#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 0.73 0.15 4.33 5.75 -2.06 -2.22 115.11 121.79 3hqp h GLN 2 Ca 0.00 -0.21 0.02 0.00 -0.15 0.00 0.00 58.65 58.31 3hqp h GLN 2 Cb 0.00 -0.08 -0.04 0.00 1.07 0.00 0.00 27.48 28.43 3hqp h GLN 2 CO 0.00 0.77 -0.34 1.25 -2.65 0.00 0.00 178.83 177.86 3hqp h LEU 3 N 0.67 -0.97 -0.76 -2.39 6.46 -2.07 -1.17 115.31 115.09 3hqp h LEU 3 Ca 0.13 0.11 0.05 0.00 -0.12 0.00 0.00 57.88 58.04 3hqp h LEU 3 Cb 0.49 0.36 -0.05 0.00 -0.73 0.00 0.00 40.66 40.73 3hqp h LEU 3 CO 0.03 -0.43 0.46 0.00 -0.62 0.00 0.00 178.44 177.87 3hqp h ALA 4 N 0.02 1.01 -0.47 1.25 0.00 -1.99 -2.11 119.26 116.98 3hqp h ALA 4 Ca 0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3hqp h ALA 4 Cb 0.60 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3hqp h ALA 4 CO -0.18 0.20 0.27 1.25 0.00 0.00 0.00 179.25 180.79 3hqp h HIS 5 N 0.86 0.61 -0.31 0.00 -0.00 -1.07 -2.51 115.15 112.74 3hqp h HIS 5 Ca 0.32 0.00 -0.04 0.00 -0.00 0.00 0.00 60.37 60.65 3hqp h HIS 5 Cb 0.12 -0.20 -0.02 0.00 -0.00 0.00 0.00 27.41 27.31 3hqp h HIS 5 CO -0.05 0.42 0.01 -0.91 -0.00 0.00 0.00 177.93 177.41 3hqp h ASN 6 N 0.64 0.43 0.45 3.26 2.35 -0.51 -1.77 115.58 120.44 3hqp h ASN 6 Ca 0.17 -0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.85 3hqp h ASN 6 Cb -0.00 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.25 3hqp h ASN 6 CO -0.03 0.49 0.00 0.18 -1.65 0.00 0.00 177.43 176.42 3hqp n LEU 7 N -4.31 0.00 -0.21 1.61 4.77 -0.94 -2.52 117.00 115.40 3hqp n LEU 7 Ca 0.01 0.45 0.12 0.00 -0.03 0.00 0.00 56.01 56.56 3hqp n LEU 7 Cb 0.22 -0.45 0.13 0.00 -2.33 0.00 0.00 43.42 41.00 3hqp n LEU 7 CO 0.38 -0.22 0.36 0.35 -1.33 0.00 0.00 177.39 176.93 3hqp n THR 8 N -1.45 0.00 -2.71 -5.08 -2.24 -0.67 -4.96 114.28 97.17 3hqp n THR 8 Ca 0.04 -0.11 -0.32 0.00 -2.27 0.00 0.00 64.05 61.40 3hqp n THR 8 Cb 0.16 0.74 -0.04 0.00 -2.10 0.00 0.00 70.33 69.09 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 -2.71 3.79 0.02 3.22 1.43 -1.05 -5.10 118.68 118.28 3hqp s LEU 9 Ca 0.16 1.37 0.00 0.00 -1.03 0.00 0.00 54.13 54.64 3hqp s LEU 9 Cb 0.18 -4.26 -0.02 0.00 0.03 0.00 0.00 46.19 42.11 3hqp s LEU 9 CO 0.65 -0.45 -0.03 -0.55 0.23 0.00 0.00 176.35 176.21 3hqp s SER 10 N -2.92 0.26 0.33 2.29 0.15 -1.26 -5.04 113.70 107.52 3hqp s SER 10 Ca 0.56 -0.51 0.10 0.00 0.70 0.00 0.00 55.95 56.80 3hqp s SER 10 Cb -0.10 0.10 0.59 0.00 -1.71 0.00 0.00 66.02 64.90 3hqp s SER 10 CO 0.28 -0.30 1.76 0.16 1.20 0.00 0.00 173.24 176.34 3hqp h ILE 11 N 4.62 1.30 0.00 6.45 3.07 -2.02 -3.22 117.51 127.72 3hqp h ILE 11 Ca -0.32 -1.46 -0.01 0.00 1.55 0.00 0.00 64.86 64.62 3hqp h ILE 11 Cb 1.21 1.74 -0.00 0.00 -0.27 0.00 0.00 36.82 39.50 3hqp h ILE 11 CO 0.41 0.42 -0.04 -0.26 -1.05 0.00 0.00 178.15 177.64 3hqp h PHE 12 N 0.07 0.00 -1.89 0.16 0.04 -2.04 -3.46 116.94 109.82 3hqp h PHE 12 Ca 0.00 0.00 -0.60 0.00 2.80 0.00 0.00 57.97 60.18 3hqp h PHE 12 Cb 0.76 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.91 3hqp h PHE 12 CO 0.00 0.04 1.49 -0.25 -0.60 0.00 0.00 178.31 179.00 3hqp n ASP 13 N -3.14 3.14 -4.55 2.17 8.00 -1.22 -4.93 116.55 116.02 3hqp n ASP 13 Ca 0.01 0.21 -0.43 0.00 0.71 0.00 0.00 54.79 55.29 3hqp n ASP 13 Cb 0.36 -1.53 -0.00 0.00 -0.02 0.00 0.00 41.12 39.93 3hqp n ASP 13 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 3hqp n PRO 14 N 8.72 1.07 -1.86 -0.24 -0.02 -1.26 -4.97 135.00 136.44 3hqp n PRO 14 Ca 0.31 0.38 -0.31 0.00 -2.02 0.00 0.00 63.50 61.87 3hqp n PRO 14 Cb 0.43 -1.77 0.03 0.00 -0.02 0.00 0.00 33.50 32.16 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 -1.23 4.10 1.05 -1.45 -7.23 -1.26 -5.05 120.40 109.33 3hqp s VAL 15 Ca 0.62 0.68 -0.11 0.00 -1.81 0.00 0.00 61.98 61.35 3hqp s VAL 15 Cb -0.64 -3.66 0.22 0.00 0.56 0.00 0.00 36.38 32.86 3hqp s VAL 15 CO 0.58 -0.89 1.08 0.00 -0.31 0.00 0.00 175.10 175.57 3hqp s ALA 16 N -3.26 0.42 -1.90 1.32 0.00 -1.26 -4.94 121.76 112.14 3hqp s ALA 16 Ca 0.57 0.24 0.06 0.00 0.00 0.00 0.00 51.96 52.82 3hqp s ALA 16 Cb -0.11 -3.35 0.18 0.00 0.00 0.00 0.00 23.12 19.84 3hqp s ALA 16 CO 0.53 -3.36 1.12 0.27 0.00 0.00 0.00 175.76 174.32 3hqp n ASN 17 N -4.62 1.19 -3.73 0.00 2.04 -1.26 -4.85 115.26 104.04 3hqp n ASN 17 Ca 0.07 -2.02 -0.14 0.00 -0.44 0.00 0.00 54.58 52.05 3hqp n ASN 17 Cb 0.53 -0.17 -0.09 0.00 -2.53 0.00 0.00 39.78 37.52 3hqp n ASN 17 CO 0.00 0.00 0.00 -0.72 -0.44 0.00 0.00 177.26 176.10 3hqp s TYR 18 N -1.71 -0.28 -0.22 -2.53 -0.85 -1.26 -5.03 117.35 105.48 3hqp s TYR 18 Ca 0.14 0.51 -0.09 0.00 -0.52 0.00 0.00 57.07 57.10 3hqp s TYR 18 Cb 0.07 0.14 -0.05 0.00 0.38 0.00 0.00 41.96 42.51 3hqp s TYR 18 CO 0.09 -0.38 0.12 0.50 -1.52 0.00 0.00 175.55 174.35 3hqp s ARG 19 N -1.04 4.02 -0.16 -3.49 3.52 -1.26 -5.00 118.95 115.55 3hqp s ARG 19 Ca -0.11 -0.30 -0.23 0.00 -0.13 0.00 0.00 55.73 54.96 3hqp s ARG 19 Cb -0.04 -3.41 -0.20 0.00 -1.56 0.00 0.00 34.95 29.74 3hqp s ARG 19 CO 0.04 0.13 0.47 0.00 -0.81 0.00 0.00 175.30 175.14 3hqp h ALA 20 N 7.22 0.09 -3.01 6.12 0.00 -1.95 -3.44 119.26 124.28 3hqp h ALA 20 Ca -0.38 -0.69 -0.55 0.00 0.00 0.00 0.00 54.91 53.29 3hqp h ALA 20 Cb 1.17 0.27 0.14 0.00 0.00 0.00 0.00 17.79 19.37 3hqp h ALA 20 CO 0.68 0.25 0.51 0.00 0.00 0.00 0.00 179.25 180.69 3hqp s ALA 21 N -2.32 2.44 0.14 0.00 0.00 -1.26 -0.93 121.76 119.82 3hqp s ALA 21 Ca -0.20 1.16 0.07 0.00 0.00 0.00 0.00 51.96 52.99 3hqp s ALA 21 Cb 0.00 -3.52 -0.04 0.00 0.00 0.00 0.00 23.12 19.56 3hqp s ALA 21 CO 0.57 -1.46 -0.08 1.03 0.00 0.00 0.00 175.76 175.83 3hqp s ARG 22 N -3.35 2.18 -0.13 0.00 1.81 -0.21 -4.92 118.95 114.33 3hqp s ARG 22 Ca 0.81 -1.09 0.02 0.00 -1.72 0.00 0.00 55.73 53.75 3hqp s ARG 22 Cb -0.35 -2.29 0.00 0.00 -0.45 0.00 0.00 34.95 31.86 3hqp s ARG 22 CO 0.38 0.48 -0.20 0.42 -0.68 0.00 0.00 175.30 175.70 3hqp s ILE 23 N -1.44 2.32 -0.18 1.52 1.01 -1.26 -1.56 121.20 121.61 3hqp s ILE 23 Ca 0.24 -0.90 -0.05 0.00 0.00 0.00 0.00 60.65 59.93 3hqp s ILE 23 Cb -0.10 -1.94 -0.03 0.00 0.01 0.00 0.00 42.46 40.40 3hqp s ILE 23 CO 0.15 0.54 0.01 -0.63 0.00 0.00 0.00 174.94 175.01 3hqp s ILE 24 N 0.62 4.21 -0.12 2.92 1.01 -0.54 -1.36 121.20 127.93 3hqp s ILE 24 Ca -0.11 -0.24 0.02 0.00 0.00 0.00 0.00 60.65 60.33 3hqp s ILE 24 Cb -0.16 -2.88 -0.00 0.00 0.01 0.00 0.00 42.46 39.43 3hqp s ILE 24 CO 0.03 0.46 -0.20 0.00 0.00 0.00 0.00 174.94 175.23 3hqp s THR 26 N 0.51 4.56 -0.16 0.00 2.01 -0.43 0.01 115.64 122.16 3hqp s THR 26 Ca -0.13 1.88 -0.14 0.00 0.31 0.00 0.00 61.69 63.62 3hqp s THR 26 Cb -0.17 -4.20 -0.05 0.00 0.01 0.00 0.00 72.50 68.09 3hqp s THR 26 CO 0.05 0.17 0.29 -0.63 -0.69 0.00 0.00 174.62 173.81 3hqp s ILE 27 N 0.86 5.31 0.00 1.82 -1.09 -0.08 -2.81 121.20 125.21 3hqp s ILE 27 Ca 0.53 0.54 0.00 0.00 -2.23 0.00 0.00 60.65 59.50 3hqp s ILE 27 Cb -0.24 -3.63 0.00 0.00 -1.58 0.00 0.00 42.46 37.01 3hqp s ILE 27 CO 0.29 0.40 0.00 0.61 -1.23 0.00 0.00 174.94 175.00 3hqp n GLY 28 N 3.34 3.10 0.36 6.18 0.00 -1.25 -4.71 105.19 112.21 3hqp n GLY 28 Ca -0.12 -1.09 0.20 0.00 0.00 0.00 0.00 46.02 45.00 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 0.49 0.00 1.61 0.11 -1.73 0.26 132.00 132.74 3hqp h PRO 29 Ca 0.00 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.04 3hqp h PRO 29 Cb 0.00 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 30.99 3hqp h PRO 29 CO 0.00 0.32 -0.19 0.77 -0.21 0.00 0.00 178.00 178.70 3hqp h SER 30 N 0.50 0.00 0.00 -2.05 0.02 -1.58 -3.36 113.55 107.08 3hqp h SER 30 Ca 0.65 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.60 3hqp h SER 30 Cb 1.37 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.91 3hqp h SER 30 CO -0.46 0.19 0.00 0.35 -1.14 0.00 0.00 176.83 175.76 3hqp n THR 31 N -3.93 0.40 0.10 -2.27 -2.24 0.80 -4.85 114.28 102.28 3hqp n THR 31 Ca -0.02 -0.44 -0.05 0.00 -2.27 0.00 0.00 64.05 61.27 3hqp n THR 31 Cb 0.27 0.89 0.02 0.00 -2.10 0.00 0.00 70.33 69.41 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 0.03 -7.11 -0.78 4.15 -1.39 -3.33 115.11 106.69 3hqp h GLN 32 Ca 0.00 -0.03 -0.54 0.00 0.77 0.00 0.00 58.65 58.84 3hqp h GLN 32 Cb 0.67 0.01 0.13 0.00 0.21 0.00 0.00 27.48 28.51 3hqp h GLN 32 CO 0.00 0.83 0.49 -1.54 -1.93 0.00 0.00 178.83 176.68 3hqp s SER 33 N -6.80 4.88 0.28 -0.69 1.04 -1.26 -4.81 113.70 106.33 3hqp s SER 33 Ca -0.01 2.49 -0.04 0.00 0.48 0.00 0.00 55.95 58.88 3hqp s SER 33 Cb 0.11 -2.61 0.36 0.00 0.10 0.00 0.00 66.02 63.98 3hqp s SER 33 CO 0.80 -1.81 1.94 -0.37 0.98 0.00 0.00 173.24 174.78 3hqp h VAL 34 N 0.68 1.23 -0.71 5.02 -1.51 -1.88 0.17 116.25 119.26 3hqp h VAL 34 Ca -0.51 -0.44 -0.02 0.00 -1.23 0.00 0.00 66.70 64.50 3hqp h VAL 34 Cb 1.32 -0.07 -0.03 0.00 -2.13 0.00 0.00 31.29 30.37 3hqp h VAL 34 CO 0.54 0.23 0.36 -0.08 -1.23 0.00 0.00 177.57 177.39 3hqp h GLU 35 N 1.22 1.01 -0.57 5.19 4.57 -1.95 0.94 114.58 124.99 3hqp h GLU 35 Ca 0.33 -0.14 -0.10 0.00 -1.18 0.00 0.00 59.36 58.26 3hqp h GLU 35 Cb -0.12 -0.19 -0.02 0.00 -0.16 0.00 0.00 28.75 28.26 3hqp h GLU 35 CO -0.07 0.78 -0.05 0.00 -1.18 0.00 0.00 179.01 178.49 3hqp h ALA 36 N 1.18 0.83 -0.45 2.92 0.00 -1.70 -2.23 119.26 119.81 3hqp h ALA 36 Ca 0.25 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 3hqp h ALA 36 Cb 0.09 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3hqp h ALA 36 CO -0.03 0.67 -0.02 -0.07 0.00 0.00 0.00 179.25 179.79 3hqp h LEU 37 N 0.93 0.79 -0.56 0.00 3.38 -0.52 -1.32 115.31 118.01 3hqp h LEU 37 Ca 0.16 -0.32 0.07 0.00 0.09 0.00 0.00 57.88 57.88 3hqp h LEU 37 Cb 0.61 -0.21 -0.06 0.00 0.09 0.00 0.00 40.66 41.08 3hqp h LEU 37 CO 0.04 0.92 0.24 0.11 0.09 0.00 0.00 178.44 179.84 3hqp h LYS 38 N 0.64 0.43 -0.62 1.13 1.57 -0.77 0.16 116.57 119.12 3hqp h LYS 38 Ca 0.12 -0.03 0.08 0.00 -1.87 0.00 0.00 60.65 58.95 3hqp h LYS 38 Cb 0.53 -0.10 -0.06 0.00 0.08 0.00 0.00 32.23 32.68 3hqp h LYS 38 CO 0.03 0.29 0.29 0.78 -0.57 0.00 0.00 179.45 180.26 3hqp h GLY 39 N 0.45 0.89 1.00 3.86 0.00 -1.10 -1.00 103.07 107.16 3hqp h GLY 39 Ca 0.27 -0.18 -0.02 0.00 0.00 0.00 0.00 47.33 47.40 3hqp h GLY 39 CO -0.24 0.06 0.32 1.41 0.00 0.00 0.00 176.54 178.09 3hqp h LEU 40 N 0.52 0.80 0.18 3.11 4.07 -0.60 -1.04 115.31 122.35 3hqp h LEU 40 Ca 0.30 -0.11 -0.01 0.00 0.08 0.00 0.00 57.88 58.13 3hqp h LEU 40 Cb 0.29 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 41.82 3hqp h LEU 40 CO -0.24 0.69 -0.09 0.40 -1.08 0.00 0.00 178.44 178.12 3hqp h ILE 41 N 0.86 0.90 -0.13 1.22 2.04 -0.36 -0.59 117.51 121.46 3hqp h ILE 41 Ca 0.22 -0.38 0.04 0.00 1.00 0.00 0.00 64.86 65.74 3hqp h ILE 41 Cb 0.08 1.13 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 3hqp h ILE 41 CO -0.03 0.09 0.10 1.56 0.00 0.00 0.00 178.15 179.87 3hqp h GLN 42 N -0.42 0.00 0.00 2.37 4.20 -1.19 -1.93 115.11 118.14 3hqp h GLN 42 Ca -0.02 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.59 3hqp h GLN 42 Cb 0.33 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.09 3hqp h GLN 42 CO 0.04 0.00 -0.45 0.77 -0.67 0.00 0.00 178.83 178.52 3hqp h SER 43 N 0.00 0.00 0.00 1.46 0.02 -0.92 -3.47 113.55 110.64 3hqp h SER 43 Ca 0.06 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 3hqp h SER 43 Cb 0.27 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.81 3hqp h SER 43 CO -0.00 0.45 0.00 0.61 -1.14 0.00 0.00 176.83 176.75 3hqp n GLY 44 N 0.96 -0.53 3.74 -3.77 0.00 -0.72 -3.93 105.19 100.94 3hqp n GLY 44 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 3hqp n GLY 44 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3hqp s MET 45 N 0.00 4.37 -0.07 1.61 0.00 -0.29 -4.31 119.30 120.61 3hqp s MET 45 Ca 0.00 2.08 0.07 0.00 0.00 0.00 0.00 55.69 57.84 3hqp s MET 45 Cb 0.00 -3.19 -0.09 0.00 0.00 0.00 0.00 34.83 31.55 3hqp s MET 45 CO 0.00 -0.29 0.02 0.43 0.00 0.00 0.00 175.02 175.18 3hqp n SER 46 N 2.73 3.15 -4.06 1.11 7.64 -0.46 -4.61 113.62 119.12 3hqp n SER 46 Ca 0.07 -0.00 -0.23 0.00 1.01 0.00 0.00 58.87 59.71 3hqp n SER 46 Cb 0.42 0.67 -0.16 0.00 -1.01 0.00 0.00 64.21 64.14 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 -2.18 1.09 -0.37 0.44 1.01 -1.12 -1.74 120.40 117.52 3hqp s VAL 47 Ca -0.04 -0.52 -0.14 0.00 0.00 0.00 0.00 61.98 61.28 3hqp s VAL 47 Cb 0.02 -0.95 -0.00 0.00 0.00 0.00 0.00 36.38 35.45 3hqp s VAL 47 CO 0.31 0.33 0.30 0.00 0.00 0.00 0.00 175.10 176.03 3hqp s ALA 48 N 0.18 3.49 -0.12 5.51 0.00 0.82 -1.38 121.76 130.26 3hqp s ALA 48 Ca -0.04 -1.48 -0.19 0.00 0.00 0.00 0.00 51.96 50.25 3hqp s ALA 48 Cb -0.10 -2.80 -0.04 0.00 0.00 0.00 0.00 23.12 20.18 3hqp s ALA 48 CO 0.01 -1.20 0.50 0.50 0.00 0.00 0.00 175.76 175.58 3hqp s ARG 49 N 1.79 4.33 -0.29 0.00 3.52 0.10 -1.07 118.95 127.34 3hqp s ARG 49 Ca 0.07 0.48 -0.04 0.00 -0.13 0.00 0.00 55.73 56.12 3hqp s ARG 49 Cb -0.18 -3.45 0.03 0.00 -1.56 0.00 0.00 34.95 29.80 3hqp s ARG 49 CO 0.11 0.12 0.02 -1.64 -0.81 0.00 0.00 175.30 173.09 3hqp s MET 50 N 0.75 2.71 -0.42 5.12 -1.94 -0.41 -0.90 119.30 124.21 3hqp s MET 50 Ca 0.27 -1.09 -0.25 0.00 -1.71 0.00 0.00 55.69 52.91 3hqp s MET 50 Cb -0.15 -3.21 0.02 0.00 2.01 0.00 0.00 34.83 33.50 3hqp s MET 50 CO 0.11 -0.53 0.91 1.21 -0.01 0.00 0.00 175.02 176.71 3hqp s ASN 51 N 1.35 6.56 0.00 3.03 2.47 -1.26 -0.20 114.94 126.88 3hqp s ASN 51 Ca -0.02 0.29 0.16 0.00 0.42 0.00 0.00 52.86 53.72 3hqp s ASN 51 Cb -0.18 -2.45 0.93 0.00 -1.45 0.00 0.00 41.25 38.10 3hqp s ASN 51 CO -0.01 -0.95 1.61 0.49 -3.72 0.00 0.00 177.10 174.52 3hqp n PHE 52 N 6.95 0.03 0.21 0.43 3.01 0.10 -2.46 117.46 125.72 3hqp n PHE 52 Ca 0.06 -0.01 0.08 0.00 1.01 0.00 0.00 57.45 58.58 3hqp n PHE 52 Cb 0.48 0.00 0.40 0.00 -0.01 0.00 0.00 39.48 40.35 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 0.24 0.00 -2.81 4.37 0.02 -1.80 -3.42 113.55 110.16 3hqp h SER 53 Ca 0.00 0.00 -0.51 0.00 -0.84 0.00 0.00 61.79 60.44 3hqp h SER 53 Cb 0.05 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 62.45 3hqp h SER 53 CO 0.00 0.30 -0.69 -1.00 -1.14 0.00 0.00 176.83 174.29 3hqp s HIS 54 N -3.64 1.99 0.00 3.45 3.76 -1.03 -5.01 115.29 114.81 3hqp s HIS 54 Ca 0.00 -0.63 0.00 0.00 -0.15 0.00 0.00 55.06 54.29 3hqp s HIS 54 Cb 0.11 -1.08 0.00 0.00 1.11 0.00 0.00 32.58 32.72 3hqp s HIS 54 CO 0.66 0.36 0.00 0.41 -0.85 0.00 0.00 174.74 175.32 3hqp n GLY 55 N -0.57 -0.72 3.31 -2.22 0.00 -1.26 -4.85 105.19 98.87 3hqp n GLY 55 Ca -0.06 -1.11 -0.18 0.00 0.00 0.00 0.00 46.02 44.68 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 1.41 0.36 1.61 1.04 -1.26 -4.99 113.70 107.88 3hqp s SER 56 Ca 0.00 -1.58 0.06 0.00 0.48 0.00 0.00 55.95 54.91 3hqp s SER 56 Cb 0.00 0.42 0.74 0.00 0.10 0.00 0.00 66.02 67.28 3hqp s SER 56 CO 0.00 -0.92 1.96 0.45 0.98 0.00 0.00 173.24 175.71 3hqp h HIS 57 N 2.24 0.76 -0.21 5.02 -0.00 -1.98 0.24 115.15 121.23 3hqp h HIS 57 Ca -0.32 0.02 -0.18 0.00 -0.00 0.00 0.00 60.37 59.89 3hqp h HIS 57 Cb 1.25 -0.25 -0.00 0.00 -0.00 0.00 0.00 27.41 28.40 3hqp h HIS 57 CO 1.08 0.41 -0.60 1.49 -0.00 0.00 0.00 177.93 180.31 3hqp h GLU 58 N 0.76 0.70 -0.43 2.45 4.81 -1.99 -0.59 114.58 120.29 3hqp h GLU 58 Ca 0.31 -0.47 -0.05 0.00 -0.13 0.00 0.00 59.36 59.02 3hqp h GLU 58 Cb 0.25 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.68 3hqp h GLU 58 CO -0.10 1.09 0.08 -0.92 -0.73 0.00 0.00 179.01 178.43 3hqp h TYR 59 N 0.52 0.75 0.00 0.92 3.20 -1.74 -2.80 116.97 117.83 3hqp h TYR 59 Ca -0.00 -0.10 -0.05 0.00 3.14 0.00 0.00 58.73 61.71 3hqp h TYR 59 Cb 1.19 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 39.24 3hqp h TYR 59 CO 0.06 0.72 -0.25 0.45 -1.64 0.00 0.00 178.16 177.50 3hqp h HIS 60 N 0.57 0.00 -0.37 -3.82 3.86 -0.97 -3.01 115.15 111.42 3hqp h HIS 60 Ca 0.13 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.30 3hqp h HIS 60 Cb 0.36 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.82 3hqp h HIS 60 CO 0.02 0.25 0.07 0.37 0.86 0.00 0.00 177.93 179.50 3hqp h GLN 61 N 0.00 0.60 -0.62 2.45 5.75 -0.97 -1.41 115.11 120.92 3hqp h GLN 61 Ca -0.00 -0.16 0.10 0.00 -0.15 0.00 0.00 58.65 58.44 3hqp h GLN 61 Cb 0.89 -0.07 -0.08 0.00 1.07 0.00 0.00 27.48 29.29 3hqp h GLN 61 CO 0.03 0.66 0.20 1.15 -2.65 0.00 0.00 178.83 178.23 3hqp h THR 62 N 0.45 0.72 -0.04 2.39 2.02 -1.38 -0.05 112.91 117.03 3hqp h THR 62 Ca 0.11 -0.13 0.01 0.00 0.77 0.00 0.00 66.41 67.18 3hqp h THR 62 Cb 0.35 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 67.06 3hqp h THR 62 CO 0.01 0.07 -0.04 0.74 0.37 0.00 0.00 175.52 176.66 3hqp h THR 63 N 0.36 0.88 -0.51 3.16 2.02 -1.38 0.22 112.91 117.67 3hqp h THR 63 Ca 0.32 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.53 3hqp h THR 63 Cb 0.43 0.88 -0.04 0.00 -1.74 0.00 0.00 68.15 67.68 3hqp h THR 63 CO -0.34 0.00 0.28 