#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 0.26 -0.15 4.33 5.75 -2.05 0.45 115.11 123.70 3hqp h GLN 2 Ca 0.00 -0.02 -0.12 0.00 -0.15 0.00 0.00 58.65 58.36 3hqp h GLN 2 Cb 0.00 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 28.49 3hqp h GLN 2 CO 0.00 0.17 -0.39 1.25 -2.65 0.00 0.00 178.83 177.21 3hqp h LEU 3 N 0.27 0.60 -0.81 -2.39 6.46 -2.06 -2.82 115.31 114.55 3hqp h LEU 3 Ca 0.14 -0.58 -0.13 0.00 -0.12 0.00 0.00 57.88 57.20 3hqp h LEU 3 Cb 0.24 -0.17 -0.01 0.00 -0.73 0.00 0.00 40.66 39.98 3hqp h LEU 3 CO -0.03 1.07 -0.54 0.00 -0.62 0.00 0.00 178.44 178.33 3hqp h ALA 4 N 0.54 1.00 -0.09 1.25 0.00 -1.88 -3.06 119.26 117.02 3hqp h ALA 4 Ca -0.01 -0.49 -0.14 0.00 0.00 0.00 0.00 54.91 54.27 3hqp h ALA 4 Cb 1.00 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 3hqp h ALA 4 CO 0.08 0.68 -0.54 1.25 0.00 0.00 0.00 179.25 180.72 3hqp h HIS 5 N 0.12 0.34 0.00 0.00 -0.00 -0.97 -2.97 115.15 111.67 3hqp h HIS 5 Ca 0.00 -0.12 -0.03 0.00 -0.00 0.00 0.00 60.37 60.22 3hqp h HIS 5 Cb 0.99 -0.06 -0.00 0.00 -0.00 0.00 0.00 27.41 28.33 3hqp h HIS 5 CO 0.01 0.75 -0.16 -0.91 -0.00 0.00 0.00 177.93 177.62 3hqp h ASN 6 N 0.21 0.00 1.16 3.26 2.35 -1.39 -2.50 115.58 118.67 3hqp h ASN 6 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3hqp h ASN 6 Cb 1.02 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.39 3hqp h ASN 6 CO 0.09 0.16 0.00 0.18 -1.65 0.00 0.00 177.43 176.21 3hqp n LEU 7 N -3.88 0.41 -0.07 1.61 4.77 -1.12 -3.26 117.00 115.46 3hqp n LEU 7 Ca -0.02 0.55 0.10 0.00 -0.03 0.00 0.00 56.01 56.61 3hqp n LEU 7 Cb 0.25 -0.43 -0.07 0.00 -2.33 0.00 0.00 43.42 40.85 3hqp n LEU 7 CO 0.33 -0.14 0.04 0.35 -1.33 0.00 0.00 177.39 176.64 3hqp n THR 8 N -1.89 0.00 -2.08 -5.08 -2.24 -0.94 -4.97 114.28 97.09 3hqp n THR 8 Ca 0.06 -0.03 -0.32 0.00 -2.27 0.00 0.00 64.05 61.49 3hqp n THR 8 Cb 0.36 0.97 -0.00 0.00 -2.10 0.00 0.00 70.33 69.56 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 -2.93 3.44 0.09 3.22 1.43 -1.20 -5.10 118.68 117.63 3hqp s LEU 9 Ca 0.10 1.61 -0.10 0.00 -1.03 0.00 0.00 54.13 54.71 3hqp s LEU 9 Cb 0.16 -4.50 0.00 0.00 0.03 0.00 0.00 46.19 41.88 3hqp s LEU 9 CO 0.82 -0.92 0.22 -0.55 0.23 0.00 0.00 176.35 176.15 3hqp s SER 10 N -3.34 0.06 0.39 2.29 0.15 -1.26 -5.06 113.70 106.94 3hqp s SER 10 Ca 0.59 -0.57 0.21 0.00 0.70 0.00 0.00 55.95 56.88 3hqp s SER 10 Cb -0.12 0.35 0.26 0.00 -1.71 0.00 0.00 66.02 64.80 3hqp s SER 10 CO 0.41 -0.72 1.55 0.16 1.20 0.00 0.00 173.24 175.83 3hqp h ILE 11 N 2.79 0.22 0.00 6.45 3.07 -2.02 -3.29 117.51 124.73 3hqp h ILE 11 Ca -0.34 -1.32 0.00 0.00 1.55 0.00 0.00 64.86 64.76 3hqp h ILE 11 Cb 1.20 2.09 0.00 0.00 -0.27 0.00 0.00 36.82 39.85 3hqp h ILE 11 CO 0.54 0.13 -0.07 -0.26 -1.05 0.00 0.00 178.15 177.44 3hqp h PHE 12 N 0.00 0.00 -2.32 0.16 0.04 -2.04 -3.45 116.94 109.33 3hqp h PHE 12 Ca -0.00 0.00 -0.57 0.00 2.80 0.00 0.00 57.97 60.20 3hqp h PHE 12 Cb 1.10 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.24 3hqp h PHE 12 CO 0.00 0.00 1.38 -0.51 -0.60 0.00 0.00 178.31 178.58 3hqp s ASP 13 N -4.84 5.60 0.73 2.17 1.01 -1.24 -4.95 116.67 115.14 3hqp s ASP 13 Ca 0.09 1.40 -0.16 0.00 0.71 0.00 0.00 52.55 54.59 3hqp s ASP 13 Cb 0.11 -2.52 -0.01 0.00 1.01 0.00 0.00 42.92 41.51 3hqp s ASP 13 CO 0.62 -1.93 0.77 -2.65 0.21 0.00 0.00 175.17 172.20 3hqp n PRO 14 N 8.63 0.38 -2.12 8.23 -0.02 -1.26 -5.00 135.00 143.84 3hqp n PRO 14 Ca 0.26 0.18 -0.29 0.00 -2.02 0.00 0.00 63.50 61.63 3hqp n PRO 14 Cb 0.47 -2.05 0.04 0.00 -0.02 0.00 0.00 33.50 31.94 3hqp n PRO 14 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3hqp s VAL 15 N -1.89 3.71 0.76 -1.45 -7.23 -1.26 -5.04 120.40 108.00 3hqp s VAL 15 Ca 0.69 0.31 -0.11 0.00 -1.81 0.00 0.00 61.98 61.06 3hqp s VAL 15 Cb -0.34 -3.51 0.05 0.00 0.56 0.00 0.00 36.38 33.13 3hqp s VAL 15 CO 0.54 -0.61 1.08 0.00 -0.31 0.00 0.00 175.10 175.80 3hqp s ALA 16 N -3.17 2.34 -1.98 1.32 0.00 -1.26 -4.95 121.76 114.06 3hqp s ALA 16 Ca 0.56 0.03 0.28 0.00 0.00 0.00 0.00 51.96 52.83 3hqp s ALA 16 Cb -0.11 -3.18 1.68 0.00 0.00 0.00 0.00 23.12 21.51 3hqp s ALA 16 CO 0.49 -1.61 2.03 0.27 0.00 0.00 0.00 175.76 176.94 3hqp n ASN 17 N -3.38 0.00 -3.88 0.00 2.04 -1.26 -4.78 115.26 104.00 3hqp n ASN 17 Ca 0.08 -0.86 -0.11 0.00 -0.44 0.00 0.00 54.58 53.24 3hqp n ASN 17 Cb 0.54 -0.01 -0.12 0.00 -2.53 0.00 0.00 39.78 37.66 3hqp n ASN 17 CO 0.00 0.00 0.00 -0.72 -0.44 0.00 0.00 177.26 176.10 3hqp s TYR 18 N -2.02 0.01 -0.24 -2.53 -0.85 -1.26 -5.06 117.35 105.40 3hqp s TYR 18 Ca 0.42 0.00 -0.09 0.00 -0.52 0.00 0.00 57.07 56.88 3hqp s TYR 18 Cb 0.19 -0.03 -0.04 0.00 0.38 0.00 0.00 41.96 42.46 3hqp s TYR 18 CO 0.33 -0.13 0.11 0.50 -1.52 0.00 0.00 175.55 174.85 3hqp s ARG 19 N -0.58 3.90 -0.08 -3.49 3.52 -1.26 -5.01 118.95 115.95 3hqp s ARG 19 Ca -0.06 -0.36 -0.26 0.00 -0.13 0.00 0.00 55.73 54.91 3hqp s ARG 19 Cb -0.04 -3.41 -0.22 0.00 -1.56 0.00 0.00 34.95 29.72 3hqp s ARG 19 CO 0.00 -0.01 0.98 0.00 -0.81 0.00 0.00 175.30 175.47 3hqp h ALA 20 N 7.69 -0.03 -2.74 6.12 0.00 -1.93 -3.43 119.26 124.94 3hqp h ALA 20 Ca -0.37 -0.35 -0.53 0.00 0.00 0.00 0.00 54.91 53.66 3hqp h ALA 20 Cb 1.18 0.01 0.14 0.00 0.00 0.00 0.00 17.79 19.12 3hqp h ALA 20 CO 0.62 -0.15 0.42 0.00 0.00 0.00 0.00 179.25 180.15 3hqp s ALA 21 N -3.28 2.28 0.08 0.00 0.00 -1.26 0.27 121.76 119.85 3hqp s ALA 21 Ca -0.17 0.91 0.09 0.00 0.00 0.00 0.00 51.96 52.80 3hqp s ALA 21 Cb -0.01 -3.46 -0.03 0.00 0.00 0.00 0.00 23.12 19.62 3hqp s ALA 21 CO 0.64 -1.61 -0.22 1.03 0.00 0.00 0.00 175.76 175.60 3hqp s ARG 22 N -3.73 1.80 -0.11 0.00 1.81 -0.81 -4.88 118.95 113.03 3hqp s ARG 22 Ca 0.75 -1.13 -0.00 0.00 -1.72 0.00 0.00 55.73 53.62 3hqp s ARG 22 Cb -0.29 -2.06 -0.02 0.00 -0.45 0.00 0.00 34.95 32.12 3hqp s ARG 22 CO 0.41 0.50 -0.08 0.42 -0.68 0.00 0.00 175.30 175.87 3hqp s ILE 23 N -0.97 3.53 -0.18 1.52 1.01 -1.26 -1.23 121.20 123.63 3hqp s ILE 23 Ca 0.14 -0.51 -0.00 0.00 0.00 0.00 0.00 60.65 60.28 3hqp s ILE 23 Cb -0.10 -2.48 0.01 0.00 0.01 0.00 0.00 42.46 39.89 3hqp s ILE 23 CO 0.06 0.55 -0.15 -0.63 0.00 0.00 0.00 174.94 174.77 3hqp s ILE 24 N -0.18 2.58 -0.09 2.92 1.01 -0.44 -1.51 121.20 125.51 3hqp s ILE 24 Ca 0.02 -0.78 0.00 0.00 0.00 0.00 0.00 60.65 59.89 3hqp s ILE 24 Cb -0.13 -2.11 -0.03 0.00 0.01 0.00 0.00 42.46 40.20 3hqp s ILE 24 CO 0.03 0.50 -0.07 0.00 0.00 0.00 0.00 174.94 175.40 3hqp s THR 26 N -0.53 5.05 -0.20 0.00 -4.23 -0.72 0.11 115.64 115.13 3hqp s THR 26 Ca 0.08 0.95 -0.12 0.00 -1.18 0.00 0.00 61.69 61.42 3hqp s THR 26 Cb -0.12 -3.79 -0.05 0.00 1.34 0.00 0.00 72.50 69.88 3hqp s THR 26 CO 0.02 0.46 0.24 -0.63 -0.54 0.00 0.00 174.62 174.17 3hqp s ILE 27 N -0.29 5.32 0.00 2.99 -1.09 -0.69 -2.36 121.20 125.09 3hqp s ILE 27 Ca 0.26 0.40 0.00 0.00 -2.23 0.00 0.00 60.65 59.08 3hqp s ILE 27 Cb -0.16 -3.58 0.00 0.00 -1.58 0.00 0.00 42.46 37.14 3hqp s ILE 27 CO 0.13 0.36 0.00 0.61 -1.23 0.00 0.00 174.94 174.81 3hqp n GLY 28 N 3.74 4.85 0.37 6.18 0.00 -1.25 -4.75 105.19 114.34 3hqp n GLY 28 Ca -0.13 -1.27 0.18 0.00 0.00 0.00 0.00 46.02 44.80 3hqp n GLY 28 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3hqp h PRO 29 N 0.00 0.54 0.00 1.61 0.11 -1.86 -0.16 132.00 132.25 3hqp h PRO 29 Ca 0.00 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 66.04 3hqp h PRO 29 Cb 0.00 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 30.98 3hqp h PRO 29 CO 0.00 0.36 -0.16 0.77 -0.21 0.00 0.00 178.00 178.76 3hqp h SER 30 N 0.56 0.00 0.00 -2.05 0.02 -1.55 -3.36 113.55 107.17 3hqp h SER 30 Ca 0.59 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.54 3hqp h SER 30 Cb 1.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.76 3hqp h SER 30 CO -0.36 0.16 0.00 0.35 -1.14 0.00 0.00 176.83 175.84 3hqp n THR 31 N -3.34 0.17 0.22 -2.27 -2.24 -0.60 -4.86 114.28 101.37 3hqp n THR 31 Ca 0.00 -0.22 0.11 0.00 -2.27 0.00 0.00 64.05 61.66 3hqp n THR 31 Cb 0.38 1.19 0.30 0.00 -2.10 0.00 0.00 70.33 70.10 3hqp n THR 31 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 3hqp h GLN 32 N 0.00 0.00 -7.24 -0.78 4.15 -1.22 -3.30 115.11 106.72 3hqp h GLN 32 Ca 0.00 0.00 -0.52 0.00 0.77 0.00 0.00 58.65 58.90 3hqp h GLN 32 Cb 0.67 0.00 0.13 0.00 0.21 0.00 0.00 27.48 28.49 3hqp h GLN 32 CO 0.00 0.15 0.34 -1.54 -1.93 0.00 0.00 178.83 175.85 3hqp s SER 33 N -6.16 4.47 0.10 -0.69 1.04 -1.26 -4.81 113.70 106.40 3hqp s SER 33 Ca 0.04 2.04 -0.18 0.00 0.48 0.00 0.00 55.95 58.33 3hqp s SER 33 Cb 0.07 -2.55 -0.06 0.00 0.10 0.00 0.00 66.02 63.58 3hqp s SER 33 CO 0.65 -2.06 1.61 1.62 0.98 0.00 0.00 173.24 176.04 3hqp h VAL 34 N -0.62 1.20 -0.88 5.02 3.04 -1.88 -1.16 116.25 120.97 3hqp h VAL 34 Ca -0.45 -0.66 0.01 0.00 -1.01 0.00 0.00 66.70 64.58 3hqp h VAL 34 Cb 1.25 1.13 -0.04 0.00 -2.01 0.00 0.00 31.29 31.62 3hqp h VAL 34 CO 0.51 0.22 0.58 -0.08 -1.01 0.00 0.00 177.57 177.78 3hqp h GLU 35 N 0.27 1.16 -0.08 4.17 4.57 -1.95 -1.58 114.58 121.13 3hqp h GLU 35 Ca 0.09 -0.07 -0.13 0.00 -1.18 0.00 0.00 59.36 58.07 3hqp h GLU 35 Cb 0.26 -0.26 -0.01 0.00 -0.16 0.00 0.00 28.75 28.57 3hqp h GLU 35 CO -0.00 0.78 -0.51 0.00 -1.18 0.00 0.00 179.01 178.09 3hqp h ALA 36 N 1.44 0.98 -0.22 2.92 0.00 -1.79 -2.77 119.26 119.82 3hqp h ALA 36 Ca 0.32 -0.48 -0.18 0.00 0.00 0.00 0.00 54.91 54.57 3hqp h ALA 36 Cb -0.13 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.58 3hqp h ALA 36 CO -0.07 0.66 -0.57 -0.07 0.00 0.00 0.00 179.25 179.21 3hqp h LEU 37 N 0.18 0.88 -0.84 0.00 3.38 -0.93 -2.86 115.31 115.13 3hqp h LEU 37 Ca 0.01 -0.57 0.12 0.00 0.09 0.00 0.00 57.88 57.52 3hqp h LEU 37 Cb 0.97 -0.26 -0.08 0.00 0.09 0.00 0.00 40.66 41.38 3hqp h LEU 37 CO 0.08 1.29 0.46 0.11 0.09 0.00 0.00 178.44 180.47 3hqp h LYS 38 N 0.51 0.71 -0.42 1.13 1.57 -1.18 -0.41 116.57 118.47 3hqp h LYS 38 Ca -0.01 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.74 3hqp h LYS 38 Cb 1.18 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 33.31 3hqp h LYS 38 CO 0.12 0.47 0.28 0.78 -0.57 0.00 0.00 179.45 180.53 3hqp h GLY 39 N 0.73 0.60 0.84 3.86 0.00 -1.48 -0.46 103.07 107.16 3hqp h GLY 39 Ca 0.42 -0.22 0.03 0.00 0.00 0.00 0.00 47.33 47.57 3hqp h GLY 39 CO -0.29 0.21 0.27 1.41 0.00 0.00 0.00 176.54 178.14 3hqp h LEU 40 N 0.56 0.42 0.22 3.11 4.07 -1.10 -0.20 115.31 122.40 3hqp h LEU 40 Ca 0.16 0.01 -0.01 0.00 0.08 0.00 0.00 57.88 58.12 3hqp h LEU 40 Cb -0.06 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 41.61 3hqp h LEU 40 CO -0.04 0.30 -0.11 0.40 -1.08 0.00 0.00 178.44 177.91 3hqp h ILE 41 N 0.54 0.80 0.00 1.22 2.04 -0.86 0.14 117.51 121.39 3hqp h ILE 41 Ca 0.20 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 65.93 3hqp h ILE 41 Cb 0.05 0.87 -0.00 0.00 -0.74 0.00 0.00 36.82 37.00 3hqp h ILE 41 CO -0.11 0.03 -0.07 1.56 0.00 0.00 0.00 178.15 179.56 3hqp h GLN 42 N -0.36 0.00 0.03 2.37 4.20 -0.99 -2.55 115.11 117.81 3hqp h GLN 42 Ca -0.03 0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.45 3hqp h GLN 42 Cb 0.27 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 3hqp h GLN 42 CO 0.05 0.07 -1.10 0.77 -0.67 0.00 0.00 178.83 177.94 3hqp h SER 43 N 0.00 0.09 0.00 1.46 0.02 -0.44 -3.48 113.55 111.20 3hqp h SER 43 Ca -0.00 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.85 3hqp h SER 43 Cb 0.19 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.70 3hqp h SER 43 CO 0.01 1.08 0.00 0.61 -1.14 0.00 0.00 176.83 177.39 3hqp n GLY 44 N 1.41 -0.65 3.74 -3.77 0.00 -0.14 -4.07 105.19 101.70 3hqp n GLY 44 Ca -0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 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 4.14 -0.03 1.61 0.00 -0.17 -4.40 119.30 120.44 3hqp s MET 45 Ca 0.00 2.56 0.05 0.00 0.00 0.00 0.00 55.69 58.30 3hqp s MET 45 Cb 0.00 -3.05 -0.08 0.00 0.00 0.00 0.00 34.83 31.70 3hqp s MET 45 CO 0.00 -0.65 0.08 0.43 0.00 0.00 0.00 175.02 174.88 3hqp n SER 46 N 2.77 3.68 -3.78 1.11 7.64 -0.57 -4.63 113.62 119.85 3hqp n SER 46 Ca 0.10 0.00 -0.18 0.00 1.01 0.00 0.00 58.87 59.81 3hqp n SER 46 Cb 0.37 0.98 -0.17 0.00 -1.01 0.00 0.00 64.21 64.39 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 -2.28 0.11 -0.34 0.44 1.01 -1.12 -2.47 120.40 115.74 3hqp s VAL 47 Ca -0.02 0.17 -0.17 0.00 0.00 0.00 0.00 61.98 61.96 3hqp s VAL 47 Cb 0.03 -0.24 -0.01 0.00 0.00 0.00 0.00 36.38 36.16 3hqp s VAL 47 CO 0.23 0.15 0.44 0.00 0.00 0.00 0.00 175.10 175.92 3hqp s ALA 48 N 1.31 3.49 -0.11 5.51 0.00 0.10 -1.33 121.76 130.74 3hqp s ALA 48 Ca -0.06 -1.11 -0.22 0.00 0.00 0.00 0.00 51.96 50.57 3hqp s ALA 48 Cb -0.13 -2.92 -0.03 0.00 0.00 0.00 0.00 23.12 20.04 3hqp s ALA 48 CO -0.02 -1.14 0.65 0.50 0.00 0.00 0.00 175.76 175.74 3hqp s ARG 49 N 2.20 4.37 -0.33 0.00 3.52 0.12 -0.79 118.95 128.04 3hqp s ARG 49 Ca 0.15 0.75 -0.06 0.00 -0.13 0.00 0.00 55.73 56.44 3hqp s ARG 49 Cb -0.16 -3.47 0.04 0.00 -1.56 0.00 0.00 34.95 29.80 3hqp s ARG 49 CO 0.12 0.01 0.08 -1.64 -0.81 0.00 0.00 175.30 173.07 3hqp s MET 50 N 1.02 2.59 -0.48 5.12 -1.94 -0.12 -1.70 119.30 123.79 3hqp s MET 50 Ca 0.33 -1.19 -0.24 0.00 -1.71 0.00 0.00 55.69 52.88 3hqp s MET 50 Cb -0.17 -3.41 0.03 0.00 2.01 0.00 0.00 34.83 33.30 3hqp s MET 50 CO 0.15 -0.65 0.89 1.21 -0.01 0.00 0.00 175.02 176.60 3hqp s ASN 51 N 1.38 6.42 0.00 3.03 3.84 -1.26 -0.11 114.94 128.24 3hqp s ASN 51 Ca -0.02 -0.10 0.05 0.00 0.21 0.00 0.00 52.86 53.00 3hqp s ASN 51 Cb -0.20 -2.43 0.23 0.00 -0.55 0.00 0.00 41.25 38.31 3hqp s ASN 51 CO 0.02 -1.06 1.16 0.49 -2.79 0.00 0.00 177.10 174.92 3hqp n PHE 52 N 7.11 0.11 0.08 0.43 3.01 0.35 -2.74 117.46 125.81 3hqp n PHE 52 Ca 0.04 -0.06 -0.03 0.00 1.01 0.00 0.00 57.45 58.41 3hqp n PHE 52 Cb 0.48 0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 39.88 3hqp n PHE 52 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 3hqp h SER 53 N 0.55 0.00 -3.32 4.37 0.02 -1.83 -3.42 113.55 109.92 3hqp h SER 53 Ca 0.00 0.00 -0.66 0.00 -0.84 0.00 0.00 61.79 60.29 3hqp h SER 53 Cb 0.12 0.00 -0.27 0.00 0.14 0.00 0.00 62.40 62.39 3hqp h SER 53 CO 0.00 0.79 -0.76 -1.00 -1.14 0.00 0.00 176.83 174.72 3hqp s HIS 54 N -2.81 2.83 0.00 3.45 3.76 -1.11 -5.06 115.29 116.36 3hqp s HIS 54 Ca 0.01 -0.69 0.00 0.00 -0.15 0.00 0.00 55.06 54.23 3hqp s HIS 54 Cb 0.09 -1.87 0.00 0.00 1.11 0.00 0.00 32.58 31.91 3hqp s HIS 54 CO 0.79 -0.26 0.00 0.41 -0.85 0.00 0.00 174.74 174.84 3hqp n GLY 55 N 3.68 -0.96 3.23 -2.22 0.00 -1.26 -4.82 105.19 102.83 3hqp n GLY 55 Ca -0.18 -1.94 -0.13 0.00 0.00 0.00 0.00 46.02 43.76 3hqp n GLY 55 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hqp s SER 56 N -4.00 0.56 0.32 1.61 1.04 -1.26 -5.02 113.70 106.95 3hqp s SER 56 Ca 0.00 -1.36 0.02 0.00 0.48 0.00 0.00 55.95 55.10 3hqp s SER 56 Cb 0.00 0.29 0.60 0.00 0.10 0.00 0.00 66.02 67.00 3hqp s SER 56 CO 0.00 -0.78 1.92 0.45 0.98 0.00 0.00 173.24 175.81 3hqp h HIS 57 N 2.58 0.97 -0.48 5.02 -0.00 -1.99 -1.88 115.15 119.37 3hqp h HIS 57 Ca -0.37 0.03 -0.07 0.00 -0.00 0.00 0.00 60.37 59.96 3hqp h HIS 57 Cb 1.24 -0.32 -0.02 0.00 -0.00 0.00 0.00 27.41 28.31 3hqp h HIS 57 CO 0.40 0.50 0.04 1.49 -0.00 0.00 0.00 177.93 180.36 3hqp h GLU 58 N 0.94 0.82 -0.66 2.45 4.81 -1.99 -0.71 114.58 120.24 3hqp h GLU 58 Ca 0.38 -0.24 -0.04 0.00 -0.13 0.00 0.00 59.36 59.33 3hqp h GLU 58 Cb 0.25 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.52 3hqp h GLU 58 CO -0.14 0.85 0.26 -0.92 -0.73 0.00 0.00 179.01 178.32 3hqp h TYR 59 N 0.68 1.01 0.00 0.92 3.20 -1.82 -2.35 116.97 118.61 3hqp h TYR 59 Ca 0.14 -0.08 -0.09 0.00 3.14 0.00 0.00 58.73 61.84 3hqp h TYR 59 Cb 0.45 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 3hqp h TYR 59 CO 0.03 0.79 -0.45 0.45 -1.64 0.00 0.00 178.16 177.35 3hqp h HIS 60 N 0.94 0.00 -0.57 -3.82 3.86 -1.30 -2.80 115.15 111.46 3hqp h HIS 60 Ca 0.22 0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.46 3hqp h HIS 60 Cb 0.21 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.64 3hqp h HIS 60 CO 0.01 0.45 0.33 0.37 0.86 0.00 0.00 177.93 179.95 3hqp h GLN 61 N 0.00 0.62 -0.70 2.45 5.75 -0.84 0.12 115.11 122.52 3hqp h GLN 61 Ca -0.00 -0.04 0.10 0.00 -0.15 0.00 0.00 58.65 58.56 3hqp h GLN 61 Cb 1.21 -0.14 -0.08 0.00 1.07 0.00 0.00 27.48 29.55 3hqp h GLN 61 CO 0.06 0.41 0.32 1.15 -2.65 0.00 0.00 178.83 178.13 3hqp h THR 62 N 0.64 0.80 -0.07 2.39 2.02 -1.22 -0.56 112.91 116.91 3hqp h THR 62 Ca 0.24 -0.19 -0.00 0.00 0.77 0.00 0.00 66.41 67.23 3hqp h THR 62 Cb 0.07 0.21 -0.00 0.00 -1.74 0.00 0.00 68.15 66.68 3hqp h THR 62 CO -0.12 0.10 0.03 0.74 0.37 0.00 0.00 175.52 176.64 3hqp h THR 63 N 0.54 1.14 -0.63 3.16 2.02 -1.12 -1.19 112.91 116.84 3hqp h THR 63 Ca 0.35 -0.42 0.04 0.00 0.77 0.00 0.00 66.41 67.15 3hqp h THR 63 Cb 0.42 1.29 -0.04 0.00 -1.74 0.00 