 0.19 -0.32 8.25 -1.26 -2.80 115.22 116.73 3hqp n HIS 455 Ca -0.39 0.17 0.08 0.00 -0.26 0.00 0.00 57.72 57.32 3hqp n HIS 455 Cb 0.93 -0.75 0.19 0.00 1.12 0.00 0.00 29.99 31.48 3hqp n HIS 455 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3hqp h ARG 456 N 0.00 0.00 0.08 -0.41 3.08 -1.93 -2.66 114.38 112.54 3hqp h ARG 456 Ca 0.00 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.73 3hqp h ARG 456 Cb 0.97 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.99 3hqp h ARG 456 CO 0.00 0.23 -1.78 0.28 -1.07 0.00 0.00 179.97 177.63 3hqp h VAL 457 N 0.00 0.84 -0.13 2.04 2.07 -1.79 -3.04 116.25 116.24 3hqp h VAL 457 Ca -0.00 -2.58 -0.07 0.00 0.82 0.00 0.00 66.70 64.86 3hqp h VAL 457 Cb 1.08 2.54 -0.01 0.00 -1.52 0.00 0.00 31.29 33.38 3hqp h VAL 457 CO 0.03 0.74 -0.25 0.00 0.02 0.00 0.00 177.57 178.11 3hqp h ALA 458 N 0.50 1.35 0.05 1.67 0.00 -1.56 -1.46 119.26 119.79 3hqp h ALA 458 Ca -0.33 -0.29 -0.25 0.00 0.00 0.00 0.00 54.91 54.03 3hqp h ALA 458 Cb 2.02 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.70 3hqp h ALA 458 CO 0.10 0.45 -1.27 0.00 0.00 0.00 0.00 179.25 178.54 3hqp h ALA 459 N 1.54 0.36 -0.45 0.00 0.00 -1.62 -2.67 119.26 116.42 3hqp h ALA 459 Ca 0.03 -1.04 -0.10 0.00 0.00 0.00 0.00 54.91 53.81 3hqp h ALA 459 Cb 0.56 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 3hqp h ALA 459 CO 0.04 1.23 -0.11 0.78 0.00 0.00 0.00 179.25 181.19 3hqp h GLY 460 N 2.57 0.89 1.73 0.00 0.00 -1.39 -1.25 103.07 105.62 3hqp h GLY 460 Ca -0.12 -0.68 -0.16 0.00 0.00 0.00 0.00 47.33 46.36 3hqp h GLY 460 CO 0.14 0.63 -0.68 -2.08 0.00 0.00 0.00 176.54 174.55 3hqp h VAL 461 N 0.74 1.40 -0.40 4.60 2.07 -1.37 -3.06 116.25 120.23 3hqp h VAL 461 Ca 0.12 -2.12 -0.06 0.00 0.82 0.00 0.00 66.70 65.46 3hqp h VAL 461 Cb 0.61 2.10 -0.02 0.00 -1.52 0.00 0.00 31.29 32.46 3hqp h VAL 461 CO 0.04 0.63 0.01 -0.08 0.02 0.00 0.00 177.57 178.19 3hqp h GLU 462 N 0.19 0.63 -0.22 1.57 4.57 -1.11 -0.20 114.58 120.01 3hqp h GLU 462 Ca -0.02 -0.14 -0.19 0.00 -1.18 0.00 0.00 59.36 57.83 3hqp h GLU 462 Cb 1.22 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 29.72 3hqp h GLU 462 CO 0.11 0.64 -0.61 0.35 -1.18 0.00 0.00 179.01 178.31 3hqp h PHE 463 N 0.60 0.94 -0.10 0.92 3.57 -1.24 -1.83 116.94 119.79 3hqp h PHE 463 Ca 0.13 -0.36 -0.15 0.00 3.53 0.00 0.00 57.97 61.12 3hqp h PHE 463 Cb 0.36 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.92 3hqp h PHE 463 CO 0.02 1.16 -0.58 0.00 -2.23 0.00 0.00 178.31 176.68 3hqp h ALA 464 N 0.76 0.82 -0.53 2.41 0.00 -1.41 -2.65 119.26 118.66 3hqp h ALA 464 Ca -0.01 -0.52 -0.11 0.00 0.00 0.00 0.00 54.91 54.27 3hqp h ALA 464 Cb 1.21 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 3hqp h ALA 464 CO 0.13 0.71 -0.11 0.87 0.00 0.00 0.00 179.25 180.84 3hqp h LYS 465 N 0.25 1.01 -0.52 0.00 1.79 -1.01 0.11 116.57 118.21 3hqp