0.40 0.37 0.00 0.00 175.52 176.23 3hqp h ILE 64 N -0.06 1.00 -0.07 3.11 2.04 -0.66 0.16 117.51 123.02 3hqp h ILE 64 Ca 0.03 -0.19 -0.00 0.00 1.00 0.00 0.00 64.86 65.70 3hqp h ILE 64 Cb 0.10 0.40 -0.00 0.00 -0.74 0.00 0.00 36.82 36.58 3hqp h ILE 64 CO -0.07 0.10 0.04 0.78 0.00 0.00 0.00 178.15 179.00 3hqp h ASN 65 N 0.55 0.10 -0.23 1.72 2.35 -0.82 -2.88 115.58 116.37 3hqp h ASN 65 Ca 0.21 -0.10 -0.13 0.00 -0.55 0.00 0.00 56.30 55.73 3hqp h ASN 65 Cb 0.08 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.41 3hqp h ASN 65 CO -0.12 0.17 -0.32 0.78 -1.65 0.00 0.00 177.43 176.28 3hqp h ASN 66 N 0.01 0.78 -0.10 5.81 4.21 -0.05 -1.67 115.58 124.57 3hqp h ASN 66 Ca 0.03 -0.32 -0.00 0.00 1.21 0.00 0.00 56.30 57.21 3hqp h ASN 66 Cb 0.10 -0.22 -0.00 0.00 -1.12 0.00 0.00 38.32 37.08 3hqp h ASN 66 CO -0.00 1.04 0.05 0.58 -1.29 0.00 0.00 177.43 177.80 3hqp h VAL 67 N 0.63 1.10 0.00 2.81 2.07 -0.75 -0.04 116.25 122.06 3hqp h VAL 67 Ca 0.07 -0.28 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 3hqp h VAL 67 Cb 0.85 1.11 -0.00 0.00 -1.52 0.00 0.00 31.29 31.73 3hqp h VAL 67 CO 0.07 0.09 -0.10 0.03 0.02 0.00 0.00 177.57 177.68 3hqp h ARG 68 N 0.05 0.00 0.10 1.57 3.08 -1.38 -0.98 114.38 116.82 3hqp h ARG 68 Ca 0.03 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 3hqp h ARG 68 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.14 3hqp h ARG 68 CO -0.00 0.10 -0.05 0.37 -1.07 0.00 0.00 179.97 179.32 3hqp h GLN 69 N 0.00 -0.13 -0.69 0.04 4.15 -0.89 -1.43 115.11 116.16 3hqp h GLN 69 Ca -0.00 0.01 0.14 0.00 0.77 0.00 0.00 58.65 59.57 3hqp h GLN 69 Cb 0.18 0.03 -0.10 0.00 0.21 0.00 0.00 27.48 27.80 3hqp h GLN 69 CO 0.01 0.37 0.18 0.00 -1.93 0.00 0.00 178.83 177.47 3hqp h ALA 70 N -0.21 0.88 -0.32 3.38 0.00 -0.82 -1.61 119.26 120.56 3hqp h ALA 70 Ca -0.01 0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 3hqp h ALA 70 Cb 0.57 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 3hqp h ALA 70 CO 0.02 -0.30 -0.16 0.00 0.00 0.00 0.00 179.25 178.81 3hqp h ALA 71 N 1.55 0.46 -0.98 0.00 0.00 -1.24 -2.44 119.26 116.61 3hqp h ALA 71 Ca 0.38 -0.34 0.06 0.00 0.00 0.00 0.00 54.91 55.00 3hqp h ALA 71 Cb 0.60 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.22 3hqp h ALA 71 CO -0.45 0.37 0.64 0.00 0.00 0.00 0.00 179.25 179.81 3hqp h ALA 72 N 0.77 1.41 0.00 0.00 0.00 -0.91 0.11 119.26 120.64 3hqp h ALA 72 Ca 0.07 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 3hqp h ALA 72 Cb 0.69 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3hqp h ALA 72 CO 0.05 0.46 -0.48 0.93 0.00 0.00 0.00 179.25 180.21 3hqp h GLU 73 N 1.18 0.00 -0.02 0.00 5.08 -1.08 -2.69 114.58 117.06 3hqp h GLU 73 Ca 0.41 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.77 3hqp h GLU 73 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 3hqp h GLU 73 CO -0.15 0.48 -0.36 1.28 -1.00 0.00 0.00 179.01 179.26 3hqp n LEU 74 N -3.67 2.02 -2.92 1.33 4.77 -0.94 -4.98 117.00 112.61 3hqp n LEU 74 Ca -0.01 -0.72 -0.19 0.00 -0.03 0.00 0.00 56.01 55.06 3hqp n LEU 74 Cb 0.55 -0.02 0.06 0.00 -2.33 0.00 0.00 43.42 41.68 3hqp n LEU 74 CO 0.39 0.37 0.15 0.61 -1.33 0.00 0.00 177.39 177.58 3hqp n GLY 75 N 1.39 -0.29 3.42 -0.72 0.00 0.30 -5.03 105.19 104.26 3hqp n GLY 75 Ca 0.11 0.06 -0.21 0.00 0.00 0.00 0.00 46.02 45.98 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 -3.21 1.79 -0.30 1.61 -7.23 -0.68 -5.04 120.40 107.33 3hqp s VAL 76 Ca 0.43 -2.18 -0.10 0.00 -1.81 0.00 0.00 61.98 58.32 3hqp s VAL 76 Cb -0.19 -2.34 -0.01 0.00 0.56 0.00 0.00 36.38 34.40 3hqp s VAL 76 CO 0.53 -0.38 0.15 0.20 -0.31 0.00 0.00 175.10 175.29 3hqp s ASN 77 N -3.43 5.57 -0.12 4.85 0.01 -1.26 -4.40 114.94 116.17 3hqp s ASN 77 Ca 0.28 -0.45 -0.00 0.00 -0.71 0.00 0.00 52.86 51.97 3hqp s ASN 77 Cb 0.02 -2.01 -0.02 0.00 0.41 0.00 0.00 41.25 39.64 3hqp s ASN 77 CO 0.11 -0.17 -0.11 -0.63 -1.51 0.00 0.00 177.10 174.79 3hqp s ILE 78 N 1.63 3.26 0.27 0.60 -1.09 -1.26 -4.74 121.20 119.87 3hqp s ILE 78 Ca 0.05 -0.60 -0.30 0.00 -2.23 0.00 0.00 60.65 57.57 3hqp s ILE 78 Cb -0.17 -2.36 -0.09 0.00 -1.58 0.00 0.00 42.46 38.25 3hqp s ILE 78 CO 0.07 0.54 1.04 0.00 -1.23 0.00 0.00 174.94 175.35 3hqp s ALA 79 N 0.09 3.38 -0.21 9.38 0.00 -0.71 -4.91 121.76 128.78 3hqp s ALA 79 Ca -0.04 0.79 -0.03 0.00 0.00 0.00 0.00 51.96 52.67 3hqp s ALA 79 Cb -0.14 -3.28 -0.01 0.00 0.00 0.00 0.00 23.12 19.68 3hqp s ALA 79 CO 0.04 -0.02 -0.05 0.42 0.00 0.00 0.00 175.76 176.15 3hqp s ILE 80 N -1.18 3.36 -0.07 0.00 1.01 -1.26 -0.13 121.20 122.94 3hqp s ILE 80 Ca 0.43 -0.50 0.04 0.00 0.00 0.00 0.00 60.65 60.62 3hqp s ILE 80 Cb -0.30 -2.51 -0.02 0.00 0.01 0.00 0.00 42.46 39.64 3hqp s ILE 80 CO 0.38 0.44 -0.19 0.00 0.00 0.00 0.00 174.94 175.56 3hqp s ALA 81 N 1.28 2.42 -0.31 9.38 0.00 -0.23 -1.26 121.76 133.04 3hqp s ALA 81 Ca 0.03 -1.00 -0.10 0.00 0.00 0.00 0.00 51.96 50.90 3hqp s ALA 81 Cb -0.14 -0.87 -0.01 0.00 0.00 0.00 0.00 23.12 22.10 3hqp s ALA 81 CO -0.02 0.44 0.16 -1.17 0.00 0.00 0.00 175.76 175.17 3hqp s LEU 82 N -0.29 4.11 -0.38 0.00 0.20 -0.48 -1.28 118.68 120.57 3hqp s LEU 82 Ca 0.01 -0.49 -0.16 0.00 0.69 0.00 0.00 54.13 54.18 3hqp s LEU 82 Cb -0.13 -2.01 0.01 0.00 -0.43 0.00 0.00 46.19 43.62 3hqp s LEU 82 CO 0.03 -0.19 0.36 -0.62 -0.29 0.00 0.00 176.35 175.64 3hqp s ASP 83 N 1.63 6.15 0.92 3.68 -1.08 0.71 0.19 116.67 128.87 3hqp s ASP 83 Ca 0.05 -0.56 -0.12 0.00 -0.52 0.00 0.00 52.55 51.40 3hqp s ASP 83 Cb -0.17 -2.19 0.14 0.00 -1.46 0.00 0.00 42.92 39.24 3hqp s ASP 83 CO 0.07 -0.43 1.10 0.42 0.52 0.00 0.00 175.17 176.84 3hqp s THR 84 N 1.94 2.48 -0.02 1.71 -4.23 -0.61 0.01 115.64 116.91 3hqp s THR 84 Ca 0.10 0.16 -0.21 0.00 -1.18 0.00 0.00 61.69 60.55 3hqp s THR 84 Cb -0.17 -2.68 -0.13 0.00 1.34 0.00 0.00 72.50 70.85 3hqp s THR 84 CO 0.12 -0.20 0.94 0.11 -0.54 0.00 0.00 174.62 175.05 3hqp h LYS 85 N -1.61 -0.50 0.00 3.99 1.57 -1.91 -3.41 116.57 114.70 3hqp h LYS 85 Ca -0.51 0.03 0.09 0.00 -1.87 0.00 0.00 60.65 58.39 3hqp h LYS 85 Cb 1.30 0.11 -0.02 0.00 0.08 0.00 0.00 32.23 33.70 3hqp h LYS 85 CO 0.56 -0.21 -0.11 0.41 -0.57 0.00 0.00 179.45 179.53 3hqp n GLY 86 N 0.04 -1.92 3.02 3.86 0.00 -1.26 -4.32 105.19 104.61 3hqp n GLY 86 Ca -0.09 -1.33 -0.41 0.00 0.00 0.00 0.00 46.02 44.19 3hqp n GLY 86 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3hqp n PRO 87 N -1.61 1.65 -4.32 1.61 -0.02 -1.26 -4.89 135.00 126.16 3hqp n PRO 87 Ca 0.00 -1.85 -0.24 0.00 -2.02 0.00 0.00 63.50 59.39 3hqp n PRO 87 Cb 0.14 -2.89 -0.08 0.00 -0.02 0.00 0.00 33.50 30.65 3hqp n PRO 87 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 3hqp s GLU 88 N 4.71 2.11 -0.06 -0.52 -1.05 -1.26 -4.99 118.70 117.65 3hqp s GLU 88 Ca 0.55 -1.66 0.04 0.00 -0.15 0.00 0.00 54.97 53.75 3hqp s GLU 88 Cb 0.14 -1.99 -0.02 0.00 -0.44 0.00 0.00 34.13 31.82 3hqp s GLU 88 CO 0.09 0.20 -0.16 0.42 0.95 0.00 0.00 175.26 176.76 3hqp s ILE 89 N -2.47 2.87 0.14 1.83 1.01 -1.26 -4.94 121.20 118.38 3hqp s ILE 89 Ca 0.34 -0.79 0.05 0.00 0.00 0.00 0.00 60.65 60.25 3hqp s ILE 89 Cb -0.02 -2.12 -0.04 0.00 0.01 0.00 0.00 42.46 40.29 3hqp s ILE 89 CO 0.19 0.58 -0.12 -0.13 0.00 0.00 0.00 174.94 175.47 3hqp s ARG 90 N -0.53 1.05 0.70 2.79 1.81 -1.26 -1.47 118.95 122.05 3hqp s ARG 90 Ca 0.07 -1.37 -0.07 0.00 -1.72 0.00 0.00 55.73 52.64 3hqp s ARG 90 Cb -0.11 -0.74 0.06 0.00 -0.45 0.00 0.00 34.95 33.70 3hqp s ARG 90 CO 0.01 0.12 1.01 0.95 -0.68 0.00 0.00 175.30 176.71 3hqp s THR 91 N -2.85 2.28 0.00 0.02 -4.23 0.58 -1.50 115.64 109.95 3hqp s THR 91 Ca 0.14 -0.27 0.00 0.00 -1.18 0.00 0.00 61.69 60.38 3hqp s THR 91 Cb -0.01 -3.00 0.00 0.00 1.34 0.00 0.00 72.50 70.83 3hqp s THR 91 CO 0.02 -0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.71 3hqp n GLY 92 N -2.92 -0.90 3.93 3.99 0.00 0.11 -3.84 105.19 105.57 3hqp n GLY 92 Ca 0.08 -1.65 -0.25 0.00 0.00 0.00 0.00 46.02 44.21 3hqp n GLY 92 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hqp s GLN 93 N -1.17 3.51 0.02 1.61 -0.21 0.22 -2.40 119.66 121.25 3hqp s GLN 93 Ca 0.00 -0.23 0.09 0.00 0.02 0.00 0.00 55.36 55.24 3hqp s GLN 93 Cb 0.00 -2.63 -0.03 0.00 1.00 0.00 0.00 33.01 31.35 3hqp s GLN 93 CO 0.00 0.12 -0.26 -0.06 -2.12 0.00 0.00 175.29 172.97 3hqp s PHE 94 N -2.33 2.30 0.09 0.91 0.08 -1.26 -1.60 117.98 116.16 3hqp s PHE 94 Ca 0.41 -0.42 -0.31 0.00 0.12 0.00 0.00 56.93 56.73 3hqp s PHE 94 Cb -0.10 -1.41 -0.08 0.00 -0.57 0.00 0.00 43.02 40.86 3hqp s PHE 94 CO 0.36 0.07 1.61 0.08 -0.10 0.00 0.00 175.22 177.24 3hqp s VAL 95 N -0.74 3.00 0.00 -0.44 1.01 0.52 -1.78 120.40 121.98 3hqp s VAL 95 Ca 0.11 0.53 0.00 0.00 0.00 0.00 0.00 61.98 62.62 3hqp s VAL 95 Cb -0.10 -3.34 0.00 0.00 0.00 0.00 0.00 36.38 32.94 3hqp s VAL 95 CO 0.01 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.73 3hqp n GLY 96 N 3.90 0.78 0.51 4.51 0.00 -1.26 -4.16 105.19 109.47 3hqp n GLY 96 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 3hqp n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hqp n GLY 97 N -2.21 3.11 3.71 -0.02 0.00 -0.73 -5.00 105.19 104.05 3hqp n GLY 97 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 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 0.22 -0.21 -0.00 1.61 3.84 -1.26 -3.00 116.67 117.87 3hqp s ASP 98 Ca 0.00 -0.69 0.04 0.00 -0.00 0.00 0.00 52.55 51.90 3hqp s ASP 98 Cb 0.00 0.66 -0.01 0.00 -1.38 0.00 0.00 42.92 42.18 3hqp s ASP 98 CO 0.00 -1.23 -0.13 0.00 -0.00 0.00 0.00 175.17 173.81 3hqp s ALA 99 N -3.94 1.08 -0.50 2.11 0.00 -0.06 -4.66 121.76 115.80 3hqp s ALA 99 Ca 0.14 -0.60 -0.17 0.00 0.00 0.00 0.00 51.96 51.34 3hqp s ALA 99 Cb -0.03 -0.26 0.08 0.00 0.00 0.00 0.00 23.12 22.91 3hqp s ALA 99 CO 0.06 0.26 0.49 0.08 0.00 0.00 0.00 175.76 176.65 3hqp s VAL 100 N -0.39 5.10 -0.04 0.00 1.01 -1.26 -1.58 120.40 123.24 3hqp s VAL 100 Ca 0.04 -0.95 -0.19 0.00 0.00 0.00 0.00 61.98 60.88 3hqp s VAL 100 Cb -0.05 -4.22 -0.05 0.00 0.00 0.00 0.00 36.38 32.05 3hqp s VAL 100 CO -0.00 -0.71 0.55 -0.04 0.00 0.00 0.00 175.10 174.89 3hqp s MET 101 N 1.99 4.29 -0.10 2.72 -1.94 -0.45 -4.84 119.30 120.98 3hqp s MET 101 Ca 0.07 0.62 0.02 0.00 -1.71 0.00 0.00 55.69 54.70 3hqp s MET 101 Cb -0.24 -3.37 0.01 0.00 2.01 0.00 0.00 34.83 33.25 3hqp s MET 101 CO 0.08 0.31 -0.17 -1.21 -0.01 0.00 0.00 175.02 174.02 3hqp s GLU 102 N 0.05 2.33 -0.25 2.03 2.02 -1.26 -1.15 118.70 122.46 3hqp s GLU 102 Ca 0.29 -0.62 -0.43 0.00 0.02 0.00 0.00 54.97 54.24 3hqp s GLU 102 Cb -0.17 -1.89 -0.19 0.00 0.10 0.00 0.00 34.13 31.98 3hqp s GLU 102 CO 0.15 0.03 1.31 -2.13 0.02 0.00 0.00 175.26 174.63 3hqp n ARG 103 N 3.91 0.00 -0.80 1.61 0.63 -1.25 -1.36 116.66 119.40 3hqp n ARG 103 Ca -0.20 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.73 3hqp n ARG 103 Cb 0.52 -1.46 0.00 0.00 0.45 0.00 0.00 32.46 31.97 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 2.73 0.59 3.99 5.14 0.00 0.13 -4.92 105.19 112.85 3hqp n GLY 104 Ca 0.25 -0.06 -0.21 0.00 0.00 0.00 0.00 46.02 46.00 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 -2.00 4.00 -0.24 4.61 0.00 -0.47 -4.89 121.76 122.78 3hqp s ALA 105 Ca 0.00 -1.53 0.00 0.00 0.00 0.00 0.00 51.96 50.43 3hqp s ALA 105 Cb 0.00 -1.95 0.07 0.00 0.00 0.00 0.00 23.12 21.23 3hqp s ALA 105 CO 0.00 -0.86 -0.02 -0.08 0.00 0.00 0.00 175.76 174.79 3hqp s THR 106 N -2.79 1.43 0.50 0.00 -1.32 -1.26 -1.04 115.64 111.16 3hqp s THR 106 Ca 0.59 -1.25 0.07 0.00 -1.21 0.00 0.00 61.69 59.89 3hqp s THR 106 Cb -0.09 -1.77 0.02 0.00 -1.51 0.00 0.00 72.50 69.15 3hqp s THR 106 CO 0.39 -0.19 0.42 0.00 -2.21 0.00 0.00 174.62 173.03 3hqp s TYR 108 N -2.67 1.03 -0.15 0.00 2.02 0.11 -1.51 117.35 116.18 3hqp s TYR 108 Ca 0.41 -0.41 -0.07 0.00 -0.37 0.00 0.00 57.07 56.63 3hqp s TYR 108 Cb -0.02 -0.97 -0.04 0.00 -0.40 0.00 0.00 41.96 40.52 3hqp s TYR 108 CO 0.25 -0.39 0.10 0.14 -1.57 0.00 0.00 175.55 174.08 3hqp s VAL 109 N 1.73 5.13 0.12 0.71 -7.23 -0.98 -1.44 120.40 118.44 3hqp s VAL 109 Ca 0.03 0.08 0.07 0.00 -1.81 0.00 0.00 61.98 60.34 3hqp s VAL 109 Cb -0.13 -3.27 -0.04 0.00 0.56 0.00 0.00 36.38 33.50 3hqp s VAL 109 CO -0.06 0.53 -0.16 0.28 -0.31 0.00 0.00 175.10 175.39 3hqp s THR 110 N -0.30 1.48 -1.01 5.32 -1.32 -0.16 -1.06 115.64 118.59 3hqp s THR 110 Ca 0.10 -1.69 0.21 0.00 -1.21 0.00 0.00 61.69 59.10 3hqp s THR 110 Cb -0.12 -1.56 -0.21 0.00 -1.51 0.00 0.00 72.50 69.11 3hqp s THR 110 CO 0.01 -0.32 0.95 0.41 -2.21 0.00 0.00 174.62 173.46 3hqp n THR 111 N 0.64 0.00 -2.12 5.08 -1.04 -0.87 -1.19 114.28 114.78 3hqp n THR 111 Ca -0.16 -0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.42 3hqp n THR 111 Cb 0.56 0.94 -0.03 0.00 -1.82 0.00 0.00 70.33 69.98 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 -2.99 6.55 0.53 8.00 2.15 -1.26 -4.91 116.67 124.74 3hqp s ASP 112 Ca 0.08 1.85 0.34 0.00 0.43 0.00 0.00 52.55 55.25 3hqp s ASP 112 Cb 0.16 -2.53 1.46 0.00 -0.30 0.00 0.00 42.92 41.71 3hqp s ASP 112 CO 0.85 -1.08 2.00 -0.65 -0.17 0.00 0.00 175.17 176.13 3hqp h PRO 113 N 9.98 0.00 0.00 4.34 0.11 -1.95 -2.86 132.00 141.61 3hqp h PRO 113 Ca -0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.76 3hqp h PRO 113 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3hqp h PRO 113 CO 0.98 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.77 3hqp n ALA 114 N -2.05 1.55 -0.75 -0.75 0.00 -1.26 -1.95 120.51 115.30 3hqp n ALA 114 Ca 0.00 -0.04 0.08 0.00 0.00 0.00 0.00 53.44 53.48 3hqp n ALA 114 Cb 0.26 -1.19 0.35 0.00 0.00 0.00 0.00 19.45 18.88 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 -1.48 1.58 0.16 0.00 3.01 -1.08 -4.58 117.46 115.07 3hqp n PHE 115 Ca 0.03 -0.68 0.04 0.00 1.01 0.00 0.00 57.45 57.85 3hqp n PHE 115 Cb 0.13 -0.34 0.10 0.00 -0.01 0.00 0.00 39.48 39.36 3hqp n PHE 115 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3hqp h ALA 116 N 3.69 0.75 -0.01 4.37 0.00 -1.60 -3.30 119.26 123.15 3hqp h ALA 116 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.52 3hqp h ALA 116 Cb 1.60 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.33 3hqp h ALA 116 CO 0.31 0.53 -0.12 -0.40 0.00 0.00 0.00 179.25 179.58 3hqp n ASP 117 N -3.25 1.63 -2.42 0.00 5.75 -1.26 0.72 116.55 117.71 3hqp n ASP 117 Ca 0.02 -1.31 -0.12 0.00 -0.01 0.00 0.00 54.79 53.36 3hqp n ASP 117 Cb 0.68 0.24 0.03 0.00 -1.03 0.00 0.00 41.12 41.04 3hqp n ASP 117 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 3hqp n LYS 118 N 0.21 2.69 -2.70 0.11 2.85 -1.24 -4.56 118.16 115.51 3hqp n LYS 118 Ca 0.06 -3.85 -0.36 0.00 -1.05 0.00 0.00 58.31 53.11 3hqp n LYS 118 Cb 0.26 -1.95 -0.06 0.00 -0.65 0.00 0.00 35.03 32.64 3hqp n LYS 118 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 3hqp s GLY 119 N -3.69 2.68 0.18 2.58 0.00 -0.63 -4.75 107.32 103.69 3hqp s GLY 119 Ca 0.39 0.56 0.02 0.00 0.00 0.00 0.00 44.72 45.69 3hqp s GLY 119 CO -0.00 0.96 0.08 -1.30 0.00 0.00 0.00 173.10 172.84 3hqp n THR 120 N 0.04 0.00 0.42 0.90 -2.24 0.24 -0.35 114.28 113.30 3hqp n THR 120 Ca 0.04 -1.09 0.12 0.00 -2.27 0.00 0.00 64.05 60.85 3hqp n THR 120 Cb 0.51 0.42 0.47 0.00 -2.10 0.00 0.00 70.33 69.63 3hqp n THR 120 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 3hqp n LYS 121 N -0.39 0.18 -0.09 -0.78 2.85 -1.26 -3.51 118.16 115.16 3hqp n LYS 121 Ca -0.01 0.39 -0.15 0.00 -1.05 0.00 0.00 58.31 57.49 3hqp n LYS 121 Cb 0.28 -1.84 -0.14 0.00 -0.65 0.00 0.00 35.03 32.69 3hqp n LYS 121 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 3hqp n ASP 122 N -2.18 1.32 -3.70 -5.58 8.00 -1.26 -4.58 116.55 108.58 3hqp n ASP 122 Ca 0.02 -0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.41 3hqp n ASP 122 Cb 0.24 -0.02 -0.12 0.00 -0.02 0.00 0.00 41.12 41.20 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 -2.52 0.28 0.19 -1.24 2.20 -1.23 0.06 119.74 117.48 3hqp s LYS 123 Ca -0.23 0.72 -0.10 0.00 -0.36 0.00 0.00 55.97 56.00 3hqp s LYS 123 Cb 0.08 -0.02 -0.01 0.00 -1.51 0.00 0.00 37.83 36.37 3hqp s LYS 123 CO 0.71 -0.19 0.35 -0.59 -0.36 0.00 0.00 175.35 175.27 3hqp s PHE 124 N 1.65 0.38 0.06 4.03 -0.71 -0.52 -0.59 117.98 122.28 3hqp s PHE 124 Ca -0.07 -0.73 -0.07 0.00 -1.04 0.00 0.00 56.93 55.02 3hqp s PHE 124 Cb -0.10 0.02 -0.05 0.00 -1.21 0.00 0.00 43.02 41.68 3hqp s PHE 124 CO -0.11 -0.80 0.33 -0.47 -1.34 0.00 0.00 175.22 172.83 3hqp s TYR 125 N -3.98 3.56 -0.06 3.49 5.04 -1.25 -0.98 117.35 123.16 3hqp s TYR 125 Ca 0.19 0.62 0.02 0.00 -2.44 0.00 0.00 57.07 55.46 3hqp s TYR 125 Cb 0.02 -2.04 0.02 0.00 0.35 0.00 0.00 41.96 40.31 3hqp s TYR 125 CO 0.03 0.55 -0.09 0.42 -1.34 0.00 0.00 175.55 175.11 3hqp s ILE 126 N -1.41 0.92 -0.99 3.14 1.01 -0.33 0.09 121.20 123.62 3hqp s ILE 126 Ca 