0.00 68.15 68.07 3hqp h THR 63 CO -0.30 0.12 0.38 0.40 0.37 0.00 0.00 175.52 176.49 3hqp h ILE 64 N -0.04 1.04 0.26 3.11 2.04 -0.48 -0.12 117.51 123.32 3hqp h ILE 64 Ca 0.02 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.62 3hqp h ILE 64 Cb 0.17 0.25 0.00 0.00 -0.74 0.00 0.00 36.82 36.50 3hqp h ILE 64 CO -0.00 0.13 -0.12 0.78 0.00 0.00 0.00 178.15 178.94 3hqp h ASN 65 N 0.72 -0.29 -0.59 1.72 2.35 -1.08 -2.70 115.58 115.71 3hqp h ASN 65 Ca 0.26 -0.16 0.03 0.00 -0.55 0.00 0.00 56.30 55.88 3hqp h ASN 65 Cb 0.08 0.08 -0.04 0.00 0.05 0.00 0.00 38.32 38.48 3hqp h ASN 65 CO -0.13 0.00 0.36 0.78 -1.65 0.00 0.00 177.43 176.80 3hqp h ASN 66 N -0.60 0.59 -0.52 5.81 2.35 -1.06 -0.82 115.58 121.32 3hqp h ASN 66 Ca -0.04 0.00 0.05 0.00 -0.55 0.00 0.00 56.30 55.76 3hqp h ASN 66 Cb 0.43 -0.13 -0.05 0.00 0.05 0.00 0.00 38.32 38.63 3hqp h ASN 66 CO 0.06 0.42 0.26 0.58 -1.65 0.00 0.00 177.43 177.10 3hqp h VAL 67 N 0.72 0.95 -0.53 2.81 2.07 -1.09 0.81 116.25 121.99 3hqp h VAL 67 Ca 0.24 -0.18 -0.07 0.00 0.82 0.00 0.00 66.70 67.51 3hqp h VAL 67 Cb 0.01 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.16 3hqp h VAL 67 CO -0.10 0.09 0.05 0.03 0.02 0.00 0.00 177.57 177.66 3hqp h ARG 68 N 0.51 0.87 -0.25 1.57 3.08 -1.05 -0.84 114.38 118.27 3hqp h ARG 68 Ca 0.23 -0.22 -0.16 0.00 0.07 0.00 0.00 59.98 59.89 3hqp h ARG 68 Cb 0.14 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.09 3hqp h ARG 68 CO -0.16 0.84 -0.49 0.37 -1.07 0.00 0.00 179.97 179.46 3hqp h GLN 69 N 0.82 0.77 -0.07 0.04 4.15 -0.90 -1.48 115.11 118.44 3hqp h GLN 69 Ca 0.16 -0.50 -0.00 0.00 0.77 0.00 0.00 58.65 59.09 3hqp h GLN 69 Cb 0.42 0.06 -0.00 0.00 0.21 0.00 0.00 27.48 28.17 3hqp h GLN 69 CO 0.01 1.12 0.04 0.00 -1.93 0.00 0.00 178.83 178.08 3hqp h ALA 70 N 0.64 0.08 -0.33 3.38 0.00 -0.57 -0.41 119.26 122.06 3hqp h ALA 70 Ca 0.01 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3hqp h ALA 70 Cb 1.09 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 3hqp h ALA 70 CO 0.11 -0.40 0.14 0.00 0.00 0.00 0.00 179.25 179.10 3hqp h ALA 71 N 0.98 0.43 -0.32 0.00 0.00 -1.21 -2.65 119.26 116.49 3hqp h ALA 71 Ca 0.02 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 54.88 3hqp h ALA 71 Cb 0.04 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 17.63 3hqp h ALA 71 CO -0.00 0.03 -0.11 0.00 0.00 0.00 0.00 179.25 179.17 3hqp h ALA 72 N 0.98 0.17 -0.38 0.00 0.00 -1.03 0.21 119.26 119.21 3hqp h ALA 72 Ca 0.11 0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.18 3hqp h ALA 72 Cb 0.17 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 3hqp h ALA 72 CO -0.01 -0.49 0.25 0.93 0.00 0.00 0.00 179.25 179.94 3hqp h GLU 73 N -0.04 0.35 -0.02 0.00 5.08 -1.01 -1.96 114.58 116.99 3hqp h GLU 73 Ca 0.16 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3hqp h GLU 73 Cb 0.28 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.45 3hqp h GLU 73 CO -0.35 0.23 -0.26 1.28 -1.00 0.00 0.00 179.01 178.92 3hqp n LEU 74 N -4.48 1.95 -3.43 1.33 4.77 -0.64 -4.98 117.00 111.51 3hqp n LEU 74 Ca 0.04 -0.67 -0.22 0.00 -0.03 0.00 0.00 56.01 55.14 3hqp n LEU 74 Cb 0.18 -0.03 0.08 0.00 -2.33 0.00 0.00 43.42 41.32 3hqp n LEU 74 CO 0.35 0.35 0.22 0.61 -1.33 0.00 0.00 177.39 177.58 3hqp n GLY 75 N 1.35 -0.46 3.62 -0.72 0.00 0.63 -5.03 105.19 104.58 3hqp n GLY 75 Ca 0.12 0.19 -0.28 0.00 0.00 0.00 0.00 46.02 46.06 3hqp n GLY 75 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hqp s VAL 76 N -3.31 1.36 -0.26 1.61 -7.23 -0.78 -5.04 120.40 106.75 3hqp s VAL 76 Ca 0.48 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.68 3hqp s VAL 76 Cb -0.21 -2.59 0.06 0.00 0.56 0.00 0.00 36.38 34.21 3hqp s VAL 76 CO 0.70 0.00 -0.10 0.20 -0.31 0.00 0.00 175.10 175.59 3hqp s ASN 77 N -3.71 4.44 -0.18 4.85 0.01 -1.26 -4.45 114.94 114.63 3hqp s ASN 77 Ca 0.24 -1.43 -0.03 0.00 -0.71 0.00 0.00 52.86 50.93 3hqp s ASN 77 Cb 0.06 -1.53 -0.01 0.00 0.41 0.00 0.00 41.25 40.17 3hqp s ASN 77 CO 0.12 -0.20 -0.06 -0.63 -1.51 0.00 0.00 177.10 174.82 3hqp s ILE 78 N 1.10 3.44 0.29 0.60 -1.09 -1.26 -4.63 121.20 119.65 3hqp s ILE 78 Ca -0.08 -0.49 -0.29 0.00 -2.23 0.00 0.00 60.65 57.56 3hqp s ILE 78 Cb -0.20 -2.52 -0.10 0.00 -1.58 0.00 0.00 42.46 38.05 3hqp s ILE 78 CO -0.05 0.46 1.41 0.00 -1.23 0.00 0.00 174.94 175.53 3hqp s ALA 79 N 0.94 3.59 -0.21 9.38 0.00 -1.03 -4.91 121.76 129.51 3hqp s ALA 79 Ca -0.01 1.35 -0.04 0.00 0.00 0.00 0.00 51.96 53.26 3hqp s ALA 79 Cb -0.15 -3.54 -0.01 0.00 0.00 0.00 0.00 23.12 19.42 3hqp s ALA 79 CO 0.01 -0.76 -0.03 0.42 0.00 0.00 0.00 175.76 175.39 3hqp s ILE 80 N -0.48 3.53 -0.03 0.00 1.01 -1.26 -0.72 121.20 123.25 3hqp s ILE 80 Ca 0.56 -0.44 0.03 0.00 0.00 0.00 0.00 60.65 60.79 3hqp s ILE 80 Cb -0.42 -2.60 -0.03 0.00 0.01 0.00 0.00 42.46 39.42 3hqp s ILE 80 CO 0.49 0.42 -0.11 0.00 0.00 0.00 0.00 174.94 175.74 3hqp s ALA 81 N 1.33 2.83 -0.27 9.38 0.00 0.03 -1.00 121.76 134.06 3hqp s ALA 81 Ca 0.04 -0.99 -0.06 0.00 0.00 0.00 0.00 51.96 50.96 3hqp s ALA 81 Cb -0.14 -1.06 0.00 0.00 0.00 0.00 0.00 23.12 21.92 3hqp s ALA 81 CO -0.01 0.58 0.04 -1.17 0.00 0.00 0.00 175.76 175.19 3hqp s LEU 82 N -0.99 3.52 -0.38 0.00 0.20 -0.16 -0.95 118.68 119.92 3hqp s LEU 82 Ca 0.13 -0.58 -0.15 0.00 0.69 0.00 0.00 54.13 54.22 3hqp s LEU 82 Cb -0.11 -1.84 0.00 0.00 -0.43 0.00 0.00 46.19 43.82 3hqp s LEU 82 CO 0.03 -0.12 0.34 -0.62 -0.29 0.00 0.00 176.35 175.69 3hqp s ASP 83 N 1.50 6.14 0.80 3.68 -1.08 0.85 0.12 116.67 128.68 3hqp s ASP 83 Ca 0.04 -0.57 -0.12 0.00 -0.52 0.00 0.00 52.55 51.38 3hqp s ASP 83 Cb -0.16 -2.18 0.07 0.00 -1.46 0.00 0.00 42.92 39.19 3hqp s ASP 83 CO 0.01 -0.42 1.11 0.42 0.52 0.00 0.00 175.17 176.81 3hqp s THR 84 N 1.91 2.86 -0.00 1.71 -4.23 -0.44 -0.49 115.64 116.95 3hqp s THR 84 Ca 0.09 0.28 -0.24 0.00 -1.18 0.00 0.00 61.69 60.64 3hqp s THR 84 Cb -0.17 -3.09 -0.18 0.00 1.34 0.00 0.00 72.50 70.39 3hqp s THR 84 CO 0.12 -0.37 1.30 0.11 -0.54 0.00 0.00 174.62 175.24 3hqp h LYS 85 N -1.09 0.12 -2.06 3.99 1.57 -1.91 -3.39 116.57 113.80 3hqp h LYS 85 Ca -0.47 -0.06 0.25 0.00 -1.87 0.00 0.00 60.65 58.50 3hqp h LYS 85 Cb 1.28 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.53 3hqp h LYS 85 CO 0.61 0.56 -0.37 0.41 -0.57 0.00 0.00 179.45 180.09 3hqp n GLY 86 N 0.20 -1.79 3.30 3.86 0.00 -1.26 -4.23 105.19 105.27 3hqp n GLY 86 Ca -0.08 -1.29 -0.39 0.00 0.00 0.00 0.00 46.02 44.27 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 -3.16 1.23 -4.36 1.61 -0.04 -1.26 -4.88 135.00 124.13 3hqp n PRO 87 Ca 0.00 -1.86 -0.26 0.00 -0.04 0.00 0.00 63.50 61.34 3hqp n PRO 87 Cb 0.42 -3.10 -0.09 0.00 -0.04 0.00 0.00 33.50 30.69 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 5.84 2.08 -0.09 0.54 -1.05 -1.26 -4.96 118.70 119.80 3hqp s GLU 88 Ca 0.63 -1.91 0.03 0.00 -0.15 0.00 0.00 54.97 53.57 3hqp s GLU 88 Cb 0.10 -1.84 0.01 0.00 -0.44 0.00 0.00 34.13 31.95 3hqp s GLU 88 CO 0.16 -0.02 -0.19 0.42 0.95 0.00 0.00 175.26 176.58 3hqp s ILE 89 N -2.62 1.71 0.15 1.83 1.01 -1.26 -4.95 121.20 117.07 3hqp s ILE 89 Ca 0.37 -0.81 0.09 0.00 0.00 0.00 0.00 60.65 60.30 3hqp s ILE 89 Cb 0.05 -1.50 -0.04 0.00 0.01 0.00 0.00 42.46 40.97 3hqp s ILE 89 CO 0.20 0.48 -0.20 -0.13 0.00 0.00 0.00 174.94 175.30 3hqp s ARG 90 N 0.50 1.25 0.83 2.79 1.81 -1.26 -0.65 118.95 124.22 3hqp s ARG 90 Ca -0.16 -1.34 -0.12 0.00 -1.72 0.00 0.00 55.73 52.38 3hqp s ARG 90 Cb -0.17 -1.40 0.10 0.00 -0.45 0.00 0.00 34.95 33.03 3hqp s ARG 90 CO 0.06 0.30 1.20 0.95 -0.68 0.00 0.00 175.30 177.13 3hqp s THR 91 N -1.74 2.01 0.00 0.02 -4.23 0.07 -2.09 115.64 109.67 3hqp s THR 91 Ca 0.13 -0.01 0.00 0.00 -1.18 0.00 0.00 61.69 60.64 3hqp s THR 91 Cb -0.07 -3.00 0.00 0.00 1.34 0.00 0.00 72.50 70.77 3hqp s THR 91 CO 0.06 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.75 3hqp n GLY 92 N -3.38 -0.27 3.92 3.99 0.00 0.13 -3.96 105.19 105.62 3hqp n GLY 92 Ca 0.09 -1.73 -0.27 0.00 0.00 0.00 0.00 46.02 44.12 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 -0.18 3.56 -0.04 1.61 -0.21 -0.36 -1.18 119.66 122.85 3hqp s GLN 93 Ca 0.00 -0.15 0.07 0.00 0.02 0.00 0.00 55.36 55.29 3hqp s GLN 93 Cb 0.00 -2.67 -0.02 0.00 1.00 0.00 0.00 33.01 31.32 3hqp s GLN 93 CO 0.00 0.20 -0.23 -0.06 -2.12 0.00 0.00 175.29 173.08 3hqp s PHE 94 N -2.16 2.43 -0.01 0.91 0.08 -1.26 -1.77 117.98 116.20 3hqp s PHE 94 Ca 0.42 -0.48 -0.30 0.00 0.12 0.00 0.00 56.93 56.69 3hqp s PHE 94 Cb -0.10 -1.56 -0.08 0.00 -0.57 0.00 0.00 43.02 40.71 3hqp s PHE 94 CO 0.33 -0.06 1.94 0.08 -0.10 0.00 0.00 175.22 177.41 3hqp s VAL 95 N -0.47 3.12 0.00 -0.44 1.01 0.10 -0.97 120.40 122.75 3hqp s VAL 95 Ca 0.06 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.18 3hqp s VAL 95 Cb -0.11 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.17 3hqp s VAL 95 CO 0.01 -0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.70 3hqp n GLY 96 N 4.63 0.78 0.00 4.51 0.00 -1.26 -4.55 105.19 109.30 3hqp n GLY 96 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 3hqp n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hqp n GLY 97 N -2.00 2.88 3.46 -0.02 0.00 -0.15 -5.03 105.19 104.33 3hqp n GLY 97 Ca 0.00 -0.75 -0.23 0.00 0.00 0.00 0.00 46.02 45.03 3hqp n GLY 97 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3hqp s ASP 98 N 0.00 3.48 -0.07 1.61 3.84 -1.26 -2.28 116.67 121.99 3hqp s ASP 98 Ca 0.00 -1.03 0.03 0.00 -0.00 0.00 0.00 52.55 51.55 3hqp s ASP 98 Cb 0.00 -0.28 0.01 0.00 -1.38 0.00 0.00 42.92 41.26 3hqp s ASP 98 CO 0.00 0.01 -0.16 0.00 -0.00 0.00 0.00 175.17 175.02 3hqp s ALA 99 N -2.57 1.52 -0.36 2.11 0.00 0.29 -4.80 121.76 117.95 3hqp s ALA 99 Ca 0.29 -0.60 -0.24 0.00 0.00 0.00 0.00 51.96 51.42 3hqp s ALA 99 Cb -0.04 -0.61 0.01 0.00 0.00 0.00 0.00 23.12 22.48 3hqp s ALA 99 CO 0.14 0.19 0.83 0.08 0.00 0.00 0.00 175.76 177.00 3hqp s VAL 100 N 0.45 4.69 -0.25 0.00 1.01 -1.26 -1.12 120.40 123.92 3hqp s VAL 100 Ca -0.13 1.03 -0.12 0.00 0.00 0.00 0.00 61.98 62.76 3hqp s VAL 100 Cb -0.15 -4.25 -0.05 0.00 0.00 0.00 0.00 36.38 31.93 3hqp s VAL 100 CO 0.05 -0.45 0.21 -0.04 0.00 0.00 0.00 175.10 174.87 3hqp s MET 101 N 3.21 4.05 -0.01 2.72 -1.94 -0.32 -4.79 119.30 122.22 3hqp s MET 101 Ca 0.34 -0.20 0.01 0.00 -1.71 0.00 0.00 55.69 54.12 3hqp s MET 101 Cb -0.13 -3.58 -0.04 0.00 2.01 0.00 0.00 34.83 33.10 3hqp s MET 101 CO 0.17 -0.04 0.02 -1.21 -0.01 0.00 0.00 175.02 173.95 3hqp s GLU 102 N 1.34 2.87 0.18 2.03 2.02 -1.26 -0.56 118.70 125.32 3hqp s GLU 102 Ca 0.09 -0.55 -0.32 0.00 0.02 0.00 0.00 54.97 54.21 3hqp s GLU 102 Cb -0.14 -2.73 -0.12 0.00 0.10 0.00 0.00 34.13 31.24 3hqp s GLU 102 CO 0.07 0.64 1.73 -2.13 0.02 0.00 0.00 175.26 175.59 3hqp n ARG 103 N 1.46 2.67 0.00 1.61 0.63 -1.26 -2.20 116.66 119.57 3hqp n ARG 103 Ca -0.15 0.96 0.00 0.00 -0.92 0.00 0.00 57.85 57.75 3hqp n ARG 103 Cb 0.53 -2.81 0.00 0.00 0.45 0.00 0.00 32.46 30.63 3hqp n ARG 103 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3hqp n GLY 104 N 3.95 1.60 3.78 5.14 0.00 0.15 -4.97 105.19 114.83 3hqp n GLY 104 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 3hqp n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hqp s ALA 105 N -2.37 2.57 -0.14 4.61 0.00 -0.93 -4.71 121.76 120.79 3hqp s ALA 105 Ca 0.00 0.58 -0.05 0.00 0.00 0.00 0.00 51.96 52.49 3hqp s ALA 105 Cb 0.00 -3.31 -0.04 0.00 0.00 0.00 0.00 23.12 19.77 3hqp s ALA 105 CO 0.00 -1.08 0.06 -0.08 0.00 0.00 0.00 175.76 174.66 3hqp s THR 106 N -2.23 4.78 0.10 0.00 -1.32 -1.26 -0.27 115.64 115.44 3hqp s THR 106 Ca 0.68 -0.05 -0.01 0.00 -1.21 0.00 0.00 61.69 61.10 3hqp s THR 106 Cb -0.20 -3.09 -0.04 0.00 -1.51 0.00 0.00 72.50 67.65 3hqp s THR 106 CO 0.37 0.55 0.01 0.00 -2.21 0.00 0.00 174.62 173.34 3hqp s TYR 108 N -3.95 2.28 -0.15 0.00 2.02 0.12 -0.33 117.35 117.34 3hqp s TYR 108 Ca 0.17 -0.94 -0.01 0.00 -0.37 0.00 0.00 57.07 55.92 3hqp s TYR 108 Cb 0.08 -1.55 -0.01 0.00 -0.40 0.00 0.00 41.96 40.07 3hqp s TYR 108 CO -0.03 -0.40 -0.10 0.14 -1.57 0.00 0.00 175.55 173.59 3hqp s VAL 109 N 0.46 3.20 0.34 0.71 -7.23 -0.97 -1.64 120.40 115.27 3hqp s VAL 109 Ca -0.17 -0.60 0.09 0.00 -1.81 0.00 0.00 61.98 59.50 3hqp s VAL 109 Cb -0.17 -2.37 -0.06 0.00 0.56 0.00 0.00 36.38 34.34 3hqp s VAL 109 CO 0.07 0.50 -0.02 0.28 -0.31 0.00 0.00 175.10 175.62 3hqp s THR 110 N 0.59 2.54 -1.99 5.32 -1.32 -0.83 -1.21 115.64 118.74 3hqp s THR 110 Ca -0.06 -2.03 0.23 0.00 -1.21 0.00 0.00 61.69 58.62 3hqp s THR 110 Cb -0.15 -2.76 0.02 0.00 -1.51 0.00 0.00 72.50 68.10 3hqp s THR 110 CO 0.03 -0.20 1.15 0.41 -2.21 0.00 0.00 174.62 173.80 3hqp n THR 111 N -0.91 0.00 -2.71 5.08 -1.04 -0.84 -2.36 114.28 111.50 3hqp n THR 111 Ca -0.04 -0.24 -0.43 0.00 -2.04 0.00 0.00 64.05 61.30 3hqp n THR 111 Cb 0.63 1.14 -0.03 0.00 -1.82 0.00 0.00 70.33 70.25 3hqp n THR 111 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3hqp s ASP 112 N -2.49 6.90 0.00 8.00 3.68 -1.26 -4.92 116.67 126.58 3hqp s ASP 112 Ca 0.19 1.02 0.04 0.00 2.13 0.00 0.00 52.55 55.93 3hqp s ASP 112 Cb 0.18 -2.51 0.18 0.00 -1.45 0.00 0.00 42.92 39.31 3hqp s ASP 112 CO 0.57 -0.79 1.04 -2.65 0.13 0.00 0.00 175.17 173.47 3hqp n PRO 113 N 6.64 0.03 0.02 4.34 -0.02 -1.26 -2.22 135.00 142.53 3hqp n PRO 113 Ca 0.10 0.35 0.11 0.00 -2.02 0.00 0.00 63.50 62.04 3hqp n PRO 113 Cb 0.47 -1.50 0.47 0.00 -0.02 0.00 0.00 33.50 32.93 3hqp n PRO 113 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hqp n ALA 114 N -1.40 2.02 -0.46 3.55 0.00 -1.26 -2.77 120.51 120.19 3hqp n ALA 114 Ca 0.01 -0.06 0.06 0.00 0.00 0.00 0.00 53.44 53.46 3hqp n ALA 114 Cb 0.04 -1.37 0.18 0.00 0.00 0.00 0.00 19.45 18.29 3hqp n ALA 114 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3hqp n PHE 115 N -1.62 0.59 0.81 0.00 3.01 -0.94 -4.58 117.46 114.73 3hqp n PHE 115 Ca 0.05 -0.64 0.12 0.00 1.01 0.00 0.00 57.45 57.99 3hqp n PHE 115 Cb 0.28 -0.13 0.51 0.00 -0.01 0.00 0.00 39.48 40.13 3hqp n PHE 115 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3hqp n ALA 116 N 0.08 2.10 -0.39 4.37 0.00 -1.12 -3.33 120.51 122.22 3hqp n ALA 116 Ca 0.14 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.51 3hqp n ALA 116 Cb 0.58 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.63 3hqp n ALA 116 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3hqp n ASP 117 N -1.55 0.56 -3.02 0.00 5.75 -1.26 -1.23 116.55 115.80 3hqp n ASP 117 Ca 0.06 -0.96 -0.22 0.00 -0.01 0.00 0.00 54.79 53.66 3hqp n ASP 117 Cb 0.29 0.03 -0.03 0.00 -1.03 0.00 0.00 41.12 40.38 3hqp n ASP 117 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3hqp n LYS 118 N -0.03 2.02 -3.64 0.11 5.02 -1.21 -4.57 118.16 115.85 3hqp n LYS 118 Ca 0.00 -4.03 -0.32 0.00 -2.02 0.00 0.00 58.31 51.94 3hqp n LYS 118 Cb 0.10 -1.92 -0.05 0.00 -0.02 0.00 0.00 35.03 33.14 3hqp n LYS 118 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3hqp s GLY 119 N -2.95 2.25 0.06 0.72 0.00 -0.73 -4.84 107.32 101.83 3hqp s GLY 119 Ca 0.43 -0.52 0.01 0.00 0.00 0.00 0.00 44.72 44.64 3hqp s GLY 119 CO -0.10 -0.43 0.04 -1.30 0.00 0.00 0.00 173.10 171.31 3hqp n THR 120 N 0.13 0.00 0.21 0.90 -2.24 0.78 0.03 114.28 114.08 3hqp n THR 120 Ca -0.03 -0.39 0.05 0.00 -2.27 0.00 0.00 64.05 61.41 3hqp n THR 120 Cb 0.52 0.17 0.45 0.00 -2.10 0.00 0.00 70.33 69.37 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 0.02 -0.78 2.10 -1.92 -3.27 116.57 112.71 3hqp h LYS 121 Ca -0.04 0.00 -0.32 0.00 -2.00 0.00 0.00 60.65 58.28 3hqp h LYS 121 Cb 0.19 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 31.48 3hqp h LYS 121 CO 0.07 0.27 -1.91 -0.25 -2.00 0.00 0.00 179.45 175.63 3hqp n ASP 122 N -4.13 1.01 -3.68 7.07 8.00 -1.26 -4.70 116.55 118.85 3hqp n ASP 122 Ca -0.02 0.28 -0.11 0.00 0.71 0.00 0.00 54.79 55.65 3hqp n ASP 122 Cb 0.33 -0.05 -0.11 0.00 -0.02 0.00 0.00 41.12 41.27 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 -2.57 0.28 0.33 -1.24 2.20 -1.23 0.16 119.74 117.67 3hqp s LYS 123 Ca -0.10 0.80 0.00 0.00 -0.36 0.00 0.00 55.97 56.31 3hqp s LYS 123 Cb 0.07 0.05 -0.01 0.00 -1.51 0.00 0.00 37.83 36.44 3hqp s LYS 123 CO 0.80 -0.21 0.40 -0.59 -0.36 0.00 0.00 175.35 175.39 3hqp s PHE 124 N 1.94 1.26 -0.02 4.03 -0.71 -0.65 -0.16 117.98 123.67 3hqp s PHE 124 Ca -0.05 -1.39 0.01 0.00 -1.04 0.00 0.00 56.93 54.46 3hqp s PHE 124 Cb -0.11 -0.28 -0.03 0.00 -1.21 0.00 0.00 43.02 41.38 3hqp s PHE 124 CO -0.11 -1.03 -0.01 -0.47 -1.34 0.00 0.00 175.22 172.26 3hqp s TYR 125 N -3.24 3.07 -0.08 3.49 5.04 -1.26 -1.97 117.35 122.40 3hqp s TYR 125 Ca 0.34 0.09 0.01 0.00 -2.44 0.00 0.00 57.07 55.06 3hqp s TYR 125 Cb 0.01 -1.69 0.02 0.00 0.35 0.00 0.00 41.96 40.65 3hqp s TYR 125 CO 0.22 0.45 -0.09 0.42 -1.34 0.00 0.00 175.55 175.20 3hqp s ILE 126 N -1.03 1.01 -0.76 3.14 1.01 -0.99 0.17 121.20 123.75 3hqp s ILE 126 Ca 0.18 -0.35 0.24 0.00 0.00 0.00 0.00 60.65 60.72 3hqp s ILE 126 Cb -0.11 -0.98 0.24 0.00 0.01 0.00 0.00 42.46 41.62 3hqp s ILE 126 CO 0.08 0.34 1.73 -0.90 0.00 0.00 0.00 174.94 176.20 3hqp n ASP 127 N 4.33 0.47 -4.75 3.58 5.68 -0.89 -4.57 116.55 120.40 3hqp n ASP 127 Ca -0.19 0.57 -0.41 0.00 -0.50 0.00 0.00 54.79 54.27 3hqp n ASP 127 Cb 0.51 -0.69 -0.03 0.00 -1.14 0.00 0.00 41.12 39.77 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 -3.13 3.38 0.00 2.11 5.04 -1.26 -5.00 117.35 118.49 3hqp s TYR 128 Ca 0.09 1.46 0.00 0.00 -2.44 0.00 0.00 57.07 56.18 3hqp s TYR 128 Cb 0.12 -3.46 0.00 0.00 0.35 0.00 0.00 41.96 38.97 3hqp s TYR 128 CO 0.46 -1.25 0.03 1.04 -1.34 0.00 0.00 175.55 174.49 3hqp n GLN 129 N 1.93 0.00 -1.04 4.97 1.13 -1.26 -4.26 117.38 118.86 3hqp n GLN 129 Ca 0.03 0.44 -0.16 0.00 -1.94 0.00 0.00 57.00 55.36 3hqp n GLN 129 Cb 0.44 -0.95 -0.05 0.00 0.11 0.00 0.00 30.24 29.79 3hqp n GLN 129 CO 0.00 0.00 0.00 0.27 -1.44 0.00 0.00 177.06 175.89 3hqp n ASN 130 N -1.81 6.01 0.14 1.08 6.94 -1.26 -4.34 115.26 122.01 3hqp n ASN 130 Ca 0.00 -2.87 -0.01 0.00 -0.02 0.00 0.00 54.58 51.68 3hqp n ASN 130 Cb 0.00 -1.21 0.21 0.00 -2.36 0.00 0.00 39.78 36.42 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 3.60 0.06 -1.51 -4.53 -0.00 -1.99 -2.86 115.31 108.07 3hqp h LEU 131 Ca 0.25 -0.03 -0.04 0.00 -0.00 0.00 0.00 57.88 58.06 3hqp h LEU 131 Cb 1.01 -0.02 -0.01 0.00 -0.00 0.00 0.00 40.66 41.64 3hqp h LEU 131 CO 0.55 0.59 -0.20 0.28 -0.00 0.00 0.00 178.44 179.67 3hqp h SER 132 N 0.04 0.00 0.05 0.17 0.02 -1.86 0.10 113.55 112.07 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 0.98 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.52 3hqp h SER 132 CO 0.07 0.20 -0.09 0.29 -1.14 0.00 0.00 176.83 176.16 3hqp n LYS 133 N -3.57 1.48 -0.08 3.45 5.02 -1.09 -4.37 118.16 118.99 3hqp n LYS 133 Ca -0.01 -0.93 -0.15 0.00 -2.02 0.00 0.00 58.31 55.20 3hqp n LYS 133 Cb 0.34 -1.48 -0.05 0.00 -0.02 0.00 0.00 35.03 33.82 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 0.05 1.33 -3.07 -0.18 0.31 -0.60 -5.03 118.33 111.14 3hqp n VAL 134 Ca 0.16 -0.04 -0.32 0.00 -0.01 0.00 0.00 64.34 64.13 3hqp n VAL 134 Cb 0.38 -2.00 -0.05 0.00 -0.91 0.00 0.00 33.84 31.26 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 -2.56 4.70 0.28 2.52 -7.23 0.25 -5.09 120.40 113.27 3hqp s VAL 135 Ca -0.26 0.87 0.04 0.00 -1.81 0.00 0.00 61.98 60.82 3hqp s VAL 135 Cb 0.07 -3.64 -0.06 0.00 0.56 0.00 0.00 36.38 33.32 3hqp s VAL 135 CO 0.36 -0.26 0.02 -0.13 -0.31 0.00 0.00 175.10 174.77 3hqp s ARG 136 N -3.18 1.51 -0.01 4.82 0.52 -1.26 -4.77 118.95 116.58 3hqp s ARG 136 Ca 0.53 -1.80 -0.31 0.00 -0.52 0.00 0.00 55.73 53.63 3hqp s ARG 136 Cb -0.10 -0.81 -0.10 0.00 0.52 0.00 0.00 34.95 34.46 3hqp s ARG 136 CO 0.21 -0.12 1.95 -2.30 0.02 0.00 0.00 175.30 175.06 3hqp n PRO 137 N -0.56 2.64 0.00 3.54 -0.02 -1.26 -1.98 135.00 137.36 3hqp n PRO 137 Ca -0.04 0.97 0.00 0.00 -2.02 0.00 0.00 63.50 62.41 3hqp n PRO 137 Cb 0.65 -2.90 0.00 0.00 -0.02 0.00 0.00 33.50 31.23 3hqp n PRO 137 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hqp n GLY 138 N 4.53 1.01 3.88 -1.23 0.00 0.43 -4.98 105.19 108.82 3hqp n GLY 138 Ca 0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 3hqp n GLY 138 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hqp s ASN 139 N -1.93 6.50 -0.09 1.61 0.02 -0.84 -4.79 114.94 115.42 3hqp s ASN 139 Ca 0.00 1.08 -0.12 0.00 -1.02 0.00 0.00 52.86 52.80 3hqp s ASN 139 Cb 0.00 -2.30 -0.05 0.00 0.02 0.00 0.00 41.25 38.92 3hqp s ASN 139 CO 0.00 -0.39 0.30 -0.31 0.02 0.00 0.00 177.10 176.71 3hqp s TYR 140 N -2.37 3.59 -0.18 2.20 2.02 -1.26 -1.13 117.35 120.22 3hqp s TYR 140 Ca 0.50 0.72 -0.05 0.00 -0.37 0.00 0.00 57.07 57.87 3hqp s TYR 140 Cb -0.10 -2.22 -0.03 0.00 -0.40 0.00 0.00 41.96 39.20 3hqp s TYR 140 CO 0.32 0.51 0.01 0.42 -1.57 0.00 0.00 175.55 175.23 3hqp s ILE 141 N -0.45 4.22 -0.20 2.71 1.01 0.91 -4.94 121.20 124.46 3hqp s ILE 141 Ca 0.19 -0.23 -0.10 0.00 0.00 0.00 0.00 60.65 60.50 3hqp s ILE 141 Cb -0.14 -2.89 -0.05 0.00 0.01 0.00 0.00 42.46 39.39 3hqp s ILE 141 CO 0.07 0.46 0.15 -0.31 0.00 0.00 0.00 174.94 175.31 3hqp s TYR 142 N 0.54 3.40 -0.01 3.97 1.51 -1.18 -0.94 117.35 124.64 3hqp s TYR 142 Ca -0.00 0.34 0.06 0.00 -1.01 0.00 0.00 57.07 56.46 3hqp s TYR 142 Cb -0.14 -2.19 -0.02 0.00 -0.11 0.00 0.00 41.96 39.50 3hqp s TYR 142 CO 0.02 0.25 -0.21 0.42 -1.11 0.00 0.00 175.55 174.93 3hqp s ILE 143 N 0.47 1.64 -0.95 2.71 -1.09 0.20 -2.22 121.20 121.97 3hqp s ILE 143 Ca 0.09 -0.90 -0.04 0.00 -2.23 0.00 0.00 60.65 57.56 3hqp s ILE 143 Cb -0.12 -1.37 -0.04 0.00 -1.58 0.00 0.00 42.46 39.35 3hqp s ILE 143 CO -0.01 0.45 0.84 -0.67 -1.23 0.00 0.00 174.94 174.33 3hqp n ASP 144 N 2.53 -6.98 -3.66 3.58 2.03 -0.18 -1.15 116.55 112.71 3hqp n ASP 144 Ca -0.15 -0.51 -0.28 0.00 0.52 0.00 0.00 54.79 54.37 3hqp n ASP 144 Cb 0.53 -5.16 0.02 0.00 -0.72 0.00 0.00 41.12 35.78 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 -2.72 -4.67 0.00 1.67 8.00 -1.25 -1.86 116.55 115.71 3hqp n ASP 145 Ca -0.05 -0.62 0.00 0.00 0.71 0.00 0.00 54.79 54.83 3hqp n ASP 145 Cb 0.58 -3.77 0.00 0.00 -0.02 0.00 0.00 41.12 37.91 3hqp n ASP 145 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hqp n GLY 146 N -1.52 0.51 0.22 0.44 0.00 -1.16 -4.74 105.19 98.93 3hqp n GLY 146 Ca 0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.92 3hqp n GLY 146 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3hqp h ILE 147 N 0.00 1.31 -3.82 -0.61 2.04 -1.06 -3.44 117.51 111.92 3hqp h ILE 147 Ca 0.00 -1.75 -0.68 0.00 1.00 0.00 0.00 64.86 63.43 3hqp h ILE 147 Cb 0.13 1.70 -0.25 0.00 -0.74 0.00 0.00 36.82 37.66 3hqp h ILE 147 CO 0.00 0.55 -0.78 -0.22 0.00 0.00 0.00 178.15 177.70 3hqp s LEU 148 N -8.47 2.66 -0.05 1.44 2.96 -0.30 -4.99 118.68 111.93 3hqp s LEU 148 Ca -0.08 -0.27 0.05 0.00 -0.22 0.00 0.00 54.13 53.61 3hqp s LEU 148 Cb 0.11 -1.55 -0.01 0.00 0.50 0.00 0.00 46.19 45.24 3hqp s LEU 148 CO 0.85 0.28 -0.20 -0.63 -1.32 0.00 0.00 176.35 175.33 3hqp s ILE 149 N -0.35 1.66 -0.13 6.68 1.01 -1.26 0.61 121.20 129.42 3hqp s ILE 149 Ca 0.03 -0.85 0.02 0.00 0.00 0.00 0.00 60.65 59.86 3hqp s ILE 149 Cb -0.13 -1.41 0.00 0.00 0.01 0.00 0.00 42.46 40.94 3hqp s ILE 149 CO 0.02 0.47 -0.21 -0.76 0.00 0.00 0.00 174.94 174.46 3hqp s LEU 150 N -0.06 2.18 -0.18 2.97 1.43 -0.11 -2.17 118.68 122.74 3hqp s LEU 150 Ca -0.03 -0.56 -0.17 0.00 -1.03 0.00 0.00 54.13 52.33 3hqp s LEU 150 Cb -0.12 -1.46 -0.04 0.00 0.03 0.00 0.00 46.19 44.60 3hqp s LEU 150 CO 0.03 0.10 0.45 -1.58 0.23 0.00 0.00 176.35 175.58 3hqp s GLN 151 N 0.68 4.22 0.23 1.70 0.74 -0.48 -0.06 119.66 126.68 3hqp s GLN 151 Ca -0.10 0.32 -0.30 0.00 0.05 0.00 0.00 55.36 55.33 3hqp s GLN 151 Cb -0.16 -3.52 -0.09 0.00 1.10 0.00 0.00 33.01 30.34 3hqp s GLN 151 CO 0.01 -0.02 1.34 0.08 -0.55 0.00 0.00 175.29 176.15 3hqp s VAL 152 N 1.23 3.01 -0.06 1.34 1.01 -0.29 -1.15 120.40 125.50 3hqp s VAL 152 Ca 0.22 0.86 -0.08 0.00 0.00 0.00 0.00 61.98 62.98 3hqp s VAL 152 Cb -0.15 -3.55 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 3hqp s VAL 152 CO 0.09 0.14 -0.16 1.67 0.00 0.00 0.00 175.10 176.83 3hqp n GLN 153 N 2.36 0.25 -3.69 2.72 -0.06 0.12 -0.43 117.38 118.65 3hqp n GLN 153 Ca 0.06 0.10 -0.10 0.00 -2.00 0.00 0.00 57.00 55.06 3hqp n GLN 153 Cb 0.42 -0.94 -0.04 0.00 -4.06 0.00 0.00 30.24 25.62 3hqp n GLN 153 CO 0.00 0.00 0.00 -1.54 -0.20 0.00 0.00 177.06 175.32 3hqp s SER 154 N -6.02 -0.27 -0.25 1.69 1.04 -1.14 -4.66 113.70 104.10 3hqp s SER 154 Ca -0.15 -0.41 -0.19 0.00 0.48 0.00 0.00 55.95 55.68 3hqp s SER 154 Cb 0.03 0.55 -0.02 0.00 0.10 0.00 0.00 66.02 66.68 3hqp s SER 154 CO 0.21 -0.99 0.58 -1.00 0.98 0.00 0.00 173.24 173.02 3hqp s HIS 155 N -3.85 3.29 -0.06 5.02 3.76 -1.26 0.21 115.29 122.40 3hqp s HIS 155 Ca 0.07 0.75 -0.14 0.00 -0.15 0.00 0.00 55.06 55.59 3hqp s HIS 155 Cb -0.00 -2.78 -0.09 0.00 1.11 0.00 0.00 32.58 30.82 3hqp s HIS 155 CO -0.06 -0.29 0.56 0.93 -0.85 0.00 0.00 174.74 175.03 3hqp h GLU 156 N 7.90 -0.29 0.00 1.40 4.39 -1.69 -3.47 114.58 122.81 3hqp h GLU 156 Ca -0.28 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.44 3hqp h GLU 156 Cb 1.13 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.85 3hqp h GLU 156 CO 0.75 -0.04 0.00 -0.40 -1.16 0.00 0.00 179.01 178.15 3hqp n ASP 157 N -4.97 0.00 0.00 1.42 5.75 -1.22 -4.98 116.55 112.55 3hqp n ASP 157 Ca -0.06 0.00 0.10 0.00 -0.01 0.00 0.00 54.79 54.83 3hqp n ASP 157 Cb 0.19 0.00 0.58 0.00 -1.03 0.00 0.00 41.12 40.87 3hqp n ASP 157 CO 0.00 0.00 0.00 1.21 -0.11 0.00 0.00 177.20 178.30 3hqp n GLU 158 N 0.00 0.50 0.00 0.11 4.07 -1.26 -3.82 120.64 120.24 3hqp n GLU 158 Ca 0.00 0.04 0.00 0.00 -0.06 0.00 0.00 57.16 57.14 3hqp n GLU 158 Cb 0.00 -1.50 0.00 0.00 -0.06 0.00 0.00 31.44 29.88 3hqp n GLU 158 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 3hqp n GLN 159 N -1.13 1.60 -3.87 5.31 6.02 -1.26 -4.99 117.38 119.07 3hqp n GLN 159 Ca 0.13 0.00 -0.33 0.00 -0.01 0.00 0.00 57.00 56.79 3hqp n GLN 159 Cb 0.11 -0.56 -0.05 0.00 1.02 0.00 0.00 30.24 30.76 3hqp n GLN 159 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 3hqp s THR 160 N -0.93 5.39 -0.01 5.09 2.01 -1.25 -1.99 115.64 123.96 3hqp s THR 160 Ca 0.00 -0.12 0.05 0.00 0.31 0.00 0.00 61.69 61.93 3hqp s THR 160 Cb 0.00 -3.56 -0.01 0.00 0.01 0.00 0.00 72.50 68.93 3hqp s THR 160 CO 0.00 0.29 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.30 3hqp s LEU 161 N -2.02 2.04 -0.14 4.42 1.43 -0.35 -1.81 118.68 122.26 3hqp s LEU 161 Ca 0.29 -0.30 -0.22 0.00 -1.03 0.00 0.00 54.13 52.87 3hqp s LEU 161 Cb -0.13 -0.80 -0.03 0.00 0.03 0.00 0.00 46.19 45.26 3hqp s LEU 161 CO 0.20 0.18 0.65 -0.70 0.23 0.00 0.00 176.35 176.91 3hqp s GLU 162 N -0.45 4.32 0.19 1.70 2.12 0.13 -2.29 118.70 124.43 3hqp s GLU 162 Ca 0.06 0.73 0.07 0.00 0.36 0.00 0.00 54.97 56.19 3hqp s GLU 162 Cb -0.06 -3.51 -0.05 0.00 0.26 0.00 0.00 34.13 30.77 3hqp s GLU 162 CO -0.00 -0.08 -0.14 0.00 -0.54 0.00 0.00 175.26 174.50 3hqp s THR 164 N -2.97 2.68 -0.27 0.00 2.01 -0.30 -1.44 115.64 115.35 3hqp s THR 164 Ca 0.20 -0.83 -0.28 0.00 0.31 0.00 0.00 61.69 61.09 3hqp s THR 164 Cb -0.00 -2.05 0.01 0.00 0.01 0.00 0.00 72.50 70.47 3hqp s THR 164 CO 0.05 0.56 0.99 -0.69 -0.69 0.00 0.00 174.62 174.85 3hqp s VAL 165 N -0.18 4.66 -0.50 3.82 1.01 0.62 -1.39 120.40 128.44 3hqp s VAL 165 Ca -0.01 1.76 0.23 0.00 0.00 0.00 0.00 61.98 63.96 3hqp s VAL 165 Cb -0.13 -4.30 0.01 0.00 0.00 0.00 0.00 36.38 31.96 3hqp s VAL 165 CO 0.03 -0.27 1.18 0.71 0.00 0.00 0.00 175.10 176.75 3hqp h THR 166 N 5.56 0.00 -3.03 3.92 1.35 -1.75 0.42 112.91 119.38 3hqp h THR 166 Ca -0.21 -0.65 -0.08 0.00 -0.55 0.00 0.00 66.41 64.92 3hqp h THR 166 Cb 1.07 1.16 -0.17 0.00 -1.73 0.00 0.00 68.15 68.48 3hqp h THR 166 CO 0.97 0.00 -0.12 0.54 -0.25 0.00 0.00 175.52 176.66 3hqp s ASN 167 N -4.55 -0.27 -0.14 5.36 2.20 -1.26 -4.74 114.94 111.54 3hqp s ASN 167 Ca 0.04 0.00 -0.26 0.00 -0.94 0.00 0.00 52.86 51.70 3hqp s ASN 167 Cb 0.12 0.41 -0.02 0.00 -2.00 0.00 0.00 41.25 39.77 3hqp s ASN 167 CO 0.76 -0.65 0.87 -0.44 -2.94 0.00 0.00 177.10 174.70 3hqp s SER 168 N -1.95 7.04 -0.28 3.54 0.01 -1.26 -4.20 113.70 116.60 3hqp s SER 168 Ca -0.06 1.28 -0.22 0.00 1.31 0.00 0.00 55.95 58.26 3hqp s SER 168 Cb -0.01 -2.48 0.09 0.00 0.21 0.00 0.00 66.02 63.83 3hqp s SER 168 CO -0.02 -0.38 0.79 -2.28 0.41 0.00 0.00 173.24 171.76 3hqp s HIS 169 N 1.97 -0.78 -0.16 2.43 5.04 0.28 -4.95 115.29 119.12 3hqp s HIS 169 Ca 0.41 1.77 -0.22 0.00 -1.54 0.00 0.00 55.06 55.47 3hqp s HIS 169 Cb -0.17 0.39 -0.03 0.00 0.04 0.00 0.00 32.58 32.81 3hqp s HIS 169 CO 0.15 -0.38 0.69 0.99 -2.34 0.00 0.00 174.74 173.85 3hqp s THR 170 N 0.76 5.00 -0.07 0.89 2.01 -1.26 -1.17 115.64 121.79 3hqp s THR 170 Ca -0.03 1.35 0.03 0.00 0.31 0.00 0.00 61.69 63.36 3hqp s THR 170 Cb -0.05 -4.01 -0.02 0.00 0.01 0.00 0.00 72.50 68.43 3hqp s THR 170 CO -0.07 0.13 -0.17 0.27 -0.69 0.00 0.00 174.62 174.09 3hqp s ILE 171 N 1.65 2.75 0.58 1.82 -4.36 -0.27 -4.95 121.20 118.41 3hqp s ILE 171 Ca 0.33 -0.81 -0.01 0.00 -0.26 0.00 0.00 60.65 59.89 3hqp s ILE 171 Cb -0.16 -2.08 0.12 0.00 1.25 0.00 0.00 42.46 41.59 3hqp s ILE 171 CO 0.13 0.57 0.79 -1.20 0.24 0.00 0.00 174.94 175.47 3hqp n SER 172 N 2.80 0.94 -4.68 4.36 7.64 -1.26 -0.55 113.62 122.87 3hqp n SER 172 Ca -0.17 -1.82 -0.41 0.00 1.01 0.00 0.00 58.87 57.47 3hqp n SER 172 Cb 0.52 -0.53 0.01 0.00 -1.01 0.00 0.00 64.21 63.21 3hqp n SER 172 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3hqp n ASP 173 N -3.00 2.17 -3.58 6.43 8.00 -0.96 -4.13 116.55 121.47 3hqp n ASP 173 Ca 0.13 1.07 -0.35 0.00 0.71 0.00 0.00 54.79 56.34 3hqp n ASP 173 Cb 0.45 -1.46 0.03 0.00 -0.02 0.00 0.00 41.12 40.12 3hqp n ASP 173 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 3hqp n ARG 174 N -0.03 -1.84 -3.01 -1.24 1.85 -0.33 -4.97 116.66 107.10 3hqp n ARG 174 Ca 0.08 1.26 -0.36 0.00 -1.00 0.00 0.00 57.85 57.82 3hqp n ARG 174 Cb 0.40 -2.12 -0.06 0.00 -1.05 0.00 0.00 32.46 29.62 3hqp n ARG 174 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 3hqp s ARG 175 N -3.10 4.34 0.07 2.89 3.00 -1.26 -4.69 118.95 120.19 3hqp s ARG 175 Ca 0.29 1.00 -0.31 0.00 0.00 0.00 0.00 55.73 56.71 3hqp s ARG 175 Cb -0.03 -2.83 -0.07 0.00 0.00 0.00 0.00 34.95 32.02 3hqp s ARG 175 CO 0.88 0.34 1.40 0.20 0.00 0.00 0.00 175.30 178.12 3hqp s GLY 176 N -1.67 1.94 -0.12 -3.53 0.00 -1.26 -0.75 107.32 101.92 3hqp s GLY 176 Ca 0.46 1.02 0.01 0.00 0.00 0.00 0.00 44.72 46.21 3hqp s GLY 176 CO 0.21 2.42 -0.17 0.54 0.00 0.00 0.00 173.10 176.10 3hqp s VAL 177 N 1.68 2.70 -0.05 1.40 0.11 0.17 -1.01 120.40 125.41 3hqp s VAL 177 Ca 0.64 -0.79 0.06 0.00 -2.93 0.00 0.00 61.98 58.97 3hqp s VAL 177 Cb -0.34 -2.11 -0.01 0.00 -1.53 0.00 0.00 36.38 32.39 3hqp s VAL 177 CO 0.29 0.54 -0.25 0.20 -3.33 0.00 0.00 175.10 172.55 3hqp s ASN 178 N 0.38 2.98 -0.62 3.54 0.01 -0.94 -4.15 114.94 116.13 3hqp s ASN 178 Ca -0.13 -0.49 0.05 0.00 -0.71 0.00 0.00 52.86 51.58 3hqp s ASN 178 Cb -0.17 -0.70 0.17 0.00 0.41 0.00 0.00 41.25 40.96 3hqp s ASN 178 CO 0.06 0.25 0.44 -0.76 -1.51 0.00 0.00 177.10 175.59 3hqp s LEU 179 N -0.26 3.86 0.26 0.60 2.01 -1.26 -3.13 118.68 120.77 3hqp s LEU 179 Ca -0.00 -3.60 -0.30 0.00 0.01 0.00 0.00 54.13 50.24 3hqp s LEU 179 Cb -0.13 -1.31 -0.10 0.00 0.01 0.00 0.00 46.19 44.67 3hqp s LEU 179 CO 0.02 -0.11 1.30 -2.16 1.01 0.00 0.00 176.35 176.41 3hqp s PRO 180 N -0.99 4.39 0.00 1.29 0.04 -1.26 -2.43 135.00 136.03 3hqp s PRO 180 Ca 0.27 2.12 0.00 0.00 0.04 0.00 0.00 61.00 63.42 3hqp s PRO 180 Cb -0.03 -3.14 0.00 0.00 0.04 0.00 0.00 34.50 31.37 3hqp s PRO 180 CO -0.17 -0.20 0.00 0.41 0.04 0.00 0.00 177.00 177.08 3hqp n GLY 181 N 1.66 2.43 3.81 0.56 0.00 -1.26 -5.02 105.19 107.36 3hqp n GLY 181 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 3hqp n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hqp s ASP 183 N -0.78 6.28 0.28 0.00 3.68 -1.26 -4.97 116.67 119.90 3hqp s ASP 183 Ca 0.26 -1.38 -0.29 0.00 2.13 0.00 0.00 52.55 53.26 3hqp s ASP 183 Cb -0.17 -2.37 -0.09 0.00 -1.45 0.00 0.00 42.92 38.83 3hqp s ASP 183 CO 0.14 -1.24 1.02 0.68 0.13 0.00 0.00 175.17 175.91 3hqp s VAL 184 N 3.24 3.78 -0.97 1.11 -7.23 -1.26 -4.99 120.40 114.08 3hqp s VAL 184 Ca 0.20 1.73 -0.00 0.00 -1.81 0.00 0.00 61.98 62.10 3hqp s VAL 184 Cb -0.17 -4.08 0.32 0.00 0.56 0.00 0.00 36.38 33.01 3hqp s VAL 184 CO 0.05 0.37 1.66 -0.67 -0.31 0.00 0.00 175.10 176.20 3hqp n ASP 185 N 1.16 6.83 -4.64 4.85 -0.08 -1.26 -5.00 116.55 118.41 3hqp n ASP 185 Ca -0.01 -3.66 -0.35 0.00 -1.51 0.00 0.00 54.79 49.26 3hqp n ASP 185 Cb 0.46 -1.09 -0.10 0.00 2.34 0.00 0.00 41.12 42.74 3hqp n ASP 185 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 3hqp s LEU 186 N -4.05 3.50 0.59 -2.67 1.43 -1.26 -5.10 118.68 111.12 3hqp s LEU 186 Ca 0.40 0.09 -0.19 0.00 -1.03 0.00 0.00 54.13 53.39 3hqp s LEU 186 Cb 0.19 -1.80 -0.03 0.00 0.03 0.00 0.00 46.19 44.57 3hqp s LEU 186 CO -0.11 0.34 1.23 -2.16 0.23 0.00 0.00 176.35 175.88 3hqp s PRO 187 N -0.65 2.94 0.15 1.29 0.04 -1.26 -4.94 135.00 132.56 3hqp s PRO 187 Ca 0.10 1.90 -0.21 0.00 0.04 0.00 0.00 61.00 62.83 3hqp s PRO 187 Cb -0.12 -1.95 0.03 0.00 0.04 0.00 0.00 34.50 32.51 3hqp s PRO 187 CO 0.02 -1.25 1.65 0.00 0.04 0.00 0.00 177.00 177.46 3hqp h ALA 188 N 0.91 -0.00 -3.20 8.56 0.00 -1.98 -3.39 119.26 120.15 3hqp h ALA 188 Ca -0.51 0.09 -0.54 0.00 0.00 0.00 0.00 54.91 53.96 3hqp h ALA 188 Cb 1.30 0.39 -0.36 0.00 0.00 0.00 0.00 17.79 19.12 3hqp h ALA 188 CO 0.55 -0.59 -0.81 0.54 0.00 0.00 0.00 179.25 178.94 3hqp s VAL 189 N -6.14 1.12 0.73 0.00 0.11 -1.26 -4.50 120.40 110.46 3hqp s VAL 189 Ca -0.14 -0.36 -0.03 0.00 -2.93 0.00 0.00 61.98 58.51 3hqp s VAL 189 Cb 0.12 -1.11 0.12 0.00 -1.53 0.00 0.00 36.38 33.98 3hqp s VAL 189 CO 0.69 0.38 1.01 -0.94 -3.33 0.00 0.00 175.10 172.91 3hqp s SER 190 N 1.55 4.35 0.13 3.54 1.04 -1.26 -4.91 113.70 118.13 3hqp s SER 190 Ca 0.03 -0.14 -0.19 0.00 0.48 0.00 0.00 55.95 56.13 3hqp s SER 190 Cb -0.13 -0.29 -0.04 0.00 0.10 0.00 0.00 66.02 65.66 3hqp s SER 190 CO -0.07 -1.86 1.74 0.00 0.98 0.00 0.00 173.24 174.03 3hqp h ALA 191 N -0.61 0.22 -0.23 5.32 0.00 -2.00 -1.91 119.26 120.05 3hqp h ALA 191 Ca -0.39 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.47 3hqp h ALA 191 Cb 1.27 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 3hqp h ALA 191 CO 0.44 -0.37 -0.19 -0.22 0.00 0.00 0.00 179.25 178.91 3hqp h LYS 192 N 0.15 0.42 -0.61 0.00 3.64 -1.99 -2.66 116.57 115.51 3hqp h LYS 192 Ca 0.09 -0.13 0.03 0.00 -1.27 0.00 0.00 60.65 59.37 3hqp h LYS 192 Cb 0.07 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 31.81 3hqp h LYS 192 CO -0.10 0.60 0.37 -0.44 -2.27 0.00 0.00 179.45 177.60 3hqp h ASP 193 N 0.38 0.59 -0.32 4.20 3.32 -1.83 -0.32 116.42 122.45 3hqp h ASP 193 Ca 0.06 0.01 -0.09 0.00 0.02 0.00 0.00 57.03 57.03 3hqp h ASP 193 Cb 0.56 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 3hqp h ASP 193 CO 0.04 0.41 -0.09 0.03 -1.72 0.00 0.00 179.24 177.90 3hqp h ARG 194 N 0.72 0.73 -0.50 3.56 3.08 -1.10 0.42 114.38 121.30 3hqp h ARG 194 Ca 0.25 -0.23 -0.04 0.00 0.07 0.00 0.00 59.98 60.03 3hqp h ARG 194 Cb 0.04 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.01 3hqp h ARG 194 CO -0.11 0.81 0.16 0.28 -1.07 0.00 0.00 179.97 180.04 3hqp h VAL 195 N 0.67 1.23 -0.27 2.04 2.07 -1.14 -1.94 116.25 118.91 3hqp h VAL 195 Ca 0.12 -0.75 -0.07 0.00 0.82 0.00 0.00 66.70 66.82 3hqp h VAL 195 Cb 0.55 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 3hqp h VAL 195 CO 0.03 0.28 -0.11 0.44 0.02 0.00 0.00 177.57 178.23 3hqp h ASP 196 N 0.67 0.56 -0.68 0.57 3.32 -0.75 -2.24 116.42 117.87 3hqp h ASP 196 Ca 0.16 -0.39 -0.00 0.00 0.02 0.00 0.00 57.03 56.81 3hqp h ASP 196 Cb 0.26 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.63 3hqp h ASP 196 CO -0.01 0.83 0.41 -0.07 -1.72 0.00 0.00 179.24 178.69 3hqp h LEU 197 N 0.29 0.83 -0.32 1.55 3.38 -0.91 -1.63 115.31 118.50 3hqp h LEU 197 Ca 0.06 -0.05 -0.12 0.00 0.09 0.00 0.00 57.88 57.86 3hqp h LEU 197 Cb 0.61 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 3hqp h LEU 197 CO 0.03 0.64 -0.28 -0.61 0.09 0.00 0.00 178.44 178.31 3hqp h GLN 198 N 0.96 0.75 -0.49 1.13 5.75 -1.30 -1.96 115.11 119.95 3hqp h GLN 198 Ca 0.25 -0.38 0.08 0.00 -0.15 0.00 0.00 58.65 58.45 3hqp h GLN 198 Cb -0.03 0.01 -0.07 0.00 1.07 0.00 0.00 27.48 28.46 3hqp h GLN 198 CO -0.05 1.01 0.08 0.35 -2.65 0.00 0.00 178.83 177.57 3hqp h PHE 199 N 0.51 0.12 -0.54 3.99 3.57 -1.06 0.08 116.94 123.61 3hqp h PHE 199 Ca 0.05 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.61 3hqp h PHE 199 Cb 0.85 0.02 -0.04 0.00 2.79 0.00 0.00 35.95 39.58 3hqp h PHE 199 CO 0.07 -0.02 0.32 0.78 -2.23 0.00 0.00 178.31 177.22 3hqp h GLY 200 N 0.21 0.77 0.94 2.40 0.00 -1.19 0.44 103.07 106.64 3hqp h GLY 200 Ca 0.24 -0.24 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 3hqp h GLY 200 CO -0.33 0.19 0.09 -2.08 0.00 0.00 0.00 176.54 174.41 3hqp h VAL 201 N 0.63 1.10 -0.66 4.60 2.07 -0.95 -0.16 116.25 122.87 3hqp h VAL 201 Ca 0.22 -0.28 0.04 0.00 0.82 0.00 0.00 66.70 67.51 3hqp h VAL 201 Cb 0.04 0.98 -0.04 0.00 -1.52 0.00 0.00 31.29 30.75 3hqp h VAL 201 CO -0.11 0.09 0.44 -0.33 0.02 0.00 0.00 177.57 177.69 3hqp h GLU 202 N 0.17 0.73 -0.02 1.57 5.08 -0.66 -2.79 114.58 118.66 3hqp h GLU 202 Ca 0.06 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3hqp h GLU 202 Cb 0.07 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.16 3hqp h GLU 202 CO -0.01 0.48 -0.09 1.04 -1.00 0.00 0.00 179.01 179.43 3hqp n GLN 203 N -4.47 1.95 -3.03 2.33 1.13 0.12 -4.99 117.38 110.43 3hqp n GLN 203 Ca 0.09 -1.53 -0.13 0.00 -1.94 0.00 0.00 57.00 53.49 3hqp n GLN 203 Cb 0.16 -1.47 0.05 0.00 0.11 0.00 0.00 30.24 29.09 3hqp n GLN 203 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3hqp n GLY 204 N 1.33 0.03 3.74 1.08 0.00 -0.14 -5.02 105.19 106.21 3hqp n GLY 204 Ca 0.14 -0.13 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 3hqp n GLY 204 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hqp s VAL 205 N -3.20 2.73 -0.10 1.61 -7.23 -0.80 -4.97 120.40 108.45 3hqp s VAL 205 Ca 0.21 0.34 0.16 0.00 -1.81 0.00 0.00 61.98 60.88 3hqp s VAL 205 Cb -0.09 -2.86 -0.19 0.00 0.56 0.00 0.00 36.38 33.79 3hqp s VAL 205 CO 0.43 -0.21 0.67 0.47 -0.31 0.00 0.00 175.10 176.15 3hqp n ASP 206 N -2.67 0.74 -3.59 4.85 8.00 -0.18 -4.85 116.55 118.85 3hqp n ASP 206 Ca 0.12 0.34 -0.15 0.00 0.71 0.00 0.00 54.79 55.80 3hqp n ASP 206 Cb 0.51 0.24 -0.06 0.00 -0.02 0.00 0.00 41.12 41.79 3hqp n ASP 206 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hqp s MET 207 N -2.78 0.97 -0.21 -1.24 0.23 -1.20 -2.64 119.30 112.43 3hqp s MET 207 Ca -0.04 -0.03 -0.06 0.00 -1.03 0.00 0.00 55.69 54.52 3hqp s MET 207 Cb 0.08 0.45 -0.03 0.00 -1.53 0.00 0.00 34.83 33.80 3hqp s MET 207 CO 0.82 -0.32 0.02 0.42 -2.03 0.00 0.00 175.02 173.94 3hqp s ILE 208 N -1.73 4.12 -0.66 3.16 -1.09 0.59 -0.99 121.20 124.60 3hqp s ILE 208 Ca -0.09 -0.25 -0.21 0.00 -2.23 0.00 0.00 60.65 57.86 3hqp s ILE 208 Cb -0.01 -2.88 0.08 0.00 -1.58 0.00 0.00 42.46 38.07 3hqp s ILE 208 CO 0.04 0.41 0.91 -0.36 -1.23 0.00 0.00 174.94 174.71 3hqp s PHE 209 N 1.12 2.79 -0.44 3.97 0.08 0.32 -0.38 117.98 125.44 3hqp s PHE 209 Ca 0.03 -0.72 -0.24 0.00 0.12 0.00 0.00 56.93 56.12 3hqp s PHE 209 Cb -0.14 -4.22 0.02 0.00 -0.57 0.00 0.00 43.02 38.11 3hqp s PHE 209 CO 0.02 -1.55 0.81 0.00 -0.10 0.00 0.00 175.22 174.40 3hqp s ALA 210 N 3.60 3.29 0.43 5.36 0.00 -0.12 -1.33 121.76 133.00 3hqp s ALA 210 Ca 0.20 -0.93 -0.23 0.00 0.00 0.00 0.00 51.96 51.01 3hqp s ALA 210 Cb -0.18 -3.49 -0.08 0.00 0.00 0.00 0.00 23.12 19.36 3hqp s ALA 210 CO 0.08 -1.90 1.07 -1.12 0.00 0.00 0.00 175.76 173.88 3hqp s SER 211 N 2.13 6.51 -1.42 0.00 0.01 -1.26 -1.08 113.70 118.59 3hqp s SER 211 Ca 0.31 2.07 -0.03 0.00 1.31 0.00 0.00 55.95 59.61 3hqp s SER 211 Cb -0.12 -2.58 0.03 0.00 0.21 0.00 0.00 66.02 63.55 3hqp s SER 211 CO 0.23 -0.66 0.59 0.49 0.41 0.00 0.00 173.24 174.29 3hqp n PHE 212 N -0.39 -1.80 -2.48 2.43 3.72 -1.22 -4.44 117.46 113.27 3hqp n PHE 212 Ca 0.07 0.79 -0.43 0.00 -0.05 0.00 0.00 57.45 57.83 3hqp n PHE 212 Cb 0.50 -3.87 -0.02 0.00 -0.94 0.00 0.00 39.48 35.15 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 -3.75 4.36 -0.04 4.37 -1.09 -1.04 -4.73 121.20 119.29 3hqp s ILE 213 Ca 0.15 1.65 0.02 0.00 -2.23 0.00 0.00 60.65 60.24 3hqp s ILE 213 Cb -0.08 -4.07 -0.02 0.00 -1.58 0.00 0.00 42.46 36.72 3hqp s ILE 213 CO 0.87 -0.09 0.05 -2.11 -1.23 0.00 0.00 174.94 172.42 3hqp n ARG 214 N 6.05 2.98 -3.71 2.79 1.85 -1.26 -4.05 116.66 121.31 3hqp n ARG 214 Ca 0.12 -0.01 -0.11 0.00 -1.00 0.00 0.00 57.85 56.86 3hqp n ARG 214 Cb 0.46 -0.83 -0.06 0.00 -1.05 0.00 0.00 32.46 30.98 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 -1.72 -0.17 0.41 2.89 1.04 -1.26 -4.04 113.70 110.85 3hqp s SER 215 Ca -0.00 -0.25 0.08 0.00 0.48 0.00 0.00 55.95 56.26 3hqp s SER 215 Cb 0.01 0.41 0.86 0.00 0.10 0.00 0.00 66.02 67.40 3hqp s SER 215 CO 0.07 -0.72 2.02 0.00 0.98 0.00 0.00 173.24 175.59 3hqp h ALA 216 N 2.82 1.66 -0.10 5.32 0.00 -1.86 -2.65 119.26 124.44 3hqp h ALA 216 Ca -0.33 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 3hqp h ALA 216 Cb 1.22 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 3hqp h ALA 216 CO 0.47 0.28 0.05 1.49 0.00 0.00 0.00 179.25 181.53 3hqp h GLU 217 N 0.42 0.15 -0.87 0.00 4.81 -1.96 -1.46 114.58 115.67 3hqp h GLU 217 Ca 0.11 -0.02 0.17 0.00 -0.13 0.00 0.00 59.36 59.48 3hqp h GLU 217 Cb 0.08 -0.03 -0.10 0.00 0.63 0.00 0.00 28.75 29.33 3hqp h GLU 217 CO -0.01 0.23 0.44 0.37 -0.73 0.00 0.00 179.01 179.30 3hqp h GLN 218 N 0.03 0.55 -0.48 1.92 4.15 -1.89 0.24 115.11 119.62 3hqp h GLN 218 Ca 0.03 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3hqp h GLN 218 Cb 0.14 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 27.68 3hqp h GLN 218 CO -0.00 0.36 0.31 0.28 -1.93 0.00 0.00 178.83 177.85 3hqp h VAL 219 N 0.57 1.14 -0.70 2.39 2.07 -1.18 -1.24 116.25 119.29 3hqp h VAL 219 Ca 0.50 -0.28 0.06 0.00 0.82 0.00 0.00 66.70 67.80 3hqp h VAL 219 Cb 0.79 0.46 -0.06 0.00 -1.52 0.00 0.00 31.29 30.96 3hqp h VAL 219 CO -0.41 0.14 0.40 1.23 0.02 0.00 0.00 177.57 178.94 3hqp h GLY 220 N 0.65 1.02 0.90 2.17 0.00 -0.03 -1.56 103.07 106.23 3hqp h GLY 220 Ca 0.18 -0.28 0.03 0.00 0.00 0.00 0.00 47.33 47.25 3hqp h GLY 220 CO -0.04 0.18 0.49 -0.55 0.00 0.00 0.00 176.54 176.62 3hqp h ASP 221 N 0.73 0.81 -0.17 0.19 3.32 -0.07 0.06 116.42 121.29 3hqp h ASP 221 Ca 0.31 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.34 3hqp h ASP 221 Cb 0.18 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 3hqp h ASP 221 CO -0.18 0.56 0.08 0.58 -1.72 0.00 0.00 179.24 178.56 3hqp h VAL 222 N 0.96 1.14 -0.98 -1.35 2.07 -0.93 -1.96 116.25 115.20 3hqp h VAL 222 Ca 0.30 -0.41 0.01 0.00 0.82 0.00 0.00 66.70 67.42 3hqp h VAL 222 Cb -0.01 1.10 -0.05 0.00 -1.52 0.00 0.00 31.29 30.81 3hqp h VAL 222 CO -0.10 0.13 0.65 -0.09 0.02 0.00 0.00 177.57 178.18 3hqp h ARG 223 N 0.14 1.28 -0.74 1.57 2.43 -0.99 -1.24 114.38 116.83 3hqp h ARG 223 Ca 0.06 -0.08 -0.06 0.00 -0.81 0.00 0.00 59.98 59.09 3hqp h ARG 223 Cb 0.14 -0.29 -0.03 0.00 -0.42 0.00 0.00 29.97 29.37 3hqp h ARG 223 CO -0.01 0.85 0.24 -0.22 -1.51 0.00 0.00 179.97 179.32 3hqp h LYS 224 N 1.32 1.15 0.00 0.20 1.63 -0.87 -0.80 116.57 119.20 3hqp h LYS 224 Ca 0.36 -0.24 -0.10 0.00 -0.85 0.00 0.00 60.65 59.82 3hqp h LYS 224 Cb -0.14 -0.17 -0.01 0.00 -0.60 0.00 0.00 32.23 31.31 3hqp h LYS 224 CO -0.08 0.97 -0.46 0.00 -3.45 0.00 0.00 179.45 176.43 3hqp h ALA 225 N 1.12 0.99 -0.19 5.00 0.00 -0.86 -2.76 119.26 122.55 3hqp h ALA 225 Ca 0.24 -0.41 -0.17 0.00 0.00 0.00 0.00 54.91 54.57 3hqp h ALA 225 Cb 0.29 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3hqp h ALA 225 CO -0.01 0.57 -0.53 -0.07 0.00 0.00 0.00 179.25 179.21 3hqp h LEU 226 N 0.00 0.80 0.00 0.00 3.38 -0.91 -3.44 115.31 115.15 3hqp h LEU 226 Ca -0.00 -0.58 0.04 0.00 0.09 0.00 0.00 57.88 57.43 3hqp h LEU 226 Cb 0.96 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 3hqp h LEU 226 CO 0.06 1.24 -0.06 0.61 0.09 0.00 0.00 178.44 180.38 3hqp n GLY 227 N 0.52 -2.03 0.35 0.83 0.00 -0.34 -3.12 105.19 101.40 3hqp n GLY 227 Ca -0.06 -1.40 0.07 0.00 0.00 0.00 0.00 46.02 44.63 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 0.90 -0.40 1.61 0.11 -1.88 -1.56 132.00 130.78 3hqp h PRO 228 Ca 0.00 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.05 3hqp h PRO 228 Cb 0.15 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.04 3hqp h PRO 228 CO 0.00 0.60 0.20 0.87 -0.21 0.00 0.00 178.00 179.46 3hqp h LYS 229 N 0.93 0.55 -0.68 1.05 1.79 -2.00 -2.81 116.57 115.40 3hqp h LYS 229 Ca 0.50 -0.05 -0.37 0.00 -2.18 0.00 0.00 60.65 58.54 3hqp h LYS 229 Cb 0.54 -0.11 -0.22 0.00 -1.58 0.00 0.00 32.23 30.86 3hqp h LYS 229 CO -0.28 0.42 0.26 0.41 -1.08 0.00 0.00 179.45 179.18 3hqp n GLY 230 N -1.31 4.87 0.19 3.86 0.00 -0.63 -4.63 105.19 107.54 3hqp n GLY 230 Ca 0.03 -1.30 0.14 0.00 0.00 0.00 0.00 46.02 44.89 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 1.11 0.00 -0.01 1.61 0.11 -1.17 -2.95 114.38 113.08 3hqp h ARG 231 Ca 0.43 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.51 3hqp h ARG 231 Cb 2.11 0.00 0.00 0.00 1.11 0.00 0.00 29.97 33.19 3hqp h ARG 231 CO 0.79 0.00 -0.50 -0.25 0.10 0.00 0.00 179.97 180.11 3hqp n ASP 232 N -2.63 1.72 -4.71 0.08 8.00 -1.26 -4.91 116.55 112.85 3hqp n ASP 232 Ca 0.02 -1.36 -0.42 0.00 0.71 0.00 0.00 54.79 53.74 3hqp n ASP 232 Cb 0.33 0.56 -0.03 0.00 -0.02 0.00 0.00 41.12 41.96 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 -2.33 3.61 0.33 0.53 1.01 -1.12 -5.00 121.20 118.23 3hqp s ILE 233 Ca 0.15 1.11 -0.26 0.00 0.00 0.00 0.00 60.65 61.65 3hqp s ILE 233 Cb 0.16 -3.71 -0.10 0.00 0.01 0.00 0.00 42.46 38.81 3hqp s ILE 233 CO 0.55 0.06 0.95 -0.04 0.00 0.00 0.00 174.94 176.45 3hqp s MET 234 N 1.49 4.58 -0.36 2.79 -1.94 -1.08 -4.91 119.30 119.85 3hqp s MET 234 Ca 0.63 1.33 -0.04 0.00 -1.71 0.00 0.00 55.69 55.89 3hqp s MET 234 Cb -0.33 -2.79 0.07 0.00 2.01 0.00 0.00 34.83 33.79 3hqp s MET 234 CO 0.29 0.27 0.13 0.42 -0.01 0.00 0.00 175.02 176.12 3hqp s ILE 235 N -1.63 3.46 -0.37 2.53 1.01 -1.26 -0.30 121.20 124.64 3hqp s ILE 235 Ca 0.50 -1.54 -0.18 0.00 0.00 0.00 0.00 60.65 59.44 3hqp s ILE 235 Cb -0.18 -3.12 0.00 0.00 0.01 0.00 0.00 42.46 39.17 3hqp s ILE 235 CO 0.24 -0.37 0.48 -0.63 0.00 0.00 0.00 174.94 174.66 3hqp s ILE 236 N 1.28 5.04 -0.09 2.92 -1.09 0.49 -1.32 121.20 128.43 3hqp s ILE 236 Ca 0.01 0.13 -0.26 0.00 -2.23 0.00 0.00 60.65 58.31 3hqp s ILE 236 Cb -0.21 -3.97 -0.03 0.00 -1.58 0.00 0.00 42.46 36.67 3hqp s ILE 236 CO -0.01 -0.26 0.81 0.00 -1.23 0.00 0.00 174.94 174.25 3hqp s LYS 238 N 1.36 3.63 -0.36 0.00 1.02 -0.24 -0.20 119.74 124.94 3hqp s LYS 238 Ca 0.41 -0.13 -0.19 0.00 0.02 0.00 0.00 55.97 56.08 3hqp s LYS 238 Cb -0.18 -3.81 0.00 0.00 -0.52 0.00 0.00 37.83 33.33 3hqp s LYS 238 CO 0.18 -0.65 0.58 0.42 -0.92 0.00 0.00 175.35 174.96 3hqp s ILE 239 N 2.43 4.94 0.00 2.17 -1.09 -0.51 -2.48 121.20 126.66 3hqp s ILE 239 Ca 0.19 0.41 0.00 0.00 -2.23 0.00 0.00 60.65 59.02 3hqp s ILE 239 Cb -0.15 -4.04 0.00 0.00 -1.58 0.00 0.00 42.46 36.68 3hqp s ILE 239 CO 0.13 -0.31 0.73 -1.84 -1.23 0.00 0.00 174.94 172.42 3hqp n GLU 240 N 5.93 0.00 -4.14 2.79 0.28 -1.26 -2.89 120.64 121.35 3hqp n GLU 240 Ca -0.03 -0.45 -0.15 0.00 -0.16 0.00 0.00 57.16 56.37 3hqp n GLU 240 Cb 0.49 -0.22 -0.06 0.00 1.43 0.00 0.00 31.44 33.08 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 -0.45 0.88 0.13 -1.84 2.20 -1.26 -3.78 114.94 110.82 3hqp s ASN 241 Ca 0.00 -1.48 -0.21 0.00 -0.94 0.00 0.00 52.86 50.23 3hqp s ASN 241 Cb 0.00 0.59 -0.02 0.00 -2.00 0.00 0.00 41.25 39.82 3hqp s ASN 241 CO -0.00 -1.17 1.68 -0.74 -2.94 0.00 0.00 177.10 173.93 3hqp h HIS 242 N 2.20 -0.28 -0.59 1.54 -0.00 -1.96 -3.10 115.15 112.97 3hqp h HIS 242 Ca -0.28 0.02 -0.07 0.00 -0.00 0.00 0.00 60.37 60.04 3hqp h HIS 242 Cb 1.24 0.15 -0.02 0.00 -0.00 0.00 0.00 27.41 28.77 3hqp h HIS 242 CO 1.27 -0.17 0.09 1.96 -0.00 0.00 0.00 177.93 181.08 3hqp h GLN 243 N -0.12 0.98 -0.93 5.26 4.20 -1.94 -2.66 115.11 119.91 3hqp h GLN 243 Ca 0.10 -0.27 0.15 0.00 0.06 0.00 0.00 58.65 58.69 3hqp h GLN 243 Cb 0.26 -0.11 -0.09 0.00 0.30 0.00 0.00 27.48 27.83 3hqp h GLN 243 CO -0.23 0.93 0.53 0.78 -0.67 0.00 0.00 178.83 180.17 3hqp h GLY 244 N 0.87 1.54 0.61 3.46 0.00 -1.68 0.18 103.07 108.05 3hqp h GLY 244 Ca 0.18 -0.33 -0.02 0.00 0.00 0.00 0.00 47.33 47.16 3hqp h GLY 244 CO 0.01 0.02 -0.04 -2.08 0.00 0.00 0.00 176.54 174.46 3hqp h VAL 245 N 0.77 1.36 -0.54 4.60 2.07 -1.54 -2.78 116.25 120.19 3hqp h VAL 245 Ca 0.50 -1.13 0.09 0.00 0.82 0.00 0.00 66.70 66.98 3hqp h VAL 245 Cb 0.65 2.01 -0.08 0.00 -1.52 0.00 0.00 31.29 32.36 3hqp h VAL 245 CO -0.33 0.31 0.12 -0.61 0.02 0.00 0.00 177.57 177.07 3hqp h GLN 246 N -0.32 0.25 -0.92 1.57 4.15 -0.87 -2.07 115.11 116.90 3hqp h GLN 246 Ca 0.01 -0.01 -0.32 0.00 0.77 0.00 0.00 58.65 59.09 3hqp h GLN 246 Cb 0.52 -0.06 -0.19 0.00 0.21 0.00 0.00 27.48 27.96 3hqp h GLN 246 CO 0.01 0.16 0.41 0.09 -1.93 0.00 0.00 178.83 177.58 3hqp n ASN 247 N -5.11 3.91 -0.22 -0.69 3.02 0.50 -4.70 115.26 111.98 3hqp n ASN 247 Ca 0.07 -3.18 0.01 0.00 -0.03 0.00 0.00 54.58 51.44 3hqp n ASN 247 Cb 0.27 -0.75 0.12 0.00 -0.61 0.00 0.00 39.78 38.82 3hqp n ASN 247 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 3hqp h ILE 248 N 1.39 0.78 0.38 2.41 6.09 -1.07 -1.75 117.51 125.73 3hqp h ILE 248 Ca 0.40 -0.16 -0.02 0.00 -1.37 0.00 0.00 64.86 63.71 3hqp h ILE 248 Cb 2.34 0.28 0.00 0.00 0.47 0.00 0.00 36.82 39.91 3hqp h ILE 248 CO 0.79 0.08 -0.18 0.44 -3.07 0.00 0.00 178.15 176.21 3hqp h ASP 249 N 0.46 -0.43 -0.23 2.19 3.32 -1.85 0.16 116.42 120.03 3hqp h ASP 249 Ca 0.33 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.35 3hqp h ASP 249 Cb 0.40 0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.04 3hqp h ASP 249 CO -0.31 -0.30 0.07 0.77 -1.72 0.00 0.00 179.24 177.76 3hqp h SER 250 N -0.53 0.41 -0.07 6.45 4.64 -1.92 -1.54 113.55 121.00 3hqp h SER 250 Ca -0.05 -0.05 -0.01 0.00 -0.47 0.00 0.00 61.79 61.20 3hqp h SER 250 Cb 0.40 