#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hq9 h ALA 22 N 0.00 1.13 -0.43 0.00 0.00 -2.04 0.19 119.26 118.10 3hq9 h ALA 22 Ca 0.00 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 3hq9 h ALA 22 Cb 0.00 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 3hq9 h ALA 22 CO 0.00 0.54 0.01 -0.44 0.00 0.00 0.00 179.25 179.35 3hq9 h ASP 23 N 1.21 0.74 -0.67 0.00 3.32 -2.04 -2.05 116.42 116.93 3hq9 h ASP 23 Ca 0.32 -0.30 -0.00 0.00 0.02 0.00 0.00 57.03 57.07 3hq9 h ASP 23 Cb -0.13 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.19 3hq9 h ASP 23 CO -0.07 0.86 0.42 -0.33 -1.72 0.00 0.00 179.24 178.40 3hq9 h GLU 24 N 0.59 0.90 -0.26 3.56 3.07 -1.88 -1.35 114.58 119.21 3hq9 h GLU 24 Ca 0.12 -0.07 -0.02 0.00 -0.50 0.00 0.00 59.36 58.89 3hq9 h GLU 24 Cb 0.48 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 28.19 3hq9 h GLU 24 CO 0.02 0.62 0.10 1.25 -1.40 0.00 0.00 179.01 179.60 3hq9 h LEU 25 N 0.91 0.36 -0.64 1.33 5.85 -0.54 -0.51 115.31 122.08 3hq9 h LEU 25 Ca 0.24 -0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 3hq9 h LEU 25 Cb -0.05 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 40.85 3hq9 h LEU 25 CO -0.05 0.43 0.39 -0.61 -0.34 0.00 0.00 178.44 178.26 3hq9 h GLN 26 N 0.26 0.86 -0.70 1.25 4.15 -1.20 -0.22 115.11 119.52 3hq9 h GLN 26 Ca 0.09 -0.07 -0.07 0.00 0.77 0.00 0.00 58.65 59.36 3hq9 h GLN 26 Cb 0.19 -0.18 -0.03 0.00 0.21 0.00 0.00 27.48 27.67 3hq9 h GLN 26 CO -0.01 0.61 0.17 0.37 -1.93 0.00 0.00 178.83 178.05 3hq9 h GLN 27 N 0.86 1.11 -0.09 1.69 4.15 -1.02 -0.23 115.11 121.58 3hq9 h GLN 27 Ca 0.23 -0.26 0.01 0.00 0.77 0.00 0.00 58.65 59.40 3hq9 h GLN 27 Cb -0.03 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.50 3hq9 h GLN 27 CO -0.04 0.98 0.04 -0.09 -1.93 0.00 0.00 178.83 177.78 3hq9 h ARG 28 N 1.05 0.08 -0.84 1.69 2.43 -0.71 -2.27 114.38 115.81 3hq9 h ARG 28 Ca 0.22 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 3hq9 h ARG 28 Cb 0.36 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.85 3hq9 h ARG 28 CO 0.00 0.05 0.54 0.00 -1.51 0.00 0.00 179.97 179.05 3hq9 h ALA 29 N 1.05 1.07 0.00 2.80 0.00 -0.73 -2.43 119.26 121.03 3hq9 h ALA 29 Ca 0.04 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3hq9 h ALA 29 Cb 0.02 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.46 3hq9 h ALA 29 CO -0.04 0.51 -0.02 1.96 0.00 0.00 0.00 179.25 181.66 3hq9 h GLN 30 N 1.15 0.00 -0.02 0.00 4.20 -0.62 -1.18 115.11 118.64 3hq9 h GLN 30 Ca 0.31 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.02 3hq9 h GLN 30 Cb -0.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.69 3hq9 h GLN 30 CO -0.06 0.02 -0.04 0.41 -0.67 0.00 0.00 178.83 178.49 3hq9 n GLY 31 N -0.63 0.15 0.00 3.46 0.00 -0.89 -4.35 105.19 102.93 3hq9 n GLY 31 Ca -0.02 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.51 3hq9 n GLY 31 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hq9 n LEU 32 N 0.34 0.00 -4.30 0.99 4.77 -0.55 -5.08 117.00 113.17 3hq9 n LEU 32 Ca 0.17 -0.02 -0.16 0.00 -0.03 0.00 0.00 56.01 55.97 3hq9 n LEU 32 Cb 0.41 