0.32 -0.34 0.23 0.00 0.00 0.00 0.00 60.65 60.87 3hqp s ILE 126 Cb -0.13 -0.87 0.19 0.00 0.01 0.00 0.00 42.46 41.66 3hqp s ILE 126 CO 0.19 0.31 1.75 -0.90 0.00 0.00 0.00 174.94 176.29 3hqp n ASP 127 N 3.96 0.01 -4.61 3.58 5.68 -0.56 -4.48 116.55 120.14 3hqp n ASP 127 Ca -0.23 0.50 -0.43 0.00 -0.50 0.00 0.00 54.79 54.13 3hqp n ASP 127 Cb 0.51 -0.51 -0.02 0.00 -1.14 0.00 0.00 41.12 39.97 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 -3.00 2.48 0.12 2.11 5.04 -1.26 -4.90 117.35 117.93 3hqp s TYR 128 Ca 0.11 0.71 0.27 0.00 -2.44 0.00 0.00 57.07 55.72 3hqp s TYR 128 Cb 0.15 -4.25 1.06 0.00 0.35 0.00 0.00 41.96 39.27 3hqp s TYR 128 CO 0.43 -1.88 1.88 1.96 -1.34 0.00 0.00 175.55 176.60 3hqp h GLN 129 N 10.32 0.00 -1.54 4.97 1.08 -1.93 -2.83 115.11 125.18 3hqp h GLN 129 Ca -0.27 0.00 -0.63 0.00 -1.45 0.00 0.00 58.65 56.30 3hqp h GLN 129 Cb 1.10 0.00 -0.39 0.00 -0.05 0.00 0.00 27.48 28.14 3hqp h GLN 129 CO 1.08 0.15 -0.32 0.27 -0.95 0.00 0.00 178.83 179.05 3hqp n ASN 130 N -3.30 5.39 0.03 1.46 6.94 -1.26 -4.76 115.26 119.76 3hqp n ASN 130 Ca 0.00 -3.75 -0.02 0.00 -0.02 0.00 0.00 54.58 50.80 3hqp n ASN 130 Cb 0.39 -0.59 0.25 0.00 -2.36 0.00 0.00 39.78 37.47 3hqp n ASN 130 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 3hqp h LEU 131 N 2.62 0.44 -0.54 -4.53 5.85 -1.90 -3.26 115.31 113.98 3hqp h LEU 131 Ca 0.37 -0.12 -0.10 0.00 0.84 0.00 0.00 57.88 58.87 3hqp h LEU 131 Cb 0.78 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.68 3hqp h LEU 131 CO 0.98 0.63 -0.05 0.28 -0.34 0.00 0.00 178.44 179.95 3hqp h SER 132 N 0.41 0.98 -0.36 1.25 0.02 -1.87 -2.75 113.55 111.22 3hqp h SER 132 Ca 0.07 -0.33 -0.11 0.00 -0.84 0.00 0.00 61.79 60.58 3hqp h SER 132 Cb 0.55 -0.26 -0.07 0.00 0.14 0.00 0.00 62.40 62.76 3hqp h SER 132 CO 0.04 1.07 0.14 0.29 -1.14 0.00 0.00 176.83 177.23 3hqp n LYS 133 N -4.22 2.24 0.00 3.45 5.02 -1.23 -3.92 118.16 119.50 3hqp n LYS 133 Ca 0.01 -1.43 0.00 0.00 -2.02 0.00 0.00 58.31 54.87 3hqp n LYS 133 Cb 0.36 -1.71 0.00 0.00 -0.02 0.00 0.00 35.03 33.66 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 0.03 0.00 -4.52 -0.18 0.31 -1.06 -5.06 118.33 107.85 3hqp n VAL 134 Ca 0.20 0.00 -0.34 0.00 -0.01 0.00 0.00 64.34 64.19 3hqp n VAL 134 Cb 0.86 -0.44 -0.12 0.00 -0.91 0.00 0.00 33.84 33.22 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 -1.78 3.67 0.37 2.52 -7.23 -1.06 -5.09 120.40 111.80 3hqp s VAL 135 Ca 0.00 -0.44 -0.05 0.00 -1.81 0.00 0.00 61.98 59.68 3hqp s VAL 135 Cb 0.00 -2.58 -0.05 0.00 0.56 0.00 0.00 36.38 34.31 3hqp s VAL 135 CO 0.00 0.52 0.65 -0.13 -0.31 0.00 0.00 175.10 175.83 3hqp s ARG 136 N 0.18 3.60 0.02 4.82 0.52 -1.26 -4.87 118.95 121.95 3hqp s ARG 136 Ca -0.03 0.06 -0.32 0.00 -0.52 0.00 0.00 55.73 54.92 3hqp s ARG 136 Cb -0.14 -2.53 -0.11 0.00 0.52 0.00 0.00 34.95 32.68 3hqp s ARG 136 CO 0.03 0.04 1.86 -2.30 0.02 0.00 0.00 175.30 174.96 3hqp n PRO 137 N -1.53 2.48 0.00 3.54 -0.02 -1.26 -1.88 135.00 136.32 3hqp n PRO 137 Ca -0.01 0.91 0.00 0.00 -2.02 0.00 0.00 63.50 62.38 3hqp n PRO 137 Cb 0.55 -2.78 0.00 0.00 -0.02 0.00 0.00 33.50 31.24 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 4.30 1.35 3.77 -1.23 0.00 0.79 -4.96 105.19 109.20 3hqp n GLY 138 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.00 4.44 -0.13 1.61 0.02 -0.79 -4.64 114.94 114.45 3hqp s ASN 139 Ca 0.00 1.76 -0.05 0.00 -1.02 0.00 0.00 52.86 53.55 3hqp s ASN 139 Cb 0.00 -2.47 -0.04 0.00 0.02 0.00 0.00 41.25 38.76 3hqp s ASN 139 CO 0.00 -2.07 0.07 -0.31 0.02 0.00 0.00 177.10 174.81 3hqp s TYR 140 N -2.92 3.34 -0.19 2.20 2.02 -1.26 -1.88 117.35 118.65 3hqp s TYR 140 Ca 0.61 0.27 -0.05 0.00 -0.37 0.00 0.00 57.07 57.54 3hqp s TYR 140 Cb -0.17 -1.92 -0.03 0.00 -0.40 0.00 0.00 41.96 39.44 3hqp s TYR 140 CO 0.56 0.47 0.00 0.42 -1.57 0.00 0.00 175.55 175.43 3hqp s ILE 141 N -0.57 4.08 -0.20 2.71 1.01 0.76 -4.93 121.20 124.07 3hqp s ILE 141 Ca 0.11 -0.28 -0.09 0.00 0.00 0.00 0.00 60.65 60.39 3hqp s ILE 141 Cb -0.12 -2.83 -0.05 0.00 0.01 0.00 0.00 42.46 39.47 3hqp s ILE 141 CO 0.02 0.45 0.11 -0.31 0.00 0.00 0.00 174.94 175.21 3hqp s TYR 142 N 0.75 3.35 -0.03 3.97 1.51 -1.15 -0.53 117.35 125.22 3hqp s TYR 142 Ca 0.00 0.23 0.04 0.00 -1.01 0.00 0.00 57.07 56.33 3hqp s TYR 142 Cb -0.14 -2.15 -0.00 0.00 -0.11 0.00 0.00 41.96 39.55 3hqp s TYR 142 CO 0.02 0.21 -0.14 0.42 -1.11 0.00 0.00 175.55 174.96 3hqp s ILE 143 N 0.47 1.12 -0.65 2.71 -1.09 0.17 -1.37 121.20 122.56 3hqp s ILE 143 Ca 0.07 -0.56 -0.03 0.00 -2.23 0.00 0.00 60.65 57.90 3hqp s ILE 143 Cb -0.12 -0.96 -0.03 0.00 -1.58 0.00 0.00 42.46 39.77 3hqp s ILE 143 CO -0.00 0.33 0.56 -0.67 -1.23 0.00 0.00 174.94 173.93 3hqp n ASP 144 N 3.08 -4.01 -3.79 3.58 2.03 0.07 -0.75 116.55 116.77 3hqp n ASP 144 Ca -0.17 -0.41 -0.27 0.00 0.52 0.00 0.00 54.79 54.46 3hqp n ASP 144 Cb 0.54 -3.31 0.05 0.00 -0.72 0.00 0.00 41.12 37.68 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 -2.46 -5.10 -0.25 1.67 8.00 -1.26 -2.46 116.55 114.69 3hqp n ASP 145 Ca -0.08 -0.70 -0.03 0.00 0.71 0.00 0.00 54.79 54.69 3hqp n ASP 145 Cb 0.58 -4.32 -0.01 0.00 -0.02 0.00 0.00 41.12 37.35 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 -1.79 0.55 0.13 0.44 0.00 -1.19 -4.76 105.19 98.57 3hqp n GLY 146 Ca 0.01 -0.18 -0.13 0.00 0.00 0.00 0.00 46.02 45.72 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 1.33 -3.25 -0.61 2.04 -1.14 -3.43 117.51 112.45 3hqp h ILE 147 Ca -0.07 -1.20 -0.61 0.00 1.00 0.00 0.00 64.86 63.98 3hqp h ILE 147 Cb 0.55 1.77 -0.13 0.00 -0.74 0.00 0.00 36.82 38.27 3hqp h ILE 147 CO 0.10 0.36 -0.51 -0.22 0.00 0.00 0.00 178.15 177.87 3hqp s LEU 148 N -9.19 4.10 -0.14 1.44 2.96 0.08 -4.99 118.68 112.93 3hqp s LEU 148 Ca -0.14 0.19 0.00 0.00 -0.22 0.00 0.00 54.13 53.97 3hqp s LEU 148 Cb 0.06 -2.05 -0.01 0.00 0.50 0.00 0.00 46.19 44.69 3hqp s LEU 148 CO 0.75 0.19 -0.14 -0.63 -1.32 0.00 0.00 176.35 175.19 3hqp s ILE 149 N 0.31 2.82 -0.01 6.68 1.01 -1.26 0.42 121.20 131.17 3hqp s ILE 149 Ca 0.07 -0.73 0.00 0.00 0.00 0.00 0.00 60.65 59.99 3hqp s ILE 149 Cb -0.11 -2.19 -0.04 0.00 0.01 0.00 0.00 42.46 40.13 3hqp s ILE 149 CO -0.01 0.52 0.04 -0.76 0.00 0.00 0.00 174.94 174.73 3hqp s LEU 150 N 0.59 3.71 -0.20 2.97 1.43 0.30 -2.55 118.68 124.93 3hqp s LEU 150 Ca -0.09 0.08 -0.02 0.00 -1.03 0.00 0.00 54.13 53.08 3hqp s LEU 150 Cb -0.16 -2.11 0.00 0.00 0.03 0.00 0.00 46.19 43.95 3hqp s LEU 150 CO 0.03 0.29 -0.11 -1.58 0.23 0.00 0.00 176.35 175.21 3hqp s GLN 151 N -1.57 3.23 0.19 1.70 0.74 -0.04 -0.17 119.66 123.75 3hqp s GLN 151 Ca 0.20 -0.71 -0.31 0.00 0.05 0.00 0.00 55.36 54.59 3hqp s GLN 151 Cb -0.12 -2.82 -0.10 0.00 1.10 0.00 0.00 33.01 31.07 3hqp s GLN 151 CO 0.11 -0.18 1.57 0.08 -0.55 0.00 0.00 175.29 176.32 3hqp s VAL 152 N 1.35 2.51 -0.19 1.34 1.01 -0.79 -0.11 120.40 125.53 3hqp s VAL 152 Ca 0.05 0.38 -0.02 0.00 0.00 0.00 0.00 61.98 62.38 3hqp s VAL 152 Cb -0.14 -3.24 -0.11 0.00 0.00 0.00 0.00 36.38 32.89 3hqp s VAL 152 CO -0.07 0.04 -0.19 0.00 0.00 0.00 0.00 175.10 174.88 3hqp n GLN 153 N 3.57 0.44 -3.81 2.72 1.13 0.12 -0.15 117.38 121.40 3hqp n GLN 153 Ca 0.13 0.13 -0.04 0.00 -1.94 0.00 0.00 57.00 55.28 3hqp n GLN 153 Cb 0.38 -1.31 0.00 0.00 0.11 0.00 0.00 30.24 29.43 3hqp n GLN 153 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 3hqp s SER 154 N -6.12 -0.08 -0.19 1.08 1.04 -1.16 -4.73 113.70 103.53 3hqp s SER 154 Ca -0.26 -0.58 -0.16 0.00 0.48 0.00 0.00 55.95 55.44 3hqp s SER 154 Cb 0.08 0.52 -0.04 0.00 0.10 0.00 0.00 66.02 66.68 3hqp s SER 154 CO 0.40 -1.00 0.38 -1.00 0.98 0.00 0.00 173.24 173.00 3hqp s HIS 155 N -2.73 3.39 -0.06 5.02 3.76 -1.26 -1.61 115.29 121.80 3hqp s HIS 155 Ca 0.17 0.62 -0.01 0.00 -0.15 0.00 0.00 55.06 55.68 3hqp s HIS 155 Cb -0.02 -2.50 -0.01 0.00 1.11 0.00 0.00 32.58 31.16 3hqp s HIS 155 CO 0.04 0.04 0.08 0.93 -0.85 0.00 0.00 174.74 174.98 3hqp h GLU 156 N 7.24 -0.05 0.00 1.40 4.39 -1.77 -3.47 114.58 122.31 3hqp h GLU 156 Ca -0.37 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.33 3hqp h GLU 156 Cb 1.16 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.83 3hqp h GLU 156 CO 0.72 -0.03 0.00 -0.40 -1.16 0.00 0.00 179.01 178.14 3hqp n ASP 157 N -4.00 0.07 0.00 1.42 3.85 -1.19 -4.99 116.55 111.71 3hqp n ASP 157 Ca -0.01 -0.31 0.09 0.00 -0.71 0.00 0.00 54.79 53.86 3hqp n ASP 157 Cb 0.02 0.00 0.50 0.00 -1.35 0.00 0.00 41.12 40.29 3hqp n ASP 157 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.20 177.40 3hqp n GLU 158 N 0.00 0.38 0.00 0.11 2.13 -1.26 -3.70 120.64 118.30 3hqp n GLU 158 Ca 0.00 0.07 0.00 0.00 0.66 0.00 0.00 57.16 57.89 3hqp n GLU 158 Cb 0.00 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.21 3hqp n GLU 158 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 3hqp n GLN 159 N -1.18 1.81 -4.19 5.31 6.02 -1.26 -4.83 117.38 119.05 3hqp n GLN 159 Ca 0.11 0.00 -0.34 0.00 -0.01 0.00 0.00 57.00 56.75 3hqp n GLN 159 Cb 0.12 -0.89 -0.08 0.00 1.02 0.00 0.00 30.24 30.41 3hqp n GLN 159 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 3hqp s THR 160 N -1.78 4.63 -0.04 5.09 2.01 -1.24 -2.05 115.64 122.26 3hqp s THR 160 Ca 0.00 -0.26 0.06 0.00 0.31 0.00 0.00 61.69 61.80 3hqp s THR 160 Cb 0.00 -3.03 -0.01 0.00 0.01 0.00 0.00 72.50 69.47 3hqp s THR 160 CO 0.00 0.50 -0.24 -0.76 -0.69 0.00 0.00 174.62 173.43 3hqp s LEU 161 N -1.26 2.04 -0.30 4.42 1.43 -0.23 -2.08 118.68 122.70 3hqp s LEU 161 Ca 0.17 -0.46 -0.22 0.00 -1.03 0.00 0.00 54.13 52.59 3hqp s LEU 161 Cb -0.12 -1.27 -0.01 0.00 0.03 0.00 0.00 46.19 44.83 3hqp s LEU 161 CO 0.07 0.25 0.71 -0.70 0.23 0.00 0.00 176.35 176.91 3hqp s GLU 162 N -0.25 3.97 0.09 1.70 2.12 -0.63 -2.32 118.70 123.37 3hqp s GLU 162 Ca 0.00 0.49 0.07 0.00 0.36 0.00 0.00 54.97 55.89 3hqp s GLU 162 Cb -0.12 -3.71 -0.03 0.00 0.26 0.00 0.00 34.13 30.52 3hqp s GLU 162 CO 0.02 -0.60 -0.17 0.00 -0.54 0.00 0.00 175.26 173.97 3hqp s THR 164 N -1.21 5.35 -0.49 0.00 2.01 0.84 -1.44 115.64 120.70 3hqp s THR 164 Ca 0.02 0.41 -0.26 0.00 0.31 0.00 0.00 61.69 62.18 3hqp s THR 164 Cb -0.10 -3.55 0.03 0.00 0.01 0.00 0.00 72.50 68.89 3hqp s THR 164 CO 0.03 0.47 0.96 -0.69 -0.69 0.00 0.00 174.62 174.70 3hqp s VAL 165 N 0.00 4.41 -0.58 3.82 1.01 -0.21 -0.86 120.40 127.99 3hqp s VAL 165 Ca 0.14 0.69 0.25 0.00 0.00 0.00 0.00 61.98 63.06 3hqp s VAL 165 Cb -0.13 -4.48 0.27 0.00 0.00 0.00 0.00 36.38 32.03 3hqp s VAL 165 CO 0.03 -0.93 1.62 0.71 0.00 0.00 0.00 175.10 176.53 3hqp h THR 166 N 6.09 0.00 -2.86 3.92 1.35 -1.81 0.38 112.91 119.98 3hqp h THR 166 Ca -0.24 -0.71 -0.10 0.00 -0.55 0.00 0.00 66.41 64.80 3hqp h THR 166 Cb 1.07 1.64 -0.19 0.00 -1.73 0.00 0.00 68.15 68.93 3hqp h THR 166 CO 1.06 0.00 -0.18 0.54 -0.25 0.00 0.00 175.52 176.69 3hqp s ASN 167 N -5.19 -0.28 -0.11 5.36 2.20 -1.26 -4.68 114.94 110.98 3hqp s ASN 167 Ca 0.08 0.18 -0.30 0.00 -0.94 0.00 0.00 52.86 51.89 3hqp s ASN 167 Cb 0.09 0.36 -0.01 0.00 -2.00 0.00 0.00 41.25 39.69 3hqp s ASN 167 CO 0.65 -0.50 1.05 -0.44 -2.94 0.00 0.00 177.10 174.92 3hqp s SER 168 N -1.39 7.18 -0.17 3.54 0.01 -1.26 -3.90 113.70 117.71 3hqp s SER 168 Ca -0.12 1.57 -0.28 0.00 1.31 0.00 0.00 55.95 58.43 3hqp s SER 168 Cb -0.04 -2.55 0.08 0.00 0.21 0.00 0.00 66.02 63.72 3hqp s SER 168 CO 0.04 -0.51 0.75 -2.28 0.41 0.00 0.00 173.24 171.66 3hqp s HIS 169 N 2.25 -0.68 -0.26 2.43 5.04 -0.30 -4.90 115.29 118.87 3hqp s HIS 169 Ca 0.49 1.43 -0.11 0.00 -1.54 0.00 0.00 55.06 55.34 3hqp s HIS 169 Cb -0.19 0.35 -0.05 0.00 0.04 0.00 0.00 32.58 32.73 3hqp s HIS 169 CO 0.17 -0.46 0.17 0.99 -2.34 0.00 0.00 174.74 173.28 3hqp s THR 170 N -0.39 5.29 -0.05 0.89 2.01 -1.26 -1.34 115.64 120.78 3hqp s THR 170 Ca -0.04 0.16 -0.00 0.00 0.31 0.00 0.00 61.69 62.11 3hqp s THR 170 Cb -0.03 -3.50 -0.03 0.00 0.01 0.00 0.00 72.50 68.95 3hqp s THR 170 CO 0.04 0.29 -0.01 0.27 -0.69 0.00 0.00 174.62 174.52 3hqp s ILE 171 N 1.48 4.12 0.54 1.82 -4.36 -0.61 -4.97 121.20 119.23 3hqp s ILE 171 Ca 0.07 -0.42 0.07 0.00 -0.26 0.00 0.00 60.65 60.11 3hqp s ILE 171 Cb -0.15 -2.76 0.05 0.00 1.25 0.00 0.00 42.46 40.85 3hqp s ILE 171 CO 0.08 0.52 0.54 -0.44 0.24 0.00 0.00 174.94 175.89 3hqp s SER 172 N -1.10 4.85 0.29 4.36 0.01 -1.26 -0.88 113.70 119.97 3hqp s SER 172 Ca 0.15 -1.05 -0.29 0.00 1.31 0.00 0.00 55.95 56.08 3hqp s SER 172 Cb -0.11 0.27 -0.13 0.00 0.21 0.00 0.00 66.02 66.25 3hqp s SER 172 CO 0.05 -1.14 1.17 0.47 0.41 0.00 0.00 173.24 174.20 3hqp n ASP 173 N -1.92 2.03 -3.36 2.44 9.92 -1.16 -3.69 116.55 120.81 3hqp n ASP 173 Ca 0.05 1.18 -0.17 0.00 -0.53 0.00 0.00 54.79 55.33 3hqp n ASP 173 Cb 0.63 -1.37 0.04 0.00 -0.64 0.00 0.00 41.12 39.78 3hqp n ASP 173 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 3hqp n ARG 174 N 0.89 -1.71 -3.07 -1.24 1.74 -1.01 -4.98 116.66 107.29 3hqp n ARG 174 Ca 0.08 0.89 -0.39 0.00 -0.77 0.00 0.00 57.85 57.66 3hqp n ARG 174 Cb 0.33 -5.14 -0.05 0.00 -1.02 0.00 0.00 32.46 26.58 3hqp n ARG 174 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 3hqp s ARG 175 N -4.56 4.42 0.26 5.56 6.06 -1.24 -4.74 118.95 124.71 3hqp s ARG 175 Ca 0.34 0.86 -0.30 0.00 -2.50 0.00 0.00 55.73 54.13 3hqp s ARG 175 Cb -0.07 -3.42 -0.10 0.00 0.06 0.00 0.00 34.95 31.42 3hqp s ARG 175 CO 0.79 0.14 1.36 0.20 -2.50 0.00 0.00 175.30 175.29 3hqp s GLY 176 N 0.53 2.57 -0.03 8.12 0.00 -1.26 -0.30 107.32 116.94 3hqp s GLY 176 Ca 0.36 1.24 0.07 0.00 0.00 0.00 0.00 44.72 46.39 3hqp s GLY 176 CO 0.18 2.10 -0.24 0.54 0.00 0.00 0.00 173.10 175.69 3hqp s VAL 177 N -0.32 1.90 -0.02 1.40 0.11 -0.54 -0.75 120.40 122.18 3hqp s VAL 177 Ca 0.55 -1.01 0.06 0.00 -2.93 0.00 0.00 61.98 58.65 3hqp s VAL 177 Cb -0.40 -1.59 -0.01 0.00 -1.53 0.00 0.00 36.38 32.85 3hqp s VAL 177 CO 0.45 0.54 -0.19 0.20 -3.33 0.00 0.00 175.10 172.76 3hqp s ASN 178 N -0.42 2.30 -0.64 3.54 0.01 -0.47 -4.25 114.94 115.01 3hqp s ASN 178 Ca 0.05 -0.36 0.05 0.00 -0.71 0.00 0.00 52.86 51.89 3hqp s ASN 178 Cb -0.11 -0.31 0.17 0.00 0.41 0.00 0.00 41.25 41.41 3hqp s ASN 178 CO 0.00 0.23 0.46 -0.76 -1.51 0.00 0.00 177.10 175.53 3hqp s LEU 179 N -0.39 4.12 0.00 0.60 2.01 -1.26 -2.91 118.68 120.85 3hqp s LEU 179 Ca 0.06 -3.70 -0.36 0.00 0.01 0.00 0.00 54.13 50.14 3hqp s LEU 179 Cb -0.08 -1.39 -0.15 0.00 0.01 0.00 0.00 46.19 44.58 3hqp s LEU 179 CO -0.00 -0.10 1.58 -2.65 1.01 0.00 0.00 176.35 176.19 3hqp n PRO 180 N 2.15 1.59 -3.35 1.29 -0.02 -1.26 -2.99 135.00 132.41 3hqp n PRO 180 Ca 0.22 0.58 -0.17 0.00 -2.02 0.00 0.00 63.50 62.11 3hqp n PRO 180 Cb 0.38 -2.30 0.07 0.00 -0.02 0.00 0.00 33.50 31.63 3hqp n PRO 180 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hqp n GLY 181 N 3.43 -0.89 0.00 -1.23 0.00 -1.26 -4.97 105.19 100.26 3hqp n GLY 181 Ca 0.20 0.42 0.00 0.00 0.00 0.00 0.00 46.02 46.65 3hqp n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hqp n ASP 183 N -1.32 -6.61 -4.72 0.00 4.64 -1.26 -4.97 116.55 102.31 3hqp n ASP 183 Ca 0.00 0.02 -0.42 0.00 -1.38 0.00 0.00 54.79 53.01 3hqp n ASP 183 Cb 0.10 -4.42 -0.03 0.00 -1.04 0.00 0.00 41.12 35.72 3hqp n ASP 183 CO 0.00 0.00 0.00 0.68 -0.82 0.00 0.00 177.20 177.06 3hqp s VAL 184 N -2.89 4.37 -1.58 5.18 -7.23 -1.26 -4.94 120.40 112.05 3hqp s VAL 184 Ca 0.03 1.80 -0.10 0.00 -1.81 0.00 0.00 61.98 61.90 3hqp s VAL 184 Cb -0.01 -4.15 -0.05 0.00 0.56 0.00 0.00 36.38 32.72 3hqp s VAL 184 CO 0.59 0.20 2.81 -0.67 -0.31 0.00 0.00 175.10 177.72 3hqp n ASP 185 N 3.41 7.95 -4.55 4.85 2.03 -1.26 -4.91 116.55 124.07 3hqp n ASP 185 Ca 0.06 -2.66 -0.34 0.00 0.52 0.00 0.00 54.79 52.37 3hqp n ASP 185 Cb 0.48 -1.56 -0.11 0.00 -0.72 0.00 0.00 41.12 39.21 3hqp n ASP 185 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3hqp s LEU 186 N 0.32 3.25 0.79 -2.67 1.43 -1.26 -5.11 118.68 115.43 3hqp s LEU 186 Ca 0.65 -0.06 -0.11 0.00 -1.03 0.00 0.00 54.13 53.59 3hqp s LEU 186 Cb 0.17 -1.75 0.07 0.00 0.03 0.00 0.00 46.19 44.72 3hqp s LEU 186 CO -0.07 0.27 1.10 -2.16 0.23 0.00 0.00 176.35 175.73 3hqp s PRO 187 N -0.25 2.06 0.06 1.29 0.04 -1.26 -4.97 135.00 131.97 3hqp s PRO 187 Ca 0.04 1.26 -0.31 0.00 0.04 0.00 0.00 61.00 62.03 3hqp s PRO 187 Cb -0.13 -1.87 -0.17 0.00 0.04 0.00 0.00 34.50 32.38 3hqp s PRO 187 CO 0.02 -1.80 1.47 0.00 0.04 0.00 0.00 177.00 176.73 3hqp h ALA 188 N -1.19 -1.24 -3.36 8.56 0.00 -1.99 -3.40 119.26 116.64 3hqp h ALA 188 Ca -0.44 -0.22 -0.56 0.00 0.00 0.00 0.00 54.91 53.69 3hqp h ALA 188 Cb 1.24 0.51 -0.38 0.00 0.00 0.00 0.00 17.79 19.16 3hqp h ALA 188 CO 0.50 -1.19 -0.79 0.54 0.00 0.00 0.00 179.25 178.30 3hqp s VAL 189 N -5.46 1.16 0.92 0.00 0.11 -1.26 -4.62 120.40 111.25 3hqp s VAL 189 Ca -0.16 -0.70 -0.13 0.00 -2.93 0.00 0.00 61.98 