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 62.38 3hqp h SER 250 CO 0.09 0.43 -0.00 0.40 -0.87 0.00 0.00 176.83 176.87 3hqp h ILE 251 N 0.45 1.26 -0.29 0.95 2.04 -1.05 -2.64 117.51 118.21 3hqp h ILE 251 Ca 0.11 -0.79 0.03 0.00 1.00 0.00 0.00 64.86 65.20 3hqp h ILE 251 Cb 0.19 1.65 -0.03 0.00 -0.74 0.00 0.00 36.82 37.89 3hqp h ILE 251 CO -0.00 0.22 0.11 0.40 0.00 0.00 0.00 178.15 178.88 3hqp h ILE 252 N -0.17 0.94 -0.76 -0.67 2.04 -0.42 0.22 117.51 118.69 3hqp h ILE 252 Ca 0.02 -0.09 0.14 0.00 1.00 0.00 0.00 64.86 65.93 3hqp h ILE 252 Cb 0.35 0.67 -0.09 0.00 -0.74 0.00 0.00 36.82 37.00 3hqp h ILE 252 CO 0.00 0.05 0.32 -0.08 0.00 0.00 0.00 178.15 178.44 3hqp h GLU 253 N 0.25 0.46 0.13 2.37 4.57 -1.31 -2.65 114.58 118.40 3hqp h GLU 253 Ca 0.13 -0.03 -0.28 0.00 -1.18 0.00 0.00 59.36 58.00 3hqp h GLU 253 Cb 0.08 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 28.57 3hqp h GLU 253 CO -0.12 0.30 -1.29 0.93 -1.18 0.00 0.00 179.01 177.65 3hqp h GLU 254 N 0.47 0.27 -7.65 1.92 4.39 -1.04 -3.48 114.58 109.47 3hqp h GLU 254 Ca 0.41 -0.47 -0.44 0.00 0.34 0.00 0.00 59.36 59.21 3hqp h GLU 254 Cb 0.61 0.17 0.17 0.00 -0.10 0.00 0.00 28.75 29.60 3hqp h GLU 254 CO -0.39 1.21 0.32 -1.54 -1.16 0.00 0.00 179.01 177.44 3hqp s SER 255 N -7.13 2.42 0.00 1.42 1.04 0.72 -4.98 113.70 107.19 3hqp s SER 255 Ca -0.05 0.46 0.16 0.00 0.48 0.00 0.00 55.95 57.00 3hqp s SER 255 Cb 0.07 -0.62 -0.02 0.00 0.10 0.00 0.00 66.02 65.55 3hqp s SER 255 CO 0.88 -3.18 0.82 0.47 0.98 0.00 0.00 173.24 173.22 3hqp n ASP 256 N -4.10 1.52 0.00 7.02 10.43 -0.43 -4.95 116.55 126.03 3hqp n ASP 256 Ca 0.14 -1.26 0.00 0.00 2.57 0.00 0.00 54.79 56.24 3hqp n ASP 256 Cb 0.59 0.52 0.00 0.00 1.84 0.00 0.00 41.12 44.08 3hqp n ASP 256 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3hqp n GLY 257 N 1.16 1.43 3.21 0.44 0.00 -1.22 -4.09 105.19 106.13 3hqp n GLY 257 Ca 0.06 -0.99 -0.25 0.00 0.00 0.00 0.00 46.02 44.84 3hqp n GLY 257 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hqp s ILE 258 N -2.00 1.53 -0.18 -0.61 -1.09 -0.65 -0.78 121.20 117.43 3hqp s ILE 258 Ca 0.00 -0.98 -0.02 0.00 -2.23 0.00 0.00 60.65 57.42 3hqp s ILE 258 Cb 0.00 -1.31 -0.01 0.00 -1.58 0.00 0.00 42.46 39.56 3hqp s ILE 258 CO 0.00 0.30 -0.08 -0.32 -1.23 0.00 0.00 174.94 173.61 3hqp s MET 259 N -0.79 3.38 -1.13 2.79 -2.45 0.72 -0.78 119.30 121.05 3hqp s MET 259 Ca 0.07 -0.65 -0.21 0.00 -1.25 0.00 0.00 55.69 53.65 3hqp s MET 259 Cb -0.08 -2.85 0.02 0.00 1.25 0.00 0.00 34.83 33.17 3hqp s MET 259 CO 0.00 -0.02 1.72 0.08 1.05 0.00 0.00 175.02 177.85 3hqp s VAL 260 N 1.00 3.85 -1.28 10.11 1.01 0.75 -1.42 120.40 134.41 3hqp s VAL 260 Ca -0.01 -1.14 -0.18 0.00 0.00 0.00 0.00 61.98 60.65 3hqp s VAL 260 Cb -0.15 -4.86 0.03 0.00 0.00 0.00 0.00 36.38 31.40 3hqp s VAL 260 CO -0.01 -1.65 1.85 0.00 0.00 0.00 0.00 175.10 175.30 3hqp n ALA 261 N 10.49 3.49 0.26 5.51 0.00 -1.14 -2.79 120.51 136.34 3hqp n ALA 261 Ca 0.42 -3.67 0.12 0.00 0.00 0.00 0.00 53.44 50.31 3hqp n ALA 261 Cb 0.48 -3.58 0.73 0.00 0.00 0.00 0.00 19.45 17.08 3hqp n ALA 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hqp h ARG 262 N 7.76 0.00 0.12 0.00 3.08 -1.83 -2.47 114.38 121.04 3hqp h ARG 262 Ca 0.42 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.47 3hqp h ARG 262 Cb 0.84 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.89 3hqp h ARG 262 CO 1.50 0.11 -0.12 0.78 -1.07 0.00 0.00 179.97 181.17 3hqp h GLY 263 N 0.77 -0.84 2.00 0.04 0.00 -1.86 -1.60 103.07 101.59 3hqp h GLY 263 Ca -0.00 0.37 -0.05 0.00 0.00 0.00 0.00 47.33 47.65 3hqp h GLY 263 CO 0.01 -0.29 -0.22 -0.55 0.00 0.00 0.00 176.54 175.49 3hqp h ASP 264 N -0.25 0.00 -0.02 0.19 3.32 -1.86 -3.21 116.42 114.59 3hqp h ASP 264 Ca -0.02 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.90 3hqp h ASP 264 Cb 0.21 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 3hqp h ASP 264 CO -0.02 0.22 -0.43 0.25 -1.72 0.00 0.00 179.24 177.54 3hqp h LEU 265 N 0.00 0.59 -1.15 1.55 6.46 -1.33 -2.37 115.31 119.07 3hqp h LEU 265 Ca -0.00 -0.27 0.00 0.00 -0.12 0.00 0.00 57.88 57.49 3hqp h LEU 265 Cb 0.66 -0.17 0.00 0.00 -0.73 0.00 0.00 40.66 40.42 3hqp h LEU 265 CO 0.03 0.94 0.00 1.23 -0.62 0.00 0.00 178.44 180.02 3hqp h GLY 266 N 1.07 0.00 0.22 3.75 0.00 -1.29 -0.18 103.07 106.63 3hqp h GLY 266 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 46.98 3hqp h GLY 266 CO 0.08 0.00 -2.26 -0.62 0.00 0.00 0.00 176.54 173.74 3hqp n VAL 267 N -2.66 1.60 0.11 4.60 0.31 -1.13 -3.45 118.33 117.71 3hqp n VAL 267 Ca 0.01 -0.56 -0.02 0.00 -0.01 0.00 0.00 64.34 63.76 3hqp n VAL 267 Cb 0.25 -1.60 0.05 0.00 -0.91 0.00 0.00 33.84 31.64 3hqp n VAL 267 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 3hqp h GLU 268 N -0.10 0.00 -5.92 5.55 4.57 -1.36 -3.44 114.58 113.89 3hqp h GLU 268 Ca -0.52 0.00 -0.58 0.00 -1.18 0.00 0.00 59.36 57.07 3hqp h GLU 268 Cb 1.90 0.00 -0.29 0.00 -0.16 0.00 0.00 28.75 30.20 3hqp h GLU 268 CO -0.06 0.73 -0.85 0.42 -1.18 0.00 0.00 179.01 178.08 3hqp s ILE 269 N -3.14 1.56 0.06 2.32 1.09 -0.09 -4.66 121.20 118.34 3hqp s ILE 269 Ca 0.01 -0.88 -0.37 0.00 -1.10 0.00 0.00 60.65 58.30 3hqp s ILE 269 Cb 0.11 -1.30 -0.17 0.00 -1.06 0.00 0.00 42.46 40.03 3hqp s ILE 269 CO 0.77 0.41 1.32 -2.65 -0.10 0.00 0.00 174.94 174.69 3hqp n PRO 270 N 2.50 0.98 -0.32 2.79 -0.02 -1.26 -4.22 135.00 135.45 3hqp n PRO 270 Ca -0.15 0.35 0.19 0.00 -2.02 0.00 0.00 63.50 61.87 3hqp n PRO 270 Cb 0.53 -1.98 0.39 0.00 -0.02 0.00 0.00 33.50 32.42 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 4.45 1.58 0.00 3.55 0.00 -1.88 0.36 119.26 127.32 3hqp h ALA 271 Ca -0.48 0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3hqp h ALA 271 Cb 1.35 0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.45 3hqp h ALA 271 CO 0.77 -0.58 0.00 1.05 0.00 0.00 0.00 179.25 180.48 3hqp h GLU 272 N 0.18 0.00 0.00 0.00 9.09 -1.91 -2.80 114.58 119.14 3hqp h GLU 272 Ca 0.65 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.06 3hqp h GLU 272 Cb 1.46 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.56 3hqp h GLU 272 CO -0.70 0.00 0.00 1.63 0.05 0.00 0.00 179.01 179.99 3hqp n LYS 273 N -2.39 0.26 -0.15 1.06 4.76 0.13 -3.53 118.16 118.30 3hqp n LYS 273 Ca 0.03 0.22 -0.08 0.00 -2.87 0.00 0.00 58.31 55.60 3hqp n LYS 273 Cb 0.29 -1.81 0.00 0.00 -1.84 0.00 0.00 35.03 31.68 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 1.18 -0.85 -0.18 2.07 -1.55 -1.21 116.25 115.71 3hqp h VAL 274 Ca 0.00 -0.53 0.18 0.00 0.82 0.00 0.00 66.70 67.18 3hqp h VAL 274 Cb 0.72 0.70 -0.11 0.00 -1.52 0.00 0.00 31.29 31.09 3hqp h VAL 274 CO 0.00 0.20 0.38 0.58 0.02 0.00 0.00 177.57 178.75 3hqp h VAL 275 N 0.58 0.58 0.03 2.57 2.07 -1.76 0.41 116.25 120.74 3hqp h VAL 275 Ca 0.15 -0.16 -0.13 0.00 0.82 0.00 0.00 66.70 67.39 3hqp h VAL 275 Cb 0.12 0.07 0.01 0.00 -1.52 0.00 0.00 31.29 29.98 3hqp h VAL 275 CO -0.02 0.09 -0.52 0.58 0.02 0.00 0.00 177.57 177.72 3hqp h VAL 276 N 0.47 1.50 -0.61 2.57 2.07 -1.70 -2.83 116.25 117.71 3hqp h VAL 276 Ca 0.50 -2.16 0.13 0.00 0.82 0.00 0.00 66.70 65.99 3hqp h VAL 276 Cb 0.85 2.82 -0.10 0.00 -1.52 0.00 0.00 31.29 33.34 3hqp h VAL 276 CO -0.46 0.61 0.03 0.00 0.02 0.00 0.00 177.57 177.77 3hqp h ALA 277 N 0.23 0.63 -0.57 1.67 0.00 -0.56 -1.37 119.26 119.29 3hqp h ALA 277 Ca -0.07 0.18 0.01 0.00 0.00 0.00 0.00 54.91 55.02 3hqp h ALA 277 Cb 1.28 0.30 -0.03 0.00 0.00 0.00 0.00 17.79 19.34 3hqp h ALA 277 CO 0.10 -0.38 0.38 0.37 0.00 0.00 0.00 179.25 179.72 3hqp h GLN 278 N 0.14 0.74 -0.87 0.00 4.15 -0.20 -0.81 115.11 118.27 3hqp h GLN 278 Ca 0.32 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.70 3hqp h GLN 278 Cb 0.52 -0.17 -0.04 0.00 0.21 0.00 0.00 27.48 28.00 3hqp h GLN 278 CO -0.50 0.49 0.55 0.87 -1.93 0.00 0.00 178.83 178.31 3hqp h LYS 279 N 0.77 1.16 0.22 1.69 1.57 -1.15 -2.58 116.57 118.25 3hqp h LYS 279 Ca 0.21 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 3hqp h LYS 279 Cb -0.08 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 31.98 3hqp h LYS 279 CO -0.05 0.80 -0.10 0.82 -0.57 0.00 0.00 179.45 180.34 3hqp h ILE 280 N 1.19 0.84 -0.70 1.86 2.04 -0.66 -2.73 117.51 119.36 3hqp h ILE 280 Ca 0.31 -0.79 -0.05 0.00 1.00 0.00 0.00 64.86 65.34 3hqp h ILE 280 Cb -0.09 1.27 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 3hqp h ILE 280 CO -0.06 0.16 0.25 -0.07 0.00 0.00 0.00 178.15 178.43 3hqp h LEU 281 N -0.72 0.99 -0.31 1.44 3.38 -1.17 -0.30 115.31 118.62 3hqp h LEU 281 Ca -0.03 -0.19 -0.05 0.00 0.09 0.00 0.00 57.88 57.70 3hqp h LEU 281 Cb 0.49 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 3hqp h LEU 281 CO 0.05 0.91 -0.02 0.40 0.09 0.00 0.00 178.44 179.87 3hqp h ILE 282 N 1.01 1.27 -0.44 1.22 2.04 -1.55 -1.49 117.51 119.57 3hqp h ILE 282 Ca 0.23 -1.00 -0.11 0.00 1.00 0.00 0.00 64.86 64.99 3hqp h ILE 282 Cb 0.25 1.30 -0.02 0.00 -0.74 0.00 0.00 36.82 37.62 3hqp h ILE 282 CO -0.01 0.32 -0.15 0.28 0.00 0.00 0.00 178.15 178.58 3hqp h SER 283 N 0.34 0.82 -0.30 1.72 0.02 -1.27 -0.46 113.55 114.42 3hqp h SER 283 Ca 0.08 -0.27 -0.09 0.00 -0.84 0.00 0.00 61.79 60.67 3hqp h SER 283 Cb 0.47 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.77 3hqp h SER 283 CO 0.02 0.98 -0.14 0.11 -1.14 0.00 0.00 176.83 176.66 3hqp h LYS 284 N 0.73 0.73 -0.24 3.45 1.57 -0.98 -1.68 116.57 120.15 3hqp h LYS 284 Ca 0.11 -0.25 -0.11 0.00 -1.87 0.00 0.00 60.65 58.53 3hqp h LYS 284 Cb 0.66 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.91 3hqp h LYS 284 CO 0.05 0.84 -0.28 0.00 -0.57 0.00 0.00 179.45 179.48 3hqp h ASN 286 N 0.33 -0.10 -0.94 0.00 -0.26 -0.98 0.22 115.58 113.84 3hqp h ASN 286 Ca 0.03 0.05 0.03 0.00 -0.56 0.00 0.00 56.30 55.85 3hqp h ASN 286 Cb 0.85 0.09 -0.05 0.00 -1.06 0.00 0.00 38.32 38.15 3hqp h ASN 286 CO 0.07 -0.02 0.62 0.58 -1.06 0.00 0.00 177.43 177.62 3hqp h VAL 287 N 0.06 1.19 -0.00 2.81 2.07 -1.35 -2.39 116.25 118.65 3hqp h VAL 287 Ca 0.10 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.20 3hqp h VAL 287 Cb 0.13 -0.14 0.00 0.00 -1.52 0.00 0.00 31.29 29.77 3hqp h VAL 287 CO -0.18 0.22 -0.11 0.00 0.02 0.00 0.00 177.57 177.53 3hqp n ALA 288 N -2.39 2.69 -2.78 1.67 0.00 -0.77 -4.93 120.51 114.00 3hqp n ALA 288 Ca 0.12 -0.21 -0.15 0.00 0.00 0.00 0.00 53.44 53.21 3hqp n ALA 288 Cb 0.07 -1.38 0.03 0.00 0.00 0.00 0.00 19.45 18.17 3hqp n ALA 288 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hqp n GLY 289 N 1.37 -0.11 3.49 0.00 0.00 0.66 -5.03 105.19 105.57 3hqp n GLY 289 Ca 0.11 -0.17 -0.31 0.00 0.00 0.00 0.00 46.02 45.65 3hqp n GLY 289 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hqp s LYS 290 N -5.32 2.12 0.55 1.61 1.02 -0.60 -4.84 119.74 114.28 3hqp s LYS 290 Ca 0.21 -0.96 -0.21 0.00 0.02 0.00 0.00 55.97 55.02 3hqp s LYS 290 Cb -0.09 -2.24 -0.05 0.00 -0.52 0.00 0.00 37.83 34.93 3hqp s LYS 290 CO 0.26 0.54 1.35 -2.14 -0.92 0.00 0.00 175.35 174.44 3hqp s PRO 291 N -1.59 3.10 -0.02 -1.68 0.02 -1.26 -4.30 135.00 129.28 3hqp s PRO 291 Ca 0.16 2.22 -0.01 0.00 0.02 0.00 0.00 61.00 63.39 3hqp s PRO 291 Cb -0.11 -2.23 0.01 0.00 0.02 0.00 0.00 34.50 32.20 3hqp s PRO 291 CO 0.07 -1.21 0.04 0.54 -0.33 0.00 0.00 177.00 176.11 3hqp s VAL 292 N -1.31 -0.01 -0.12 3.83 0.11 -1.26 -1.63 120.40 120.00 3hqp s VAL 292 Ca 0.72 0.05 0.02 0.00 -2.93 0.00 0.00 61.98 59.85 3hqp s VAL 292 Cb -0.40 -0.07 -0.00 0.00 -1.53 0.00 0.00 36.38 34.38 3hqp s VAL 292 CO 0.47 0.02 -0.20 -0.63 -3.33 0.00 0.00 175.10 171.43 3hqp s ILE 293 N 0.28 2.38 -0.12 7.04 1.01 0.04 -1.54 121.20 130.30 3hqp s ILE 293 Ca -0.02 -0.89 -0.18 0.00 0.00 0.00 0.00 60.65 59.56 3hqp s ILE 293 Cb -0.03 -1.96 -0.04 0.00 0.01 0.00 0.00 42.46 40.44 3hqp s ILE 293 CO -0.01 0.54 0.48 0.00 0.00 0.00 0.00 174.94 175.95 3hqp s ALA 295 N 0.66 0.92 0.00 0.00 0.00 -1.12 -2.00 121.76 120.23 3hqp s ALA 295 Ca 0.26 -1.17 0.00 0.00 0.00 0.00 0.00 51.96 51.05 3hqp s ALA 295 Cb -0.15 0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.06 3hqp s ALA 295 CO 0.10 -0.13 0.00 2.41 0.00 0.00 0.00 175.76 178.14 3hqp n THR 296 N 0.47 -1.48 -1.91 0.00 -1.04 -1.26 -3.49 114.28 105.56 3hqp n THR 296 Ca -0.16 0.00 -0.20 0.00 -2.04 0.00 0.00 64.05 61.66 3hqp n THR 296 Cb 0.59 -1.48 -0.05 0.00 -1.82 0.00 0.00 70.33 67.56 3hqp n THR 296 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3hqp n GLN 297 N 0.42 -1.46 -0.06 -2.82 6.02 -1.26 -4.78 117.38 113.44 3hqp n GLN 297 Ca 0.00 1.10 -0.13 0.00 -0.01 0.00 0.00 57.00 57.96 3hqp n GLN 297 Cb 0.00 -5.55 -0.01 0.00 1.02 0.00 0.00 30.24 25.70 3hqp n GLN 297 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.06 176.57 3hqp h MET 298 N 0.00 0.80 -0.71 -1.09 2.86 -1.88 -3.29 114.93 111.62 3hqp h MET 298 Ca -0.43 -0.49 -0.39 0.00 -2.06 0.00 0.00 59.70 56.32 3hqp h MET 298 Cb 1.31 0.05 -0.41 0.00 0.06 0.00 0.00 31.60 32.61 3hqp h MET 298 CO 0.58 1.12 -0.99 1.28 1.06 0.00 0.00 176.91 179.96 3hqp n LEU 299 N -4.00 3.01 -0.31 1.22 4.77 -1.26 -4.59 117.00 115.84 3hqp n LEU 299 Ca -0.04 -3.91 0.16 0.00 -0.03 0.00 0.00 56.01 52.19 3hqp n LEU 299 Cb 0.61 0.10 0.34 0.00 -2.33 0.00 0.00 43.42 42.14 3hqp n LEU 299 CO 0.49 1.58 1.00 -0.08 -1.33 0.00 0.00 177.39 179.05 3hqp h GLU 300 N 2.51 0.25 0.00 3.23 4.57 -1.96 -1.31 114.58 121.85 3hqp h GLU 300 Ca 0.08 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.22 3hqp h GLU 300 Cb 1.32 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 29.85 3hqp h GLU 300 CO 0.48 0.16 -0.12 0.66 -1.18 0.00 0.00 179.01 179.02 3hqp h SER 301 N 0.25 0.00 0.00 1.04 4.64 -1.92 -2.64 113.55 114.92 3hqp h SER 301 Ca 0.60 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.92 3hqp h SER 301 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 3hqp h SER 301 CO -0.64 0.12 0.00 0.23 -0.87 0.00 0.00 176.83 175.67 3hqp n MET 302 N -3.44 0.83 0.18 4.77 2.81 -0.50 -0.89 117.12 120.88 3hqp n MET 302 Ca -0.01 0.00 0.04 0.00 -1.81 0.00 0.00 57.70 55.92 3hqp n MET 302 Cb 0.28 -1.23 0.31 0.00 -0.71 0.00 0.00 33.22 31.87 3hqp n MET 302 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 3hqp h THR 303 N 0.00 1.05 0.00 2.03 2.02 -1.64 -3.36 112.91 113.01 3hqp h THR 303 Ca 0.00 -1.62 0.00 0.00 0.77 0.00 0.00 66.41 65.56 3hqp h THR 303 Cb 0.00 1.95 0.00 0.00 -1.74 0.00 0.00 68.15 68.36 3hqp h THR 303 CO 0.00 0.42 -0.46 -1.22 0.37 0.00 0.00 175.52 174.63 3hqp n TYR 304 N -3.65 0.00 -4.63 3.16 4.02 -0.99 -1.00 117.16 114.06 3hqp n TYR 304 Ca -0.01 0.00 -0.32 0.00 -0.01 0.00 0.00 57.90 57.56 3hqp n TYR 304 Cb 0.52 0.00 -0.12 0.00 -0.02 0.00 0.00 39.34 39.72 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 -1.04 4.33 0.00 7.72 0.01 -0.07 -4.99 114.94 120.90 3hqp s ASN 305 Ca 0.00 -0.19 0.22 0.00 -0.71 0.00 0.00 52.86 52.18 3hqp s ASN 305 Cb 0.00 -0.95 1.11 0.00 0.41 0.00 0.00 41.25 41.81 3hqp s ASN 305 CO 0.00 0.31 1.71 -0.81 -1.51 0.00 0.00 177.10 176.79 3hqp n PRO 306 N 1.85 0.31 -4.01 -0.60 -0.04 -1.26 -4.10 135.00 127.16 3hqp n PRO 306 Ca -0.16 0.08 -0.11 0.00 -0.04 0.00 0.00 63.50 63.27 3hqp n PRO 306 Cb 0.52 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.37 3hqp n PRO 306 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3hqp s ARG 307 N -2.57 0.38 0.47 0.54 0.52 -1.26 -4.95 118.95 112.08 3hqp s ARG 307 Ca 0.21 -0.65 0.03 0.00 -0.52 0.00 0.00 55.73 54.80 3hqp s ARG 307 Cb 0.15 -0.04 0.01 0.00 0.52 0.00 0.00 34.95 35.59 3hqp s ARG 307 CO 0.33 -0.01 0.67 -1.25 0.02 0.00 0.00 175.30 175.06 3hqp s PRO 308 N -1.46 2.83 0.65 3.54 0.04 -1.26 -4.56 135.00 134.78 3hqp s PRO 308 Ca -0.13 -0.79 -0.11 0.00 0.04 0.00 0.00 61.00 60.01 3hqp s PRO 308 Cb -0.10 -2.59 -0.02 0.00 0.04 0.00 0.00 34.50 31.82 3hqp s PRO 308 CO -0.00 -0.40 1.04 0.95 0.04 0.00 0.00 177.00 178.62 3hqp s THR 309 N -2.56 4.44 0.40 1.26 -4.23 -1.26 -4.94 115.64 108.75 3hqp s THR 309 Ca 0.52 0.79 0.07 0.00 -1.18 0.00 0.00 61.69 61.90 3hqp s THR 309 Cb -0.10 -3.73 0.22 0.00 1.34 0.00 0.00 72.50 70.23 3hqp s THR 309 CO 0.36 -1.03 2.00 0.03 -0.54 0.00 0.00 174.62 175.44 3hqp h ARG 310 N -0.44 0.45 -0.29 3.99 2.47 -2.00 -1.94 114.38 116.62 3hqp h ARG 310 Ca -0.44 -0.05 -0.06 0.00 -1.26 0.00 0.00 59.98 58.16 3hqp h ARG 310 Cb 1.20 -0.09 -0.02 0.00 -1.65 0.00 0.00 29.97 29.42 3hqp h ARG 310 CO 0.61 0.38 -0.08 0.00 0.56 0.00 0.00 179.97 181.44 3hqp h ALA 311 N 1.69 1.32 0.11 0.04 0.00 -1.99 -2.26 119.26 118.17 3hqp h ALA 311 Ca 0.11 -0.24 -0.30 0.00 0.00 0.00 0.00 54.91 54.49 3hqp h ALA 311 Cb 0.11 -0.13 0.03 0.00 0.00 0.00 0.00 17.79 17.79 3hqp h ALA 311 CO -0.01 0.46 -1.23 0.93 0.00 0.00 0.00 179.25 179.40 3hqp h GLU 312 N 0.44 0.64 -0.39 0.00 5.08 -1.61 -0.44 114.58 118.30 3hqp h GLU 312 Ca 0.09 -0.83 -0.00 0.00 -1.00 0.00 0.00 59.36 