h LYS 465 Ca -0.00 -0.38 -0.10 0.00 -2.18 0.00 0.00 60.65 57.99 3hqp h LYS 465 Cb 1.08 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 31.65 3hqp h LYS 465 CO 0.09 1.06 -0.05 0.66 -1.08 0.00 0.00 179.45 180.14 3hqp h SER 466 N 0.88 0.94 0.55 0.86 4.64 -1.27 -2.63 113.55 117.52 3hqp h SER 466 Ca 0.14 -0.33 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 3hqp h SER 466 Cb 0.68 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 3hqp h SER 466 CO 0.05 1.05 -0.04 0.29 -0.87 0.00 0.00 176.83 177.30 3hqp n LYS 467 N -4.25 0.45 -1.21 4.77 4.76 -1.01 -4.93 118.16 116.75 3hqp n LYS 467 Ca 0.01 -0.05 0.00 0.00 -2.87 0.00 0.00 58.31 55.40 3hqp n LYS 467 Cb 0.36 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.05 3hqp n LYS 467 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3hqp n GLY 468 N 1.30 0.43 0.19 0.72 0.00 -0.91 -4.96 105.19 101.97 3hqp n GLY 468 Ca 0.14 -0.97 -0.18 0.00 0.00 0.00 0.00 46.02 45.00 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 0.94 -3.54 1.61 0.05 -1.04 -3.44 116.97 111.54 3hqp h TYR 469 Ca 0.00 -0.47 -0.67 0.00 0.05 0.00 0.00 58.73 57.64 3hqp h TYR 469 Cb 0.27 -0.12 -0.27 0.00 1.01 0.00 0.00 36.73 37.63 3hqp h TYR 469 CO 0.00 1.30 -0.78 0.14 -1.05 0.00 0.00 178.16 177.77 3hqp s VAL 470 N -3.46 2.92 0.00 -2.88 -7.23 -1.18 -4.72 120.40 103.85 3hqp s VAL 470 Ca -0.11 -0.73 0.00 0.00 -1.81 0.00 0.00 61.98 59.33 3hqp s VAL 470 Cb 0.07 -2.19 0.00 0.00 0.56 0.00 0.00 36.38 34.81 3hqp s VAL 470 CO 0.89 0.55 0.00 0.00 -0.31 0.00 0.00 175.10 176.22 3hqp n GLN 471 N 3.19 0.01 -3.90 4.82 3.00 -1.26 -4.51 117.38 118.73 3hqp n GLN 471 Ca -0.18 0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.52 3hqp n GLN 471 Cb 0.53 0.00 -0.13 0.00 0.00 0.00 0.00 30.24 30.63 3hqp n GLN 471 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 3hqp s THR 472 N 1.90 2.53 0.00 5.09 2.01 -1.26 -4.65 115.64 121.26 3hqp s THR 472 Ca 0.00 -3.58 0.00 0.00 0.31 0.00 0.00 61.69 58.42 3hqp s THR 472 Cb 0.00 -2.72 0.00 0.00 0.01 0.00 0.00 72.50 69.79 3hqp s THR 472 CO 0.00 -0.89 0.00 0.61 -0.69 0.00 0.00 174.62 173.65 3hqp n GLY 473 N 2.73 0.69 3.86 4.40 0.00 -0.94 -4.98 105.19 110.95 3hqp n GLY 473 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.04 6.63 0.58 1.61 1.01 -1.26 -4.78 116.67 119.42 3hqp s ASP 474 Ca 0.00 0.76 -0.17 0.00 0.71 0.00 0.00 52.55 53.84 3hqp s ASP 474 Cb 0.00 -2.17 -0.04 0.00 1.01 0.00 0.00 42.92 41.72 3hqp s ASP 474 CO 0.00 0.24 1.08 -0.31 0.21 0.00 0.00 175.17 176.39 3hqp s TYR 475 N -1.28 2.86 -0.13 4.23 2.02 -1.26 -2.79 117.35 120.99 3hqp s TYR 475 Ca 0.28 1.54 -0.07 0.00 -0.37 0.00 0.00 57.07 58.46 3hqp s TYR 475 Cb -0.14 -3.10 0.05 0.00 -0.40 0.00 0.00 41.96 38.37 3hqp s TYR 475 CO 0.16 -1.26 0.31 0.00 -1.57 0.00 0.00 175.55 173.19 3hqp s VAL 477 N 1.42 4.93 -0.02 0.00 1.01 -1.23 -1.81 120.40 