58.05 3hqp s VAL 189 Cb 0.02 -1.35 0.19 0.00 -1.53 0.00 0.00 36.38 33.71 3hqp s VAL 189 CO 0.50 0.10 1.27 -0.94 -3.33 0.00 0.00 175.10 172.70 3hqp s SER 190 N 1.60 3.35 0.21 3.54 1.04 -1.26 -4.86 113.70 117.32 3hqp s SER 190 Ca 0.00 0.18 -0.07 0.00 0.48 0.00 0.00 55.95 56.53 3hqp s SER 190 Cb -0.16 -0.28 0.15 0.00 0.10 0.00 0.00 66.02 65.83 3hqp s SER 190 CO -0.08 -2.57 1.72 0.00 0.98 0.00 0.00 173.24 173.29 3hqp h ALA 191 N -1.45 0.97 -0.46 5.32 0.00 -2.00 -1.35 119.26 120.30 3hqp h ALA 191 Ca -0.43 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.14 3hqp h ALA 191 Cb 1.24 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 3hqp h ALA 191 CO 0.39 0.66 -0.07 0.87 0.00 0.00 0.00 179.25 181.10 3hqp h LYS 192 N 1.04 0.86 -0.93 0.00 1.57 -1.99 -2.10 116.57 115.02 3hqp h LYS 192 Ca 0.21 -0.31 -0.00 0.00 -1.87 0.00 0.00 60.65 58.68 3hqp h LYS 192 Cb 0.39 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.59 3hqp h LYS 192 CO 0.00 0.94 0.58 -0.44 -0.57 0.00 0.00 179.45 179.96 3hqp h ASP 193 N 0.70 1.11 0.10 0.86 3.32 -1.89 0.39 116.42 121.00 3hqp h ASP 193 Ca 0.12 -0.06 -0.12 0.00 0.02 0.00 0.00 57.03 56.99 3hqp h ASP 193 Cb 0.60 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 3hqp h ASP 193 CO 0.04 0.84 -0.41 -0.09 -1.72 0.00 0.00 179.24 177.90 3hqp h ARG 194 N 1.28 0.40 -0.26 3.56 2.43 -1.08 0.13 114.38 120.84 3hqp h ARG 194 Ca 0.34 -0.20 -0.16 0.00 -0.81 0.00 0.00 59.98 59.15 3hqp h ARG 194 Cb -0.08 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.47 3hqp h ARG 194 CO -0.07 0.74 -0.45 0.28 -1.51 0.00 0.00 179.97 178.97 3hqp h VAL 195 N 0.33 1.30 -0.42 0.20 2.07 -1.16 -2.57 116.25 116.00 3hqp h VAL 195 Ca 0.03 -1.65 -0.02 0.00 0.82 0.00 0.00 66.70 65.88 3hqp h VAL 195 Cb 0.86 1.71 -0.02 0.00 -1.52 0.00 0.00 31.29 32.32 3hqp h VAL 195 CO 0.07 0.53 0.18 0.44 0.02 0.00 0.00 177.57 178.81 3hqp h ASP 196 N 0.51 0.56 -0.49 0.57 3.32 -0.63 -2.45 116.42 117.81 3hqp h ASP 196 Ca 0.02 -0.15 -0.04 0.00 0.02 0.00 0.00 57.03 56.87 3hqp h ASP 196 Cb 1.06 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.44 3hqp h ASP 196 CO 0.10 0.56 0.13 -0.07 -1.72 0.00 0.00 179.24 178.24 3hqp h LEU 197 N 0.53 0.73 -0.65 1.55 3.38 -0.79 -2.46 115.31 117.59 3hqp h LEU 197 Ca 0.14 -0.22 0.03 0.00 0.09 0.00 0.00 57.88 57.91 3hqp h LEU 197 Cb 0.16 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.68 3hqp h LEU 197 CO -0.01 0.76 0.41 -0.61 0.09 0.00 0.00 178.44 179.07 3hqp h GLN 198 N 0.66 0.78 -0.82 1.13 5.75 -1.42 -0.35 115.11 120.83 3hqp h GLN 198 Ca 0.15 -0.05 0.14 0.00 -0.15 0.00 0.00 58.65 58.74 3hqp h GLN 198 Cb 0.31 -0.18 -0.09 0.00 1.07 0.00 0.00 27.48 28.59 3hqp h GLN 198 CO -0.00 0.52 0.42 0.35 -2.65 0.00 0.00 178.83 177.46 3hqp h PHE 199 N 0.81 0.73 -0.77 3.99 3.57 -1.28 -1.05 116.94 122.94 3hqp h PHE 199 Ca 0.26 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.74 3hqp h PHE 199 Cb 0.00 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.51 3hqp h PHE 199 CO -0.05 0.19 0.27 0.78 -2.23 0.00 0.00 178.31 177.27 3hqp h GLY 200 N 0.62 1.26 0.70 2.40 0.00 -0.63 0.29 103.07 107.71 3hqp h GLY 200 Ca 0.44 -0.72 -0.02 0.00 0.00 0.00 0.00 47.33 47.03 3hqp h GLY 200 CO -0.35 0.68 -0.22 -2.08 0.00 0.00 0.00 176.54 174.58 3hqp h VAL 201 N 1.14 0.46 -1.06 4.60 2.07 -0.77 -1.42 116.25 121.26 3hqp h VAL 201 Ca 0.25 -0.46 0.29 0.00 0.82 0.00 0.00 66.70 67.60 3hqp h VAL 201 Cb 0.27 0.64 -0.11 0.00 -1.52 0.00 0.00 31.29 30.57 3hqp h VAL 201 CO -0.01 0.07 0.66 -0.33 0.02 0.00 0.00 177.57 177.97 3hqp h GLU 202 N -0.91 0.40 -0.31 1.57 5.08 -1.14 -1.19 114.58 118.08 3hqp h GLU 202 Ca -0.06 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 3hqp h GLU 202 Cb 0.57 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.73 3hqp h GLU 202 CO 0.10 0.26 0.00 1.04 -1.00 0.00 0.00 179.01 179.41 3hqp n GLN 203 N -4.76 2.13 -3.05 2.33 1.13 0.08 -4.96 117.38 110.28 3hqp n GLN 203 Ca 0.28 -1.72 -0.16 0.00 -1.94 0.00 0.00 57.00 53.46 3hqp n GLN 203 Cb 0.91 -1.45 0.04 0.00 0.11 0.00 0.00 30.24 29.86 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 1.32 -0.13 3.70 1.08 0.00 -0.45 -5.00 105.19 105.71 3hqp n GLY 204 Ca 0.18 -0.08 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 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 -3.12 2.38 -0.08 1.61 -7.23 -0.61 -4.97 120.40 108.39 3hqp s VAL 205 Ca 0.32 0.13 0.13 0.00 -1.81 0.00 0.00 61.98 60.75 3hqp s VAL 205 Cb -0.14 -2.33 -0.23 0.00 0.56 0.00 0.00 36.38 34.23 3hqp s VAL 205 CO 0.40 -0.15 0.54 0.47 -0.31 0.00 0.00 175.10 176.04 3hqp n ASP 206 N -3.87 0.75 -3.52 4.85 8.00 -0.39 -4.88 116.55 117.49 3hqp n ASP 206 Ca 0.11 0.33 -0.18 0.00 0.71 0.00 0.00 54.79 55.77 3hqp n ASP 206 Cb 0.52 0.11 -0.06 0.00 -0.02 0.00 0.00 41.12 41.67 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 -2.58 1.06 -0.20 -1.24 0.23 -1.18 -2.80 119.30 112.59 3hqp s MET 207 Ca -0.06 0.26 -0.07 0.00 -1.03 0.00 0.00 55.69 54.79 3hqp s MET 207 Cb 0.08 0.50 -0.03 0.00 -1.53 0.00 0.00 34.83 33.84 3hqp s MET 207 CO 0.82 -0.33 0.05 0.42 -2.03 0.00 0.00 175.02 173.95 3hqp s ILE 208 N -1.20 4.46 -0.92 3.16 -1.09 0.40 -1.38 121.20 124.63 3hqp s ILE 208 Ca -0.11 -0.14 -0.18 0.00 -2.23 0.00 0.00 60.65 57.99 3hqp s ILE 208 Cb -0.00 -3.03 0.15 0.00 -1.58 0.00 0.00 42.46 38.00 3hqp s ILE 208 CO 0.10 0.42 1.08 -0.36 -1.23 0.00 0.00 174.94 174.95 3hqp s PHE 209 N 0.80 3.24 -0.31 3.97 0.08 0.13 -0.19 117.98 125.70 3hqp s PHE 209 Ca 0.03 -1.52 -0.29 0.00 0.12 0.00 0.00 56.93 55.27 3hqp s PHE 209 Cb -0.14 -4.20 0.00 0.00 -0.57 0.00 0.00 43.02 38.11 3hqp s PHE 209 CO 0.02 -1.40 1.35 0.00 -0.10 0.00 0.00 175.22 175.09 3hqp s ALA 210 N 2.22 3.31 0.51 5.36 0.00 -0.42 -1.58 121.76 131.15 3hqp s ALA 210 Ca 0.31 0.09 -0.20 0.00 0.00 0.00 0.00 51.96 52.16 3hqp s ALA 210 Cb -0.06 -3.81 -0.07 0.00 0.00 0.00 0.00 23.12 19.19 3hqp s ALA 210 CO -0.09 -1.88 1.09 -1.12 0.00 0.00 0.00 175.76 173.76 3hqp s SER 211 N 3.09 6.06 -1.43 0.00 0.01 -1.26 -1.11 113.70 119.05 3hqp s SER 211 Ca 0.58 2.07 -0.02 0.00 1.31 0.00 0.00 55.95 59.90 3hqp s SER 211 Cb -0.17 -2.57 0.01 0.00 0.21 0.00 0.00 66.02 63.50 3hqp s SER 211 CO 0.25 -0.98 0.46 0.49 0.41 0.00 0.00 173.24 173.87 3hqp n PHE 212 N -1.05 -1.67 -2.15 2.43 3.72 -1.24 -4.55 117.46 112.96 3hqp n PHE 212 Ca 0.10 0.75 -0.43 0.00 -0.05 0.00 0.00 57.45 57.83 3hqp n PHE 212 Cb 0.51 -3.69 -0.03 0.00 -0.94 0.00 0.00 39.48 35.34 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 -3.90 3.82 -0.07 4.37 -1.09 -0.80 -4.80 121.20 118.73 3hqp s ILE 213 Ca 0.07 0.99 0.14 0.00 -2.23 0.00 0.00 60.65 59.62 3hqp s ILE 213 Cb -0.04 -3.66 -0.21 0.00 -1.58 0.00 0.00 42.46 36.98 3hqp s ILE 213 CO 0.89 -0.11 0.21 -2.11 -1.23 0.00 0.00 174.94 172.59 3hqp n ARG 214 N 7.01 1.00 -3.46 2.79 1.85 -1.26 -4.16 116.66 120.43 3hqp n ARG 214 Ca 0.16 -0.08 -0.11 0.00 -1.00 0.00 0.00 57.85 56.82 3hqp n ARG 214 Cb 0.44 -1.36 -0.02 0.00 -1.05 0.00 0.00 32.46 30.47 3hqp n ARG 214 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 3hqp s SER 215 N -4.17 -0.53 0.19 2.89 1.04 -1.26 -4.06 113.70 107.81 3hqp s SER 215 Ca -0.06 -0.04 -0.11 0.00 0.48 0.00 0.00 55.95 56.22 3hqp s SER 215 Cb 0.07 0.58 0.20 0.00 0.10 0.00 0.00 66.02 66.98 3hqp s SER 215 CO 0.61 -0.95 1.77 0.00 0.98 0.00 0.00 173.24 175.65 3hqp h ALA 216 N 2.00 0.73 -0.66 5.32 0.00 -1.87 -2.57 119.26 122.22 3hqp h ALA 216 Ca -0.32 0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.65 3hqp h ALA 216 Cb 1.30 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 3hqp h ALA 216 CO 0.36 -0.11 0.44 1.49 0.00 0.00 0.00 179.25 181.43 3hqp h GLU 217 N 0.49 0.81 -0.75 0.00 4.81 -1.97 -1.56 114.58 116.42 3hqp h GLU 217 Ca 0.26 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.40 3hqp h GLU 217 Cb 0.23 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 29.39 3hqp h GLU 217 CO -0.21 0.54 0.31 0.37 -0.73 0.00 0.00 179.01 179.29 3hqp h GLN 218 N 0.84 1.12 -0.20 1.92 4.15 -1.88 -1.78 115.11 119.28 3hqp h GLN 218 Ca 0.25 -0.20 0.02 0.00 0.77 0.00 0.00 58.65 59.50 3hqp h GLN 218 Cb -0.02 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 27.46 3hqp h GLN 218 CO -0.06 0.91 0.04 0.28 -1.93 0.00 0.00 178.83 178.07 3hqp h VAL 219 N 1.08 0.92 0.00 2.39 2.07 -1.04 -1.66 116.25 120.01 3hqp h VAL 219 Ca 0.25 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.72 3hqp h VAL 219 Cb 0.20 0.78 -0.00 0.00 -1.52 0.00 0.00 31.29 30.75 3hqp h VAL 219 CO -0.02 0.02 -0.03 1.23 0.02 0.00 0.00 177.57 178.79 3hqp h GLY 220 N 0.12 0.00 0.86 2.17 0.00 -1.22 -1.40 103.07 103.60 3hqp h GLY 220 Ca 0.09 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.33 3hqp h GLY 220 CO -0.11 0.00 -0.21 -0.55 0.00 0.00 0.00 176.54 175.67 3hqp h ASP 221 N 0.00 0.56 -0.47 0.19 3.32 -0.42 -2.27 116.42 117.34 3hqp h ASP 221 Ca -0.00 -0.47 -0.02 0.00 0.02 0.00 0.00 57.03 56.56 3hqp h ASP 221 Cb 0.11 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 3hqp h ASP 221 CO 0.00 0.92 0.23 0.58 -1.72 0.00 0.00 179.24 179.25 3hqp h VAL 222 N 0.22 1.18 -0.73 -1.35 2.07 -0.71 -0.15 116.25 116.79 3hqp h VAL 222 Ca 0.04 -0.50 -0.01 0.00 0.82 0.00 0.00 66.70 67.04 3hqp h VAL 222 Cb 0.75 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 3hqp h VAL 222 CO 0.05 0.20 0.40 -0.09 0.02 0.00 0.00 177.57 178.15 3hqp h ARG 223 N 0.62 1.01 -0.49 1.57 2.43 -1.36 0.89 114.38 119.05 3hqp h ARG 223 Ca 0.16 -0.12 -0.07 0.00 -0.81 0.00 0.00 59.98 59.14 3hqp h ARG 223 Cb 0.10 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 29.43 3hqp h ARG 223 CO -0.02 0.76 0.01 -0.22 -1.51 0.00 0.00 179.97 178.99 3hqp h LYS 224 N 1.00 0.81 -0.24 0.20 3.64 -1.22 -2.62 116.57 118.14 3hqp h LYS 224 Ca 0.26 -0.21 -0.12 0.00 -1.27 0.00 0.00 60.65 59.30 3hqp h LYS 224 Cb 0.04 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.75 3hqp h LYS 224 CO -0.04 0.80 -0.37 0.00 -2.27 0.00 0.00 179.45 177.57 3hqp h ALA 225 N 1.26 0.91 0.00 5.00 0.00 -0.29 -2.59 119.26 123.55 3hqp h ALA 225 Ca 0.15 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 3hqp h ALA 225 Cb 0.44 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 3hqp h ALA 225 CO 0.02 0.63 -0.09 -0.07 0.00 0.00 0.00 179.25 179.74 3hqp h LEU 226 N 0.45 0.00 0.00 0.00 3.38 -0.56 -3.44 115.31 115.15 3hqp h LEU 226 Ca 0.05 0.00 0.20 0.00 0.09 0.00 0.00 57.88 58.22 3hqp h LEU 226 Cb 0.85 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.55 3hqp h LEU 226 CO 0.07 0.09 -0.27 0.61 0.09 0.00 0.00 178.44 179.03 3hqp n GLY 227 N -0.39 -1.88 0.36 0.83 0.00 -0.98 -2.53 105.19 100.60 3hqp n GLY 227 Ca -0.01 -1.26 -0.03 0.00 0.00 0.00 0.00 46.02 44.73 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 1.23 0.00 1.61 0.11 -1.89 -1.65 132.00 131.42 3hqp h PRO 228 Ca 0.02 -0.12 0.00 0.00 0.11 0.00 0.00 66.00 66.01 3hqp h PRO 228 Cb 0.68 -0.26 0.00 0.00 0.11 0.00 0.00 31.00 31.53 3hqp h PRO 228 CO 0.01 0.87 0.00 0.87 -0.21 0.00 0.00 178.00 179.54 3hqp h LYS 229 N 1.25 0.00 -0.35 1.05 1.79 -2.00 -2.66 116.57 115.64 3hqp h LYS 229 Ca 0.32 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.79 3hqp h LYS 229 Cb -0.04 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.61 3hqp h LYS 229 CO -0.06 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 178.72 3hqp n GLY 230 N -0.67 2.96 0.49 3.86 0.00 -0.64 -4.76 105.19 106.44 3hqp n GLY 230 Ca 0.00 -0.51 0.30 0.00 0.00 0.00 0.00 46.02 45.82 3hqp n GLY 230 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3hqp h ARG 231 N 2.12 0.02 -0.52 1.61 0.11 -1.31 -1.64 114.38 114.77 3hqp h ARG 231 Ca 0.00 -0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3hqp h ARG 231 Cb 0.87 -0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.95 3hqp h ARG 231 CO 0.04 0.01 0.00 -0.25 0.10 0.00 0.00 179.97 179.88 3hqp n ASP 232 N -4.25 3.54 -4.68 0.08 8.00 -1.26 -4.90 116.55 113.07 3hqp n ASP 232 Ca 0.21 -1.97 -0.40 0.00 0.71 0.00 0.00 54.79 53.34 3hqp n ASP 232 Cb 1.05 -0.34 -0.06 0.00 -0.02 0.00 0.00 41.12 41.75 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 -1.17 5.06 0.31 0.53 1.01 -0.62 -5.01 121.20 121.31 3hqp s ILE 233 Ca 0.40 1.17 -0.29 0.00 0.00 0.00 0.00 60.65 61.93 3hqp s ILE 233 Cb 0.22 -3.93 -0.10 0.00 0.01 0.00 0.00 42.46 38.65 3hqp s ILE 233 CO 0.29 0.17 1.24 -0.04 0.00 0.00 0.00 174.94 176.60 3hqp s MET 234 N 1.54 4.45 -0.28 2.79 -1.94 -1.12 -4.88 119.30 119.86 3hqp s MET 234 Ca 0.29 2.08 -0.08 0.00 -1.71 0.00 0.00 55.69 56.28 3hqp s MET 234 Cb -0.16 -3.11 -0.01 0.00 2.01 0.00 0.00 34.83 33.56 3hqp s MET 234 CO 0.11 -0.07 0.09 0.42 -0.01 0.00 0.00 175.02 175.57 3hqp s ILE 235 N -1.10 4.29 -0.22 2.53 1.01 -1.26 -0.45 121.20 125.99 3hqp s ILE 235 Ca 0.48 -0.38 -0.07 0.00 0.00 0.00 0.00 60.65 60.67 3hqp s ILE 235 Cb -0.37 -3.11 -0.03 0.00 0.01 0.00 0.00 42.46 38.96 3hqp s ILE 235 CO 0.49 0.20 0.07 -0.63 0.00 0.00 0.00 174.94 175.06 3hqp s ILE 236 N 1.58 4.51 -0.20 2.92 -1.09 0.73 -1.33 121.20 128.33 3hqp s ILE 236 Ca 0.05 -0.12 -0.17 0.00 -2.23 0.00 0.00 60.65 58.19 3hqp s ILE 236 Cb -0.16 -3.08 -0.04 0.00 -1.58 0.00 0.00 42.46 37.60 3hqp s ILE 236 CO 0.04 0.38 0.44 0.00 -1.23 0.00 0.00 174.94 174.57 3hqp s LYS 238 N 1.44 4.05 -0.45 0.00 1.02 -0.27 -0.24 119.74 125.29 3hqp s LYS 238 Ca 0.21 0.70 -0.16 0.00 0.02 0.00 0.00 55.97 56.74 3hqp s LYS 238 Cb -0.15 -3.69 0.05 0.00 -0.52 0.00 0.00 37.83 33.51 3hqp s LYS 238 CO 0.09 -0.60 0.41 0.42 -0.92 0.00 0.00 175.35 174.74 3hqp s ILE 239 N 2.89 5.16 0.00 2.17 -1.09 -0.54 -1.91 121.20 127.87 3hqp s ILE 239 Ca 0.33 -0.75 0.09 0.00 -2.23 0.00 0.00 60.65 58.09 3hqp s ILE 239 Cb -0.15 -4.08 0.15 0.00 -1.58 0.00 0.00 42.46 36.80 3hqp s ILE 239 CO 0.10 -0.51 0.99 -1.84 -1.23 0.00 0.00 174.94 172.45 3hqp n GLU 240 N 5.40 0.00 -3.89 2.79 0.28 -1.26 -2.75 120.64 121.22 3hqp n GLU 240 Ca -0.10 -1.21 -0.09 0.00 -0.16 0.00 0.00 57.16 55.59 3hqp n GLU 240 Cb 0.45 -0.13 -0.06 0.00 1.43 0.00 0.00 31.44 33.14 3hqp n GLU 240 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 3hqp s ASN 241 N -1.21 -0.06 0.28 -1.84 2.20 -1.26 -3.71 114.94 109.33 3hqp s ASN 241 Ca 0.12 -0.74 0.02 0.00 -0.94 0.00 0.00 52.86 51.33 3hqp s ASN 241 Cb 0.14 0.49 0.64 0.00 -2.00 0.00 0.00 41.25 40.52 3hqp s ASN 241 CO -0.06 -0.95 1.77 -0.74 -2.94 0.00 0.00 177.10 174.17 3hqp h HIS 242 N 2.42 0.91 0.02 1.54 -0.00 -1.95 -2.53 115.15 115.56 3hqp h HIS 242 Ca -0.30 0.03 -0.22 0.00 -0.00 0.00 0.00 60.37 59.88 3hqp h HIS 242 Cb 1.24 -0.26 -0.02 0.00 -0.00 0.00 0.00 27.41 28.36 3hqp h HIS 242 CO 0.38 0.20 -1.03 -0.56 -0.00 0.00 0.00 177.93 176.92 3hqp h GLN 243 N 0.68 0.05 -0.57 5.26 3.07 -1.94 -2.88 115.11 118.78 3hqp h GLN 243 Ca 0.52 -0.09 -0.02 0.00 0.09 0.00 0.00 58.65 59.16 3hqp h GLN 243 Cb 0.79 0.03 -0.03 0.00 0.08 0.00 0.00 27.48 28.35 3hqp h GLN 243 CO -0.38 1.03 0.28 0.78 0.09 0.00 0.00 178.83 180.63 3hqp h GLY 244 N 2.70 0.85 1.03 0.06 0.00 -1.60 0.14 103.07 106.26 3hqp h GLY 244 Ca -0.03 -0.39 -0.14 0.00 0.00 0.00 0.00 47.33 46.77 3hqp h GLY 244 CO 0.14 0.37 -0.34 -2.08 0.00 0.00 0.00 176.54 174.64 3hqp h VAL 245 N 0.80 1.29 -0.68 4.60 2.07 -1.54 -3.08 116.25 119.71 3hqp h VAL 245 Ca 0.20 -1.51 -0.06 0.00 0.82 0.00 0.00 66.70 66.15 3hqp h VAL 245 Cb 0.07 1.52 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 3hqp h VAL 245 CO -0.03 0.49 0.17 -0.61 0.02 0.00 0.00 177.57 177.62 3hqp h GLN 246 N 0.56 1.08 -0.80 1.57 4.15 -1.20 -3.02 115.11 117.46 3hqp h GLN 246 Ca 0.05 -0.25 -0.16 0.00 0.77 0.00 0.00 58.65 59.06 3hqp h GLN 246 Cb 0.92 -0.14 -0.09 0.00 0.21 0.00 0.00 27.48 28.37 3hqp h GLN 246 CO 0.08 0.95 0.20 0.09 -1.93 0.00 0.00 178.83 178.23 3hqp n ASN 247 N -4.28 4.32 -0.16 -0.69 3.02 0.45 -4.72 115.26 113.20 3hqp n ASN 247 Ca 0.05 -2.95 0.02 0.00 -0.03 0.00 0.00 54.58 51.68 3hqp n ASN 247 Cb 0.25 -0.70 0.31 0.00 -0.61 0.00 0.00 39.78 39.03 3hqp n ASN 247 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 3hqp h ILE 248 N 2.26 1.14 -0.32 2.41 6.09 -1.43 -2.06 117.51 125.59 3hqp h ILE 248 Ca 0.19 -0.29 -0.10 0.00 -1.37 0.00 0.00 64.86 63.29 3hqp h ILE 248 Cb 1.99 0.21 -0.01 0.00 0.47 0.00 0.00 36.82 39.48 3hqp h ILE 248 CO 0.58 0.16 -0.20 0.44 -3.07 0.00 0.00 178.15 176.06 3hqp h ASP 249 N 0.86 0.74 0.61 2.19 3.32 -1.87 0.57 116.42 122.83 3hqp h ASP 249 Ca 0.25 -0.43 -0.13 0.00 0.02 0.00 0.00 57.03 56.75 3hqp h ASP 249 Cb -0.04 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.29 3hqp h ASP 249 CO -0.06 1.00 -0.61 0.77 -1.72 0.00 0.00 179.24 178.62 3hqp h SER 250 N 0.47 0.00 -0.11 6.45 4.64 -1.90 -1.95 113.55 121.16 3hqp h SER 250 Ca 0.07 -0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.31 3hqp h SER 250 Cb 0.75 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 3hqp h SER 250 CO 0.06 0.61 -0.25 0.40 -0.87 0.00 0.00 176.83 176.78 3hqp h ILE 251 N 0.00 1.39 -0.94 0.95 2.04 -1.21 -2.83 117.51 116.90 3hqp h ILE 251 Ca -0.01 -1.54 0.08 0.00 1.00 0.00 0.00 64.86 64.39 3hqp h ILE 251 Cb 1.08 2.11 -0.07 0.00 -0.74 0.00 0.00 36.82 39.21 3hqp h ILE 251 CO 0.08 0.45 0.59 0.40 0.00 0.00 0.00 178.15 179.67 3hqp h ILE 252 N -0.07 1.03 -0.54 -0.67 2.04 -0.87 -1.14 117.51 117.28 3hqp h ILE 252 Ca 0.00 -0.36 0.04 0.00 1.00 0.00 0.00 64.86 65.54 3hqp h ILE 252 Cb 0.84 -0.11 -0.04 0.00 -0.74 0.00 0.00 36.82 36.77 3hqp h ILE 252 CO 0.05 0.19 0.29 -0.08 0.00 0.00 0.00 178.15 178.61 3hqp h GLU 253 N 1.05 0.55 0.01 2.37 4.57 -1.33 -3.22 114.58 118.58 3hqp h GLU 253 Ca 0.42 -0.03 -0.25 0.00 -1.18 0.00 0.00 59.36 58.32 3hqp h GLU 253 Cb 0.24 -0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.67 3hqp h GLU 253 CO -0.19 0.36 -1.33 0.93 -1.18 0.00 0.00 179.01 177.60 3hqp h GLU 254 N 0.57 0.03 -7.21 1.92 4.39 -1.20 -3.47 114.58 109.60 3hqp h GLU 254 Ca 0.24 -0.05 -0.46 0.00 0.34 0.00 0.00 59.36 59.42 3hqp h GLU 254 Cb 0.12 0.02 0.09 0.00 -0.10 0.00 0.00 28.75 28.87 3hqp h GLU 254 CO -0.15 0.83 0.16 -1.54 -1.16 0.00 0.00 179.01 177.15 3hqp s SER 255 N -6.51 4.42 0.00 1.42 1.04 -0.47 -4.97 113.70 108.63 3hqp s SER 255 Ca -0.02 -0.03 0.23 0.00 0.48 0.00 0.00 55.95 56.60 3hqp s SER 255 Cb 0.09 -0.44 0.39 0.00 0.10 0.00 0.00 66.02 66.16 3hqp s SER 255 CO 0.83 -1.82 1.37 0.47 0.98 0.00 0.00 173.24 175.07 3hqp n ASP 256 N -2.91 3.40 0.00 7.02 9.92 -0.44 -4.91 116.55 128.62 3hqp n ASP 256 Ca 0.12 -1.98 0.00 0.00 -0.53 0.00 0.00 54.79 52.40 3hqp n ASP 256 Cb 0.60 -0.22 0.00 0.00 -0.64 0.00 0.00 41.12 40.86 3hqp n ASP 256 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3hqp n GLY 257 N 1.45 -2.78 2.99 0.44 0.00 -1.24 -4.09 105.19 101.96 3hqp n GLY 257 Ca 0.18 -1.35 -0.12 0.00 0.00 0.00 0.00 46.02 44.74 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 -1.99 0.03 -0.18 -0.61 -1.09 -0.78 -0.56 121.20 116.03 3hqp s ILE 258 Ca 0.00 -0.22 -0.01 0.00 -2.23 0.00 0.00 60.65 58.19 3hqp s ILE 258 Cb 0.00 -0.20 -0.00 0.00 -1.58 0.00 0.00 42.46 40.68 3hqp s ILE 258 CO 0.00 -0.12 -0.12 -0.32 -1.23 0.00 0.00 174.94 173.15 3hqp s MET 259 N -0.36 3.28 -0.92 2.79 -2.45 0.66 -0.45 119.30 121.84 3hqp s MET 259 Ca -0.04 -0.70 -0.24 0.00 -1.25 0.00 0.00 55.69 53.45 3hqp s MET 259 Cb -0.03 -2.75 0.00 0.00 1.25 0.00 0.00 34.83 33.31 3hqp s MET 259 CO 0.00 -0.04 1.67 0.08 1.05 0.00 0.00 175.02 177.78 3hqp s VAL 260 N 1.00 3.67 -1.19 10.11 1.01 0.70 -1.47 120.40 134.24 3hqp s VAL 260 Ca -0.01 -0.44 -0.17 0.00 0.00 0.00 0.00 61.98 61.36 3hqp s VAL 260 Cb -0.15 -4.54 0.12 0.00 0.00 0.00 0.00 36.38 31.81 3hqp s VAL 260 CO -0.02 -1.45 1.50 0.00 0.00 0.00 0.00 175.10 175.13 3hqp s ALA 261 N 7.42 3.57 -0.43 5.51 0.00 -1.11 -2.44 121.76 134.27 3hqp s ALA 261 Ca 0.57 -3.04 0.24 0.00 0.00 0.00 0.00 51.96 49.73 3hqp s ALA 261 Cb -0.04 -4.33 1.01 0.00 0.00 0.00 0.00 23.12 19.76 3hqp s ALA 261 CO -0.02 -3.06 1.72 0.54 0.00 0.00 0.00 175.76 174.94 3hqp n ARG 262 N 6.99 0.20 0.00 0.00 1.74 -1.22 -2.31 116.66 122.06 3hqp n ARG 262 Ca 0.39 0.45 0.00 0.00 -0.77 0.00 0.00 57.85 57.92 3hqp n ARG 262 Cb 0.45 -1.90 0.00 0.00 -1.02 0.00 0.00 32.46 30.00 3hqp n ARG 262 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hqp n GLY 263 N -0.10 -2.59 0.31 -0.13 0.00 -1.26 -0.93 105.19 100.49 3hqp n GLY 263 Ca 0.02 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.02 3hqp n GLY 263 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3hqp h ASP 264 N 0.00 0.76 -0.91 1.61 3.32 -1.87 -3.03 116.42 116.30 3hqp h ASP 264 Ca 0.00 -0.12 0.04 0.00 0.02 0.00 0.00 57.03 56.97 3hqp h ASP 264 Cb 0.00 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 39.30 3hqp h ASP 264 CO 0.00 0.72 0.59 0.25 -1.72 0.00 0.00 179.24 179.08 3hqp h LEU 265 N 0.81 0.98 0.00 1.55 6.46 -1.51 -0.69 115.31 122.91 3hqp h LEU 265 Ca 0.19 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.94 3hqp h LEU 265 Cb 0.23 -0.22 0.00 0.00 -0.73 0.00 0.00 40.66 39.94 3hqp h LEU 265 CO -0.01 0.67 0.00 0.61 -0.62 0.00 0.00 178.44 179.09 3hqp n GLY 266 N -1.35 -0.96 0.11 3.75 0.00 -0.10 -1.43 105.19 105.21 3hqp n GLY 266 Ca 0.12 -0.05 -0.15 0.00 0.00 0.00 0.00 46.02 45.93 3hqp n GLY 266 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3hqp n VAL 267 N -1.47 1.28 -0.25 1.61 0.31 -0.80 -3.82 118.33 115.20 3hqp n VAL 267 Ca 0.04 -0.50 -0.07 0.00 -0.01 0.00 0.00 64.34 63.81 3hqp n VAL 267 Cb 0.16 -1.28 0.05 0.00 -0.91 0.00 0.00 33.84 31.86 3hqp n VAL 267 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 3hqp h GLU 268 N 0.00 1.06 -6.16 5.55 4.57 -0.95 -3.44 114.58 115.21 3hqp h GLU 268 Ca -0.50 -0.21 -0.60 0.00 -1.18 0.00 0.00 59.36 56.87 3hqp h GLU 268 Cb 1.78 -0.16 -0.13 0.00 -0.16 0.00 0.00 28.75 30.08 3hqp h GLU 268 CO -0.08 0.90 -0.72 0.96 -1.18 0.00 0.00 179.01 178.89 3hqp s ILE 269 N -5.47 2.63 0.25 2.32 -4.36 -0.52 -4.67 121.20 111.37 3hqp s ILE 269 Ca -0.12 -2.27 -0.30 0.00 -0.26 0.00 0.00 60.65 57.70 3hqp s ILE 269 Cb 0.14 -2.46 -0.15 0.00 1.25 0.00 0.00 42.46 41.24 3hqp s ILE 269 CO 0.82 -0.36 1.04 -2.65 0.24 0.00 0.00 174.94 174.03 3hqp n PRO 270 N -0.71 1.22 -0.31 0.37 -0.02 -1.26 -4.47 135.00 129.82 3hqp n PRO 270 Ca -0.05 0.43 0.06 0.00 -2.02 0.00 0.00 63.50 61.92 3hqp n PRO 270 Cb 0.60 -1.82 0.22 0.00 -0.02 0.00 0.00 33.50 32.48 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 2.41 1.30 0.00 3.55 0.00 -1.90 -1.50 119.26 123.13 3hqp h ALA 271 Ca -0.40 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 3hqp h ALA 271 Cb 1.35 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 3hqp h ALA 271 CO 0.64 0.01 -0.04 1.05 0.00 0.00 0.00 179.25 180.91 3hqp h GLU 272 N 0.73 0.00 -0.00 0.00 9.09 -1.92 -2.69 114.58 119.79 3hqp h GLU 272 Ca 0.46 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.87 3hqp h GLU 272 Cb 0.57 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.67 3hqp h GLU 272 CO -0.32 0.04 -0.01 1.63 0.05 0.00 0.00 179.01 180.40 3hqp n LYS 273 N -3.16 0.05 0.18 1.06 5.02 -0.57 -3.51 118.16 117.23 3hqp n LYS 273 Ca 0.00 -0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.32 3hqp n LYS 273 Cb 0.30 -1.50 0.32 0.00 -0.02 0.00 0.00 35.03 34.13 3hqp n LYS 273 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3hqp h VAL 274 N 0.00 1.15 -0.22 -0.18 2.07 -1.54 -1.98 116.25 115.56 3hqp h VAL 274 Ca 0.00 -1.57 -0.02 0.00 0.82 0.00 0.00 66.70 65.93 3hqp h VAL 274 Cb 0.48 1.88 -0.01 0.00 -1.52 0.00 0.00 31.29 32.12 3hqp h VAL 274 CO 0.00 0.42 0.05 0.58 0.02 0.00 0.00 177.57 178.64 3hqp h VAL 275 N 0.00 1.22 -0.41 2.57 2.07 -1.75 0.21 116.25 120.14 3hqp h VAL 275 Ca -0.00 -0.70 -0.15 0.00 0.82 0.00 0.00 66.70 66.66 3hqp h VAL 275 Cb 0.85 1.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 3hqp h VAL 275 CO 0.06 0.22 -0.32 0.58 0.02 0.00 0.00 177.57 178.13 3hqp h VAL 276 N 0.17 1.27 -0.37 2.57 2.07 -1.73 -2.14 116.25 118.09 3hqp h VAL 276 Ca 0.07 -1.49 -0.07 0.00 0.82 0.00 0.00 66.70 66.03 3hqp h VAL 276 Cb 0.29 1.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.33 3hqp h VAL 276 CO 0.00 0.50 -0.07 0.00 0.02 0.00 0.00 177.57 178.02 3hqp h ALA 277 N 0.84 1.18 0.45 1.67 0.00 -1.28 -1.26 119.26 120.86 3hqp h ALA 277 Ca 0.08 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 3hqp h ALA 277 Cb 0.90 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3hqp h ALA 277 CO 0.08 0.53 -0.22 0.37 0.00 0.00 0.00 179.25 180.01 3hqp h GLN 278 N 0.58 -0.59 -0.08 0.00 4.15 -0.38 -1.98 115.11 116.81 3hqp h GLN 278 Ca 0.11 0.04 0.04 0.00 0.77 0.00 0.00 58.65 59.61 3hqp h GLN 278 Cb 0.47 0.13 -0.05 0.00 0.21 0.00 0.00 27.48 28.25 3hqp h GLN 278 CO 0.03 -0.39 -0.22 0.87 -1.93 0.00 0.00 178.83 177.18 3hqp h LYS 279 N -0.61 -0.29 0.21 1.69 1.57 -1.15 -2.09 116.57 115.90 3hqp h LYS 279 Ca -0.06 0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.75 3hqp h LYS 279 Cb 0.48 0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.82 3hqp h LYS 279 CO 0.09 -0.19 -0.38 0.82 -0.57 0.00 0.00 179.45 179.22 3hqp h ILE 280 N -0.30 0.22 -0.09 1.86 2.04 -1.24 -1.17 117.51 118.83 3hqp h ILE 280 Ca 0.09 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.86 3hqp h ILE 280 Cb 0.42 0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.71 3hqp h ILE 280 CO -0.26 0.00 -0.31 -0.07 0.00 0.00 0.00 178.15 177.51 3hqp h LEU 281 N -0.67 0.18 -0.07 1.44 3.38 -1.26 -0.88 115.31 117.42 3hqp h LEU 281 Ca 0.01 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 3hqp h LEU 281 Cb 0.66 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.36 3hqp h LEU 281 CO -0.17 0.49 -0.19 0.40 0.09 0.00 0.00 178.44 179.06 3hqp h ILE 282 N 0.16 1.42 -0.54 1.22 2.04 -1.25 -2.46 117.51 118.10 3hqp h ILE 282 Ca 0.02 -1.54 0.04 0.00 1.00 0.00 0.00 64.86 64.38 3hqp h ILE 282 Cb 0.63 2.24 -0.04 0.00 -0.74 0.00 0.00 36.82 38.91 3hqp h ILE 282 CO 0.05 0.44 0.29 0.28 0.00 0.00 0.00 178.15 179.20 3hqp h SER 283 N -0.23 0.44 -0.49 1.72 0.02 -0.97 -1.06 113.55 112.99 3hqp h SER 283 Ca -0.00 0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 60.93 3hqp h SER 283 Cb 0.80 -0.07 -0.03 0.00 0.14 0.00 0.00 62.40 63.25 3hqp h SER 283 CO 0.04 0.30 0.19 0.11 -1.14 0.00 0.00 176.83 176.33 3hqp h LYS 284 N 0.57 0.79 -0.25 3.45 1.57 -1.20 -1.78 116.57 119.72 3hqp h LYS 284 Ca 0.23 -0.13 -0.14 0.00 -1.87 0.00 0.00 60.65 58.74 3hqp h LYS 284 Cb 0.10 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.28 3hqp h LYS 284 CO -0.14 0.67 -0.40 0.00 -0.57 0.00 0.00 179.45 179.01 3hqp h ASN 286 N 0.43 -0.09 -0.73 0.00 -0.26 -0.98 0.29 115.58 114.23 3hqp h ASN 286 Ca 0.02 0.07 -0.07 0.00 -0.56 0.00 0.00 56.30 55.76 3hqp h ASN 286 Cb 1.00 0.12 -0.03 0.00 -1.06 0.00 0.00 38.32 38.34 3hqp h ASN 286 CO 0.09 -0.01 0.19 0.58 -1.06 0.00 0.00 177.43 177.22 3hqp h VAL 287 N 0.12 1.26 0.00 2.81 2.07 -1.33 -2.59 116.25 118.59 3hqp h VAL 287 Ca 0.16 -0.96 0.00 0.00 0.82 0.00 0.00 66.70 66.72 3hqp h VAL 287 Cb 0.21 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 30.48 3hqp h VAL 287 CO -0.25 0.37 0.00 0.00 0.02 0.00 0.00 177.57 177.71 3hqp h ALA 288 N 1.10 1.00 -0.34 1.67 0.00 -1.07 -3.48 119.26 118.13 3hqp h ALA 288 Ca 0.23 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 3hqp h ALA 288 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3hqp h ALA 288 CO -0.00 0.00 -0.01 0.41 0.00 0.00 0.00 179.25 179.64 3hqp n GLY 289 N 0.87 0.49 3.41 0.00 0.00 0.83 -5.07 105.19 105.73 3hqp n GLY 289 Ca 0.04 -0.81 -0.32 0.00 0.00 0.00 0.00 46.02 44.92 3hqp n GLY 289 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hqp s LYS 290 N -4.28 2.28 0.22 1.61 1.02 -0.18 -4.83 119.74 115.58 3hqp s LYS 290 Ca 0.00 -0.83 -0.31 0.00 0.02 0.00 0.00 55.97 54.85 3hqp s LYS 290 Cb -0.00 -2.22 -0.15 0.00 -0.52 0.00 0.00 37.83 34.94 3hqp s LYS 290 CO 0.00 0.59 1.17 -2.30 -0.92 0.00 0.00 175.35 173.89 3hqp n PRO 291 N 2.22 1.39 -4.17 -1.68 -0.02 -1.26 -4.33 135.00 127.14 3hqp n PRO 291 Ca -0.17 0.49 -0.20 0.00 -2.02 0.00 0.00 63.50 61.61 3hqp n PRO 291 Cb 0.52 -1.98 -0.16 0.00 -0.02 0.00 0.00 33.50 31.85 3hqp n PRO 291 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3hqp s VAL 292 N -0.41 0.53 -0.15 -1.45 0.11 -1.26 -1.86 120.40 115.91 3hqp s VAL 292 Ca 0.68 -0.13 -0.03 0.00 -2.93 0.00 0.00 61.98 59.57 3hqp s VAL 292 Cb -0.77 -0.55 -0.02 0.00 -1.53 0.00 0.00 36.38 33.50 3hqp s VAL 292 CO 0.54 0.22 -0.05 -0.63 -3.33 0.00 0.00 175.10 171.85 3hqp s ILE 293 N 0.86 3.73 -0.15 7.04 1.01 0.40 -1.96 121.20 132.13 3hqp s ILE 293 Ca -0.12 -0.41 -0.16 0.00 0.00 0.00 0.00 60.65 59.96 3hqp s ILE 293 Cb -0.14 -2.63 -0.04 0.00 0.01 0.00 0.00 42.46 39.66 3hqp s ILE 293 CO 0.00 0.50 0.38 0.00 0.00 0.00 0.00 174.94 175.82 3hqp s ALA 295 N 0.69 0.97 0.00 0.00 0.00 -1.02 -1.37 121.76 121.04 3hqp s ALA 295 Ca 0.20 -1.19 0.00 0.00 0.00 0.00 0.00 51.96 50.98 3hqp s ALA 295 Cb -0.14 0.08 0.00 0.00 0.00 0.00 0.00 23.12 23.06 3hqp s ALA 295 CO 0.07 -0.11 0.00 2.41 0.00 0.00 0.00 175.76 178.13 3hqp n THR 296 N 0.46 -1.35 -1.52 0.00 -1.04 -1.26 -3.42 114.28 106.15 3hqp n THR 296 Ca -0.16 0.00 -0.07 0.00 -2.04 0.00 0.00 64.05 61.78 3hqp n THR 296 Cb 0.58 -1.75 -0.02 0.00 -1.82 0.00 0.00 70.33 67.32 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 0.97 -0.54 -0.01 -2.82 6.02 -1.26 -4.80 117.38 114.94 3hqp n GLN 297 Ca 0.00 0.63 -0.17 0.00 -0.01 0.00 0.00 57.00 57.45 3hqp n GLN 297 Cb 0.00 -4.47 -0.10 0.00 1.02 0.00 0.00 30.24 26.69 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 0.48 -1.20 -1.09 2.86 -1.89 -3.30 114.93 110.79 3hqp h MET 298 Ca -0.16 -0.45 -0.54 0.00 -2.06 0.00 0.00 59.70 56.49 3hqp h MET 298 Cb 0.69 0.11 -0.42 0.00 0.06 0.00 0.00 31.60 32.04 3hqp h MET 298 CO 0.22 1.09 -0.81 1.28 1.06 0.00 0.00 176.91 179.74 3hqp n LEU 299 N -4.21 4.38 -0.18 1.22 4.77 -1.26 -4.61 117.00 117.12 3hqp n LEU 299 Ca -0.09 -4.87 -0.02 0.00 -0.03 0.00 0.00 56.01 51.01 3hqp n LEU 299 Cb 0.65 -0.31 0.08 0.00 -2.33 0.00 0.00 43.42 41.50 3hqp n LEU 299 CO 0.47 2.10 0.95 -0.08 -1.33 0.00 0.00 177.39 179.49 3hqp h GLU 300 N 2.50 0.31 0.00 3.23 4.57 -1.97 -0.22 114.58 122.99 3hqp h GLU 300 Ca 0.27 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.43 3hqp h GLU 300 Cb 1.14 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.66 3hqp h GLU 300 CO 0.77 0.20 0.00 0.66 -1.18 0.00 0.00 179.01 179.46 3hqp h SER 301 N 0.32 0.00 0.00 1.04 4.64 -1.93 -2.25 113.55 115.37 3hqp h SER 301 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 3hqp h SER 301 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 3hqp h SER 301 CO -0.31 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 175.88 3hqp n MET 302 N -2.84 0.89 0.14 4.77 2.81 -0.09 -1.15 117.12 121.64 3hqp n MET 302 Ca -0.01 0.00 -0.01 0.00 -1.81 0.00 0.00 57.70 55.87 3hqp n MET 302 Cb 0.15 -1.22 0.22 0.00 -0.71 0.00 0.00 33.22 31.66 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 1.38 0.00 2.03 2.02 -1.54 -3.38 112.91 113.42 3hqp h THR 303 Ca 0.00 -1.83 0.00 0.00 0.77 0.00 0.00 66.41 65.35 3hqp h THR 303 Cb 0.00 1.97 0.00 0.00 -1.74 0.00 0.00 68.15 68.38 3hqp h THR 303 CO 0.00 0.53 -0.84 -1.22 0.37 0.00 0.00 175.52 174.36 3hqp n TYR 304 N -3.91 0.00 -4.49 3.16 4.02 -0.82 -0.78 117.16 114.34 3hqp n TYR 304 Ca -0.02 0.00 -0.26 0.00 -0.01 0.00 0.00 57.90 57.62 3hqp n TYR 304 Cb 0.55 0.00 -0.13 0.00 -0.02 0.00 0.00 39.34 39.74 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 -1.80 2.72 0.00 7.72 -0.87 -0.30 -4.95 114.94 117.45 3hqp s ASN 305 Ca 0.00 -0.63 0.25 0.00 -1.57 0.00 0.00 52.86 50.90 3hqp s ASN 305 Cb 0.00 -0.19 1.27 0.00 -0.02 0.00 0.00 41.25 42.31 3hqp s ASN 305 CO 0.00 0.13 1.82 -0.81 -2.57 0.00 0.00 177.10 175.67 3hqp n PRO 306 N 1.39 0.41 -3.93 -0.60 -0.04 -1.26 -4.23 135.00 126.74 3hqp n PRO 306 Ca -0.18 0.05 -0.13 0.00 -0.04 0.00 0.00 63.50 63.20 3hqp n PRO 306 Cb 0.53 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.35 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 -2.49 0.10 0.93 0.54 0.52 -1.26 -4.92 118.95 112.37 3hqp s ARG 307 Ca 0.25 -0.02 -0.15 0.00 -0.52 0.00 0.00 55.73 55.29 3hqp s ARG 307 Cb 0.16 -0.11 0.18 0.00 0.52 0.00 0.00 34.95 35.70 3hqp s ARG 307 CO 0.36 0.01 1.29 -1.25 0.02 0.00 0.00 175.30 175.73 3hqp s PRO 308 N 0.07 0.89 0.57 3.54 0.04 -1.26 -4.68 135.00 134.17 3hqp s PRO 308 Ca -0.00 -0.34 -0.01 0.00 0.04 0.00 0.00 61.00 60.69 3hqp s PRO 308 Cb -0.02 -1.87 0.03 0.00 0.04 0.00 0.00 34.50 32.68 3hqp s PRO 308 CO -0.00 -2.25 0.82 0.95 0.04 0.00 0.00 177.00 176.55 3hqp s THR 309 N -3.82 2.81 0.17 1.26 -4.23 -1.26 -4.97 115.64 105.59 3hqp s THR 309 Ca 0.72 -0.52 -0.12 0.00 -1.18 0.00 0.00 61.69 60.59 3hqp s THR 309 Cb -0.05 -3.09 0.07 0.00 1.34 0.00 0.00 72.50 70.77 3hqp s THR 309 CO 0.52 -0.07 1.70 0.03 -0.54 0.00 0.00 174.62 176.27 3hqp h ARG 310 N -0.04 0.91 -0.29 3.99 2.47 -2.00 -2.34 114.38 117.07 3hqp h ARG 310 Ca -0.43 -0.19 0.00 0.00 -1.26 0.00 0.00 59.98 58.10 3hqp h ARG 310 Cb 1.29 -0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 29.46 3hqp h ARG 310 CO 0.55 0.80 0.19 0.00 0.56 0.00 0.00 179.97 182.08 3hqp h ALA 311 N 1.06 1.80 -0.00 0.04 0.00 -1.99 -2.24 119.26 117.92 3hqp h ALA 311 Ca 0.19 -0.02 -0.24 0.00 0.00 0.00 0.00 54.91 54.84 3hqp h ALA 311 Cb 0.27 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 17.95 3hqp h ALA 311 CO -0.01 0.19 -0.98 0.93 0.00 0.00 0.00 179.25 179.38 