57.61 3hqp h GLU 312 Cb 0.42 0.27 -0.02 0.00 0.50 0.00 0.00 28.75 29.92 3hqp h GLU 312 CO 0.02 1.38 0.24 0.28 -1.00 0.00 0.00 179.01 179.93 3hqp h VAL 313 N 0.29 1.12 -0.47 3.13 2.07 -1.47 -2.14 116.25 118.78 3hqp h VAL 313 Ca -0.18 -0.27 0.02 0.00 0.82 0.00 0.00 66.70 67.09 3hqp h VAL 313 Cb 1.90 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 32.24 3hqp h VAL 313 CO 0.24 0.12 0.27 -1.28 0.02 0.00 0.00 177.57 176.94 3hqp h SER 314 N 0.51 0.44 -0.93 0.57 0.87 -1.37 -2.32 113.55 111.32 3hqp h SER 314 Ca 0.14 0.01 0.02 0.00 -1.23 0.00 0.00 61.79 60.73 3hqp h SER 314 Cb -0.01 -0.09 -0.05 0.00 -0.44 0.00 0.00 62.40 61.82 3hqp h SER 314 CO -0.03 0.31 0.61 -0.78 -0.53 0.00 0.00 176.83 176.41 3hqp h ASP 315 N 0.55 1.03 0.31 6.23 3.58 -0.85 -0.72 116.42 126.56 3hqp h ASP 315 Ca 0.19 -0.02 -0.02 0.00 0.42 0.00 0.00 57.03 57.60 3hqp h ASP 315 Cb 0.02 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 40.83 3hqp h ASP 315 CO -0.09 0.73 -0.15 0.58 -2.88 0.00 0.00 179.24 177.43 3hqp h VAL 316 N 1.21 0.69 -0.95 2.25 2.07 -1.17 -2.28 116.25 118.08 3hqp h VAL 316 Ca 0.35 -0.54 0.11 0.00 0.82 0.00 0.00 66.70 67.45 3hqp h VAL 316 Cb -0.08 0.96 -0.08 0.00 -1.52 0.00 0.00 31.29 30.58 3hqp h VAL 316 CO -0.09 0.10 0.58 0.00 0.02 0.00 0.00 177.57 178.18 3hqp h ALA 317 N -0.17 1.40 -0.16 1.67 0.00 -1.27 -2.34 119.26 118.39 3hqp h ALA 317 Ca -0.04 0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.75 3hqp h ALA 317 Cb 0.49 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3hqp h ALA 317 CO 0.07 0.18 -0.52 -0.91 0.00 0.00 0.00 179.25 178.07 3hqp h ASN 318 N 0.93 0.49 -0.36 0.00 2.35 -1.12 0.24 115.58 118.10 3hqp h ASN 318 Ca 0.46 -0.25 0.06 0.00 -0.55 0.00 0.00 56.30 56.03 3hqp h ASN 318 Cb 0.45 -0.14 -0.06 0.00 0.05 0.00 0.00 38.32 38.62 3hqp h ASN 318 CO -0.26 0.92 -0.01 0.00 -1.65 0.00 0.00 177.43 176.43 3hqp h ALA 319 N 1.09 0.32 -0.29 -0.83 0.00 -0.89 0.74 119.26 119.40 3hqp h ALA 319 Ca 0.01 0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.05 3hqp h ALA 319 Cb 1.03 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.98 3hqp h ALA 319 CO 0.09 -0.40 0.14 0.28 0.00 0.00 0.00 179.25 179.35 3hqp h VAL 320 N 0.09 0.97 -0.46 0.00 2.07 -1.08 -2.35 116.25 115.50 3hqp h VAL 320 Ca 0.17 -0.10 0.05 0.00 0.82 0.00 0.00 66.70 67.65 3hqp h VAL 320 Cb 0.24 0.66 -0.05 0.00 -1.52 0.00 0.00 31.29 30.63 3hqp h VAL 320 CO -0.30 0.05 0.19 -0.26 0.02 0.00 0.00 177.57 177.28 3hqp h PHE 321 N 0.29 0.35 -1.11 1.57 0.04 -0.38 -2.39 116.94 115.30 3hqp h PHE 321 Ca 0.12 0.02 0.32 0.00 2.80 0.00 0.00 57.97 61.23 3hqp h PHE 321 Cb 0.05 -0.09 -0.05 0.00 2.20 0.00 0.00 35.95 38.06 3hqp h PHE 321 CO -0.10 0.15 0.79 -0.91 -0.60 0.00 0.00 178.31 177.64 3hqp h ASN 322 N 0.39 0.04 0.00 2.17 -0.26 0.99 -3.45 115.58 115.47 3hqp h ASN 322 Ca 0.21 0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.96 3hqp h ASN 322 Cb 0.17 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.43 3hqp h ASN 322 CO -0.18 0.01 0.00 0.61 -1.06 0.00 0.00 177.43 176.80 3hqp n GLY 323 N -1.73 1.46 3.77 2.83 0.00 -0.90 -4.61 105.19 106.01 3hqp n GLY 323 Ca 0.24 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.86 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 3.24 0.02 4.61 0.00 -0.97 -4.89 121.76 121.77 3hqp s ALA 324 Ca 0.00 1.46 -0.14 0.00 0.00 0.00 0.00 51.96 53.28 3hqp s ALA 324 Cb 0.00 -3.59 -0.34 0.00 0.00 0.00 0.00 23.12 19.19 3hqp s ALA 324 CO 0.00 -1.19 0.94 -0.44 0.00 0.00 0.00 175.76 175.07 3hqp h ASP 325 N 2.32 0.78 -4.53 0.00 5.19 -1.61 -3.45 116.42 115.13 3hqp h ASP 325 Ca -0.51 -0.89 -0.39 0.00 -0.62 0.00 0.00 57.03 54.62 3hqp h ASP 325 Cb 1.27 -0.26 -0.21 0.00 0.18 0.00 0.00 39.33 40.31 3hqp h ASP 325 CO 0.61 1.71 -0.77 0.00 -3.12 0.00 0.00 179.24 177.67 3hqp s VAL 327 N -1.31 2.66 0.09 0.00 -7.23 -0.36 -1.73 120.40 112.51 3hqp s VAL 327 Ca -0.03 -1.52 0.08 0.00 -1.81 0.00 0.00 61.98 58.70 3hqp s VAL 327 Cb -0.10 -2.19 -0.03 0.00 0.56 0.00 0.00 36.38 34.62 3hqp s VAL 327 CO 0.02 0.15 -0.21 -0.32 -0.31 0.00 0.00 175.10 174.43 3hqp s MET 328 N -1.97 1.15 -0.06 4.82 1.75 -0.85 -1.32 119.30 122.82 3hqp s MET 328 Ca 0.16 -1.12 0.05 0.00 -1.25 0.00 0.00 55.69 53.54 3hqp s MET 328 Cb -0.10 -1.38 -0.01 0.00 2.84 0.00 0.00 34.83 36.17 3hqp s MET 328 CO 0.08 0.32 -0.22 -0.51 -0.65 0.00 0.00 175.02 174.04 3hqp s LEU 329 N -1.78 2.24 0.00 4.11 1.43 0.24 -4.38 118.68 120.53 3hqp s LEU 329 Ca 0.06 -0.44 0.00 0.00 -1.03 0.00 0.00 54.13 52.73 3hqp s LEU 329 Cb -0.10 -1.42 0.00 0.00 0.03 0.00 0.00 46.19 44.70 3hqp s LEU 329 CO 0.04 0.26 0.00 -1.20 0.23 0.00 0.00 176.35 175.68 3hqp n SER 330 N 2.84 0.00 0.23 2.29 7.64 -1.26 -1.75 113.62 123.60 3hqp n SER 330 Ca -0.17 0.00 0.08 0.00 1.01 0.00 0.00 58.87 59.79 3hqp n SER 330 Cb 0.52 0.00 0.54 0.00 -1.01 0.00 0.00 64.21 64.26 3hqp n SER 330 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 3hqp h GLY 331 N 0.00 0.00 0.89 0.23 0.00 -1.97 -1.35 103.07 100.87 3hqp h GLY 331 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 47.33 47.42 3hqp h GLY 331 CO 0.00 0.00 0.49 0.83 0.00 0.00 0.00 176.54 177.86 3hqp h GLU 332 N 0.00 0.66 0.00 4.80 3.07 -1.89 -0.45 114.58 120.77 3hqp h GLU 332 Ca -0.00 -0.04 -0.31 0.00 -0.50 0.00 0.00 59.36 58.50 3hqp h GLU 332 Cb 0.51 -0.15 -0.06 0.00 -0.84 0.00 0.00 28.75 28.22 3hqp h GLU 332 CO 0.03 0.44 -2.19 0.25 -1.40 0.00 0.00 179.01 176.14 3hqp n THR 333 N -4.50 1.19 -0.09 1.13 -2.24 -1.11 -3.37 114.28 105.31 3hqp n THR 333 Ca 0.12 -0.59 -0.11 0.00 -2.27 0.00 0.00 64.05 61.21 3hqp n THR 333 Cb 0.32 -0.91 -0.04 0.00 -2.10 0.00 0.00 70.33 67.61 3hqp n THR 333 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hqp h ALA 334 N 0.41 0.35 0.00 6.98 0.00 -0.86 -3.35 119.26 122.78 3hqp h ALA 334 Ca -0.47 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.27 3hqp h ALA 334 Cb 1.89 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.58 3hqp h ALA 334 CO -0.03 0.01 -0.20 0.36 0.00 0.00 0.00 179.25 179.40 3hqp n LYS 335 N -4.69 0.34 -1.36 0.00 2.85 -0.91 -1.68 118.16 112.71 3hqp n LYS 335 Ca -0.03 -0.94 -0.32 0.00 -1.05 0.00 0.00 58.31 55.97 3hqp n LYS 335 Cb 0.19 -0.62 0.09 0.00 -0.65 0.00 0.00 35.03 34.04 3hqp n LYS 335 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 3hqp s GLY 336 N -0.70 1.86 0.18 2.58 0.00 -0.22 -4.90 107.32 106.11 3hqp s GLY 336 Ca 0.02 0.42 0.20 0.00 0.00 0.00 0.00 44.72 45.36 3hqp s GLY 336 CO 0.00 0.78 1.04 0.50 0.00 0.00 0.00 173.10 175.42 3hqp h LYS 337 N -0.81 0.00 -2.19 2.90 1.57 -1.30 -3.40 116.57 113.34 3hqp h LYS 337 Ca -0.45 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 57.76 3hqp h LYS 337 Cb 1.24 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 33.14 3hqp h LYS 337 CO 0.51 0.14 -0.73 0.66 -0.57 0.00 0.00 179.45 179.46 3hqp n TYR 338 N -2.83 3.05 -0.08 -1.35 4.01 -1.26 -4.96 117.16 113.75 3hqp n TYR 338 Ca -0.03 -4.00 -0.08 0.00 -0.16 0.00 0.00 57.90 53.63 3hqp n TYR 338 Cb 0.67 -0.49 -0.01 0.00 -0.31 0.00 0.00 39.34 39.20 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 3.51 0.27 -0.30 -0.72 0.11 -1.78 -1.80 132.00 131.30 3hqp h PRO 339 Ca 0.15 -0.02 -0.13 0.00 0.11 0.00 0.00 66.00 66.11 3hqp h PRO 339 Cb 0.65 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 31.69 3hqp h PRO 339 CO 0.76 0.18 -0.33 -0.91 -0.21 0.00 0.00 178.00 177.48 3hqp h ASN 340 N 0.28 0.81 -0.56 -2.05 2.35 -1.92 -2.82 115.58 111.66 3hqp h ASN 340 Ca 0.12 -0.48 -0.04 0.00 -0.55 0.00 0.00 56.30 55.35 3hqp h ASN 340 Cb 0.06 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.17 3hqp h ASN 340 CO -0.10 1.13 0.21 -0.33 -1.65 0.00 0.00 177.43 176.69 3hqp h GLU 341 N 0.50 0.85 -0.02 0.81 3.07 -1.95 0.29 114.58 118.15 3hqp h GLU 341 Ca 0.04 -0.17 -0.06 0.00 -0.50 0.00 0.00 59.36 58.68 3hqp h GLU 341 Cb 0.91 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.68 3hqp h GLU 341 CO 0.08 0.75 -0.28 -0.24 -1.40 0.00 0.00 179.01 177.92 3hqp h VAL 342 N 0.78 1.21 0.12 3.13 3.04 -1.34 0.64 116.25 123.83 3hqp h VAL 342 Ca 0.19 -0.99 -0.28 0.00 -1.01 0.00 0.00 66.70 64.61 3hqp h VAL 342 Cb 0.23 1.51 0.02 0.00 -2.01 0.00 0.00 31.29 31.04 3hqp h VAL 342 CO -0.01 0.28 -1.22 0.58 -1.01 0.00 0.00 177.57 176.20 3hqp h VAL 343 N 0.03 1.39 -0.53 1.51 2.07 -1.21 -2.78 116.25 116.72 3hqp h VAL 343 Ca 0.00 -2.71 -0.08 0.00 0.82 0.00 0.00 66.70 64.73 3hqp h VAL 343 Cb 0.51 2.78 -0.02 0.00 -1.52 0.00 0.00 31.29 33.04 3hqp h VAL 343 CO 0.04 0.81 0.02 1.56 0.02 0.00 0.00 177.57 180.01 3hqp h GLN 344 N 0.18 0.92 -0.24 1.57 4.20 -0.52 -2.02 115.11 119.20 3hqp h GLN 344 Ca -0.16 -0.28 -0.07 0.00 0.06 0.00 0.00 58.65 58.20 3hqp h GLN 344 Cb 1.90 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 29.59 3hqp h GLN 344 CO 0.22 0.93 -0.12 -0.92 -0.67 0.00 0.00 178.83 178.27 3hqp h TYR 345 N 0.79 0.58 -0.46 2.96 5.03 -0.97 -1.44 116.97 123.46 3hqp h TYR 345 Ca 0.15 -0.14 0.07 0.00 2.58 0.00 0.00 58.73 61.39 3hqp h TYR 345 Cb 0.50 -0.13 -0.06 0.00 1.55 0.00 0.00 36.73 38.59 3hqp h TYR 345 CO 0.04 0.77 0.12 1.98 -1.32 0.00 0.00 178.16 179.74 3hqp h MET 346 N 0.23 0.25 -0.36 1.82 4.05 -1.47 -0.74 114.93 118.72 3hqp h MET 346 Ca 0.05 -0.02 0.03 0.00 -0.28 0.00 0.00 59.70 59.49 3hqp h MET 346 Cb 0.62 -0.06 -0.03 0.00 -0.80 0.00 0.00 31.60 31.33 3hqp h MET 346 CO 0.04 0.17 0.16 0.00 0.23 0.00 0.00 176.91 177.50 3hqp h ALA 347 N 1.34 0.43 -0.79 0.39 0.00 -1.19 -0.86 119.26 118.58 3hqp h ALA 347 Ca 0.22 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.17 3hqp h ALA 347 Cb 0.27 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 3hqp h ALA 347 CO -0.27 -0.22 0.51 -0.09 0.00 0.00 0.00 179.25 179.18 3hqp h ARG 348 N 0.33 1.00 -0.21 0.00 2.43 -0.73 -0.47 114.38 116.74 3hqp h ARG 348 Ca 0.16 -0.06 -0.06 0.00 -0.81 0.00 0.00 59.98 59.21 3hqp h ARG 348 Cb 0.10 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.41 3hqp h ARG 348 CO -0.13 0.66 -0.10 0.82 -1.51 0.00 0.00 179.97 179.72 3hqp h ILE 349 N 1.03 1.30 -0.29 1.20 2.04 -0.87 -1.69 117.51 120.23 3hqp h ILE 349 Ca 0.30 -1.16 0.04 0.00 1.00 0.00 0.00 64.86 65.04 3hqp h ILE 349 Cb -0.08 1.62 -0.04 0.00 -0.74 0.00 0.00 36.82 37.58 3hqp h ILE 349 CO -0.08 0.35 0.03 0.00 0.00 0.00 0.00 178.15 178.46 3hqp h LEU 351 N 0.13 0.24 -0.00 0.00 6.46 -1.04 -0.70 115.31 120.39 3hqp h LEU 351 Ca 0.14 -0.00 -0.08 0.00 -0.12 0.00 0.00 57.88 57.82 3hqp h LEU 351 Cb 0.16 -0.05 0.01 0.00 -0.73 0.00 0.00 40.66 40.04 3hqp h LEU 351 CO -0.20 0.16 -0.30 -0.08 -0.62 0.00 0.00 178.44 177.40 3hqp h GLU 352 N 0.27 0.21 -0.81 1.25 4.57 -0.30 -3.24 114.58 116.53 3hqp h GLU 352 Ca 0.17 -0.22 -0.04 0.00 -1.18 0.00 0.00 59.36 58.08 3hqp h GLU 352 Cb 0.31 0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 28.93 3hqp h GLU 352 CO -0.03 0.94 0.36 0.00 -1.18 0.00 0.00 179.01 179.10 3hqp h ALA 353 N 0.28 1.05 -1.01 2.92 0.00 -0.64 -2.28 119.26 119.58 3hqp h ALA 353 Ca -0.04 -0.18 0.24 0.00 0.00 0.00 0.00 54.91 54.94 3hqp h ALA 353 Cb 1.05 -0.32 -0.09 0.00 0.00 0.00 0.00 17.79 18.43 3hqp h ALA 353 CO 0.06 0.65 0.64 0.37 0.00 0.00 0.00 179.25 180.97 3hqp h GLN 354 N 1.17 0.44 -0.25 0.00 4.15 -1.22 0.12 115.11 119.51 3hqp h GLN 354 Ca 0.28 -0.03 -0.06 0.00 0.77 0.00 0.00 58.65 59.60 3hqp h GLN 354 Cb 0.17 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.74 3hqp h GLN 354 CO -0.03 0.29 -0.12 0.77 -1.93 0.00 0.00 178.83 177.81 3hqp h SER 355 N 0.46 0.40 0.18 -0.69 0.02 -1.43 -2.91 113.55 109.58 3hqp h SER 355 Ca 0.57 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 61.42 3hqp h SER 355 Cb 1.34 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.77 3hqp h SER 355 CO -0.29 0.56 -0.27 0.00 -1.14 0.00 0.00 176.83 175.69 3hqp n ALA 356 N -2.48 3.12 -2.45 3.77 0.00 0.30 -4.90 120.51 117.87 3hqp n ALA 356 Ca 0.00 -0.45 -0.40 0.00 0.00 0.00 0.00 53.44 52.60 3hqp n ALA 356 Cb 0.31 -1.08 -0.05 0.00 0.00 0.00 0.00 19.45 18.63 3hqp n ALA 356 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3hqp s LEU 357 N -2.46 4.43 -0.82 0.00 2.96 -0.60 -5.01 118.68 117.18 3hqp s LEU 357 Ca 0.24 1.44 -0.16 0.00 -0.22 0.00 0.00 54.13 55.44 3hqp s LEU 357 Cb 0.19 -3.25 0.18 0.00 0.50 0.00 0.00 46.19 43.82 3hqp s LEU 357 CO 0.51 -0.02 0.83 0.21 -1.32 0.00 0.00 176.35 176.57 3hqp s ASN 358 N 0.12 6.65 0.33 3.68 3.84 -1.26 -4.90 114.94 123.40 3hqp s ASN 358 Ca 0.40 -2.38 0.05 0.00 0.21 0.00 0.00 52.86 51.13 3hqp s ASN 358 Cb -0.20 -2.26 0.58 0.00 -0.55 0.00 0.00 41.25 38.82 3hqp s ASN 358 CO 0.23 -0.75 1.85 -0.33 -2.79 0.00 0.00 177.10 175.30 3hqp h GLU 359 N 8.22 0.48 -0.50 0.43 3.07 -1.93 -2.07 114.58 122.27 3hqp h GLU 359 Ca 0.06 -0.12 -0.09 0.00 -0.50 0.00 0.00 59.36 58.72 3hqp h GLU 359 Cb 1.04 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.87 3hqp h GLU 359 CO 0.88 0.56 -0.03 -0.92 -1.40 0.00 0.00 179.01 178.10 3hqp h TYR 360 N 0.45 0.94 -0.38 4.33 3.20 -1.91 0.31 116.97 123.91 3hqp h TYR 360 Ca 0.09 -0.15 -0.11 0.00 3.14 0.00 0.00 58.73 61.70 3hqp h TYR 360 Cb 0.41 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.42 3hqp h TYR 360 CO 0.01 0.87 -0.19 0.28 -1.64 0.00 0.00 178.16 177.49 3hqp h VAL 361 N 0.80 1.28 0.05 1.81 2.07 -1.92 -2.20 116.25 118.13 3hqp h VAL 361 Ca 0.15 -1.32 0.02 0.00 0.82 0.00 0.00 66.70 66.37 3hqp h VAL 361 Cb 0.52 1.33 -0.03 0.00 -1.52 0.00 0.00 31.29 31.59 3hqp h VAL 361 CO 0.03 0.44 -0.17 0.15 0.02 0.00 0.00 177.57 178.03 3hqp h PHE 362 N 0.59 -0.46 -0.08 1.57 -0.00 -0.92 0.62 116.94 118.27 3hqp h PHE 362 Ca 0.08 0.01 0.04 0.00 -0.00 0.00 0.00 57.97 58.10 3hqp h PHE 362 Cb 0.74 0.20 -0.06 0.00 -0.00 0.00 0.00 35.95 36.82 3hqp h PHE 362 CO 0.06 -0.26 -0.40 0.35 -0.00 0.00 0.00 178.31 178.06 3hqp h PHE 363 N -0.31 -1.13 -0.93 0.41 3.57 -0.39 -0.55 116.94 117.62 3hqp h PHE 363 Ca 0.04 0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.63 3hqp h PHE 363 Cb 0.36 0.51 -0.06 0.00 2.79 0.00 0.00 35.95 39.55 3hqp h PHE 363 CO -0.20 -0.47 0.61 -0.91 -2.23 0.00 0.00 178.31 175.11 3hqp h ASN 364 N -0.50 0.97 -0.34 0.41 2.35 -1.18 -0.86 115.58 116.43 3hqp h ASN 364 Ca 0.07 -0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.78 3hqp h ASN 364 Cb 0.62 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.77 3hqp h ASN 364 CO -0.36 0.64 0.06 0.28 -1.65 0.00 0.00 177.43 176.40 3hqp h SER 365 N 1.11 0.54 -0.41 5.81 0.02 -0.31 -1.37 113.55 118.95 3hqp h SER 365 Ca 0.39 -0.26 -0.02 0.00 -0.84 0.00 0.00 61.79 61.05 3hqp h SER 365 Cb 0.11 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 3hqp h SER 365 CO -0.13 0.66 0.17 0.40 -1.14 0.00 0.00 176.83 176.79 3hqp h ILE 366 N 0.40 1.19 -0.63 3.27 2.04 -0.85 -3.12 117.51 119.80 3hqp h ILE 366 Ca 0.10 -0.60 0.01 0.00 1.00 0.00 0.00 64.86 65.38 3hqp h ILE 366 Cb 0.35 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 3hqp h ILE 366 CO 0.01 0.22 0.41 0.50 0.00 0.00 0.00 178.15 179.29 3hqp h LYS 367 N 0.51 0.81 0.00 2.37 3.64 -1.02 -2.65 116.57 120.24 3hqp h LYS 367 Ca 0.14 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.45 3hqp h LYS 367 Cb 0.18 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 31.82 3hqp h LYS 367 CO -0.01 0.53 -0.08 0.87 -2.27 0.00 0.00 179.45 178.49 3hqp h LYS 368 N 0.83 0.00 -0.19 1.90 6.56 -1.20 -2.91 116.57 121.56 3hqp h LYS 368 Ca 0.24 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.83 3hqp h LYS 368 Cb -0.07 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.59 3hqp h LYS 368 CO -0.07 0.08 0.00 1.28 -2.06 0.00 0.00 179.45 178.69 3hqp n LEU 369 N -3.58 2.96 -4.79 2.94 4.77 -1.00 -4.92 117.00 113.37 3hqp n LEU 369 Ca -0.02 -1.14 -0.38 0.00 -0.03 0.00 0.00 56.01 54.44 3hqp n LEU 369 Cb 0.20 -0.11 -0.06 0.00 -2.33 0.00 0.00 43.42 41.12 3hqp n LEU 369 CO 0.28 0.57 0.49 -1.10 -1.33 0.00 0.00 177.39 176.30 3hqp s GLN 370 N -1.77 4.46 0.16 3.23 -1.52 -1.10 -5.02 119.66 118.10 3hqp s GLN 370 Ca 0.34 1.08 -0.31 0.00 -1.95 0.00 0.00 55.36 54.52 3hqp s GLN 370 Cb 0.21 -3.06 -0.09 0.00 -0.22 0.00 0.00 33.01 29.85 3hqp s GLN 370 CO 0.31 0.47 1.45 -1.58 -0.25 0.00 0.00 175.29 175.69 3hqp s HIS 371 N -1.35 3.15 -0.13 0.91 5.65 -1.26 -5.00 115.29 117.26 3hqp s HIS 371 Ca 0.40 0.87 -0.03 0.00 0.25 0.00 0.00 55.06 56.55 3hqp s HIS 371 Cb -0.20 -3.78 -0.03 0.00 -1.18 0.00 0.00 32.58 27.38 3hqp s HIS 371 CO 0.24 -2.76 -0.02 0.42 -0.65 0.00 0.00 174.74 171.97 3hqp s ILE 372 N 0.87 4.06 0.24 0.89 1.01 -1.26 -3.13 121.20 123.89 3hqp s ILE 372 Ca 0.65 -0.31 -0.30 0.00 0.00 0.00 0.00 60.65 60.69 3hqp s ILE 372 Cb -0.40 -2.76 -0.09 0.00 0.01 0.00 0.00 42.46 39.22 3hqp s ILE 372 CO 0.33 0.53 1.15 -2.16 0.00 0.00 0.00 174.94 174.79 3hqp s PRO 373 N -0.04 4.56 0.59 2.79 0.04 -1.26 -5.17 135.00 