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.40 3hq9 n LEU 32 CO 0.17 0.00 -0.32 -0.36 -1.33 0.00 0.00 177.39 175.55 3hq9 s PHE 33 N -1.91 1.45 0.05 -1.77 0.08 -0.61 -1.30 117.98 113.97 3hq9 s PHE 33 Ca 0.00 -0.97 0.03 0.00 0.12 0.00 0.00 56.93 56.11 3hq9 s PHE 33 Cb 0.00 -0.84 -0.03 0.00 -0.57 0.00 0.00 43.02 41.59 3hq9 s PHE 33 CO 0.00 -0.12 -0.10 0.15 -0.10 0.00 0.00 175.22 175.05 3hq9 s LYS 34 N -3.89 0.66 0.59 0.44 -0.14 -1.24 -4.70 119.74 111.45 3hq9 s LYS 34 Ca 0.28 -0.81 -0.16 0.00 -1.36 0.00 0.00 55.97 53.91 3hq9 s LYS 34 Cb 0.06 -0.54 -0.04 0.00 -1.68 0.00 0.00 37.83 35.63 3hq9 s LYS 34 CO 0.08 0.11 1.06 -1.25 -0.76 0.00 0.00 175.35 174.59 3hq9 s PRO 35 N -1.57 3.34 0.23 -1.68 0.04 -1.26 -4.38 135.00 129.72 3hq9 s PRO 35 Ca -0.06 1.22 -0.31 0.00 0.04 0.00 0.00 61.00 61.89 3hq9 s PRO 35 Cb -0.10 -2.03 -0.11 0.00 0.04 0.00 0.00 34.50 32.30 3hq9 s PRO 35 CO 0.01 -0.80 1.54 0.08 0.04 0.00 0.00 177.00 177.88 3hq9 s VAL 36 N -2.43 2.44 0.81 -0.36 1.01 -1.26 -4.98 120.40 115.63 3hq9 s VAL 36 Ca 0.64 0.35 -0.11 0.00 0.00 0.00 0.00 61.98 62.86 3hq9 s VAL 36 Cb -0.16 -3.22 0.08 0.00 0.00 0.00 0.00 36.38 33.07 3hq9 s VAL 36 CO 0.36 0.05 1.09 -2.16 0.00 0.00 0.00 175.10 174.44 3hq9 s PRO 37 N 0.18 1.94 0.38 2.72 0.04 -1.26 -4.68 135.00 134.32 3hq9 s PRO 37 Ca 0.65 1.05 0.19 0.00 0.04 0.00 0.00 61.00 62.93 3hq9 s PRO 37 Cb -0.45 -1.87 0.67 0.00 0.04 0.00 0.00 34.50 32.90 3hq9 s PRO 37 CO 0.40 -1.83 1.73 0.00 0.04 0.00 0.00 177.00 177.34 3hq9 h ALA 38 N -1.26 0.97 -3.58 8.56 0.00 -2.01 -3.42 119.26 118.52 3hq9 h ALA 38 Ca -0.45 -0.33 -0.62 0.00 0.00 0.00 0.00 54.91 53.51 3hq9 h ALA 38 Cb 1.25 -0.06 -0.21 0.00 0.00 0.00 0.00 17.79 18.77 3hq9 h ALA 38 CO 0.52 0.45 -0.84 -1.59 0.00 0.00 0.00 179.25 177.80 3hq9 s LYS 39 N -3.57 1.32 0.16 0.00 0.00 -1.26 -5.00 119.74 111.40 3hq9 s LYS 39 Ca 0.00 -1.33 -0.34 0.00 0.00 0.00 0.00 55.97 54.30 3hq9 s LYS 39 Cb 0.11 -1.66 -0.15 0.00 0.00 0.00 0.00 37.83 36.12 3hq9 s LYS 39 CO 0.68 0.38 1.33 0.00 0.00 0.00 0.00 175.35 177.74 3hq9 n ALA 40 N 0.77 -0.16 -1.62 0.59 0.00 -1.26 -4.94 120.51 113.89 3hq9 n ALA 40 Ca -0.17 0.47 -0.33 0.00 0.00 0.00 0.00 53.44 53.41 3hq9 n ALA 40 Cb 0.54 -2.14 0.02 0.00 0.00 0.00 0.00 19.45 17.88 3hq9 n ALA 40 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3hq9 s PRO 41 N 0.08 3.15 0.12 0.00 0.04 -1.26 -5.01 135.00 132.12 3hq9 s PRO 41 Ca 0.77 1.23 -0.30 0.00 0.04 0.00 0.00 61.00 62.73 3hq9 s PRO 41 Cb -0.82 -2.01 -0.06 0.00 0.04 0.00 0.00 34.50 31.65 3hq9 s PRO 41 CO 0.48 -0.95 1.07 0.99 0.04 0.00 0.00 177.00 178.63 3hq9 s THR 42 N -2.48 4.16 -0.12 1.26 2.01 -1.26 -4.98 115.64 114.23 3hq9 s THR 42 Ca 0.64 1.74 -0.07 0.00 0.31 0.00 0.00 61.69 64.31 3hq9 s THR 42 Cb -0.17 -4.11 -0.04 0.00 0.01 0.00 0.00 72.50 68.19 3hq9 s THR 42 CO 0.40 0.24 0.15 -0.76 -0.69 0.00 0.00 174.62 173.95 3hq9 s LEU 43 N 0.13 4.39 -0.14 4.42 1.43 -1.26 -5.03 118.68 122.63 3hq9 s LEU 43 Ca 0.51 0.48 -0.34 0.00 -1.03 0.00 0.00 54.13 53.75 3hq9 s LEU 43 Cb -0.27 -2.08 -0.11 0.00 0.03 0.00 0.00 46.19 43.76 3hq9 