3hqp h GLU 312 N 0.39 0.54 0.38 0.00 5.08 -1.69 -1.87 114.58 117.41 3hqp h GLU 312 Ca 0.11 -0.58 -0.02 0.00 -1.00 0.00 0.00 59.36 57.87 3hqp h GLU 312 Cb -0.04 0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.38 3hqp h GLU 312 CO -0.02 1.20 -0.18 0.28 -1.00 0.00 0.00 179.01 179.28 3hqp h VAL 313 N 0.30 0.63 -0.89 3.13 2.07 -1.21 -2.47 116.25 117.82 3hqp h VAL 313 Ca -0.10 -0.21 0.16 0.00 0.82 0.00 0.00 66.70 67.37 3hqp h VAL 313 Cb 1.62 0.74 -0.07 0.00 -1.52 0.00 0.00 31.29 32.07 3hqp h VAL 313 CO 0.18 0.04 0.58 -1.28 0.02 0.00 0.00 177.57 177.11 3hqp h SER 314 N -0.63 0.59 -0.02 0.57 0.87 -1.45 -1.63 113.55 111.85 3hqp h SER 314 Ca -0.05 0.04 -0.18 0.00 -1.23 0.00 0.00 61.79 60.37 3hqp h SER 314 Cb 0.46 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.35 3hqp h SER 314 CO 0.09 0.28 -0.62 -0.78 -0.53 0.00 0.00 176.83 175.27 3hqp h ASP 315 N 0.61 0.72 -0.30 6.23 3.58 -1.16 -1.36 116.42 124.74 3hqp h ASP 315 Ca 0.45 -0.41 -0.13 0.00 0.42 0.00 0.00 57.03 57.36 3hqp h ASP 315 Cb 0.83 -0.21 -0.00 0.00 1.72 0.00 0.00 39.33 41.67 3hqp h ASP 315 CO -0.20 1.16 -0.31 0.58 -2.88 0.00 0.00 179.24 177.59 3hqp h VAL 316 N 0.47 1.30 -0.29 2.25 2.07 -0.97 -2.27 116.25 118.81 3hqp h VAL 316 Ca -0.01 -1.48 -0.02 0.00 0.82 0.00 0.00 66.70 66.01 3hqp h VAL 316 Cb 1.19 1.57 -0.01 0.00 -1.52 0.00 0.00 31.29 32.52 3hqp h VAL 316 CO 0.12 0.48 0.08 0.00 0.02 0.00 0.00 177.57 178.27 3hqp h ALA 317 N 0.71 0.38 0.00 1.67 0.00 -1.29 -2.68 119.26 118.05 3hqp h ALA 317 Ca 0.05 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 3hqp h ALA 317 Cb 0.89 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 3hqp h ALA 317 CO 0.08 0.01 -0.01 -0.91 0.00 0.00 0.00 179.25 178.43 3hqp h ASN 318 N 0.30 0.00 -0.16 0.00 2.35 -1.29 -0.54 115.58 116.23 3hqp h ASN 318 Ca 0.09 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.79 3hqp h ASN 318 Cb 0.25 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.62 3hqp h ASN 318 CO -0.00 0.01 -0.10 0.00 -1.65 0.00 0.00 177.43 175.69 3hqp h ALA 319 N 1.99 0.23 -0.58 -0.83 0.00 -1.07 -0.49 119.26 118.51 3hqp h ALA 319 Ca -0.00 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.64 3hqp h ALA 319 Cb 0.41 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 3hqp h ALA 319 CO 0.00 0.06 0.37 0.28 0.00 0.00 0.00 179.25 179.96 3hqp h VAL 320 N 0.01 1.12 -0.03 0.00 2.07 -1.24 -1.82 116.25 116.36 3hqp h VAL 320 Ca 0.03 -0.26 -0.03 0.00 0.82 0.00 0.00 66.70 67.26 3hqp h VAL 320 Cb 0.58 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 3hqp h VAL 320 CO 0.03 0.14 -0.14 -0.26 0.02 0.00 0.00 177.57 177.35 3hqp h PHE 321 N 0.75 0.05 -0.40 1.57 0.04 -1.07 -2.95 116.94 114.94 3hqp h PHE 321 Ca 0.22 -0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.88 3hqp h PHE 321 Cb -0.05 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.07 3hqp h PHE 321 CO -0.04 0.19 -0.19 -0.91 -0.60 0.00 0.00 178.31 176.75 3hqp h ASN 322 N 0.04 0.77 0.00 2.17 -0.26 -0.21 -3.47 115.58 114.62 3hqp h ASN 322 Ca 0.01 -0.26 0.00 0.00 -0.56 0.00 0.00 56.30 55.48 3hqp h ASN 322 Cb 0.28 -0.21 0.00 0.00 -1.06 0.00 0.00 38.32 37.33 3hqp h ASN 322 CO 0.02 0.95 0.00 0.61 -1.06 0.00 0.00 177.43 177.95 3hqp n GLY 323 N -0.30 1.17 3.73 2.83 0.00 -1.07 -4.59 105.19 106.98 3hqp n GLY 323 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 -1.27 3.33 0.14 4.61 0.00 -1.11 -4.85 121.76 122.61 3hqp s ALA 324 Ca 0.00 0.74 -0.12 0.00 0.00 0.00 0.00 51.96 52.58 3hqp s ALA 324 Cb 0.00 -3.33 -0.03 0.00 0.00 0.00 0.00 23.12 19.75 3hqp s ALA 324 CO 0.00 -0.16 1.49 -0.44 0.00 0.00 0.00 175.76 176.66 3hqp h ASP 325 N 5.29 0.94 -4.34 0.00 5.19 -1.71 -3.44 116.42 118.34 3hqp h ASP 325 Ca -0.44 -0.43 -0.45 0.00 -0.62 0.00 0.00 57.03 55.09 3hqp h ASP 325 Cb 1.21 -0.26 -0.21 0.00 0.18 0.00 0.00 39.33 40.25 3hqp h ASP 325 CO 0.72 1.17 -0.79 0.00 -3.12 0.00 0.00 179.24 177.22 3hqp s VAL 327 N -1.35 2.08 0.11 0.00 -7.23 -0.60 -1.43 120.40 111.98 3hqp s VAL 327 Ca 0.02 -1.61 0.11 0.00 -1.81 0.00 0.00 61.98 58.68 3hqp s VAL 327 Cb -0.09 -1.84 -0.04 0.00 0.56 0.00 0.00 36.38 34.97 3hqp s VAL 327 CO 0.03 0.12 -0.27 -0.32 -0.31 0.00 0.00 175.10 174.35 3hqp s MET 328 N -1.82 1.48 -0.07 4.82 1.75 -0.47 -1.47 119.30 123.51 3hqp s MET 328 Ca 0.12 -1.30 0.04 0.00 -1.25 0.00 0.00 55.69 53.29 3hqp s MET 328 Cb -0.10 -1.92 -0.02 0.00 2.84 0.00 0.00 34.83 35.64 3hqp s MET 328 CO 0.05 0.46 -0.20 -0.51 -0.65 0.00 0.00 175.02 174.17 3hqp s LEU 329 N -1.90 2.39 0.00 4.11 1.43 0.17 -4.38 118.68 120.50 3hqp s LEU 329 Ca 0.14 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 52.84 3hqp s LEU 329 Cb -0.10 -1.47 0.00 0.00 0.03 0.00 0.00 46.19 44.65 3hqp s LEU 329 CO 0.05 0.25 0.00 -1.20 0.23 0.00 0.00 176.35 175.68 3hqp n SER 330 N 2.94 0.00 -0.03 2.29 7.64 -1.26 -1.31 113.62 123.89 3hqp n SER 330 Ca -0.18 0.00 0.14 0.00 1.01 0.00 0.00 58.87 59.84 3hqp n SER 330 Cb 0.52 0.00 0.56 0.00 -1.01 0.00 0.00 64.21 64.28 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 0.38 1.17 0.23 0.00 -1.97 -0.43 103.07 102.45 3hqp h GLY 331 Ca 0.00 -0.11 0.05 0.00 0.00 0.00 0.00 47.33 47.27 3hqp h GLY 331 CO 0.00 0.06 0.42 0.83 0.00 0.00 0.00 176.54 177.86 3hqp h GLU 332 N 0.27 0.65 0.00 4.80 3.07 -1.91 -0.34 114.58 121.12 3hqp h GLU 332 Ca 0.25 -0.04 -0.17 0.00 -0.50 0.00 0.00 59.36 58.90 3hqp h GLU 332 Cb 0.62 -0.15 -0.03 0.00 -0.84 0.00 0.00 28.75 28.35 3hqp h GLU 332 CO -0.05 0.43 -1.90 0.25 -1.40 0.00 0.00 179.01 176.34 3hqp n THR 333 N -4.47 0.63 -0.11 1.13 -2.24 -1.05 -3.47 114.28 104.70 3hqp n THR 333 Ca 0.09 -0.52 -0.12 0.00 -2.27 0.00 0.00 64.05 61.23 3hqp n THR 333 Cb 0.21 -0.33 -0.03 0.00 -2.10 0.00 0.00 70.33 68.07 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 0.99 0.44 -0.13 6.98 0.00 -0.76 -3.34 119.26 123.44 3hqp h ALA 334 Ca -0.25 -0.30 -0.19 0.00 0.00 0.00 0.00 54.91 54.18 3hqp h ALA 334 Cb 1.46 -0.11 -0.33 0.00 0.00 0.00 0.00 17.79 18.81 3hqp h ALA 334 CO 0.01 0.29 -0.86 0.36 0.00 0.00 0.00 179.25 179.05 3hqp n LYS 335 N -4.44 0.67 -3.66 0.00 2.85 -0.17 -1.81 118.16 111.61 3hqp n LYS 335 Ca -0.03 -2.21 -0.23 0.00 -1.05 0.00 0.00 58.31 54.79 3hqp n LYS 335 Cb 0.34 -0.36 -0.02 0.00 -0.65 0.00 0.00 35.03 34.34 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 -2.29 1.34 0.43 2.58 0.00 -1.09 -4.93 107.32 103.36 3hqp s GLY 336 Ca 0.24 -1.03 0.23 0.00 0.00 0.00 0.00 44.72 44.17 3hqp s GLY 336 CO -0.10 -1.00 1.70 0.50 0.00 0.00 0.00 173.10 174.20 3hqp h LYS 337 N 1.08 0.00 -2.07 2.90 1.57 -1.20 -3.39 116.57 115.45 3hqp h LYS 337 Ca -0.50 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 57.74 3hqp h LYS 337 Cb 1.22 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 33.12 3hqp h LYS 337 CO 0.62 0.16 -0.91 0.66 -0.57 0.00 0.00 179.45 179.41 3hqp n TYR 338 N -3.20 2.24 -0.31 -1.35 4.01 -1.26 -4.96 117.16 112.33 3hqp n TYR 338 Ca 0.02 -3.83 -0.04 0.00 -0.16 0.00 0.00 57.90 53.89 3hqp n TYR 338 Cb 0.51 -0.43 0.08 0.00 -0.31 0.00 0.00 39.34 39.18 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 2.97 1.16 -0.14 -0.72 0.11 -1.77 -1.25 132.00 132.35 3hqp h PRO 339 Ca 0.12 -0.13 -0.09 0.00 0.11 0.00 0.00 66.00 66.01 3hqp h PRO 339 Cb 0.75 -0.23 -0.00 0.00 0.11 0.00 0.00 31.00 31.63 3hqp h PRO 339 CO 0.67 0.85 -0.24 -0.91 -0.21 0.00 0.00 178.00 178.15 3hqp h ASN 340 N 1.16 0.46 -0.66 -2.05 2.35 -1.93 -3.08 115.58 111.83 3hqp h ASN 340 Ca 0.29 -0.54 -0.01 0.00 -0.55 0.00 0.00 56.30 55.50 3hqp h ASN 340 Cb 0.02 -0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.22 3hqp h ASN 340 CO -0.05 0.91 0.38 -0.33 -1.65 0.00 0.00 177.43 176.70 3hqp h GLU 341 N 0.03 0.92 -0.24 0.81 3.07 -1.87 -0.44 114.58 116.86 3hqp h GLU 341 Ca 0.01 -0.09 -0.05 0.00 -0.50 0.00 0.00 59.36 58.73 3hqp h GLU 341 Cb 0.82 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 28.53 3hqp h GLU 341 CO 0.06 0.66 -0.04 -0.24 -1.40 0.00 0.00 179.01 178.05 3hqp h VAL 342 N 0.93 1.28 -0.53 3.13 3.04 -1.27 -0.53 116.25 122.31 3hqp h VAL 342 Ca 0.24 -1.02 -0.11 0.00 -1.01 0.00 0.00 66.70 64.80 3hqp h VAL 342 Cb -0.00 1.46 -0.02 0.00 -2.01 0.00 0.00 31.29 30.72 3hqp h VAL 342 CO -0.04 0.32 -0.10 0.58 -1.01 0.00 0.00 177.57 177.31 3hqp h VAL 343 N 0.21 1.27 -0.50 1.51 2.07 -1.41 -1.33 116.25 118.06 3hqp h VAL 343 Ca 0.06 -1.24 -0.01 0.00 0.82 0.00 0.00 66.70 66.33 3hqp h VAL 343 Cb 0.49 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 31.21 3hqp h VAL 343 CO 0.02 0.44 0.27 1.56 0.02 0.00 0.00 177.57 179.87 3hqp h GLN 344 N 0.88 0.71 -0.52 1.57 4.20 -0.98 -0.10 115.11 120.86 3hqp h GLN 344 Ca 0.14 -0.09 -0.03 0.00 0.06 0.00 0.00 58.65 58.73 3hqp h GLN 344 Cb 0.65 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.27 3hqp h GLN 344 CO 0.05 0.56 0.21 1.88 -0.67 0.00 0.00 178.83 180.85 3hqp h TYR 345 N 0.67 0.80 -0.47 2.96 0.05 -1.01 -2.20 116.97 117.77 3hqp h TYR 345 Ca 0.18 -0.06 0.00 0.00 0.05 0.00 0.00 58.73 58.89 3hqp h TYR 345 Cb 0.07 -0.24 -0.02 0.00 1.01 0.00 0.00 36.73 37.55 3hqp h TYR 345 CO -0.01 0.66 0.30 1.98 -1.05 0.00 0.00 178.16 180.03 3hqp h MET 346 N 0.70 0.63 -0.91 4.88 4.05 -0.97 0.07 114.93 123.40 3hqp h MET 346 Ca 0.17 -0.05 -0.01 0.00 -0.28 0.00 0.00 59.70 59.54 3hqp h MET 346 Cb 0.20 -0.14 -0.04 0.00 -0.80 0.00 0.00 31.60 30.82 3hqp h MET 346 CO -0.01 0.45 0.53 0.00 0.23 0.00 0.00 176.91 178.10 3hqp h ALA 347 N 1.15 1.23 -0.29 0.39 0.00 -0.92 -1.94 119.26 118.89 3hqp h ALA 347 Ca 0.17 -0.11 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 3hqp h ALA 347 Cb -0.03 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.39 3hqp h ALA 347 CO -0.03 0.65 -0.23 -0.09 0.00 0.00 0.00 179.25 179.54 3hqp h ARG 348 N 1.25 0.67 -0.65 0.00 2.43 -0.84 -1.96 114.38 115.28 3hqp h ARG 348 Ca 0.32 -0.33 -0.09 0.00 -0.81 0.00 0.00 59.98 59.07 3hqp h ARG 348 Cb -0.03 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 3hqp h ARG 348 CO -0.06 0.94 0.06 0.82 -1.51 0.00 0.00 179.97 180.22 3hqp h ILE 349 N 0.41 1.27 -0.03 1.20 2.04 -0.84 -2.18 117.51 119.38 3hqp h ILE 349 Ca 0.05 -1.10 -0.00 0.00 1.00 0.00 0.00 64.86 64.82 3hqp h ILE 349 Cb 0.78 0.69 -0.00 0.00 -0.74 0.00 0.00 36.82 37.56 3hqp h ILE 349 CO 0.06 0.41 0.02 0.00 0.00 0.00 0.00 178.15 178.63 3hqp h LEU 351 N -0.08 -0.00 0.06 0.00 3.38 -1.32 0.06 115.31 117.40 3hqp h LEU 351 Ca 0.01 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3hqp h LEU 351 Cb 0.13 0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 3hqp h LEU 351 CO -0.00 0.01 -0.06 -0.08 0.09 0.00 0.00 178.44 178.39 3hqp h GLU 352 N 0.26 -0.13 -0.63 1.13 4.57 -1.17 -2.22 114.58 116.38 3hqp h GLU 352 Ca 0.32 0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.47 3hqp h GLU 352 Cb 0.47 0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 29.06 3hqp h GLU 352 CO -0.41 -0.09 0.27 0.00 -1.18 0.00 0.00 179.01 177.60 3hqp h ALA 353 N 0.79 0.82 -0.99 2.92 0.00 -0.88 -1.64 119.26 120.28 3hqp h ALA 353 Ca 0.00 -0.16 0.19 0.00 0.00 0.00 0.00 54.91 54.95 3hqp h ALA 353 Cb 0.13 -0.25 -0.11 0.00 0.00 0.00 0.00 17.79 17.57 3hqp h ALA 353 CO -0.02 0.42 0.59 0.37 0.00 0.00 0.00 179.25 180.61 3hqp h GLN 354 N 0.88 0.69 -0.84 0.00 4.15 -0.84 0.14 115.11 119.30 3hqp h GLN 354 Ca 0.21 -0.04 0.06 0.00 0.77 0.00 0.00 58.65 59.65 3hqp h GLN 354 Cb 0.18 -0.16 -0.06 0.00 0.21 0.00 0.00 27.48 27.66 3hqp h GLN 354 CO -0.02 0.46 0.52 0.77 -1.93 0.00 0.00 178.83 178.63 3hqp h SER 355 N 0.72 0.81 1.74 -0.69 0.02 -0.66 -2.47 113.55 113.02 3hqp h SER 355 Ca 0.58 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.55 3hqp h SER 355 Cb 0.93 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.31 3hqp h SER 355 CO -0.40 0.52 0.00 0.00 -1.14 0.00 0.00 176.83 175.81 3hqp h ALA 356 N 1.40 1.00 -2.63 3.77 0.00 -0.90 -3.46 119.26 118.44 3hqp h ALA 356 Ca 0.37 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.75 3hqp h ALA 356 Cb 0.17 0.00 0.04 0.00 0.00 0.00 0.00 17.79 18.00 3hqp h ALA 356 CO -0.17 0.00 0.86 -1.17 0.00 0.00 0.00 179.25 178.77 3hqp s LEU 357 N -5.84 4.37 -1.18 0.00 2.96 0.30 -4.94 118.68 114.36 3hqp s LEU 357 Ca 0.07 2.62 -0.12 0.00 -0.22 0.00 0.00 54.13 56.48 3hqp s LEU 357 Cb 0.07 -3.60 0.21 0.00 0.50 0.00 0.00 46.19 43.37 3hqp s LEU 357 CO 0.63 -0.81 1.33 0.21 -1.32 0.00 0.00 176.35 176.39 3hqp s ASN 358 N 1.03 7.16 0.57 3.68 3.84 -1.26 -4.88 114.94 125.07 3hqp s ASN 358 Ca 0.68 -3.19 0.26 0.00 0.21 0.00 0.00 52.86 50.82 3hqp s ASN 358 Cb -0.43 -2.34 1.62 0.00 -0.55 0.00 0.00 41.25 39.55 3hqp s ASN 358 CO 0.33 -0.60 2.15 -0.33 -2.79 0.00 0.00 177.10 175.87 3hqp h GLU 359 N 7.00 0.00 0.19 0.43 3.07 -1.92 -2.23 114.58 121.11 3hqp h GLU 359 Ca 0.27 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 59.12 3hqp h GLU 359 Cb 0.87 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.79 3hqp h GLU 359 CO 1.17 0.00 -0.09 -0.92 -1.40 0.00 0.00 179.01 177.77 3hqp h TYR 360 N 0.00 -0.24 -0.90 4.33 3.20 -1.90 0.16 116.97 121.62 3hqp h TYR 360 Ca 0.05 -0.01 0.12 0.00 3.14 0.00 0.00 58.73 62.04 3hqp h TYR 360 Cb 0.28 0.08 -0.08 0.00 1.54 0.00 0.00 36.73 38.54 3hqp h TYR 360 CO 0.00 0.13 0.53 0.28 -1.64 0.00 0.00 178.16 177.46 3hqp h VAL 361 N -0.65 0.86 0.18 1.81 2.07 -1.93 -1.55 116.25 117.04 3hqp h VAL 361 Ca -0.03 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.22 3hqp h VAL 361 Cb 0.47 -0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.19 3hqp h VAL 361 CO 0.04 0.15 -0.19 0.15 0.02 0.00 0.00 177.57 177.75 3hqp h PHE 362 N 0.83 -0.49 -0.28 1.57 3.57 -1.16 -0.24 116.94 120.74 3hqp h PHE 362 Ca 0.46 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.99 3hqp h PHE 362 Cb 0.50 0.19 -0.03 0.00 2.79 0.00 0.00 35.95 39.40 3hqp h PHE 362 CO -0.04 -0.28 0.09 0.35 -2.23 0.00 0.00 178.31 176.19 3hqp h PHE 363 N -0.40 0.16 -0.63 0.41 3.57 -0.30 -2.10 116.94 117.65 3hqp h PHE 363 Ca 0.00 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.52 3hqp h PHE 363 Cb 0.38 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.06 3hqp h PHE 363 CO -0.15 0.07 0.38 -0.91 -2.23 0.00 0.00 178.31 175.47 3hqp h ASN 364 N 0.21 0.74 -0.29 0.41 2.35 -1.17 -1.61 115.58 116.23 3hqp h ASN 364 Ca 0.12 -0.04 -0.17 0.00 -0.55 0.00 0.00 56.30 55.67 3hqp h ASN 364 Cb 0.10 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.28 3hqp h ASN 364 CO -0.13 0.57 -0.49 0.28 -1.65 0.00 0.00 177.43 176.00 3hqp h SER 365 N 0.86 0.93 -0.10 5.81 0.02 -0.52 -2.46 113.55 118.09 3hqp h SER 365 Ca 0.23 -0.53 -0.01 0.00 -0.84 0.00 0.00 61.79 60.64 3hqp h SER 365 Cb -0.04 -0.27 -0.00 0.00 0.14 0.00 0.00 62.40 62.23 3hqp h SER 365 CO -0.04 1.28 0.03 0.40 -1.14 0.00 0.00 176.83 177.35 3hqp h ILE 366 N 0.62 1.19 -0.88 3.27 2.04 -1.29 -3.18 117.51 119.28 3hqp h ILE 366 Ca 0.02 -0.58 0.16 0.00 1.00 0.00 0.00 64.86 65.45 3hqp h ILE 366 Cb 1.10 1.39 -0.10 0.00 -0.74 0.00 0.00 36.82 38.48 3hqp h ILE 366 CO 0.11 0.17 0.47 0.50 0.00 0.00 0.00 178.15 179.40 3hqp h LYS 367 N -0.04 0.63 0.00 2.37 3.64 -1.20 -0.90 116.57 121.06 3hqp h LYS 367 Ca 0.03 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3hqp h LYS 367 Cb 0.24 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 3hqp h LYS 367 CO -0.00 0.42 0.00 0.87 -2.27 0.00 0.00 179.45 178.47 3hqp h LYS 368 N 0.65 0.00 -0.41 1.90 1.57 -1.42 -3.18 116.57 115.67 3hqp h LYS 368 Ca 0.49 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.27 3hqp h LYS 368 Cb 0.70 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.01 3hqp h LYS 368 CO -0.37 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 179.79 3hqp n LEU 369 N -2.41 3.39 -4.76 2.94 4.77 -0.35 -4.93 117.00 115.66 3hqp n LEU 369 Ca 0.02 -1.58 -0.38 0.00 -0.03 0.00 0.00 56.01 54.04 3hqp n LEU 369 Cb 0.28 -0.26 -0.06 0.00 -2.33 0.00 0.00 43.42 41.05 3hqp n LEU 369 CO 0.23 0.75 0.23 -1.10 -1.33 0.00 0.00 177.39 176.17 3hqp s GLN 370 N -1.34 4.27 0.21 3.23 -1.52 -1.21 -5.04 119.66 118.27 3hqp s GLN 370 Ca 0.37 0.60 -0.32 0.00 -1.95 0.00 0.00 55.36 54.06 3hqp s GLN 370 Cb 0.21 -3.36 -0.14 0.00 -0.22 0.00 0.00 33.01 29.50 3hqp s GLN 370 CO 0.29 0.34 1.35 1.58 -0.25 0.00 0.00 175.29 178.60 3hqp n HIS 371 N 2.93 1.89 -4.62 0.91 -0.00 -1.26 -4.97 115.22 110.09 3hqp n HIS 371 Ca -0.08 0.50 -0.33 0.00 -0.00 0.00 0.00 57.72 57.81 3hqp n HIS 371 Cb 0.51 -2.41 -0.13 0.00 -0.00 0.00 0.00 29.99 27.97 3hqp n HIS 371 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 3hqp s ILE 372 N -0.00 3.45 0.36 3.57 1.01 -1.26 -3.56 121.20 124.77 3hqp s ILE 372 Ca 0.71 -0.53 -0.25 0.00 0.00 0.00 0.00 60.65 60.58 3hqp s ILE 372 Cb -0.72 -2.47 -0.09 0.00 0.01 0.00 0.00 42.46 39.19 3hqp