136.51 3hqp s PRO 373 Ca 0.02 1.86 -0.14 0.00 0.04 0.00 0.00 61.00 62.78 3hqp s PRO 373 Cb -0.13 -3.20 -0.04 0.00 0.04 0.00 0.00 34.50 31.17 3hqp s PRO 373 CO 0.02 0.06 1.03 -1.64 0.04 0.00 0.00 177.00 176.51 3hqp s MET 374 N -0.96 3.49 0.83 4.56 -1.94 -1.18 -5.05 119.30 119.03 3hqp s MET 374 Ca 0.48 1.01 -0.11 0.00 -1.71 0.00 0.00 55.69 55.36 3hqp s MET 374 Cb -0.33 -2.06 0.09 0.00 2.01 0.00 0.00 34.83 34.54 3hqp s MET 374 CO 0.40 -0.66 1.13 -1.54 -0.01 0.00 0.00 175.02 174.34 3hqp s SER 375 N -3.28 3.76 0.20 3.03 1.04 -1.26 -4.84 113.70 112.36 3hqp s SER 375 Ca 0.60 2.07 -0.11 0.00 0.48 0.00 0.00 55.95 59.00 3hqp s SER 375 Cb -0.13 -2.55 0.16 0.00 0.10 0.00 0.00 66.02 63.60 3hqp s SER 375 CO 0.41 -2.54 1.86 0.00 0.98 0.00 0.00 173.24 173.95 3hqp h ALA 376 N -1.30 0.91 0.00 5.32 0.00 -1.96 -2.08 119.26 120.14 3hqp h ALA 376 Ca -0.44 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.38 3hqp h ALA 376 Cb 1.26 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 3hqp h ALA 376 CO 0.47 0.26 -0.27 0.38 0.00 0.00 0.00 179.25 180.09 3hqp h ASP 377 N 0.91 0.00 0.20 0.00 -0.00 -1.93 -0.09 116.42 115.51 3hqp h ASP 377 Ca 0.27 0.00 -0.28 0.00 -0.00 0.00 0.00 57.03 57.03 3hqp h ASP 377 Cb -0.04 0.00 0.02 0.00 -0.00 0.00 0.00 39.33 39.31 3hqp h ASP 377 CO -0.08 0.27 -1.15 -0.08 -0.00 0.00 0.00 179.24 178.20 3hqp h GLU 378 N 0.00 0.56 -0.49 4.15 4.81 -1.83 -2.90 114.58 118.87 3hqp h GLU 378 Ca -0.00 -0.70 -0.03 0.00 -0.13 0.00 0.00 59.36 58.49 3hqp h GLU 378 Cb 0.54 0.22 -0.02 0.00 0.63 0.00 0.00 28.75 30.11 3hqp h GLU 378 CO 0.04 1.30 0.17 0.00 -0.73 0.00 0.00 179.01 179.78 3hqp h ALA 379 N 0.44 1.37 -0.41 2.92 0.00 -1.01 0.14 119.26 122.72 3hqp h ALA 379 Ca -0.15 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3hqp h ALA 379 Cb 1.81 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 19.38 3hqp h ALA 379 CO 0.21 0.46 0.26 0.28 0.00 0.00 0.00 179.25 180.46 3hqp h VAL 380 N 0.70 1.12 -0.12 0.00 2.07 -1.03 -0.50 116.25 118.49 3hqp h VAL 380 Ca 0.17 -0.24 -0.14 0.00 0.82 0.00 0.00 66.70 67.30 3hqp h VAL 380 Cb 0.19 0.55 0.01 0.00 -1.52 0.00 0.00 31.29 30.52 3hqp h VAL 380 CO -0.01 0.12 -0.48 0.00 0.02 0.00 0.00 177.57 177.22 3hqp h SER 382 N 0.15 -0.58 0.68 0.00 0.87 -0.71 -1.94 113.55 112.02 3hqp h SER 382 Ca -0.02 0.08 -0.06 0.00 -1.23 0.00 0.00 61.79 60.56 3hqp h SER 382 Cb 1.11 0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 63.30 3hqp h SER 382 CO 0.10 -0.27 -0.27 0.28 -0.53 0.00 0.00 176.83 176.14 3hqp h SER 383 N -0.34 0.00 -0.14 6.23 0.02 -1.09 -2.13 113.55 116.10 3hqp h SER 383 Ca 0.05 0.00 -0.16 0.00 -0.84 0.00 0.00 61.79 60.84 3hqp h SER 383 Cb 0.40 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.95 3hqp h SER 383 CO -0.17 0.27 -0.54 0.00 -1.14 0.00 0.00 176.83 175.25 3hqp h ALA 384 N 1.73 0.26 -0.73 3.77 0.00 -1.05 -1.44 119.26 121.80 3hqp h ALA 384 Ca -0.00 -0.52 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 3hqp h ALA 384 Cb 0.69 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 3hqp h ALA 384 CO 0.04 0.47 0.42 0.28 0.00 0.00 0.00 179.25 180.45 3hqp h VAL 385 N 0.27 1.21 -0.86 0.00 2.07 -1.21 -2.06 116.25 115.67 3hqp h VAL 385 Ca -0.03 -0.49 0.01 0.00 0.82 0.00 0.00 66.70 67.00 3hqp h VAL 385 Cb 1.17 0.21 -0.04 0.00 -1.52 0.00 0.00 31.29 31.11 3hqp h VAL 385 CO 0.11 0.23 0.56 -1.13 0.02 0.00 0.00 177.57 177.36 3hqp h ASN 386 N 1.01 0.99 0.42 0.57 -0.73 -1.23 -2.30 115.58 114.31 3hqp h ASN 386 Ca 0.26 -0.03 -0.05 0.00 1.87 0.00 0.00 56.30 58.35 3hqp h ASN 386 Cb -0.01 -0.25 -0.01 0.00 0.27 0.00 0.00 38.32 38.33 3hqp h ASN 386 CO -0.05 0.72 -0.24 0.28 -0.37 0.00 0.00 177.43 177.78 3hqp h SER 387 N 1.16 0.00 -0.18 1.15 0.02 -0.68 -2.36 113.55 112.66 3hqp h SER 387 Ca 0.31 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 61.19 3hqp h SER 387 Cb -0.12 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.41 3hqp h SER 387 CO -0.07 0.24 -0.18 0.58 -1.14 0.00 0.00 176.83 176.26 3hqp h VAL 388 N 0.00 1.33 -0.33 2.27 2.07 -0.82 -2.17 116.25 118.60 3hqp h VAL 388 Ca -0.00 -1.34 -0.13 0.00 0.82 0.00 0.00 66.70 66.04 3hqp h VAL 388 Cb 0.52 1.80 -0.01 0.00 -1.52 0.00 0.00 31.29 32.08 3hqp h VAL 388 CO 0.03 0.40 -0.32 1.88 0.02 0.00 0.00 177.57 179.58 3hqp h TYR 389 N 0.10 0.85 0.00 1.57 0.05 -1.35 0.27 116.97 118.46 3hqp h TYR 389 Ca 0.03 -0.22 -0.11 0.00 0.05 0.00 0.00 58.73 58.47 3hqp h TYR 389 Cb 0.72 -0.19 -0.02 0.00 1.01 0.00 0.00 36.73 38.26 3hqp h TYR 389 CO 0.08 0.95 -0.55 0.93 -1.05 0.00 0.00 178.16 178.53 3hqp h GLU 390 N 0.61 0.00 0.00 4.88 5.08 -1.45 -3.27 114.58 120.43 3hqp h GLU 390 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3hqp h GLU 390 Cb 0.85 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.10 3hqp h GLU 390 CO 0.07 0.55 -1.01 -2.37 -1.00 0.00 0.00 179.01 175.25 3hqp n THR 391 N -3.64 0.00 -3.47 1.13 5.66 -0.82 -5.01 114.28 108.13 3hqp n THR 391 Ca -0.01 -0.24 -0.18 0.00 -3.05 0.00 0.00 64.05 60.58 3hqp n THR 391 Cb 0.60 0.68 0.08 0.00 -1.55 0.00 0.00 70.33 70.14 3hqp n THR 391 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 3hqp n LYS 392 N -1.57 -6.15 -2.10 1.09 5.02 0.89 -4.94 118.16 110.40 3hqp n LYS 392 Ca 0.00 0.81 -0.35 0.00 -2.02 0.00 0.00 58.31 56.75 3hqp n LYS 392 Cb 0.26 -5.74 0.02 0.00 -0.02 0.00 0.00 35.03 29.55 3hqp n LYS 392 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hqp s ALA 393 N -3.42 2.61 -0.95 7.82 0.00 -0.82 -4.76 121.76 122.23 3hqp s ALA 393 Ca 0.02 0.81 0.18 0.00 0.00 0.00 0.00 51.96 52.97 3hqp s ALA 393 Cb -0.00 -3.37 -0.17 0.00 0.00 0.00 0.00 23.12 19.58 3hqp s ALA 393 CO 0.75 -0.96 0.78 1.63 0.00 0.00 0.00 175.76 177.95 3hqp n LYS 394 N -1.58 1.23 -3.57 0.00 5.02 -0.88 -4.80 118.16 113.57 3hqp n LYS 394 Ca 0.12 -0.13 -0.12 0.00 -2.02 0.00 0.00 58.31 56.16 3hqp n LYS 394 Cb 0.51 -1.33 -0.04 0.00 -0.02 0.00 0.00 35.03 34.14 3hqp n LYS 394 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hqp s ALA 395 N -2.59 -1.21 0.01 7.82 0.00 -1.26 -4.18 121.76 120.36 3hqp s ALA 395 Ca 0.08 0.32 0.08 0.00 0.00 0.00 0.00 51.96 52.44 3hqp s ALA 395 Cb 0.14 0.59 -0.03 0.00 0.00 0.00 0.00 23.12 23.82 3hqp s ALA 395 CO 0.69 -0.60 -0.24 -1.64 0.00 0.00 0.00 175.76 173.97 3hqp s MET 396 N -3.19 2.01 -0.21 0.00 -1.94 -0.64 -2.19 119.30 113.14 3hqp s MET 396 Ca -0.01 -0.99 0.01 0.00 -1.71 0.00 0.00 55.69 52.99 3hqp s MET 396 Cb 0.00 -2.07 0.03 0.00 2.01 0.00 0.00 34.83 34.81 3hqp s MET 396 CO -0.08 0.54 -0.15 0.08 -0.01 0.00 0.00 175.02 175.41 3hqp s VAL 397 N -0.74 2.22 -0.10 -6.03 1.01 0.01 -0.07 120.40 116.71 3hqp s VAL 397 Ca 0.11 -1.16 0.02 0.00 0.00 0.00 0.00 61.98 60.96 3hqp s VAL 397 Cb -0.10 -2.08 -0.01 0.00 0.00 0.00 0.00 36.38 34.19 3hqp s VAL 397 CO 0.01 0.32 -0.17 0.54 0.00 0.00 0.00 175.10 175.81 3hqp s VAL 398 N 1.24 2.78 -0.16 2.92 0.11 0.12 0.06 120.40 127.47 3hqp s VAL 398 Ca 0.00 -0.78 -0.20 0.00 -2.93 0.00 0.00 61.98 58.07 3hqp s VAL 398 Cb -0.16 -2.12 -0.03 0.00 -1.53 0.00 0.00 36.38 32.54 3hqp s VAL 398 CO -0.09 0.55 0.57 -0.76 -3.33 0.00 0.00 175.10 172.04 3hqp s LEU 399 N 0.03 4.20 -0.19 2.54 1.43 -0.81 -0.76 118.68 125.12 3hqp s LEU 399 Ca -0.06 0.83 -0.08 0.00 -1.03 0.00 0.00 54.13 53.79 3hqp s LEU 399 Cb -0.15 -2.82 0.08 0.00 0.03 0.00 0.00 46.19 43.34 3hqp s LEU 399 CO 0.05 -0.16 0.42 -0.55 0.23 0.00 0.00 176.35 176.34 3hqp s SER 400 N 1.00 -0.35 -0.12 2.29 0.15 -0.94 -4.82 113.70 110.92 3hqp s SER 400 Ca 0.28 0.98 -0.05 0.00 0.70 0.00 0.00 55.95 57.86 3hqp s SER 400 Cb -0.16 1.19 -0.26 0.00 -1.71 0.00 0.00 66.02 65.08 3hqp s SER 400 CO 0.11 -0.22 0.37 0.59 1.20 0.00 0.00 173.24 175.29 3hqp n ASN 401 N 5.04 2.00 0.03 5.45 5.03 -1.26 -3.97 115.26 127.59 3hqp n ASN 401 Ca -0.13 0.22 -0.03 0.00 0.87 0.00 0.00 54.58 55.51 3hqp n ASN 401 Cb 0.51 -0.77 -0.09 0.00 -1.02 0.00 0.00 39.78 38.41 3hqp n ASN 401 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.26 176.14 3hqp h THR 402 N 0.06 0.74 0.00 3.41 1.35 -1.97 -3.39 112.91 113.11 3hqp h THR 402 Ca -0.42 -2.33 0.00 0.00 -0.55 0.00 0.00 66.41 63.12 3hqp h THR 402 Cb 2.03 2.25 0.00 0.00 -1.73 0.00 0.00 68.15 70.70 3hqp h THR 402 CO 0.08 0.42 0.00 0.61 -0.25 0.00 0.00 175.52 176.38 3hqp n GLY 403 N 1.41 1.21 0.22 5.82 0.00 -1.26 -4.84 105.19 107.75 3hqp n GLY 403 Ca -0.09 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.85 3hqp n GLY 403 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3hqp h ARG 404 N 2.46 -0.17 -0.71 1.61 2.43 -1.92 -1.98 114.38 116.09 3hqp h ARG 404 Ca 0.00 0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.12 3hqp h ARG 404 Cb 0.00 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.56 3hqp h ARG 404 CO 0.00 -0.11 0.19 0.77 -1.51 0.00 0.00 179.97 179.31 3hqp h SER 405 N -0.17 1.06 -0.45 -3.80 0.02 -1.94 -1.68 113.55 106.59 3hqp h SER 405 Ca 0.13 -0.22 -0.00 0.00 -0.84 0.00 0.00 61.79 60.86 3hqp h SER 405 Cb 0.37 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 3hqp h SER 405 CO -0.33 1.01 0.27 0.00 -1.14 0.00 0.00 176.83 176.64 3hqp h ALA 406 N 1.13 0.58 -0.11 3.77 0.00 -1.79 -1.38 119.26 121.46 3hqp h ALA 406 Ca 0.23 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 3hqp h ALA 406 Cb 0.35 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3hqp h ALA 406 CO -0.00 0.08 -0.23 0.00 0.00 0.00 0.00 179.25 179.10 3hqp h ARG 407 N 0.60 0.19 -0.17 0.00 3.08 -1.18 -0.40 114.38 116.50 3hqp h ARG 407 Ca 0.16 -0.06 -0.15 0.00 0.07 0.00 0.00 59.98 60.01 3hqp h ARG 407 Cb 0.01 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 3hqp h ARG 407 CO -0.03 0.42 -0.53 1.25 -1.07 0.00 0.00 179.97 180.01 3hqp h LEU 408 N 0.17 0.52 0.15 3.04 5.85 -0.73 -1.05 115.31 123.27 3hqp h LEU 408 Ca 0.03 -0.27 -0.01 0.00 0.84 0.00 0.00 57.88 58.47 3hqp h LEU 408 Cb 0.51 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.39 3hqp h LEU 408 CO 0.03 0.95 -0.07 0.58 -0.34 0.00 0.00 178.44 179.59 3hqp h VAL 409 N 0.37 0.89 -0.80 1.05 2.07 -1.08 -3.29 116.25 115.46 3hqp h VAL 409 Ca 0.01 -1.13 0.21 0.00 0.82 0.00 0.00 66.70 66.61 3hqp h VAL 409 Cb 1.04 1.49 -0.04 0.00 -1.52 0.00 0.00 31.29 32.26 3hqp h VAL 409 CO 0.09 0.23 0.56 0.00 0.02 0.00 0.00 177.57 178.47 3hqp h ALA 410 N -0.25 2.55 -0.55 1.67 0.00 -1.08 0.18 119.26 121.78 3hqp h ALA 410 Ca -0.02 -0.01 0.14 0.00 0.00 0.00 0.00 54.91 55.02 3hqp h ALA 410 Cb 0.53 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 3hqp h ALA 410 CO 0.03 -0.79 0.38 -0.22 0.00 0.00 0.00 179.25 178.66 3hqp h LYS 411 N 0.13 0.10 -0.58 0.00 3.64 -1.25 -2.12 116.57 116.50 3hqp h LYS 411 Ca 0.39 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.77 3hqp h LYS 411 Cb 1.35 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.15 3hqp h LYS 411 CO -0.06 0.07 0.00 0.66 -2.27 0.00 0.00 179.45 177.85 3hqp n TYR 412 N -4.41 0.77 -3.74 1.91 4.01 0.05 -4.96 117.16 110.79 3hqp n TYR 412 Ca 0.10 -0.38 -0.25 0.00 -0.16 0.00 0.00 57.90 57.20 3hqp n TYR 412 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.58 3hqp n TYR 412 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3hqp n ARG 413 N 1.32 -1.58 -1.09 -0.72 5.12 -0.80 -4.23 116.66 114.68 3hqp n ARG 413 Ca 0.21 0.86 -0.30 0.00 -1.93 0.00 0.00 57.85 56.69 3hqp n ARG 413 Cb 0.53 -2.39 0.15 0.00 -1.16 0.00 0.00 32.46 29.60 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 -4.61 0.98 -0.17 5.56 0.04 -1.26 -4.48 135.00 131.05 3hqp s PRO 414 Ca 0.04 0.88 0.07 0.00 0.04 0.00 0.00 61.00 62.03 3hqp s PRO 414 Cb -0.00 -1.77 0.50 0.00 0.04 0.00 0.00 34.50 33.26 3hqp s PRO 414 CO 0.89 -2.45 1.34 0.27 0.04 0.00 0.00 177.00 177.09 3hqp n ASN 415 N -4.03 3.87 -4.23 6.66 6.94 -1.26 -4.92 115.26 118.29 3hqp n ASN 415 Ca 0.07 -2.66 -0.13 0.00 -0.02 0.00 0.00 54.58 51.84 3hqp n ASN 415 Cb 0.55 -0.64 -0.10 0.00 -2.36 0.00 0.00 39.78 37.23 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 -4.02 3.53 -0.35 0.00 0.02 -1.26 -4.85 135.00 128.07 3hqp s PRO 417 Ca 0.30 2.08 -0.08 0.00 0.02 0.00 0.00 61.00 63.32 3hqp s PRO 417 Cb 0.07 -2.42 0.03 0.00 0.02 0.00 0.00 34.50 32.20 3hqp s PRO 417 CO 0.07 -0.83 0.14 0.42 -0.33 0.00 0.00 177.00 176.48 3hqp s ILE 418 N -1.37 4.14 -0.32 2.83 1.01 -0.73 -1.63 121.20 125.14 3hqp s ILE 418 Ca 0.66 -0.95 -0.22 0.00 0.00 0.00 0.00 60.65 60.14 3hqp s ILE 418 Cb -0.36 -3.30 -0.00 0.00 0.01 0.00 0.00 42.46 38.81 3hqp s ILE 418 CO 0.44 -0.16 0.71 -0.69 0.00 0.00 0.00 174.94 175.24 3hqp s VAL 419 N 1.48 4.85 -0.27 2.92 1.01 0.90 -0.48 120.40 130.81 3hqp s VAL 419 Ca 0.00 0.93 -0.12 0.00 0.00 0.00 0.00 61.98 62.80 3hqp s VAL 419 Cb -0.19 -4.09 -0.05 0.00 0.00 0.00 0.00 36.38 32.05 3hqp s VAL 419 CO 0.04 -0.25 0.21 0.00 0.00 0.00 0.00 175.10 175.11 3hqp s VAL 421 N 1.74 5.22 0.16 0.00 1.01 0.06 0.25 120.40 128.84 3hqp s VAL 421 Ca 0.08 -0.07 0.09 0.00 0.00 0.00 0.00 61.98 62.09 3hqp s VAL 421 Cb -0.16 -3.78 -0.04 0.00 0.00 0.00 0.00 36.38 32.41 3hqp s VAL 421 CO 0.10 -0.06 -0.20 0.28 0.00 0.00 0.00 175.10 175.22 3hqp s THR 422 N 1.89 1.95 -2.07 3.92 -1.32 -0.08 -2.20 115.64 117.73 3hqp s THR 422 Ca 0.09 -1.87 0.22 0.00 -1.21 0.00 0.00 61.69 58.92 3hqp s THR 422 Cb -0.17 -1.87 0.01 0.00 -1.51 0.00 0.00 72.50 68.97 3hqp s THR 422 CO 0.11 -0.21 1.07 0.35 -2.21 0.00 0.00 174.62 173.74 3hqp n THR 423 N 0.45 0.00 -4.18 5.08 -2.24 -1.26 -0.72 114.28 111.41 3hqp n THR 423 Ca -0.14 -0.30 -0.34 0.00 -2.27 0.00 0.00 64.05 60.99 3hqp n THR 423 Cb 0.56 1.28 -0.14 0.00 -2.10 0.00 0.00 70.33 69.93 3hqp n THR 423 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3hqp s ARG 424 N -2.32 3.36 0.34 -0.78 0.52 -1.26 -4.73 118.95 114.08 3hqp s ARG 424 Ca 0.19 -0.65 0.11 0.00 -0.52 0.00 0.00 55.73 54.86 3hqp s ARG 424 Cb 0.17 -2.87 0.62 0.00 0.52 0.00 0.00 34.95 33.39 3hqp s ARG 424 CO 0.51 -0.07 1.77 1.25 0.02 0.00 0.00 175.30 178.79 3hqp h LEU 425 N 7.65 0.06 -1.33 2.53 5.85 -1.94 -2.13 115.31 125.99 3hqp h LEU 425 Ca -0.37 -0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.26 3hqp h LEU 425 Cb 1.17 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.18 3hqp h LEU 425 CO 0.60 0.46 -0.33 -0.61 -0.34 0.00 0.00 178.44 178.21 3hqp h GLN 426 N 0.05 0.00 -0.23 1.25 4.15 -1.97 -2.40 115.11 115.96 3hqp h GLN 426 Ca 0.00 0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.35 3hqp h GLN 426 Cb 0.74 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.43 3hqp h GLN 426 CO 0.06 0.33 -0.12 1.15 -1.93 0.00 0.00 178.83 178.31 3hqp h THR 427 N 0.00 1.31 -0.51 2.39 2.02 -1.70 0.11 112.91 116.53 3hqp h THR 427 Ca -0.00 -1.21 0.09 0.00 0.77 0.00 0.00 66.41 66.05 3hqp h THR 427 Cb 0.60 1.61 -0.10 0.00 -1.74 0.00 0.00 68.15 68.51 3hqp h THR 427 CO 0.04 0.37 -0.37 0.00 0.37 0.00 0.00 175.52 175.93 3hqp h ARG 429 N -0.23 -0.14 0.00 0.00 3.08 -1.31 -3.10 114.38 112.68 3hqp h ARG 429 Ca 0.19 0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.22 3hqp h ARG 429 Cb 0.56 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.64 3hqp h ARG 429 CO -0.63 -0.09 -0.14 1.96 -1.07 0.00 0.00 179.97 180.00 3hqp h GLN 430 N -0.14 0.00 0.00 0.04 4.20 -0.34 -1.15 115.11 117.72 3hqp h GLN 430 Ca -0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.70 3hqp h GLN 430 Cb 0.12 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.90 3hqp h GLN 430 CO 0.01 0.14 0.00 -0.07 -0.67 0.00 0.00 178.83 178.24 3hqp h LEU 431 N 0.00 0.00 0.00 1.46 3.38 -0.87 -3.20 115.31 116.09 3hqp h LEU 431 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3hqp h LEU 431 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 3hqp h LEU 431 CO 0.02 0.00 0.05 0.59 0.09 0.00 0.00 178.44 179.19 3hqp n ASN 432 N -2.46 0.00 -0.88 -0.43 3.02 -0.44 -0.07 115.26 114.01 3hqp n ASN 432 Ca 0.02 0.40 0.09 0.00 -0.03 0.00 0.00 54.58 55.06 3hqp n ASN 432 Cb 0.29 -0.40 0.17 0.00 -0.61 0.00 0.00 39.78 39.23 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 -1.39 0.61 -3.74 2.41 -5.35 -1.21 -4.77 119.36 105.92 3hqp n ILE 433 Ca 0.00 -0.80 -0.37 0.00 -0.27 0.00 0.00 62.75 61.31 3hqp n ILE 433 Cb 0.05 0.84 -0.11 0.00 -1.74 0.00 0.00 39.64 38.67 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 -1.17 4.83 0.31 7.28 2.01 0.90 -4.63 115.64 125.17 3hqp s THR 434 Ca 0.30 0.00 -0.30 0.00 0.31 0.00 0.00 61.69 62.00 3hqp s THR 434 Cb 0.17 -3.26 -0.12 0.00 0.01 0.00 0.00 72.50 69.30 3hqp s THR 434 CO 0.23 0.33 1.51 1.67 -0.69 0.00 0.00 174.62 177.67 3hqp n GLN 435 N 4.64 2.53 -0.98 4.92 0.00 -1.26 -3.64 117.38 123.58 3hqp n GLN 435 Ca -0.15 0.89 0.00 0.00 -0.00 0.00 0.00 57.00 57.74 3hqp n GLN 435 Cb 0.52 -2.62 0.00 0.00 0.00 0.00 0.00 30.24 28.14 3hqp n GLN 435 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3hqp n GLY 436 N 1.61 0.57 