s LEU 43 CO 0.32 0.41 1.97 2.29 0.23 0.00 0.00 176.35 181.56 3hq9 n LYS 44 N 2.00 2.02 -2.19 1.70 -0.00 -1.26 -2.00 118.16 118.42 3hq9 n LYS 44 Ca -0.20 0.70 -0.18 0.00 -0.00 0.00 0.00 58.31 58.63 3hq9 n LYS 44 Cb 0.55 -2.70 -0.03 0.00 -0.00 0.00 0.00 35.03 32.86 3hq9 n LYS 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3hq9 n GLY 45 N 4.87 0.07 2.63 2.58 0.00 -1.26 -4.92 105.19 109.16 3hq9 n GLY 45 Ca 0.26 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.14 3hq9 n GLY 45 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3hq9 s ASN 46 N -2.17 -0.18 0.38 1.61 2.47 -0.85 -5.15 114.94 111.05 3hq9 s ASN 46 Ca 0.00 -2.21 -0.25 0.00 0.42 0.00 0.00 52.86 50.83 3hq9 s ASN 46 Cb 0.00 0.92 -0.09 0.00 -1.45 0.00 0.00 41.25 40.63 3hq9 s ASN 46 CO 0.00 -0.11 1.03 -2.16 -3.72 0.00 0.00 177.10 172.13 3hq9 s PRO 47 N 0.63 4.27 0.20 0.43 0.04 -1.26 -4.06 135.00 135.26 3hq9 s PRO 47 Ca 0.30 1.47 -0.18 0.00 0.04 0.00 0.00 61.00 62.63 3hq9 s PRO 47 Cb 0.00 -2.61 -0.08 0.00 0.04 0.00 0.00 34.50 31.86 3hq9 s PRO 47 CO -0.11 -0.04 0.67 0.00 0.04 0.00 0.00 177.00 177.56 3hq9 s ALA 48 N -1.65 3.46 0.05 8.56 0.00 -1.26 -5.02 121.76 125.90 3hq9 s ALA 48 Ca 0.56 0.06 -0.04 0.00 0.00 0.00 0.00 51.96 52.54 3hq9 s ALA 48 Cb -0.21 -2.72 -0.02 0.00 0.00 0.00 0.00 23.12 20.17 3hq9 s ALA 48 CO 0.27 0.37 0.07 -1.54 0.00 0.00 0.00 175.76 174.92 3hq9 s SER 49 N -1.70 0.27 0.23 0.00 1.04 -1.26 -5.04 113.70 107.24 3hq9 s SER 49 Ca 0.42 -0.71 -0.06 0.00 0.48 0.00 0.00 55.95 56.08 3hq9 s SER 49 Cb -0.16 0.24 0.34 0.00 0.10 0.00 0.00 66.02 66.54 3hq9 s SER 49 CO 0.20 -0.57 1.80 -0.65 0.98 0.00 0.00 173.24 175.00 3hq9 h PRO 50 N 3.35 0.71 -0.18 4.02 0.11 -1.99 -0.70 132.00 137.31 3hq9 h PRO 50 Ca -0.33 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 65.63 3hq9 h PRO 50 Cb 1.17 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 3hq9 h PRO 50 CO 0.56 0.47 -0.35 -0.24 -0.21 0.00 0.00 178.00 178.23 3hq9 h VAL 51 N 0.73 1.29 -0.35 3.15 3.04 -1.97 -1.47 116.25 120.67 3hq9 h VAL 51 Ca 0.36 -1.43 -0.17 0.00 -1.01 0.00 0.00 66.70 64.45 3hq9 h VAL 51 Cb 0.31 1.54 -0.00 0.00 -2.01 0.00 0.00 31.29 31.13 3hq9 h VAL 51 CO -0.23 0.44 -0.45 0.50 -1.01 0.00 0.00 177.57 176.81 3hq9 h LYS 52 N 0.33 0.91 -0.51 4.17 3.64 -1.74 -0.24 116.57 123.14 3hq9 h LYS 52 Ca 0.04 -0.52 -0.02 0.00 -1.27 0.00 0.00 60.65 58.87 3hq9 h LYS 52 Cb 0.78 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.61 3hq9 h LYS 52 CO 0.06 1.17 0.23 0.28 -2.27 0.00 0.00 179.45 178.91 3hq9 h VAL 53 N 0.73 1.20 -0.50 2.00 2.07 -0.98 0.11 116.25 120.88 3hq9 h VAL 53 Ca 0.04 -0.60 -0.03 0.00 0.82 0.00 0.00 66.70 66.93 3hq9 h VAL 53 Cb 1.05 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 31.46 3hq9 h VAL 53 CO 0.11 0.23 0.19 -0.08 0.02 0.00 0.00 177.57 178.04 3hq9 h GLU 54 N 0.67 0.76 -0.30 1.57 4.57 -1.15 0.29 114.58 120.99 3hq9 h GLU 54 Ca 0.17 -0.14 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 3hq9 h GLU 54 Cb 0.15 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.61 3hq9 h GLU 54 CO -0.02 0.68 0.19 