s ILE 372 CO 0.49 0.52 1.03 -2.16 0.00 0.00 0.00 174.94 174.82 3hqp s PRO 373 N 0.16 4.34 0.67 2.79 0.04 -1.26 -5.18 135.00 136.57 3hqp s PRO 373 Ca -0.05 1.49 -0.11 0.00 0.04 0.00 0.00 61.00 62.38 3hqp s PRO 373 Cb -0.14 -2.69 -0.01 0.00 0.04 0.00 0.00 34.50 31.70 3hqp s PRO 373 CO 0.04 0.02 1.06 -1.64 0.04 0.00 0.00 177.00 176.52 3hqp s MET 374 N -2.25 3.19 0.87 4.56 -1.94 -1.23 -5.07 119.30 117.42 3hqp s MET 374 Ca 0.54 0.69 -0.12 0.00 -1.71 0.00 0.00 55.69 55.09 3hqp s MET 374 Cb -0.22 -2.04 0.11 0.00 2.01 0.00 0.00 34.83 34.69 3hqp s MET 374 CO 0.28 -0.85 1.11 -1.54 -0.01 0.00 0.00 175.02 174.01 3hqp s SER 375 N -4.16 3.85 0.18 3.03 1.04 -1.26 -4.87 113.70 111.51 3hqp s SER 375 Ca 0.57 1.22 -0.13 0.00 0.48 0.00 0.00 55.95 58.09 3hqp s SER 375 Cb -0.12 -1.89 0.09 0.00 0.10 0.00 0.00 66.02 64.20 3hqp s SER 375 CO 0.54 -2.37 1.80 0.00 0.98 0.00 0.00 173.24 174.19 3hqp h ALA 376 N -1.36 0.77 -0.40 5.32 0.00 -1.97 -2.05 119.26 119.56 3hqp h ALA 376 Ca -0.49 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.22 3hqp h ALA 376 Cb 1.30 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 3hqp h ALA 376 CO 0.59 0.27 -0.17 0.38 0.00 0.00 0.00 179.25 180.31 3hqp h ASP 377 N 0.81 0.84 -0.69 0.00 2.03 -1.94 -1.60 116.42 115.87 3hqp h ASP 377 Ca 0.21 -0.40 -0.02 0.00 -0.73 0.00 0.00 57.03 56.10 3hqp h ASP 377 Cb 0.02 -0.23 -0.03 0.00 -0.83 0.00 0.00 39.33 38.25 3hqp h ASP 377 CO -0.04 1.05 0.37 -0.08 -1.03 0.00 0.00 179.24 179.51 3hqp h GLU 378 N 0.63 0.98 -0.64 4.15 4.81 -1.85 -2.16 114.58 120.49 3hqp h GLU 378 Ca 0.09 -0.12 -0.05 0.00 -0.13 0.00 0.00 59.36 59.15 3hqp h GLU 378 Cb 0.73 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.89 3hqp h GLU 378 CO 0.05 0.74 0.22 0.00 -0.73 0.00 0.00 179.01 179.29 3hqp h ALA 379 N 1.18 1.17 -0.63 2.92 0.00 -1.17 -0.11 119.26 122.63 3hqp h ALA 379 Ca 0.24 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 3hqp h ALA 379 Cb 0.06 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 3hqp h ALA 379 CO -0.04 0.58 0.24 0.28 0.00 0.00 0.00 179.25 180.31 3hqp h VAL 380 N 0.94 1.23 -0.01 0.00 2.07 -1.00 0.24 116.25 119.71 3hqp h VAL 380 Ca 0.21 -0.73 -0.09 0.00 0.82 0.00 0.00 66.70 66.91 3hqp h VAL 380 Cb 0.24 0.49 0.01 0.00 -1.52 0.00 0.00 31.29 30.51 3hqp h VAL 380 CO -0.01 0.29 -0.34 0.00 0.02 0.00 0.00 177.57 177.53 3hqp h SER 382 N -0.36 -0.79 -0.04 0.00 0.87 -1.00 -0.89 113.55 111.34 3hqp h SER 382 Ca -0.04 0.14 -0.15 0.00 -1.23 0.00 0.00 61.79 60.51 3hqp h SER 382 Cb 1.07 0.36 -0.01 0.00 -0.44 0.00 0.00 62.40 63.38 3hqp h SER 382 CO 0.07 -0.29 -0.46 0.28 -0.53 0.00 0.00 176.83 175.89 3hqp h SER 383 N -0.28 0.63 -0.83 6.23 0.02 -1.01 -1.57 113.55 116.74 3hqp h SER 383 Ca 0.12 -0.31 0.13 0.00 -0.84 0.00 0.00 61.79 60.90 3hqp h SER 383 Cb 0.47 -0.18 -0.09 0.00 0.14 0.00 0.00 62.40 62.74 3hqp h SER 383 CO -0.36 1.00 0.44 0.00 -1.14 0.00 0.00 176.83 176.77 3hqp h ALA 384 N 1.02 1.22 -0.37 3.77 0.00 -0.68 0.52 119.26 124.74 3hqp h ALA 384 Ca 0.03 0.07 -0.16 0.00 0.00 0.00 0.00 54.91 54.85 3hqp h ALA 384 Cb 0.99 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 3hqp h ALA 384 CO 0.09 -0.04 -0.39 0.28 0.00 0.00 0.00 179.25 179.19 3hqp h VAL 385 N 0.66 1.27 -0.40 0.00 2.07 -0.70 -2.00 116.25 117.15 3hqp h VAL 385 Ca 0.44 -1.56 0.08 0.00 0.82 0.00 0.00 66.70 66.48 3hqp h VAL 385 Cb 0.55 1.41 -0.09 0.00 -1.52 0.00 0.00 31.29 31.65 3hqp h VAL 385 CO -0.32 0.52 -0.21 -1.13 0.02 0.00 0.00 177.57 176.44 3hqp h ASN 386 N 0.74 -0.73 -0.97 0.57 -1.24 -0.78 -2.16 115.58 111.01 3hqp h ASN 386 Ca 0.06 0.16 0.18 0.00 0.71 0.00 0.00 56.30 57.40 3hqp h ASN 386 Cb 0.99 0.38 -0.10 0.00 0.73 0.00 0.00 38.32 40.32 3hqp h ASN 386 CO 0.10 -0.24 0.57 0.28 -1.29 0.00 0.00 177.43 176.84 3hqp h SER 387 N -0.14 0.73 0.06 1.15 0.02 -0.64 -1.47 113.55 113.26 3hqp h SER 387 Ca 0.20 0.10 0.01 0.00 -0.84 0.00 0.00 61.79 61.25 3hqp h SER 387 Cb 0.45 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.94 3hqp h SER 387 CO -0.49 0.27 -0.10 0.58 -1.14 0.00 0.00 176.83 175.95 3hqp h VAL 388 N 0.74 0.76 -0.55 2.27 2.07 -0.75 -1.53 116.25 119.26 3hqp h VAL 388 Ca 0.55 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 68.01 3hqp h VAL 388 Cb 0.83 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 3hqp h VAL 388 CO -0.38 0.00 0.10 1.88 0.02 0.00 0.00 177.57 179.19 3hqp h TYR 389 N -0.20 0.90 -0.08 1.57 0.05 -0.97 -0.98 116.97 117.27 3hqp h TYR 389 Ca 0.02 -0.10 -0.12 0.00 0.05 0.00 0.00 58.73 58.58 3hqp h TYR 389 Cb 0.21 -0.26 -0.01 0.00 1.01 0.00 0.00 36.73 37.68 3hqp h TYR 389 CO -0.13 0.77 -0.51 0.93 -1.05 0.00 0.00 178.16 178.17 3hqp h GLU 390 N 0.83 0.20 -0.01 4.88 5.08 -1.00 -3.12 114.58 121.43 3hqp h GLU 390 Ca 0.17 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3hqp h GLU 390 Cb 0.35 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.61 3hqp h GLU 390 CO 0.00 0.66 -0.63 0.25 -1.00 0.00 0.00 179.01 178.30 3hqp n THR 391 N -3.95 0.00 -3.73 1.13 -2.24 -0.60 -4.98 114.28 99.91 3hqp n THR 391 Ca -0.02 -0.19 -0.23 0.00 -2.27 0.00 0.00 64.05 61.35 3hqp n THR 391 Cb 0.54 1.17 0.02 0.00 -2.10 0.00 0.00 70.33 69.96 3hqp n THR 391 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3hqp n LYS 392 N -0.51 -4.15 -2.14 -0.78 5.02 -0.44 -4.95 118.16 110.21 3hqp n LYS 392 Ca 0.07 0.57 -0.38 0.00 -2.02 0.00 0.00 58.31 56.55 3hqp n LYS 392 Cb 0.41 -4.97 -0.00 0.00 -0.02 0.00 0.00 35.03 30.44 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 -3.70 3.08 -2.01 7.82 0.00 -0.82 -4.80 121.76 121.32 3hqp s ALA 393 Ca 0.06 1.08 0.23 0.00 0.00 0.00 0.00 51.96 53.34 3hqp s ALA 393 Cb -0.02 -3.44 0.16 0.00 0.00 0.00 0.00 23.12 19.82 3hqp s ALA 393 CO 0.83 -0.77 1.19 1.63 0.00 0.00 0.00 175.76 178.64 3hqp n LYS 394 N -0.25 1.17 -3.68 0.00 5.02 -0.99 -4.82 118.16 114.61 3hqp n LYS 394 Ca 0.06 -0.93 -0.09 0.00 -2.02 0.00 0.00 58.31 55.34 3hqp n LYS 394 Cb 0.46 -1.48 -0.02 0.00 -0.02 0.00 0.00 35.03 33.97 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 -2.47 -1.38 0.05 7.82 0.00 -1.25 -4.31 121.76 120.22 3hqp s ALA 395 Ca 0.20 0.02 0.04 0.00 0.00 0.00 0.00 51.96 52.22 3hqp s ALA 395 Cb 0.18 0.86 -0.02 0.00 0.00 0.00 0.00 23.12 24.14 3hqp s ALA 395 CO 0.55 -0.93 -0.12 1.41 0.00 0.00 0.00 175.76 176.67 3hqp s MET 396 N -3.83 0.76 -0.08 0.00 1.75 -0.89 -2.45 119.30 114.56 3hqp s MET 396 Ca 0.07 -0.77 -0.00 0.00 -1.25 0.00 0.00 55.69 53.74 3hqp s MET 396 Cb -0.04 -0.71 0.02 0.00 2.84 0.00 0.00 34.83 36.95 3hqp s MET 396 CO -0.01 0.16 -0.04 0.08 -0.65 0.00 0.00 175.02 174.56 3hqp s VAL 397 N -1.05 0.67 -0.05 10.11 1.01 -0.19 -1.00 120.40 129.91 3hqp s VAL 397 Ca -0.02 -0.11 0.03 0.00 0.00 0.00 0.00 61.98 61.87 3hqp s VAL 397 Cb -0.09 -0.73 0.01 0.00 0.00 0.00 0.00 36.38 35.57 3hqp s VAL 397 CO 0.01 0.29 -0.12 0.54 0.00 0.00 0.00 175.10 175.82 3hqp s VAL 398 N 1.51 1.11 -0.29 2.92 0.11 -0.38 -0.31 120.40 125.06 3hqp s VAL 398 Ca -0.01 -0.50 -0.19 0.00 -2.93 0.00 0.00 61.98 58.35 3hqp s VAL 398 Cb -0.13 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 33.70 3hqp s VAL 398 CO -0.04 0.34 0.59 -0.76 -3.33 0.00 0.00 175.10 171.90 3hqp s LEU 399 N 0.46 4.14 -0.05 2.54 1.43 -0.92 -1.66 118.68 124.62 3hqp s LEU 399 Ca -0.10 0.42 -0.02 0.00 -1.03 0.00 0.00 54.13 53.40 3hqp s LEU 399 Cb -0.14 -2.75 0.04 0.00 0.03 0.00 0.00 46.19 43.37 3hqp s LEU 399 CO 0.03 -0.42 0.09 -0.55 0.23 0.00 0.00 176.35 175.73 3hqp s SER 400 N 1.62 0.63 -0.10 2.29 0.15 -1.12 -4.83 113.70 112.33 3hqp s SER 400 Ca 0.23 0.18 0.03 0.00 0.70 0.00 0.00 55.95 57.09 3hqp s SER 400 Cb -0.15 0.04 -0.24 0.00 -1.71 0.00 0.00 66.02 63.95 3hqp s SER 400 CO 0.11 -0.21 0.44 0.59 1.20 0.00 0.00 173.24 175.37 3hqp n ASN 401 N 4.92 1.52 0.06 5.45 4.13 -1.26 -4.21 115.26 125.86 3hqp n ASN 401 Ca -0.12 0.26 0.11 0.00 1.68 0.00 0.00 54.58 56.51 3hqp n ASN 401 Cb 0.50 -0.43 -0.07 0.00 -1.54 0.00 0.00 39.78 38.24 3hqp n ASN 401 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 3hqp n THR 402 N -3.26 0.40 0.00 3.41 -2.24 -1.26 -4.47 114.28 106.85 3hqp n THR 402 Ca -0.27 -0.54 0.00 0.00 -2.27 0.00 0.00 64.05 60.97 3hqp n THR 402 Cb 1.05 -0.22 0.00 0.00 -2.10 0.00 0.00 70.33 69.06 3hqp n THR 402 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hqp n GLY 403 N 1.22 1.95 0.14 3.38 0.00 -1.26 -4.91 105.19 105.72 3hqp n GLY 403 Ca -0.02 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.94 3hqp n GLY 403 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3hqp h ARG 404 N 2.72 0.18 -0.73 1.61 0.11 -1.93 -1.10 114.38 115.24 3hqp h ARG 404 Ca 0.00 -0.15 0.01 0.00 0.10 0.00 0.00 59.98 59.94 3hqp h ARG 404 Cb 0.00 0.03 -0.04 0.00 1.11 0.00 0.00 29.97 31.08 3hqp h ARG 404 CO 0.00 0.82 0.48 0.77 0.10 0.00 0.00 179.97 182.14 3hqp h SER 405 N 0.12 0.82 -0.56 0.08 0.02 -1.94 -0.47 113.55 111.62 3hqp h SER 405 Ca -0.02 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.89 3hqp h SER 405 Cb 1.27 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 63.59 3hqp h SER 405 CO 0.11 0.59 0.28 0.00 -1.14 0.00 0.00 176.83 176.66 3hqp h ALA 406 N 1.28 0.72 -0.22 3.77 0.00 -1.80 -1.17 119.26 121.83 3hqp h ALA 406 Ca 0.27 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 3hqp h ALA 406 Cb -0.09 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 3hqp h ALA 406 CO -0.07 0.27 -0.38 0.00 0.00 0.00 0.00 179.25 179.08 3hqp h ARG 407 N 0.75 0.50 -0.66 0.00 3.08 -1.07 -2.22 114.38 114.77 3hqp h ARG 407 Ca 0.19 -0.24 -0.06 0.00 0.07 0.00 0.00 59.98 59.94 3hqp h ARG 407 Cb 0.10 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 3hqp h ARG 407 CO -0.03 0.80 0.17 1.25 -1.07 0.00 0.00 179.97 181.10 3hqp h LEU 408 N 0.42 0.97 -0.07 3.04 5.85 -0.80 -0.32 115.31 124.40 3hqp h LEU 408 Ca 0.04 -0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.55 3hqp h LEU 408 Cb 0.85 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.63 3hqp h LEU 408 CO 0.07 0.92 -0.05 0.58 -0.34 0.00 0.00 178.44 179.62 3hqp h VAL 409 N 0.98 1.35 -0.32 1.05 2.07 -1.09 -3.22 116.25 117.08 3hqp h VAL 409 Ca 0.21 -1.13 -0.03 0.00 0.82 0.00 0.00 66.70 66.58 3hqp h VAL 409 Cb 0.33 1.95 -0.02 0.00 -1.52 0.00 0.00 31.29 32.03 3hqp h VAL 409 CO -0.00 0.31 0.08 0.00 0.02 0.00 0.00 177.57 177.98 3hqp h ALA 410 N 0.59 1.55 -1.11 1.67 0.00 -1.32 -1.22 119.26 119.42 3hqp h ALA 410 Ca 0.01 -0.13 0.35 0.00 0.00 0.00 0.00 54.91 55.15 3hqp h ALA 410 Cb 0.52 -0.14 -0.13 0.00 0.00 0.00 0.00 17.79 18.04 3hqp h ALA 410 CO 0.01 0.34 0.68 -0.22 0.00 0.00 0.00 179.25 180.06 3hqp h LYS 411 N 0.45 0.23 -0.01 0.00 3.64 -1.06 -1.58 116.57 118.24 3hqp h LYS 411 Ca 0.11 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3hqp h LYS 411 Cb 0.18 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 3hqp h LYS 411 CO -0.00 0.15 -0.01 0.66 -2.27 0.00 0.00 179.45 177.98 3hqp n TYR 412 N -4.87 0.00 -3.37 1.91 4.01 -0.46 -4.97 117.16 109.41 3hqp n TYR 412 Ca 0.33 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.95 3hqp n TYR 412 Cb 1.13 -0.01 0.01 0.00 -0.31 0.00 0.00 39.34 40.16 3hqp n TYR 412 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3hqp n ARG 413 N 0.09 -1.41 -1.46 -0.72 5.12 -0.60 -4.22 116.66 113.45 3hqp n ARG 413 Ca 0.19 1.14 -0.32 0.00 -1.93 0.00 0.00 57.85 56.93 3hqp n ARG 413 Cb 0.34 -4.45 0.07 0.00 -1.16 0.00 0.00 32.46 27.27 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 -3.96 2.46 -0.44 5.56 0.04 -1.26 -4.51 135.00 132.88 3hqp s PRO 414 Ca 0.06 1.28 -0.00 0.00 0.04 0.00 0.00 61.00 62.38 3hqp s PRO 414 Cb -0.02 -1.91 0.36 0.00 0.04 0.00 0.00 34.50 32.97 3hqp s PRO 414 CO 0.81 -1.50 1.94 0.27 0.04 0.00 0.00 177.00 178.56 3hqp n ASN 415 N -3.05 6.20 -3.82 6.66 6.94 -1.26 -4.89 115.26 122.05 3hqp n ASN 415 Ca 0.10 -3.34 -0.10 0.00 -0.02 0.00 0.00 54.58 51.22 3hqp n ASN 415 Cb 0.52 -0.96 -0.05 0.00 -2.36 0.00 0.00 39.78 36.94 3hqp n ASN 415 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3hqp s PRO 417 N -3.90 3.74 -0.19 0.00 0.02 -1.26 -4.89 135.00 128.53 3hqp s PRO 417 Ca 0.11 1.91 -0.07 0.00 0.02 0.00 0.00 61.00 62.97 3hqp s PRO 417 Cb 0.02 -2.48 -0.04 0.00 0.02 0.00 0.00 34.50 32.02 3hqp s PRO 417 CO -0.04 -0.60 0.06 0.42 -0.33 0.00 0.00 177.00 176.50 3hqp s ILE 418 N -1.44 4.64 -0.34 2.83 1.01 -0.75 -2.09 121.20 125.06 3hqp s ILE 418 Ca 0.63 -0.08 -0.06 0.00 0.00 0.00 0.00 60.65 61.14 3hqp s ILE 418 Cb -0.32 -3.10 0.05 0.00 0.01 0.00 0.00 42.46 39.10 3hqp s ILE 418 CO 0.39 0.44 0.10 -0.69 0.00 0.00 0.00 174.94 175.19 3hqp s VAL 419 N 0.60 3.66 -0.12 2.92 1.01 -0.17 -0.64 120.40 127.66 3hqp s VAL 419 Ca 0.03 -1.25 -0.20 0.00 0.00 0.00 0.00 61.98 60.57 3hqp s VAL 419 Cb -0.13 -3.11 -0.04 0.00 0.00 0.00 0.00 36.38 33.10 3hqp s VAL 419 CO 0.01 -0.22 0.54 0.00 0.00 0.00 0.00 175.10 175.44 3hqp s VAL 421 N 0.84 3.93 0.06 0.00 1.01 -0.66 -0.06 120.40 125.51 3hqp s VAL 421 Ca 0.29 -0.31 0.05 0.00 0.00 0.00 0.00 61.98 62.01 3hqp s VAL 421 Cb -0.16 -2.82 -0.03 0.00 0.00 0.00 0.00 36.38 33.38 3hqp s VAL 421 CO 0.12 0.37 -0.13 0.28 0.00 0.00 0.00 175.10 175.74 3hqp s THR 422 N 1.56 1.05 -2.34 3.92 -1.32 0.06 -2.79 115.64 115.78 3hqp s THR 422 Ca 0.06 -1.15 0.22 0.00 -1.21 0.00 0.00 61.69 59.61 3hqp s THR 422 Cb -0.15 -1.00 0.45 0.00 -1.51 0.00 0.00 72.50 70.30 3hqp s THR 422 CO 0.01 -0.15 1.44 0.35 -2.21 0.00 0.00 174.62 174.06 3hqp n THR 423 N 1.55 0.51 -4.07 5.08 -2.24 -1.26 0.13 114.28 113.98 3hqp n THR 423 Ca -0.20 -0.68 -0.27 0.00 -2.27 0.00 0.00 64.05 60.63 3hqp n THR 423 Cb 0.54 0.74 -0.17 0.00 -2.10 0.00 0.00 70.33 69.34 3hqp n THR 423 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3hqp s ARG 424 N -1.49 1.69 0.34 -0.78 0.52 -1.26 -4.78 118.95 113.18 3hqp s ARG 424 Ca 0.38 -0.34 0.02 0.00 -0.52 0.00 0.00 55.73 55.27 3hqp s ARG 424 Cb 0.21 -1.64 0.60 0.00 0.52 0.00 0.00 34.95 34.64 3hqp s ARG 424 CO 0.30 -0.20 1.99 -0.07 0.02 0.00 0.00 175.30 177.33 3hqp h LEU 425 N 7.91 0.78 -1.16 2.53 4.07 -1.95 -2.55 115.31 124.95 3hqp h LEU 425 Ca -0.31 -0.02 -0.07 0.00 0.08 0.00 0.00 57.88 57.56 3hqp h LEU 425 Cb 1.14 -0.19 -0.01 0.00 1.08 0.00 0.00 40.66 42.68 3hqp h LEU 425 CO 0.44 0.56 -0.21 -0.61 -1.08 0.00 0.00 178.44 177.54 3hqp h GLN 426 N 0.92 0.32 -0.33 1.13 4.15 -1.96 -2.47 115.11 116.86 3hqp h GLN 426 Ca 0.27 -0.10 -0.03 0.00 0.77 0.00 0.00 58.65 59.56 3hqp h GLN 426 Cb -0.04 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.61 3hqp h GLN 426 CO -0.07 0.53 0.10 1.15 -1.93 0.00 0.00 178.83 178.61 3hqp h THR 427 N 0.30 1.21 -0.61 2.39 2.02 -1.76 0.34 112.91 116.80 3hqp h THR 427 Ca 0.05 -0.69 0.12 0.00 0.77 0.00 0.00 66.41 66.66 3hqp h THR 427 Cb 0.54 1.04 -0.12 0.00 -1.74 0.00 0.00 68.15 67.87 3hqp h THR 427 CO 0.04 0.23 -0.21 0.00 0.37 0.00 0.00 175.52 175.95 3hqp h ARG 429 N -0.05 0.17 0.00 0.00 3.08 -1.22 -3.16 114.38 113.19 3hqp h ARG 429 Ca 0.28 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.25 3hqp h ARG 429 Cb 0.49 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.54 3hqp h ARG 429 CO -0.65 0.53 -0.03 1.96 -1.07 0.00 0.00 179.97 180.71 3hqp h GLN 430 N -0.19 0.00 0.00 0.04 4.20 0.07 -1.50 115.11 117.73 3hqp h GLN 430 Ca 0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.73 3hqp h GLN 430 Cb 0.48 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.26 3hqp h GLN 430 CO 0.01 0.03 0.00 1.28 -0.67 0.00 0.00 178.83 179.48 3hqp n LEU 431 N -4.29 0.00 0.18 1.46 4.77 -0.05 -3.44 117.00 115.63 3hqp n LEU 431 Ca -0.03 0.31 0.13 0.00 -0.03 0.00 0.00 56.01 56.39 3hqp n LEU 431 Cb 0.11 -0.31 0.62 0.00 -2.33 0.00 0.00 43.42 41.51 3hqp n LEU 431 CO 0.32 -0.04 0.88 0.78 -1.33 0.00 0.00 177.39 178.01 3hqp h ASN 432 N 0.00 0.00 -0.52 -1.43 4.21 -1.34 -1.62 115.58 114.88 3hqp h ASN 432 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 3hqp h ASN 432 Cb 0.27 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.47 3hqp h ASN 432 CO 0.00 0.00 0.00 2.30 -1.29 0.00 0.00 177.43 178.44 3hqp n ILE 433 N -2.39 0.69 -3.78 2.81 -5.35 -1.22 -4.76 119.36 105.36 3hqp n ILE 433 Ca -0.00 -0.84 -0.36 0.00 -0.27 0.00 0.00 62.75 61.27 3hqp n ILE 433 Cb 0.13 0.81 -0.13 0.00 -1.74 0.00 0.00 39.64 38.71 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 -1.31 4.22 0.58 7.28 2.01 -0.61 -4.60 115.64 123.22 3hqp s THR 434 Ca 0.43 -0.20 -0.20 0.00 0.31 0.00 0.00 61.69 62.03 3hqp s THR 434 Cb 0.24 -2.97 -0.05 0.00 0.01 0.00 0.00 72.50 69.74 3hqp s THR 434 CO 0.32 0.35 1.11 1.67 -0.69 0.00 0.00 174.62 177.39 3hqp n GLN 435 N 4.86 1.15 -0.91 4.92 0.00 -1.26 -3.85 117.38 122.30 3hqp n GLN 435 Ca -0.16 0.44 0.00 0.00 -0.00 0.00 0.00 57.00 57.27 