3.47 1.69 0.00 0.14 -4.86 105.19 107.81 3hqp n GLY 436 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 3hqp n GLY 436 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hqp s VAL 437 N -2.40 3.08 -0.02 1.61 1.01 -1.24 -1.77 120.40 120.66 3hqp s VAL 437 Ca 0.00 -0.71 0.05 0.00 0.00 0.00 0.00 61.98 61.31 3hqp s VAL 437 Cb 0.00 -2.21 -0.01 0.00 0.00 0.00 0.00 36.38 34.16 3hqp s VAL 437 CO 0.00 0.59 -0.17 -1.61 0.00 0.00 0.00 175.10 173.91 3hqp s GLU 438 N -0.66 1.47 -0.10 2.72 2.02 0.37 -4.93 118.70 119.58 3hqp s GLU 438 Ca 0.10 -0.59 -0.00 0.00 0.02 0.00 0.00 54.97 54.50 3hqp s GLU 438 Cb -0.11 -1.37 -0.03 0.00 0.10 0.00 0.00 34.13 32.73 3hqp s GLU 438 CO 0.01 0.32 -0.08 -1.12 0.02 0.00 0.00 175.26 174.40 3hqp s SER 439 N -0.24 4.50 -0.15 -0.19 0.01 -1.26 0.02 113.70 116.40 3hqp s SER 439 Ca 0.03 -0.12 -0.00 0.00 1.31 0.00 0.00 55.95 57.17 3hqp s SER 439 Cb -0.08 -1.36 -0.01 0.00 0.21 0.00 0.00 66.02 64.78 3hqp s SER 439 CO 0.00 0.28 -0.14 -0.69 0.41 0.00 0.00 173.24 173.10 3hqp s VAL 440 N -0.31 2.86 -0.07 3.43 1.01 0.14 -4.95 120.40 122.51 3hqp s VAL 440 Ca 0.04 -0.71 -0.25 0.00 0.00 0.00 0.00 61.98 61.05 3hqp s VAL 440 Cb -0.13 -2.21 -0.03 0.00 0.00 0.00 0.00 36.38 34.02 3hqp s VAL 440 CO 0.02 0.51 0.80 0.12 0.00 0.00 0.00 175.10 176.56 3hqp s PHE 441 N 0.66 3.56 -0.29 5.22 5.36 -1.26 -0.90 117.98 130.34 3hqp s PHE 441 Ca -0.07 1.36 -0.02 0.00 -0.96 0.00 0.00 56.93 57.24 3hqp s PHE 441 Cb -0.16 -2.93 0.04 0.00 -0.34 0.00 0.00 43.02 39.64 3hqp s PHE 441 CO 0.02 -0.01 -0.01 0.12 -1.46 0.00 0.00 175.22 173.88 3hqp s PHE 442 N 1.17 3.21 -0.92 10.12 5.36 0.11 -4.94 117.98 132.08 3hqp s PHE 442 Ca 0.41 -1.77 -0.24 0.00 -0.96 0.00 0.00 56.93 54.37 3hqp s PHE 442 Cb -0.18 -2.10 0.04 0.00 -0.34 0.00 0.00 43.02 40.44 3hqp s PHE 442 CO 0.19 -0.78 1.45 0.34 -1.46 0.00 0.00 175.22 174.96 3hqp s ASP 443 N 1.28 6.29 0.42 6.13 -1.08 -1.26 -4.26 116.67 124.18 3hqp s ASP 443 Ca -0.04 -1.08 0.11 0.00 -0.52 0.00 0.00 52.55 51.03 3hqp s ASP 443 Cb -0.19 -2.57 0.92 0.00 -1.46 0.00 0.00 42.92 39.62 3hqp s ASP 443 CO -0.02 -1.70 1.99 0.00 0.52 0.00 0.00 175.17 175.95 3hqp h ALA 444 N 10.10 1.65 0.00 3.66 0.00 -1.85 -0.22 119.26 132.60 3hqp h ALA 444 Ca 0.05 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 3hqp h ALA 444 Cb 1.02 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 3hqp h ALA 444 CO 1.37 0.26 -0.10 -0.44 0.00 0.00 0.00 179.25 180.34 3hqp h ASP 445 N 0.17 0.00 0.00 0.00 5.19 -1.88 -0.67 116.42 119.23 3hqp h ASP 445 Ca 0.04 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 56.42 3hqp h ASP 445 Cb 0.26 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.76 3hqp h ASP 445 CO 0.01 0.10 -1.25 2.29 -3.12 0.00 0.00 179.24 177.28 3hqp n LYS 446 N -3.46 1.45 0.00 3.56 2.85 -1.13 -4.74 118.16 116.69 3hqp n LYS 446 Ca -0.01 -0.03 0.10 0.00 -1.05 0.00 0.00 58.31 57.33 3hqp n LYS 446 Cb 0.25 -1.11 -0.05 0.00 -0.65 0.00 0.00 35.03 33.47 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 -1.87 1.12 0.00 -5.58 4.77 -0.11 -5.09 117.00 110.24 3hqp n LEU 447 Ca -0.03 -0.48 0.00 0.00 -0.03 0.00 0.00 56.01 55.46 3hqp n LEU 447 Cb 0.34 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 3hqp n LEU 447 CO 0.09 0.26 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 3hqp n GLY 448 N 1.48 0.84 0.04 -0.72 0.00 -0.26 -4.74 105.19 101.83 3hqp n GLY 448 Ca 0.05 -2.05 0.12 0.00 0.00 0.00 0.00 46.02 44.14 3hqp n GLY 448 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3hqp n HIS 449 N 0.95 0.33 -3.71 1.61 8.25 -1.26 -4.32 115.22 117.07 3hqp n HIS 449 Ca 0.00 0.10 -0.26 0.00 -0.26 0.00 0.00 57.72 57.29 3hqp n HIS 449 Cb 0.00 -0.54 0.03 0.00 1.12 0.00 0.00 29.99 30.60 3hqp n HIS 449 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 3hqp n ASP 450 N -1.83 -3.35 -4.76 0.41 2.03 -1.26 -4.96 116.55 102.84 3hqp n ASP 450 Ca 0.05 -0.94 -0.41 0.00 0.52 0.00 0.00 54.79 54.01 3hqp n ASP 450 Cb 0.39 -3.62 -0.02 0.00 -0.72 0.00 0.00 41.12 37.15 3hqp n ASP 450 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 3hqp s GLU 451 N -5.98 4.36 0.00 -0.67 8.01 -1.26 -2.18 118.70 120.98 3hqp s GLU 451 Ca 0.26 2.19 0.00 0.00 0.01 0.00 0.00 54.97 57.43 3hqp s GLU 451 Cb -0.08 -3.10 0.00 0.00 -4.31 0.00 0.00 34.13 26.64 3hqp s GLU 451 CO 0.85 -0.22 0.00 0.41 0.01 0.00 0.00 175.26 176.30 3hqp n GLY 452 N 1.29 2.28 4.09 -1.39 0.00 -1.26 -4.73 105.19 105.47 3hqp n GLY 452 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -2.00 0.00 -0.17 1.61 4.76 -0.93 -4.82 118.16 116.62 3hqp n LYS 453 Ca 0.00 0.00 -0.03 0.00 -2.87 0.00 0.00 58.31 55.41 3hqp n LYS 453 Cb 0.00 -3.16 0.07 0.00 -1.84 0.00 0.00 35.03 30.09 3hqp n LYS 453 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 3hqp h GLU 454 N 0.87 0.37 -0.10 1.97 3.07 -1.85 -2.40 114.58 116.50 3hqp h GLU 454 Ca 0.00 -0.02 -0.17 0.00 -0.50 0.00 0.00 59.36 58.67 3hqp h GLU 454 Cb 0.00 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 27.82 3hqp h GLU 454 CO 0.00 0.24 -0.66 0.45 -1.40 0.00 0.00 179.01 177.64 3hqp h HIS 455 N 0.38 0.54 -0.41 4.33 3.86 -1.90 -1.29 115.15 120.64 3hqp h HIS 455 Ca 0.25 -0.22 -0.15 0.00 -1.16 0.00 0.00 60.37 59.08 3hqp h HIS 455 Cb 0.26 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 28.63 3hqp h HIS 455 CO -0.16 0.95 -0.34 0.00 0.86 0.00 0.00 177.93 179.24 3hqp h ARG 456 N 0.29 0.96 0.05 2.45 3.08 -1.88 -1.83 114.38 117.50 3hqp h ARG 456 Ca -0.02 -0.48 -0.00 0.00 0.07 0.00 0.00 59.98 59.55 3hqp h ARG 456 Cb 1.21 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.27 3hqp h ARG 456 CO 0.11 1.15 -0.03 0.28 -1.07 0.00 0.00 179.97 180.41 3hqp h VAL 457 N 0.80 1.13 -0.62 2.04 2.07 -1.33 -1.98 116.25 118.35 3hqp h VAL 457 Ca 0.07 -0.60 0.13 0.00 0.82 0.00 0.00 66.70 67.12 3hqp h VAL 457 Cb 0.94 1.52 -0.10 0.00 -1.52 0.00 0.00 31.29 32.13 3hqp h VAL 457 CO 0.09 0.15 0.07 0.00 0.02 0.00 0.00 177.57 177.90 3hqp h ALA 458 N 0.59 0.69 -0.56 1.67 0.00 -1.28 0.10 119.26 120.48 3hqp h ALA 458 Ca -0.01 0.16 0.06 0.00 0.00 0.00 0.00 54.91 55.13 3hqp h ALA 458 Cb 0.30 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 3hqp h ALA 458 CO 0.01 -0.36 0.37 0.00 0.00 0.00 0.00 179.25 179.27 3hqp h ALA 459 N 1.54 1.85 0.18 0.00 0.00 -1.10 -0.74 119.26 120.97 3hqp h ALA 459 Ca 0.33 -0.02 -0.33 0.00 0.00 0.00 0.00 54.91 54.90 3hqp h ALA 459 Cb 0.53 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.20 3hqp h ALA 459 CO -0.48 0.06 -1.56 0.78 0.00 0.00 0.00 179.25 178.06 3hqp h GLY 460 N 0.53 0.43 1.03 0.00 0.00 -0.43 -2.91 103.07 101.70 3hqp h GLY 460 Ca 0.24 -1.09 -0.04 0.00 0.00 0.00 0.00 47.33 46.44 3hqp h GLY 460 CO -0.07 0.95 0.28 -2.08 0.00 0.00 0.00 176.54 175.63 3hqp h VAL 461 N 0.10 1.25 -0.52 4.60 2.07 -0.63 -1.76 116.25 121.36 3hqp h VAL 461 Ca -0.27 -0.79 -0.12 0.00 0.82 0.00 0.00 66.70 66.34 3hqp h VAL 461 Cb 2.08 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 32.25 3hqp h VAL 461 CO 0.20 0.32 -0.16 -0.08 0.02 0.00 0.00 177.57 177.87 3hqp h GLU 462 N 1.03 1.03 -0.89 1.57 4.57 -1.25 0.64 114.58 121.27 3hqp h GLU 462 Ca 0.24 -0.41 0.02 0.00 -1.18 0.00 0.00 59.36 58.03 3hqp h GLU 462 Cb 0.22 -0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 28.71 3hqp h GLU 462 CO -0.02 1.10 0.59 0.35 -1.18 0.00 0.00 179.01 179.85 3hqp h PHE 463 N 0.90 1.11 -0.12 0.92 3.57 -1.36 0.37 116.94 122.32 3hqp h PHE 463 Ca 0.13 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.53 3hqp h PHE 463 Cb 0.74 -0.37 -0.01 0.00 2.79 0.00 0.00 35.95 39.10 3hqp h PHE 463 CO 0.05 0.67 -0.47 0.00 -2.23 0.00 0.00 178.31 176.34 3hqp h ALA 464 N 1.35 0.98 -0.12 2.41 0.00 -1.02 -1.59 119.26 121.26 3hqp h ALA 464 Ca 0.34 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 3hqp h ALA 464 Cb -0.08 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 3hqp h ALA 464 CO -0.09 0.64 0.00 0.87 0.00 0.00 0.00 179.25 180.67 3hqp h LYS 465 N 0.25 0.22 0.00 0.00 1.79 -0.31 -1.24 116.57 117.28 3hqp h LYS 465 Ca 0.02 -0.07 -0.03 0.00 -2.18 0.00 0.00 60.65 58.39 3hqp h LYS 465 Cb 0.92 -0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 31.54 3hqp h LYS 465 CO 0.08 0.46 -0.14 0.66 -1.08 0.00 0.00 179.45 179.42 3hqp h SER 466 N -0.05 0.00 0.64 0.86 4.64 -0.10 -1.97 113.55 117.57 3hqp h SER 466 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 3hqp h SER 466 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 3hqp h SER 466 CO 0.01 0.14 -0.44 0.29 -0.87 0.00 0.00 176.83 175.95 3hqp n LYS 467 N -3.85 0.05 -0.67 4.77 4.76 -0.61 -4.95 118.16 117.66 3hqp n LYS 467 Ca -0.02 0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 3hqp n LYS 467 Cb 0.24 -1.53 0.00 0.00 -1.84 0.00 0.00 35.03 31.90 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 1.47 0.66 0.22 0.72 0.00 -0.74 -4.95 105.19 102.57 3hqp n GLY 468 Ca 0.05 -0.03 -0.08 0.00 0.00 0.00 0.00 46.02 45.96 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 0.65 -3.76 1.61 0.05 -1.46 -3.45 116.97 110.62 3hqp h TYR 469 Ca 0.00 -0.21 -0.42 0.00 0.05 0.00 0.00 58.73 58.15 3hqp h TYR 469 Cb 0.00 -0.13 -0.31 0.00 1.01 0.00 0.00 36.73 37.30 3hqp h TYR 469 CO 0.00 0.92 -0.78 0.14 -1.05 0.00 0.00 178.16 177.39 3hqp s VAL 470 N -4.09 0.73 0.39 -2.88 -7.23 -1.13 -4.72 120.40 101.47 3hqp s VAL 470 Ca -0.07 -0.32 0.08 0.00 -1.81 0.00 0.00 61.98 59.86 3hqp s VAL 470 Cb 0.12 -0.66 -0.05 0.00 0.56 0.00 0.00 36.38 36.35 3hqp s VAL 470 CO 0.83 0.24 0.16 -1.10 -0.31 0.00 0.00 175.10 174.92 3hqp s GLN 471 N 0.28 2.24 0.09 4.82 -0.21 -1.26 -4.38 119.66 121.24 3hqp s GLN 471 Ca -0.04 -1.78 -0.34 0.00 0.02 0.00 0.00 55.36 53.21 3hqp s GLN 471 Cb -0.09 -2.01 -0.13 0.00 1.00 0.00 0.00 33.01 31.77 3hqp s GLN 471 CO 0.00 -0.06 1.66 2.41 -2.12 0.00 0.00 175.29 177.19 3hqp n THR 472 N -1.20 0.17 0.00 -0.19 -1.04 -1.26 -1.82 114.28 108.94 3hqp n THR 472 Ca -0.02 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 61.96 3hqp n THR 472 Cb 0.64 -1.62 0.00 0.00 -1.82 0.00 0.00 70.33 67.53 3hqp n THR 472 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3hqp n GLY 473 N 3.68 0.32 3.89 3.41 0.00 -0.49 -5.02 105.19 110.98 3hqp n GLY 473 Ca 0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 3hqp n GLY 473 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hqp s ASP 474 N -2.36 6.03 -0.03 1.61 1.01 -0.75 -4.85 116.67 117.32 3hqp s ASP 474 Ca 0.00 1.18 -0.12 0.00 0.71 0.00 0.00 52.55 54.33 3hqp s ASP 474 Cb 0.00 -2.24 -0.05 0.00 1.01 0.00 0.00 42.92 41.64 3hqp s ASP 474 CO 0.00 -0.91 0.32 -0.31 0.21 0.00 0.00 175.17 174.48 3hqp s TYR 475 N -3.10 3.68 -0.03 4.23 2.02 -1.26 -1.71 117.35 121.18 3hqp s TYR 475 Ca 0.54 0.83 0.04 0.00 -0.37 0.00 0.00 57.07 58.10 3hqp s TYR 475 Cb -0.11 -2.16 -0.00 0.00 -0.40 0.00 0.00 41.96 39.29 3hqp s TYR 475 CO 0.51 0.66 -0.14 0.00 -1.57 0.00 0.00 175.55 175.01 3hqp s VAL 477 N -0.01 4.28 -0.15 0.00 1.01 -0.93 -1.29 120.40 123.32 3hqp s VAL 477 Ca -0.01 -0.30 -0.02 0.00 0.00 0.00 0.00 61.98 61.65 3hqp s VAL 477 Cb -0.09 -3.07 -0.02 0.00 0.00 0.00 0.00 36.38 33.21 3hqp s VAL 477 CO 0.01 0.25 -0.10 -0.69 0.00 0.00 0.00 175.10 174.58 3hqp s VAL 478 N 1.59 3.28 -0.20 2.92 1.01 -0.11 -0.81 120.40 128.09 3hqp s VAL 478 Ca 0.05 -0.57 0.01 0.00 0.00 0.00 0.00 61.98 61.48 3hqp s VAL 478 Cb -0.16 -2.41 0.03 0.00 0.00 0.00 0.00 36.38 33.84 3hqp s VAL 478 CO 0.04 0.50 -0.18 -0.63 0.00 0.00 0.00 175.10 174.83 3hqp s ILE 479 N 0.55 2.08 0.00 2.22 1.01 0.11 -1.67 121.20 125.49 3hqp s ILE 479 Ca -0.06 -1.10 0.00 0.00 0.00 0.00 0.00 60.65 59.49 3hqp s ILE 479 Cb -0.15 -1.95 0.00 0.00 0.01 0.00 0.00 42.46 40.36 3hqp s ILE 479 CO 0.03 0.41 0.00 0.00 0.00 0.00 0.00 174.94 175.39 3hqp n HIS 480 N 4.58 -0.23 -3.73 3.97 1.44 -1.11 -1.92 115.22 118.22 3hqp n HIS 480 Ca -0.19 0.00 -0.20 0.00 -2.01 0.00 0.00 57.72 55.31 3hqp n HIS 480 Cb 0.48 0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.58 3hqp n HIS 480 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3hqp s ALA 481 N -1.12 4.06 1.04 1.59 0.00 -1.26 -1.62 121.76 124.45 3hqp s ALA 481 Ca 0.00 -1.32 -0.07 0.00 0.00 0.00 0.00 51.96 50.57 3hqp s ALA 481 Cb 0.00 -1.72 0.10 0.00 0.00 0.00 0.00 23.12 21.49 3hqp s ALA 481 CO 0.00 0.11 0.46 -0.40 0.00 0.00 0.00 175.76 175.93 3hqp n ASP 482 N -1.53 -0.59 0.26 0.00 5.68 -1.26 -4.88 116.55 114.22 3hqp n ASP 482 Ca -0.05 -0.99 0.15 0.00 -0.50 0.00 0.00 54.79 53.39 3hqp n ASP 482 Cb 0.57 -0.38 0.57 0.00 -1.14 0.00 0.00 41.12 40.74 3hqp n ASP 482 CO 0.00 0.00 0.00 0.45 -1.33 0.00 0.00 177.20 176.32 3hqp h HIS 483 N -1.58 0.00 0.00 2.11 3.86 -2.00 -3.34 115.15 114.20 3hqp h HIS 483 Ca -0.16 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.05 3hqp h HIS 483 Cb 0.45 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.92 3hqp h HIS 483 CO 0.00 0.07 -0.48 -0.22 0.86 0.00 0.00 177.93 178.16 3hqp h LYS 484 N 0.00 0.00 -6.48 2.45 3.64 -2.03 -3.48 116.57 110.66 3hqp h LYS 484 Ca -0.00 0.00 -0.60 0.00 -1.27 0.00 0.00 60.65 58.78 3hqp h LYS 484 Cb 0.63 0.00 0.06 0.00 -0.41 0.00 0.00 32.23 32.51 3hqp h LYS 484 CO 0.01 0.02 0.70 0.28 -2.27 0.00 0.00 179.45 178.19 3hqp n VAL 485 N -4.63 0.18 -5.12 2.00 0.31 -1.26 -5.02 118.33 104.79 3hqp n VAL 485 Ca -0.07 -0.04 -0.29 0.00 -0.01 0.00 0.00 64.34 63.93 3hqp n VAL 485 Cb 0.25 -1.40 -0.16 0.00 -0.91 0.00 0.00 33.84 31.62 3hqp n VAL 485 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 3hqp s LYS 486 N 0.59 1.98 0.00 5.55 -0.14 -1.26 -4.71 119.74 121.76 3hqp s LYS 486 Ca 0.78 -0.81 0.00 0.00 -1.36 0.00 0.00 55.97 54.58 3hqp s LYS 486 Cb -0.72 -1.83 0.00 0.00 -1.68 0.00 0.00 37.83 33.60 3hqp s LYS 486 CO 0.41 0.44 0.00 0.41 -0.76 0.00 0.00 175.35 175.86 3hqp n GLY 487 N 2.68 2.10 3.70 -3.33 0.00 -1.26 -5.04 105.19 104.03 3hqp n GLY 487 Ca -0.16 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.79 3hqp n GLY 487 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3hqp s TYR 488 N -2.45 -0.24 -0.21 1.61 -0.85 -1.26 -5.10 117.35 108.85 3hqp s TYR 488 Ca 0.00 -0.07 -0.18 0.00 -0.52 0.00 0.00 57.07 56.30 3hqp s TYR 488 Cb 0.00 0.63 -0.03 0.00 0.38 0.00 0.00 41.96 42.94 3hqp s TYR 488 CO 0.00 -0.91 0.49 0.00 -1.52 0.00 0.00 175.55 173.61 3hqp s ALA 489 N -3.51 3.55 -0.34 9.51 0.00 -1.26 -4.48 121.76 125.23 3hqp s ALA 489 Ca 0.09 -0.45 0.04 0.00 0.00 0.00 0.00 51.96 51.63 3hqp s ALA 489 Cb -0.03 -2.78 0.10 0.00 0.00 0.00 0.00 23.12 20.41 3hqp s ALA 489 CO -0.00 -0.45 1.05 0.27 0.00 0.00 0.00 175.76 176.63 3hqp n ASN 490 N 4.81 2.24 -3.87 0.00 2.04 -1.10 -4.36 115.26 115.02 3hqp n ASN 490 Ca -0.05 -1.93 -0.16 0.00 -0.44 0.00 0.00 54.58 51.99 3hqp n ASN 490 Cb 0.50 -0.07 -0.15 0.00 -2.53 0.00 0.00 39.78 37.53 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 -0.95 0.34 0.06 -3.83 0.74 -0.64 -4.90 119.66 110.48 3hqp s GLN 491 Ca 0.08 -0.03 0.09 0.00 0.05 0.00 0.00 55.36 55.56 3hqp s GLN 491 Cb 0.04 -0.42 -0.03 0.00 1.10 0.00 0.00 33.01 33.70 3hqp s GLN 491 CO 0.05 -0.04 -0.26 0.95 -0.55 0.00 0.00 175.29 175.44 3hqp s THR 492 N 0.54 2.13 -0.00 -0.34 -4.23 -1.26 -2.74 115.64 109.74 3hqp s THR 492 Ca -0.05 -1.45 0.00 0.00 -1.18 0.00 0.00 61.69 59.01 3hqp s THR 492 Cb -0.09 -1.84 -0.00 0.00 1.34 0.00 0.00 72.50 71.92 3hqp s THR 492 CO -0.01 0.30 -0.01 0.00 -0.54 0.00 0.00 174.62 174.36 3hqp s ARG 493 N -1.40 0.10 -0.42 3.99 1.70 -0.67 -5.00 118.95 117.25 3hqp s ARG 493 Ca 0.12 -0.04 -0.14 0.00 -0.47 0.00 0.00 55.73 55.19 3hqp s ARG 493 Cb -0.10 -0.10 0.04 0.00 -0.57 0.00 0.00 34.95 34.21 3hqp s ARG 493 CO 0.03 0.02 0.31 0.42 -1.08 0.00 0.00 175.30 175.00 3hqp s ILE 494 N -0.01 5.13 0.20 4.99 1.01 -1.26 -0.94 121.20 130.32 3hqp s ILE 494 Ca 0.00 -0.83 0.08 0.00 0.00 0.00 0.00 60.65 59.90 3hqp s ILE 494 Cb -0.01 -3.93 -0.04 0.00 0.01 0.00 0.00 42.46 38.50 3hqp s ILE 494 CO -0.00 -0.38 0.02 -1.48 0.00 0.00 0.00 174.94 173.09 3hqp s LEU 495 N 1.64 3.33 -0.20 2.97 0.05 -0.41 -4.96 118.68 121.11 3hqp s LEU 495 Ca 0.04 -0.43 -0.16 0.00 0.05 0.00 0.00 54.13 53.63 3hqp s LEU 495 Cb -0.21 -1.95 -0.04 0.00 -2.05 0.00 0.00 46.19 41.95 3hqp s LEU 495 CO 0.08 0.06 0.41 -0.22 -0.55 0.00 0.00 176.35 176.13 3hqp s LEU 496 N -3.17 4.16 0.22 1.48 2.96 -1.26 -1.32 118.68 121.74 3hqp s LEU 496 Ca 0.29 0.54 -0.30 0.00 -0.22 0.00 0.00 54.13 54.44 3hqp s LEU 496 Cb -0.09 -2.54 -0.08 0.00 0.50 0.00 0.00 46.19 43.98 3hqp s LEU 496 CO 0.19 -0.08 0.97 0.68 -1.32 0.00 0.00 176.35 176.79 3hqp s VAL 497 N 1.32 4.06 -2.65 1.68 -7.23 -0.69 -4.94 120.40 111.94 3hqp s VAL 497 Ca 0.20 1.98 0.27 0.00 -1.81 0.00 0.00 61.98 62.62 3hqp s VAL 497 Cb -0.15 -4.26 0.44 0.00 0.56 0.00 0.00 36.38 32.97 3hqp s VAL 497 CO 0.08 0.44 1.60 -0.62 -0.31 0.00 0.00 175.10 176.29