1.25 -1.18 0.00 0.00 179.01 179.93 3hq9 h LEU 55 N 0.67 0.35 -0.87 1.64 5.85 -0.84 -0.89 115.31 121.22 3hq9 h LEU 55 Ca 0.17 -0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.88 3hq9 h LEU 55 Cb 0.22 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.11 3hq9 h LEU 55 CO -0.01 0.27 0.57 1.23 -0.34 0.00 0.00 178.44 180.15 3hq9 h GLY 56 N 0.39 1.25 0.95 3.75 0.00 -0.46 -0.86 103.07 108.10 3hq9 h GLY 56 Ca 0.11 -0.44 -0.00 0.00 0.00 0.00 0.00 47.33 47.00 3hq9 h GLY 56 CO -0.02 0.39 0.08 1.70 0.00 0.00 0.00 176.54 178.68 3hq9 h LYS 57 N 1.12 0.18 -0.43 4.80 3.64 -0.63 -0.66 116.57 124.58 3hq9 h LYS 57 Ca 0.34 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.75 3hq9 h LYS 57 Cb -0.04 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 31.70 3hq9 h LYS 57 CO -0.10 0.18 0.16 0.52 -2.27 0.00 0.00 179.45 177.93 3hq9 h MET 58 N 0.13 0.33 -0.81 1.90 2.86 -0.72 -2.40 114.93 116.22 3hq9 h MET 58 Ca 0.05 -0.02 -0.03 0.00 -2.06 0.00 0.00 59.70 57.64 3hq9 h MET 58 Cb 0.04 -0.07 -0.04 0.00 0.06 0.00 0.00 31.60 31.59 3hq9 h MET 58 CO -0.01 0.22 0.39 -0.07 1.06 0.00 0.00 176.91 178.49 3hq9 h LEU 59 N 0.34 1.06 -1.64 1.22 3.38 -1.03 -1.81 115.31 116.83 3hq9 h LEU 59 Ca 0.20 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3hq9 h LEU 59 Cb 0.18 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 3hq9 h LEU 59 CO -0.20 0.90 0.25 0.22 0.09 0.00 0.00 178.44 179.70 3hq9 h TYR 60 N 1.15 0.46 -0.06 1.13 3.20 -0.67 -2.43 116.97 119.76 3hq9 h TYR 60 Ca 0.28 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.16 3hq9 h TYR 60 Cb 0.12 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.24 3hq9 h TYR 60 CO 0.01 0.29 0.00 1.19 -1.64 0.00 0.00 178.16 178.01 3hq9 n PHE 61 N -4.48 0.05 -3.13 -3.82 3.72 -0.94 -1.78 117.46 107.07 3hq9 n PHE 61 Ca 0.03 -0.02 -0.43 0.00 -0.05 0.00 0.00 57.45 56.97 3hq9 n PHE 61 Cb 0.06 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.53 3hq9 n PHE 61 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3hq9 s ASP 62 N -1.95 6.32 0.00 4.37 -1.08 -0.71 -4.84 116.67 118.79 3hq9 s ASP 62 Ca 0.30 -0.33 0.16 0.00 -0.52 0.00 0.00 52.55 52.17 3hq9 s ASP 62 Cb 0.20 -2.31 0.76 0.00 -1.46 0.00 0.00 42.92 40.12 3hq9 s ASP 62 CO 0.31 -0.74 1.49 -0.81 0.52 0.00 0.00 175.17 175.93 3hq9 n PRO 63 N 6.17 0.13 0.00 4.34 -0.04 -1.26 -2.52 135.00 141.83 3hq9 n PRO 63 Ca -0.02 0.17 0.08 0.00 -0.04 0.00 0.00 63.50 63.69 3hq9 n PRO 63 Cb 0.48 -1.50 0.37 0.00 -0.04 0.00 0.00 33.50 32.81 3hq9 n PRO 63 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3hq9 n ARG 64 N -1.38 0.11 0.28 0.54 1.74 -1.26 -1.20 116.66 115.50 3hq9 n ARG 64 Ca 0.06 0.18 0.17 0.00 -0.77 0.00 0.00 57.85 57.49 3hq9 n ARG 64 Cb 0.15 -1.50 0.79 0.00 -1.02 0.00 0.00 32.46 30.89 3hq9 n ARG 64 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 3hq9 h LEU 65 N 0.00 0.00-10.13 0.55 3.38 -1.76 -3.44 115.31 103.91 3hq9 h LEU 65 Ca 0.00 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.46 3hq9 h LEU 65 Cb 0.21 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 3hq9 h LEU 65 CO 