3hqp n GLN 435 Cb 0.51 -2.31 0.00 0.00 0.00 0.00 0.00 30.24 28.44 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 1.10 0.69 3.38 1.69 0.00 -0.11 -4.87 105.19 107.06 3hqp n GLY 436 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.98 2.49 0.00 1.61 1.01 -1.25 -1.80 120.40 119.48 3hqp s VAL 437 Ca 0.00 -0.94 0.06 0.00 0.00 0.00 0.00 61.98 61.10 3hqp s VAL 437 Cb 0.00 -1.92 -0.02 0.00 0.00 0.00 0.00 36.38 34.44 3hqp s VAL 437 CO 0.00 0.58 -0.19 -1.61 0.00 0.00 0.00 175.10 173.88 3hqp s GLU 438 N -0.61 1.47 -0.08 2.72 2.02 0.18 -4.94 118.70 119.46 3hqp s GLU 438 Ca 0.09 -0.74 -0.00 0.00 0.02 0.00 0.00 54.97 54.35 3hqp s GLU 438 Cb -0.11 -1.46 -0.03 0.00 0.10 0.00 0.00 34.13 32.64 3hqp s GLU 438 CO 0.00 0.39 -0.06 -1.12 0.02 0.00 0.00 175.26 174.50 3hqp s SER 439 N -0.64 4.75 -0.11 -0.19 0.01 -1.26 -0.27 113.70 115.99 3hqp s SER 439 Ca 0.07 -0.01 0.04 0.00 1.31 0.00 0.00 55.95 57.36 3hqp s SER 439 Cb -0.08 -1.28 0.00 0.00 0.21 0.00 0.00 66.02 64.88 3hqp s SER 439 CO -0.00 0.35 -0.23 -0.69 0.41 0.00 0.00 173.24 173.07 3hqp s VAL 440 N -0.70 2.06 -0.13 3.43 1.01 0.91 -4.96 120.40 122.02 3hqp s VAL 440 Ca 0.11 -1.01 -0.21 0.00 0.00 0.00 0.00 61.98 60.87 3hqp s VAL 440 Cb -0.11 -1.79 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 3hqp s VAL 440 CO 0.02 0.56 0.60 0.12 0.00 0.00 0.00 175.10 176.39 3hqp s PHE 441 N 0.45 3.48 -0.35 5.22 5.36 -1.26 -0.76 117.98 130.12 3hqp s PHE 441 Ca -0.16 1.01 -0.08 0.00 -0.96 0.00 0.00 56.93 56.74 3hqp s PHE 441 Cb -0.17 -2.72 0.04 0.00 -0.34 0.00 0.00 43.02 39.83 3hqp s PHE 441 CO 0.06 0.02 0.14 0.12 -1.46 0.00 0.00 175.22 174.11 3hqp s PHE 442 N 1.15 3.26 -0.88 10.12 5.36 0.34 -4.90 117.98 132.43 3hqp s PHE 442 Ca 0.30 -1.29 -0.25 0.00 -0.96 0.00 0.00 56.93 54.73 3hqp s PHE 442 Cb -0.16 -2.36 0.03 0.00 -0.34 0.00 0.00 43.02 40.19 3hqp s PHE 442 CO 0.13 -0.71 1.46 0.34 -1.46 0.00 0.00 175.22 174.97 3hqp s ASP 443 N 1.48 6.17 0.54 6.13 2.15 -1.26 -4.17 116.67 127.71 3hqp s ASP 443 Ca -0.00 -0.88 0.33 0.00 0.43 0.00 0.00 52.55 52.42 3hqp s ASP 443 Cb -0.20 -2.56 1.39 0.00 -0.30 0.00 0.00 42.92 41.26 3hqp s ASP 443 CO 0.04 -1.80 2.00 0.00 -0.17 0.00 0.00 175.17 175.24 3hqp h ALA 444 N 10.38 1.03 -0.27 3.66 0.00 -1.87 0.63 119.26 132.82 3hqp h ALA 444 Ca -0.02 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 3hqp h ALA 444 Cb 1.04 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 3hqp h ALA 444 CO 1.34 0.06 -0.27 -0.44 0.00 0.00 0.00 179.25 179.94 3hqp h ASP 445 N 0.00 0.71 0.44 0.00 3.32 -1.88 -1.53 116.42 117.48 3hqp h ASP 445 Ca -0.00 -0.47 0.00 0.00 0.02 0.00 0.00 57.03 56.58 3hqp h ASP 445 Cb 0.49 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.84 3hqp h ASP 445 CO 0.01 1.04 -1.51 2.29 -1.72 0.00 0.00 179.24 179.34 3hqp n LYS 446 N -4.30 0.60 0.00 3.56 2.85 -1.11 -4.49 118.16 115.27 3hqp n LYS 446 Ca -0.04 -0.05 0.05 0.00 -1.05 0.00 0.00 58.31 57.22 3hqp n LYS 446 Cb 0.46 -1.65 0.01 0.00 -0.65 0.00 0.00 35.03 33.19 3hqp n LYS 446 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 3hqp n LEU 447 N -2.40 1.31 0.00 -5.58 4.77 0.20 -5.11 117.00 110.18 3hqp n LEU 447 Ca -0.02 -0.81 0.00 0.00 -0.03 0.00 0.00 56.01 55.15 3hqp n LEU 447 Cb 0.55 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.64 3hqp n LEU 447 CO 0.43 0.26 0.00 0.61 -1.33 0.00 0.00 177.39 177.36 3hqp n GLY 448 N 0.83 0.18 0.09 -0.72 0.00 -0.58 -4.76 105.19 100.22 3hqp n GLY 448 Ca 0.04 -1.76 0.13 0.00 0.00 0.00 0.00 46.02 44.43 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 0.32 0.76 -3.39 1.61 -0.00 -1.26 -4.39 115.22 108.88 3hqp n HIS 449 Ca 0.00 0.22 -0.15 0.00 -0.00 0.00 0.00 57.72 57.79 3hqp n HIS 449 Cb 0.00 -0.85 0.02 0.00 -0.00 0.00 0.00 29.99 29.16 3hqp n HIS 449 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.34 172.87 3hqp n ASP 450 N -2.13 -6.43 0.18 0.41 2.03 -1.26 -4.92 116.55 104.43 3hqp n ASP 450 Ca 0.06 -0.60 0.10 0.00 0.52 0.00 0.00 54.79 54.87 3hqp n ASP 450 Cb 0.42 -4.16 0.11 0.00 -0.72 0.00 0.00 41.12 36.77 3hqp n ASP 450 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 3hqp h GLU 451 N -0.59 0.00 0.00 -0.67 9.09 -2.01 -2.75 114.58 117.65 3hqp h GLU 451 Ca -0.40 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.01 3hqp h GLU 451 Cb 1.22 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.32 3hqp h GLU 451 CO 0.39 0.11 0.00 0.41 0.05 0.00 0.00 179.01 179.96 3hqp n GLY 452 N 1.14 -1.49 3.61 1.06 0.00 -1.26 -4.88 105.19 103.38 3hqp n GLY 452 Ca 0.03 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.95 3hqp n GLY 452 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3hqp n LYS 453 N -1.50 0.00 -0.13 1.61 4.76 -1.04 -4.89 118.16 116.98 3hqp n LYS 453 Ca 0.07 0.00 -0.11 0.00 -2.87 0.00 0.00 58.31 55.40 3hqp n LYS 453 Cb 0.34 -3.38 -0.02 0.00 -1.84 0.00 0.00 35.03 30.12 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 1.37 0.68 -0.77 1.97 3.07 -1.92 -2.33 114.58 116.65 3hqp h GLU 454 Ca 0.00 -0.24 -0.03 0.00 -0.50 0.00 0.00 59.36 58.59 3hqp h GLU 454 Cb 0.00 -0.05 -0.04 0.00 -0.84 0.00 0.00 28.75 27.82 3hqp h GLU 454 CO 0.00 0.81 0.36 0.45 -1.40 0.00 0.00 179.01 179.23 3hqp h HIS 455 N 0.48 1.11 -0.46 4.33 3.86 -1.92 0.51 115.15 123.06 3hqp h HIS 455 Ca 0.10 -0.06 -0.13 0.00 -1.16 0.00 0.00 60.37 59.12 3hqp h HIS 455 Cb 0.53 -0.34 -0.01 0.00 1.06 0.00 0.00 27.41 28.64 3hqp h HIS 455 CO 0.04 0.82 -0.23 0.00 0.86 0.00 0.00 177.93 179.42 3hqp h ARG 456 N 1.09 0.97 -0.50 2.45 3.08 -1.91 -0.90 114.38 118.66 3hqp h ARG 456 Ca 0.26 -0.43 -0.02 0.00 0.07 0.00 0.00 59.98 59.86 3hqp h ARG 456 Cb 0.13 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.13 3hqp h ARG 456 CO -0.03 1.10 0.22 0.28 -1.07 0.00 0.00 179.97 180.47 3hqp h VAL 457 N 0.81 1.20 -0.79 2.04 2.07 -1.20 -2.24 116.25 118.14 3hqp h VAL 457 Ca 0.10 -0.60 0.05 0.00 0.82 0.00 0.00 66.70 67.07 3hqp h VAL 457 Cb 0.81 0.67 -0.05 0.00 -1.52 0.00 0.00 31.29 31.19 3hqp h VAL 457 CO 0.07 0.23 0.49 0.00 0.02 0.00 0.00 177.57 178.38 3hqp h ALA 458 N 1.07 1.07 -0.46 1.67 0.00 -0.71 -1.47 119.26 120.42 3hqp h ALA 458 Ca 0.17 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 3hqp h ALA 458 Cb 0.15 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3hqp h ALA 458 CO -0.02 0.25 -0.06 0.00 0.00 0.00 0.00 179.25 179.42 3hqp h ALA 459 N 1.36 1.02 -0.34 0.00 0.00 -0.93 -0.02 119.26 120.36 3hqp h ALA 459 Ca 0.34 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 3hqp h ALA 459 Cb 0.11 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3hqp h ALA 459 CO -0.15 0.60 -0.15 0.78 0.00 0.00 0.00 179.25 180.33 3hqp h GLY 460 N 0.98 0.76 0.94 0.00 0.00 -1.02 -2.04 103.07 102.68 3hqp h GLY 460 Ca 0.13 -0.67 -0.09 0.00 0.00 0.00 0.00 47.33 46.70 3hqp h GLY 460 CO 0.03 0.61 -0.14 -2.08 0.00 0.00 0.00 176.54 174.96 3hqp h VAL 461 N 0.47 1.29 -0.75 4.60 2.07 -1.03 -1.50 116.25 121.41 3hqp h VAL 461 Ca 0.08 -1.24 -0.03 0.00 0.82 0.00 0.00 66.70 66.32 3hqp h VAL 461 Cb 0.68 1.39 -0.03 0.00 -1.52 0.00 0.00 31.29 31.81 3hqp h VAL 461 CO 0.05 0.40 0.35 -0.08 0.02 0.00 0.00 177.57 178.31 3hqp h GLU 462 N 0.46 1.07 -0.17 1.57 4.57 -1.05 0.90 114.58 121.93 3hqp h GLU 462 Ca 0.08 -0.15 -0.00 0.00 -1.18 0.00 0.00 59.36 58.10 3hqp h GLU 462 Cb 0.67 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 29.06 3hqp h GLU 462 CO 0.05 0.83 0.10 0.35 -1.18 0.00 0.00 179.01 179.16 3hqp h PHE 463 N 1.07 0.23 -0.99 0.92 3.57 -1.19 -0.51 116.94 120.03 3hqp h PHE 463 Ca 0.26 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.79 3hqp h PHE 463 Cb 0.12 -0.07 -0.06 0.00 2.79 0.00 0.00 35.95 38.73 3hqp h PHE 463 CO 0.01 0.19 0.65 0.00 -2.23 0.00 0.00 178.31 176.94 3hqp h ALA 464 N 1.02 1.34 0.19 2.41 0.00 -0.86 -0.87 119.26 122.48 3hqp h ALA 464 Ca 0.06 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 3hqp h ALA 464 Cb 0.03 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 3hqp h ALA 464 CO -0.01 0.58 -0.13 0.87 0.00 0.00 0.00 179.25 180.56 3hqp h LYS 465 N 1.28 -0.30 -0.14 0.00 1.79 -0.47 -0.84 116.57 117.88 3hqp h LYS 465 Ca 0.39 0.02 -0.02 0.00 -2.18 0.00 0.00 60.65 58.86 3hqp h LYS 465 Cb -0.04 0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 30.67 3hqp h LYS 465 CO -0.11 -0.20 0.02 0.66 -1.08 0.00 0.00 179.45 178.73 3hqp h SER 466 N -0.32 0.17 0.97 0.86 4.64 -0.75 -0.55 113.55 118.58 3hqp h SER 466 Ca -0.02 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 3hqp h SER 466 Cb 0.27 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 3hqp h SER 466 CO 0.01 0.20 -0.11 0.29 -0.87 0.00 0.00 176.83 176.35 3hqp n LYS 467 N -4.43 0.05 -0.88 4.77 4.76 -0.36 -4.94 118.16 117.12 3hqp n LYS 467 Ca -0.01 0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.46 3hqp n LYS 467 Cb 0.14 -1.55 0.00 0.00 -1.84 0.00 0.00 35.03 31.79 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 0.48 0.22 0.72 0.00 -0.22 -4.95 105.19 102.91 3hqp n GLY 468 Ca 0.06 -0.71 -0.18 0.00 0.00 0.00 0.00 46.02 45.19 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 1.08 -3.99 1.61 0.05 -1.41 -3.46 116.97 110.86 3hqp h TYR 469 Ca 0.00 -0.49 -0.50 0.00 0.05 0.00 0.00 58.73 57.79 3hqp h TYR 469 Cb 0.00 -0.16 -0.23 0.00 1.01 0.00 0.00 36.73 37.35 3hqp h TYR 469 CO 0.00 1.33 -0.81 0.14 -1.05 0.00 0.00 178.16 177.77 3hqp s VAL 470 N -3.71 1.44 0.39 -2.88 -7.23 -1.23 -4.71 120.40 102.47 3hqp s VAL 470 Ca -0.10 -1.33 0.06 0.00 -1.81 0.00 0.00 61.98 58.80 3hqp s VAL 470 Cb 0.08 -1.32 -0.08 0.00 0.56 0.00 0.00 36.38 35.63 3hqp s VAL 470 CO 0.91 -0.05 0.02 -1.10 -0.31 0.00 0.00 175.10 174.57 3hqp s GLN 471 N -1.60 1.88 -0.05 4.82 -0.21 -1.26 -4.40 119.66 118.83 3hqp s GLN 471 Ca 0.04 -2.06 -0.38 0.00 0.02 0.00 0.00 55.36 52.98 3hqp s GLN 471 Cb -0.09 -1.46 -0.16 0.00 1.00 0.00 0.00 33.01 32.30 3hqp s GLN 471 CO 0.03 -0.08 1.53 2.41 -2.12 0.00 0.00 175.29 177.06 3hqp n THR 472 N -0.89 0.14 -0.23 -0.19 -1.04 -1.26 -1.18 114.28 109.63 3hqp n THR 472 Ca -0.04 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 3hqp n THR 472 Cb 0.67 -1.07 0.00 0.00 -1.82 0.00 0.00 70.33 68.11 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 3.29 0.83 3.85 3.41 0.00 0.43 -5.00 105.19 111.99 3hqp n GLY 473 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.90 5.97 -0.01 1.61 1.01 -0.33 -4.81 116.67 117.22 3hqp s ASP 474 Ca 0.00 1.53 -0.15 0.00 0.71 0.00 0.00 52.55 54.64 3hqp s ASP 474 Cb 0.00 -2.49 -0.06 0.00 1.01 0.00 0.00 42.92 41.39 3hqp s ASP 474 CO 0.00 -1.04 0.42 -0.31 0.21 0.00 0.00 175.17 174.44 3hqp s TYR 475 N -3.01 3.71 -0.08 4.23 2.02 -1.26 -1.28 117.35 121.68 3hqp s TYR 475 Ca 0.57 0.99 0.02 0.00 -0.37 0.00 0.00 57.07 58.27 3hqp s TYR 475 Cb -0.12 -2.32 0.02 0.00 -0.40 0.00 0.00 41.96 39.14 3hqp s TYR 475 CO 0.50 0.60 -0.11 0.00 -1.57 0.00 0.00 175.55 174.97 3hqp s VAL 477 N 0.94 5.25 -0.10 0.00 1.01 -1.03 -0.36 120.40 126.11 3hqp s VAL 477 Ca -0.09 0.17 0.01 0.00 0.00 0.00 0.00 61.98 62.07 3hqp s VAL 477 Cb -0.15 -3.66 -0.02 0.00 0.00 0.00 0.00 36.38 32.55 3hqp s VAL 477 CO 0.00 0.12 -0.13 -0.69 0.00 0.00 0.00 175.10 174.40 3hqp s VAL 478 N 1.88 3.10 -0.12 2.92 1.01 0.12 -1.02 120.40 128.29 3hqp s VAL 478 Ca 0.10 -0.67 0.02 0.00 0.00 0.00 0.00 61.98 61.43 3hqp s VAL 478 Cb -0.16 -2.27 0.01 0.00 0.00 0.00 0.00 36.38 33.95 3hqp s VAL 478 CO 0.11 0.55 -0.19 -0.63 0.00 0.00 0.00 175.10 174.93 3hqp s ILE 479 N -0.01 1.80 0.00 2.22 1.01 0.57 -0.79 121.20 126.00 3hqp s ILE 479 Ca -0.03 -0.82 0.00 0.00 0.00 0.00 0.00 60.65 59.79 3hqp s ILE 479 Cb -0.14 -1.61 0.00 0.00 0.01 0.00 0.00 42.46 40.72 3hqp s ILE 479 CO 0.04 0.50 0.00 0.00 0.00 0.00 0.00 174.94 175.48 3hqp n HIS 480 N 4.11 -0.42 -3.00 3.97 1.44 -0.88 -2.17 115.22 118.27 3hqp n HIS 480 Ca -0.19 0.00 -0.27 0.00 -2.01 0.00 0.00 57.72 55.25 3hqp n HIS 480 Cb 0.51 0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.61 3hqp n HIS 480 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3hqp s ALA 481 N -1.00 3.53 1.00 1.59 0.00 -1.26 -1.30 121.76 124.32 3hqp s ALA 481 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 51.96 51.33 3hqp s ALA 481 Cb 0.00 -2.39 0.00 0.00 0.00 0.00 0.00 23.12 20.73 3hqp s ALA 481 CO 0.00 -0.14 0.00 -0.40 0.00 0.00 0.00 175.76 175.22 3hqp n ASP 482 N -1.86 -0.72 0.00 0.00 5.68 -1.26 -4.87 116.55 113.53 3hqp n ASP 482 Ca -0.01 -0.35 0.12 0.00 -0.50 0.00 0.00 54.79 54.05 3hqp n ASP 482 Cb 0.55 0.00 0.73 0.00 -1.14 0.00 0.00 41.12 41.26 3hqp n ASP 482 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 3hqp n HIS 483 N -1.92 0.00 0.00 2.11 8.25 -1.26 -4.10 115.22 118.29 3hqp n HIS 483 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 3hqp n HIS 483 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 3hqp n HIS 483 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 3hqp n LYS 484 N -0.93 0.10 -2.16 -0.41 4.81 -1.26 -5.06 118.16 113.24 3hqp n LYS 484 Ca 0.18 0.00 -0.41 0.00 -0.87 0.00 0.00 58.31 57.21 3hqp n LYS 484 Cb 0.08 -0.77 -0.03 0.00 0.02 0.00 0.00 35.03 34.34 3hqp n LYS 484 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 3hqp s VAL 485 N -1.54 2.94 -0.00 3.15 1.01 -1.26 -5.05 120.40 119.66 3hqp s VAL 485 Ca 0.00 0.86 0.04 0.00 0.00 0.00 0.00 61.98 62.87 3hqp s VAL 485 Cb 0.00 -3.55 -0.01 0.00 0.00 0.00 0.00 36.38 32.82 3hqp s VAL 485 CO 0.00 0.17 -0.12 -0.54 0.00 0.00 0.00 175.10 174.61 3hqp s LYS 486 N -0.93 0.95 0.00 2.72 -0.14 -1.26 -4.71 119.74 116.37 3hqp s LYS 486 Ca 0.53 -0.47 0.00 0.00 -1.36 0.00 0.00 55.97 54.67 3hqp s LYS 486 Cb -0.38 -0.92 0.00 0.00 -1.68 0.00 0.00 37.83 34.85 3hqp s LYS 486 CO 0.45 0.25 0.00 0.41 -0.76 0.00 0.00 175.35 175.70 3hqp n GLY 487 N 2.66 2.39 3.59 -3.33 0.00 -1.26 -5.04 105.19 104.20 3hqp n GLY 487 Ca -0.14 0.00 -0.09 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 -2.33 -0.04 0.12 1.61 -0.85 -1.26 -5.08 117.35 109.52 3hqp s TYR 488 Ca 0.00 -0.33 -0.19 0.00 -0.52 0.00 0.00 57.07 56.02 3hqp s TYR 488 Cb 0.00 0.41 -0.07 0.00 0.38 0.00 0.00 41.96 42.68 3hqp s TYR 488 CO 0.00 -0.99 0.62 0.00 -1.52 0.00 0.00 175.55 173.67 3hqp s ALA 489 N -3.91 3.54 0.00 9.51 0.00 -1.26 -4.46 121.76 125.18 3hqp s ALA 489 Ca 0.12 0.08 0.00 0.00 0.00 0.00 0.00 51.96 52.16 3hqp s ALA 489 Cb -0.02 -2.70 0.00 0.00 0.00 0.00 0.00 23.12 20.40 3hqp s ALA 489 CO 0.01 0.38 0.64 0.27 0.00 0.00 0.00 175.76 177.06 3hqp n ASN 490 N 1.38 0.59 -3.69 0.00 6.94 -1.09 -4.06 115.26 115.33 3hqp n ASN 490 Ca -0.07 -1.29 -0.14 0.00 -0.02 0.00 0.00 54.58 53.05 3hqp n ASN 490 Cb 0.51 0.00 -0.14 0.00 -2.36 0.00 0.00 39.78 37.79 3hqp n ASN 490 CO 0.00 0.00 0.00 -1.58 -1.03 0.00 0.00 177.26 174.65 3hqp s GLN 491 N -0.29 0.13 0.17 -3.83 0.74 -0.42 -4.83 119.66 111.33 3hqp s GLN 491 Ca 0.00 0.60 0.03 0.00 0.05 0.00 0.00 55.36 56.04 3hqp s GLN 491 Cb 0.00 -0.13 -0.03 0.00 1.10 0.00 0.00 33.01 33.95 3hqp s GLN 491 CO 0.00 -0.24 0.28 0.99 -0.55 0.00 0.00 175.29 175.77 3hqp s THR 492 N 1.90 5.20 -0.15 -0.34 2.01 -1.26 -2.08 115.64 120.93 3hqp s THR 492 Ca -0.03 -0.81 -0.07 0.00 0.31 0.00 0.00 61.69 61.10 3hqp s THR 492 Cb -0.11 -3.71 0.06 0.00 0.01 0.00 0.00 72.50 68.74 3hqp s THR 492 CO -0.08 -0.15 0.33 -0.60 -0.69 0.00 0.00 174.62 173.44 3hqp s ARG 493 N -3.39 0.28 -0.40 4.92 3.52 0.03 -4.97 118.95 118.95 3hqp s ARG 493 Ca 0.34 0.73 -0.17 0.00 -0.13 0.00 0.00 55.73 56.51 3hqp s ARG 493 Cb -0.10 -0.01 0.01 0.00 -1.56 0.00 0.00 34.95 33.29 3hqp s ARG 493 CO 0.28 -0.20 0.42 0.42 -0.81 0.00 0.00 175.30 175.41 3hqp s ILE 494 N 1.71 5.10 0.18 4.11 1.01 -1.26 0.16 121.20 132.22 3hqp s ILE 494 Ca -0.06 -0.20 0.10 0.00 0.00 0.00 0.00 60.65 60.49 3hqp s ILE 494 Cb -0.10 -3.98 -0.04 0.00 0.01 0.00 0.00 42.46 38.35 3hqp s ILE 494 CO -0.11 -0.32 -0.18 -1.48 0.00 0.00 0.00 174.94 172.85 3hqp s LEU 495 N 2.12 2.66 -0.32 2.97 0.05 0.51 -4.95 118.68 121.72 3hqp s LEU 495 Ca 0.12 -0.73 -0.13 0.00 0.05 0.00 0.00 54.13 53.44 3hqp s LEU 495 Cb -0.17 -1.39 -0.03 0.00 -2.05 0.00 0.00 46.19 42.56 3hqp s LEU 495 CO 0.13 0.12 0.29 -0.22 -0.55 0.00 0.00 176.35 176.12 3hqp s LEU 496 N -2.68 4.31 0.17 1.48 2.96 -1.26 -0.48 118.68 123.18 3hqp s LEU 496 Ca 0.22 -0.17 -0.30 0.00 -0.22 0.00 0.00 54.13 53.66 3hqp s LEU 496 Cb -0.08 -2.24 -0.08 0.00 0.50 0.00 0.00 46.19 44.29 3hqp s LEU 496 CO 0.12 -0.22 1.18 0.68 -1.32 0.00 0.00 176.35 176.79 3hqp s VAL 497 N 1.88 3.65 -2.67 1.68 -7.23 -0.41 -4.87 120.40 112.43 3hqp s VAL 497 Ca 0.09 1.38 0.27 0.00 -1.81 0.00 0.00 61.98 61.91 3hqp s VAL 497 Cb -0.17 -3.88 0.43 0.00 0.56 0.00 0.00 36.38 33.32 3hqp s VAL 497 CO 0.11 0.21 1.58 -0.62 -0.31 0.00 0.00 175.10 176.08