124.70 3hqp s VAL 477 Ca -0.09 0.32 -0.01 0.00 0.00 0.00 0.00 61.98 62.20 3hqp s VAL 477 Cb -0.10 -4.07 -0.04 0.00 0.00 0.00 0.00 36.38 32.18 3hqp s VAL 477 CO -0.10 -0.36 0.07 -0.69 0.00 0.00 0.00 175.10 174.03 3hqp s VAL 478 N 2.59 4.73 -0.17 2.92 1.01 -0.30 -1.63 120.40 129.54 3hqp s VAL 478 Ca 0.21 -0.34 -0.00 0.00 0.00 0.00 0.00 61.98 61.85 3hqp s VAL 478 Cb -0.15 -3.13 0.00 0.00 0.00 0.00 0.00 36.38 33.10 3hqp s VAL 478 CO 0.15 0.41 -0.15 -0.63 0.00 0.00 0.00 175.10 174.88 3hqp s ILE 479 N -1.14 2.63 0.42 2.22 1.01 -0.37 -1.79 121.20 124.18 3hqp s ILE 479 Ca 0.21 -0.77 0.04 0.00 0.00 0.00 0.00 60.65 60.13 3hqp s ILE 479 Cb -0.12 -2.13 -0.04 0.00 0.01 0.00 0.00 42.46 40.18 3hqp s ILE 479 CO 0.12 0.51 0.04 -1.00 0.00 0.00 0.00 174.94 174.60 3hqp s HIS 480 N 1.05 2.05 0.00 3.97 3.76 0.17 -3.59 115.29 122.70 3hqp s HIS 480 Ca -0.01 -0.94 0.00 0.00 -0.15 0.00 0.00 55.06 53.96 3hqp s HIS 480 Cb -0.15 -1.50 0.00 0.00 1.11 0.00 0.00 32.58 32.05 3hqp s HIS 480 CO -0.04 0.14 0.00 0.00 -0.85 0.00 0.00 174.74 173.99 3hqp n ALA 481 N -0.99 0.00 0.00 -1.40 0.00 -1.26 0.11 120.51 116.97 3hqp n ALA 481 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 3hqp n ALA 481 Cb 0.67 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.12 3hqp n ALA 481 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3hqp n ASP 482 N 1.48 0.00 -0.34 0.00 5.68 -1.26 -4.13 116.55 117.98 3hqp n ASP 482 Ca 0.00 0.00 0.01 0.00 -0.50 0.00 0.00 54.79 54.30 3hqp n ASP 482 Cb 0.00 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 39.99 3hqp n ASP 482 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3hqp n HIS 483 N 11.09 0.00 0.00 2.11 1.44 -1.26 -4.67 115.22 123.93 3hqp n HIS 483 Ca 0.00 -0.12 0.00 0.00 -2.01 0.00 0.00 57.72 55.59 3hqp n HIS 483 Cb 0.00 -0.05 0.00 0.00 0.12 0.00 0.00 29.99 30.06 3hqp n HIS 483 CO 0.00 0.00 0.00 1.17 -2.81 0.00 0.00 176.34 174.70 3hqp n LYS 484 N -0.16 0.00 -2.71 -1.40 4.81 -1.26 -5.03 118.16 112.41 3hqp n LYS 484 Ca 0.02 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.03 3hqp n LYS 484 Cb 0.64 -0.15 -0.03 0.00 0.02 0.00 0.00 35.03 35.51 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 -1.89 4.79 -0.11 3.15 1.01 -1.26 -5.04 120.40 121.05 3hqp s VAL 485 Ca 0.00 2.01 -0.00 0.00 0.00 0.00 0.00 61.98 63.98 3hqp s VAL 485 Cb 0.00 -4.30 -0.02 0.00 0.00 0.00 0.00 36.38 32.06 3hqp s VAL 485 CO 0.00 0.01 -0.09 -0.54 0.00 0.00 0.00 175.10 174.47 3hqp s LYS 486 N 2.03 3.22 0.00 2.72 -0.14 -1.26 -4.79 119.74 121.51 3hqp s LYS 486 Ca 0.47 -0.61 0.00 0.00 -1.36 0.00 0.00 55.97 54.48 3hqp s LYS 486 Cb -0.18 -2.67 0.00 0.00 -1.68 0.00 0.00 37.83 33.30 3hqp s LYS 486 CO 0.17 0.37 0.00 0.41 -0.76 0.00 0.00 175.35 175.55 3hqp n GLY 487 N 3.08 2.22 3.26 -3.33 0.00 -1.26 -5.08 105.19 104.08 3hqp n GLY 487 Ca -0.18 -0.58 -0.16 0.00 0.00 