0.00 0.05 -0.18 -0.94 0.09 0.00 0.00 178.44 177.47 3hq9 s SER 66 N -5.73 6.40 0.24 -0.43 1.04 -0.34 -4.67 113.70 110.21 3hq9 s SER 66 Ca -0.01 0.62 -0.07 0.00 0.48 0.00 0.00 55.95 56.97 3hq9 s SER 66 Cb 0.11 -2.10 0.25 0.00 0.10 0.00 0.00 66.02 64.37 3hq9 s SER 66 CO 0.53 -0.20 1.91 0.00 0.98 0.00 0.00 173.24 176.47 3hq9 h ALA 67 N 1.52 1.20 0.00 5.32 0.00 -0.93 -2.68 119.26 123.69 3hq9 h ALA 67 Ca -0.48 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.37 3hq9 h ALA 67 Cb 1.20 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 3hq9 h ALA 67 CO 0.65 0.56 -0.01 0.66 0.00 0.00 0.00 179.25 181.11 3hq9 h SER 68 N 1.25 0.00 -1.61 0.00 4.64 -1.77 -0.52 113.55 115.54 3hq9 h SER 68 Ca 0.35 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 61.32 3hq9 h SER 68 Cb -0.11 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 61.90 3hq9 h SER 68 CO -0.09 0.01 -0.38 1.41 -0.87 0.00 0.00 176.83 176.92 3hq9 n HIS 69 N -3.11 -0.40 -0.00 4.77 -0.00 -1.01 -4.45 115.22 111.01 3hq9 n HIS 69 Ca 0.02 0.00 0.03 0.00 -0.00 0.00 0.00 57.72 57.77 3hq9 n HIS 69 Cb 0.39 -3.19 -0.05 0.00 -0.00 0.00 0.00 29.99 27.14 3hq9 n HIS 69 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 3hq9 n LEU 70 N -2.20 0.00 -4.19 2.41 4.77 -1.25 -4.61 117.00 111.94 3hq9 n LEU 70 Ca -0.19 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.47 3hq9 n LEU 70 Cb 0.61 0.01 -0.17 0.00 -2.33 0.00 0.00 43.42 41.54 3hq9 n LEU 70 CO 0.25 0.01 -0.55 -0.63 -1.33 0.00 0.00 177.39 175.14 3hq9 s ILE 71 N -2.43 2.06 0.50 -0.08 1.01 -1.26 -4.93 121.20 116.08 3hq9 s ILE 71 Ca -0.02 -0.99 0.04 0.00 0.00 0.00 0.00 60.65 59.67 3hq9 s ILE 71 Cb 0.04 -1.81 -0.01 0.00 0.01 0.00 0.00 42.46 40.70 3hq9 s ILE 71 CO 0.26 0.55 0.15 -0.94 0.00 0.00 0.00 174.94 174.97 3hq9 s SER 72 N 0.66 4.31 0.26 3.58 1.04 -1.26 -3.88 113.70 118.41 3hq9 s SER 72 Ca -0.11 -1.43 -0.03 0.00 0.48 0.00 0.00 55.95 54.86 3hq9 s SER 72 Cb -0.16 0.30 0.40 0.00 0.10 0.00 0.00 66.02 66.66 3hq9 s SER 72 CO 0.02 -0.86 1.85 0.00 0.98 0.00 0.00 173.24 175.22 3hq9 h ASN 74 N 1.02 0.00 -0.52 0.00 -1.24 -1.68 -0.29 115.58 112.87 3hq9 h ASN 74 Ca 0.42 0.00 0.06 0.00 0.71 0.00 0.00 56.30 57.49 3hq9 h ASN 74 Cb 0.25 0.00 -0.05 0.00 0.73 0.00 0.00 38.32 39.25 3hq9 h ASN 74 CO -0.20 0.10 0.23 0.74 -1.29 0.00 0.00 177.43 177.01 3hq9 h THR 75 N 0.00 0.89 0.00 -3.57 2.02 -1.68 -2.87 112.91 107.70 3hq9 h THR 75 Ca -0.00 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 67.03 3hq9 h THR 75 Cb 0.27 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 67.09 3hq9 h THR 75 CO 0.01 0.08 -1.65 0.00 0.37 0.00 0.00 175.52 174.33 3hq9 n HIS 77 N -2.14 2.16 -2.93 0.00 8.25 -0.15 -2.80 115.22 117.60 3hq9 n HIS 77 Ca -0.02 -3.97 -0.42 0.00 -0.26 0.00 0.00 57.72 53.05 3hq9 n HIS 77 Cb 0.52 -0.43 -0.05 0.00 1.12 0.00 0.00 29.99 31.15 3hq9 n HIS 77 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 3hq9 s ASN 78 N -1.61 6.67 0.56 0.41 3.84 0.05 -4.31 114.94 120.56 3hq9 s ASN 78 Ca 0.34 0.66 0.28 0.00 0.21 0.00 0.00 52.86 54.35 3hq9 s ASN 78 Cb 0.09 -2.41 1.67 0.00 -0.55 0.00 0.00 41.25 40.04 3hq9 s ASN 78 CO -0.10 -0.63 2.20 -0.37 -2.79 0.00 0.00 177.10 175.40 3hq9 h VAL 79 N 5.61 0.60 -0.01 -5.21 -1.51 -1.87 0.11 116.25 113.97 3hq9 h VAL 79 Ca -0.24 -0.14 0.00 0.00 -1.23 0.00 0.00 66.70 65.08 3hq9 h VAL 79 Cb 1.09 1.09 0.00 0.00 -2.13 0.00 0.00 31.29 31.34 3hq9 h VAL 79 CO 0.89 0.03 -0.24 0.61 -1.23 0.00 0.00 177.57 177.63 3hq9 n GLY 80 N -1.19 -0.83 2.41 5.19 0.00 -1.26 -4.30 105.19 105.22 3hq9 n GLY 80 Ca -0.03 -0.35 -0.21 0.00 0.00 0.00 0.00 46.02 45.44 3hq9 n GLY 80 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hq9 n LEU 81 N -0.89 3.95 -0.35 0.99 4.77 -0.36 -4.93 117.00 120.18 3hq9 n LEU 81 Ca 0.12 -4.63 -0.05 0.00 -0.03 0.00 0.00 56.01 51.42 3hq9 n LEU 81 Cb 0.33 -0.19 -0.02 0.00 -2.33 0.00 0.00 43.42 41.20 3hq9 n LEU 81 CO 0.27 1.98 -0.04 0.61 -1.33 0.00 0.00 177.39 178.87 3hq9 n GLY 82 N -0.49 0.63 1.54 -0.72 0.00 -1.23 -2.79 105.19 102.13 3hq9 n GLY 82 Ca 0.33 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.16 3hq9 n GLY 82 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hq9 n GLY 83 N -1.03 0.67 0.00 -0.02 0.00 0.22 -4.65 105.19 100.38 3hq9 n GLY 83 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 3hq9 n GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hq9 n GLY 84 N -2.62 6.47 0.00 -0.02 0.00 -1.12 -1.64 105.19 106.27 3hq9 n GLY 84 Ca 0.00 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.20 3hq9 n GLY 84 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3hq9 n ASP 85 N 0.00 0.71 -0.66 1.61 5.68 -1.12 -0.77 116.55 121.99 3hq9 n ASP 85 Ca 0.00 -1.16 -0.09 0.00 -0.50 0.00 0.00 54.79 53.05 3hq9 n ASP 85 Cb 0.00 0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 39.94 3hq9 n ASP 85 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3hq9 n LEU 86 N -0.08 -0.47 -4.55 -2.12 4.77 -1.26 -4.99 117.00 108.30 3hq9 n LEU 86 Ca 0.00 0.21 -0.26 0.00 -0.03 0.00 0.00 56.01 55.93 3hq9 n LEU 86 Cb 0.18 -1.81 -0.09 0.00 -2.33 0.00 0.00 43.42 39.37 3hq9 n LEU 86 CO 0.00 -0.62 -0.42 -1.10 -1.33 0.00 0.00 177.39 173.92 3hq9 s GLN 87 N -2.49 1.99 0.05 3.23 -1.52 -1.26 -4.82 119.66 114.84 3hq9 s GLN 87 Ca 0.00 -1.33 -0.36 0.00 -1.95 0.00 0.00 55.36 51.72 3hq9 s GLN 87 Cb 0.00 -2.10 -0.20 0.00 -0.22 0.00 0.00 33.01 30.49 3hq9 s GLN 87 CO 0.00 0.42 1.50 0.00 -0.25 0.00 0.00 175.29 176.96 3hq9 h ALA 88 N 2.84 -1.31 -2.47 6.09 0.00 -1.89 -3.40 119.26 119.12 3hq9 h ALA 88 Ca -0.46 -0.28 -0.38 0.00 0.00 0.00 0.00 54.91 53.79 3hq9 h ALA 88 Cb 1.21 0.50 -0.16 0.00 0.00 0.00 0.00 17.79 19.34 3hq9 h ALA 88 CO 0.54 -1.22 -0.73 0.95 0.00 0.00 0.00 179.25 178.79 3hq9 s THR 89 N -5.76 1.32 0.47 0.00 -4.23 -1.26 -3.28 115.64 102.91 3hq9 s THR 89 Ca -0.19 -1.96 -0.22 0.00 -1.18 0.00 0.00 61.69 58.15 3hq9 s THR 89 Cb 0.02 -1.76 -0.07 0.00 1.34 0.00 0.00 72.50 72.03 3hq9 s THR 89 CO 0.56 -0.60 1.12 -0.44 -0.54 0.00 0.00 174.62 174.72 3hq9 s SER 90 N -2.93 6.17 -0.16 3.99 0.01 -1.05 -4.66 113.70 115.08 3hq9 s SER 90 Ca 0.15 2.18 -0.07 0.00 1.31 0.00 0.00 55.95 59.51 3hq9 s SER 90 Cb -0.01 -2.59 -0.04 