0.00 0.00 46.02 45.10 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 0.00 1.38 0.20 1.61 -0.85 -1.26 -5.11 117.35 113.32 3hqp s TYR 488 Ca 0.00 -0.64 -0.30 0.00 -0.52 0.00 0.00 57.07 55.61 3hqp s TYR 488 Cb 0.00 -0.70 -0.08 0.00 0.38 0.00 0.00 41.96 41.56 3hqp s TYR 488 CO 0.00 0.15 1.14 0.00 -1.52 0.00 0.00 175.55 175.32 3hqp s ALA 489 N -2.75 3.40 -0.09 9.51 0.00 -1.26 -4.44 121.76 126.13 3hqp s ALA 489 Ca 0.14 0.89 0.19 0.00 0.00 0.00 0.00 51.96 53.18 3hqp s ALA 489 Cb -0.01 -3.37 0.37 0.00 0.00 0.00 0.00 23.12 20.10 3hqp s ALA 489 CO 0.03 -0.26 1.16 0.27 0.00 0.00 0.00 175.76 176.95 3hqp n ASN 490 N 2.15 0.55 -3.67 0.00 2.04 0.15 -4.39 115.26 112.08 3hqp n ASN 490 Ca 0.02 -2.02 -0.09 0.00 -0.44 0.00 0.00 54.58 52.05 3hqp n ASN 490 Cb 0.45 -0.14 -0.10 0.00 -2.53 0.00 0.00 39.78 37.46 3hqp n ASN 490 CO 0.00 0.00 0.00 -1.58 -0.44 0.00 0.00 177.26 175.24 3hqp s GLN 491 N -0.88 0.40 0.01 -3.83 0.74 0.30 -4.74 119.66 111.65 3hqp s GLN 491 Ca 0.24 0.97 0.04 0.00 0.05 0.00 0.00 55.36 56.66 3hqp s GLN 491 Cb 0.31 0.19 -0.03 0.00 1.10 0.00 0.00 33.01 34.57 3hqp s GLN 491 CO -0.10 -0.20 -0.09 0.95 -0.55 0.00 0.00 175.29 175.30 3hqp s THR 492 N 2.02 3.49 -0.11 -0.34 -4.23 -1.26 0.44 115.64 115.65 3hqp s THR 492 Ca -0.06 -0.84 -0.05 0.00 -1.18 0.00 0.00 61.69 59.56 3hqp s THR 492 Cb -0.10 -2.51 0.05 0.00 1.34 0.00 0.00 72.50 71.28 3hqp s THR 492 CO -0.14 0.39 0.26 0.00 -0.54 0.00 0.00 174.62 174.59 3hqp s ARG 493 N -1.40 0.21 -0.27 3.99 1.70 -0.74 -4.99 118.95 117.46 3hqp s ARG 493 Ca 0.16 0.57 -0.15 0.00 -0.47 0.00 0.00 55.73 55.84 3hqp s ARG 493 Cb -0.11 -0.11 -0.04 0.00 -0.57 0.00 0.00 34.95 34.13 3hqp s ARG 493 CO 0.07 -0.18 0.39 0.42 -1.08 0.00 0.00 175.30 174.92 3hqp s ILE 494 N 1.39 5.16 0.04 4.99 1.01 -1.26 -1.15 121.20 131.38 3hqp s ILE 494 Ca -0.08 0.61 0.04 0.00 0.00 0.00 0.00 60.65 61.22 3hqp s ILE 494 Cb -0.10 -3.71 -0.02 0.00 0.01 0.00 0.00 42.46 38.63 3hqp s ILE 494 CO -0.09 0.15 -0.11 -1.48 0.00 0.00 0.00 174.94 173.41 3hqp s LEU 495 N 2.06 2.18 0.52 2.97 0.05 -0.75 -4.94 118.68 120.77 3hqp s LEU 495 Ca 0.16 -0.44 -0.18 0.00 0.05 0.00 0.00 54.13 53.73 3hqp s LEU 495 Cb -0.16 -0.44 -0.07 0.00 -2.05 0.00 0.00 46.19 43.47 3hqp s LEU 495 CO 0.10 -0.03 1.01 -0.22 -0.55 0.00 0.00 176.35 176.66 3hqp s LEU 496 N -1.14 3.67 0.11 1.48 2.96 -1.26 -1.88 118.68 122.61 3hqp s LEU 496 Ca -0.01 1.72 0.04 0.00 -0.22 0.00 0.00 54.13 55.66 3hqp s LEU 496 Cb -0.08 -4.53 -0.04 0.00 0.50 0.00 0.00 46.19 42.05 3hqp s LEU 496 CO 0.01 -0.76 0.09 0.68 -1.32 0.00 0.00 176.35 175.05 3hqp s VAL 497 N -2.40 4.49 -1.01 1.68 -7.23 -1.12 -4.96 120.40 109.85 3hqp s VAL 497 Ca 0.62 -0.88 0.08 0.00 -1.81 0.00 0.00 61.98 60.00 3hqp s VAL 497 Cb -0.13 -3.21 0.06 0.00 0.56 0.00 0.00 36.38 33.67 3hqp s VAL 497 CO 0.29 0.05 0.75 -0.62 -0.31 0.00 0.00 175.10 175.26