0.00 0.21 0.00 0.00 66.02 63.59 3hq9 s SER 90 CO 0.03 -0.91 0.09 -0.89 0.41 0.00 0.00 173.24 171.97 3hq9 s THR 91 N -1.68 5.03 0.00 1.44 2.01 -1.26 -0.04 115.64 121.14 3hq9 s THR 91 Ca 0.65 0.05 0.00 0.00 0.31 0.00 0.00 61.69 62.70 3hq9 s THR 91 Cb -0.25 -3.24 0.00 0.00 0.01 0.00 0.00 72.50 69.02 3hq9 s THR 91 CO 0.30 0.51 0.00 0.61 -0.69 0.00 0.00 174.62 175.34 3hq9 n GLY 92 N 3.05 5.31 3.59 4.40 0.00 0.02 -4.95 105.19 116.61 3hq9 n GLY 92 Ca -0.17 -1.69 -0.49 0.00 0.00 0.00 0.00 46.02 43.67 3hq9 n GLY 92 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3hq9 n HIS 93 N 0.00 1.46 -1.01 1.61 -0.00 -0.72 -1.57 115.22 114.99 3hq9 n HIS 93 Ca 0.00 0.63 -0.00 0.00 0.46 0.00 0.00 57.72 58.81 3hq9 n HIS 93 Cb 0.00 -2.32 -0.00 0.00 -0.12 0.00 0.00 29.99 27.55 3hq9 n HIS 93 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 3hq9 n GLY 94 N 2.15 0.43 2.37 1.57 0.00 -1.26 -2.44 105.19 108.00 3hq9 n GLY 94 Ca 0.15 -0.08 -0.10 0.00 0.00 0.00 0.00 46.02 45.99 3hq9 n GLY 94 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 3hq9 n TRP 95 N -2.80 0.00 -2.02 1.61 -0.00 -0.61 -4.98 117.44 108.64 3hq9 n TRP 95 Ca -0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 57.50 57.07 3hq9 n TRP 95 Cb 0.11 -1.99 -0.03 0.00 -0.00 0.00 0.00 31.31 29.40 3hq9 n TRP 95 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 177.69 176.55 3hq9 s GLN 96 N -2.69 4.21 0.03 5.87 2.00 -1.02 -4.75 119.66 123.31 3hq9 s GLN 96 Ca 0.00 2.21 -0.30 0.00 -2.00 0.00 0.00 55.36 55.27 3hq9 s GLN 96 Cb 0.00 -3.68 -0.04 0.00 0.80 0.00 0.00 33.01 30.09 3hq9 s GLN 96 CO 0.00 -0.72 1.05 0.21 -0.50 0.00 0.00 175.29 175.33 3hq9 s LYS 97 N 2.91 4.53 0.74 1.67 2.20 -1.26 -0.80 119.74 129.72 3hq9 s LYS 97 Ca 0.71 1.54 -0.07 0.00 -0.36 0.00 0.00 55.97 57.79 3hq9 s LYS 97 Cb -0.36 -3.42 0.08 0.00 -1.51 0.00 0.00 37.83 32.62 3hq9 s LYS 97 CO 0.30 -0.10 1.05 0.20 -0.36 0.00 0.00 175.35 176.44 3hq9 s GLY 98 N 0.95 1.70 0.25 5.54 0.00 0.94 -4.97 107.32 111.73 3hq9 s GLY 98 Ca 0.54 -1.01 0.25 0.00 0.00 0.00 0.00 44.72 44.51 3hq9 s GLY 98 CO 0.29 -0.55 1.73 -0.56 0.00 0.00 0.00 173.10 174.01 3hq9 h PRO 99 N -0.72 0.00 -4.49 2.90 0.13 -1.96 -3.42 132.00 124.45 3hq9 h PRO 99 Ca -0.44 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.43 3hq9 h PRO 99 Cb 1.30 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.22 3hq9 h PRO 99 CO 0.57 0.00 -0.73 1.03 -0.23 0.00 0.00 178.00 178.64 3hq9 s ARG 100 N -3.12 0.50 0.20 0.86 1.81 -1.26 -4.71 118.95 113.23 3hq9 s ARG 100 Ca 0.10 -0.74 -0.30 0.00 -1.72 0.00 0.00 55.73 53.07 3hq9 s ARG 100 Cb 0.11 -0.24 -0.09 0.00 -0.45 0.00 0.00 34.95 34.28 3hq9 s ARG 100 CO 0.61 0.04 1.30 1.21 -0.68 0.00 0.00 175.30 177.78 3hq9 s ASN 101 N -1.56 6.91 -0.21 0.23 3.84 0.24 -2.53 114.94 121.86 3hq9 s ASN 101 Ca -0.11 2.39 -0.29 0.00 0.21 0.00 0.00 52.86 55.06 3hq9 s ASN 101 Cb -0.10 -2.61 -0.01 0.00 -0.55 0.00 0.00 41.25 37.98 3hq9 s ASN 101 CO 0.00 -0.51 1.36 0.00 -2.79 0.00 0.00 177.10 175.16 3hq9 s ALA 102 N 0.07 3.49 0.62 1.71 0.00 -1.26 -4.93 121.76 121.46 3hq9 s ALA 102 Ca 0.56 0.37 -0.16 0.00 0.00 0.00 0.00 51.96 52.73 3hq9 s ALA 102 Cb -0.36 -3.72 -0.02 0.00 0.00 0.00 0.00 23.12 19.02 3hq9 s ALA 102 CO 0.38 -1.53 1.10 -1.25 0.00 0.00 0.00 175.76 174.46 3hq9 s PRO 103 N 3.96 3.05 0.40 0.00 0.04 -1.26 -4.65 135.00 136.55 3hq9 s PRO 103 Ca 0.59 1.37 -0.26 0.00 0.04 0.00 0.00 61.00 62.74 3hq9 s PRO 103 Cb -0.21 -1.99 -0.09 0.00 0.04 0.00 0.00 34.50 32.25 3hq9 s PRO 103 CO 0.21 -1.05 1.30 -0.08 0.04 0.00 0.00 177.00 177.43 3hq9 s THR 104 N -2.28 2.63 0.09 1.26 -1.32 -1.26 -4.70 115.64 110.05 3hq9 s THR 104 Ca 0.67 0.56 0.21 0.00 -1.21 0.00 0.00 61.69 61.92 3hq9 s THR 104 Cb -0.20 -3.33 0.19 0.00 -1.51 0.00 0.00 72.50 67.65 3hq9 s THR 104 CO 0.38 0.08 1.74 1.62 -2.21 0.00 0.00 174.62 176.23 3hq9 h VAL 105 N 2.48 0.67 -2.61 5.08 3.04 -1.59 -3.40 116.25 119.92 3hq9 h VAL 105 Ca -0.50 -1.37 -0.53 0.00 -1.01 0.00 0.00 66.70 63.30 3hq9 h VAL 105 Cb 1.25 1.90 0.04 0.00 -2.01 0.00 0.00 31.29 32.46 3hq9 h VAL 105 CO 0.63 0.29 1.05 -0.76 -1.01 0.00 0.00 177.57 177.77 3hq9 s LEU 106 N -6.80 4.38 -0.14 3.16 1.43 -1.26 -1.50 118.68 117.95 3hq9 s LEU 106 Ca 0.01 2.68 0.00 0.00 -1.03 0.00 0.00 54.13 55.79 3hq9 s LEU 106 Cb 0.10 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.75 3hq9 s LEU 106 CO 0.66 -0.96 0.00 0.59 0.23 0.00 0.00 176.35 176.88 3hq9 n ASN 107 N 5.40 -5.59 0.27 2.29 5.03 0.09 -4.85 115.26 117.91 3hq9 n ASN 107 Ca 0.17 0.03 0.11 0.00 0.87 0.00 0.00 54.58 55.76 3hq9 n ASN 107 Cb 0.39 -3.20 0.74 0.00 -1.02 0.00 0.00 39.78 36.68 3hq9 n ASN 107 CO 0.00 0.00 0.00 0.77 -1.83 0.00 0.00 177.26 176.20 3hq9 h SER 108 N 0.00 0.00 -0.30 6.41 4.64 -1.48 -2.06 113.55 120.77 3hq9 h SER 108 Ca -0.03 0.00 0.09 0.00 -0.47 0.00 0.00 61.79 61.38 3hq9 h SER 108 Cb 0.90 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.97 3hq9 h SER 108 CO 0.04 0.05 0.24 1.62 -0.87 0.00 0.00 176.83 177.92 3hq9 h VAL 109 N 0.00 0.69 -0.00 0.95 3.04 -1.84 -1.64 116.25 117.44 3hq9 h VAL 109 Ca -0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 3hq9 h VAL 109 Cb 0.11 0.82 0.00 0.00 -2.01 0.00 0.00 31.29 30.21 3hq9 h VAL 109 CO 0.01 0.00 -0.23 0.49 -1.01 0.00 0.00 177.57 176.82 3hq9 n PHE 110 N -4.19 0.00 -2.94 3.17 3.72 -0.77 -4.88 117.46 111.56 3hq9 n PHE 110 Ca 0.04 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.11 3hq9 n PHE 110 Cb 0.40 -0.24 -0.07 0.00 -0.94 0.00 0.00 39.48 38.64 3hq9 n PHE 110 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 3hq9 s ASN 111 N -2.71 6.93 -0.00 4.37 0.01 -0.62 -4.92 114.94 118.00 3hq9 s ASN 111 Ca 0.20 1.55 0.02 0.00 -0.71 0.00 0.00 52.86 53.93 3hq9 s ASN 111 Cb 0.19 -2.48 -0.03 0.00 0.41 0.00 0.00 41.25 39.34 3hq9 s ASN 111 CO 0.56 -0.26 0.07 0.35 -1.51 0.00 0.00 177.10 176.31 3hq9 n THR 112 N -0.35 0.00 -2.86 1.60 -2.24 -0.43 -4.92 114.28 105.08 3hq9 n THR 112 Ca 0.05 -0.23 -0.43 0.00 -2.27 0.00 0.00 64.05 61.17 3hq9 n THR 112 Cb 0.53 0.70 -0.04 0.00 -2.10 0.00 0.00 70.33 69.42 3hq9 n THR 112 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hq9 s ALA 113 N -1.71 3.13 0.15 6.98 0.00 -0.57 -4.92 121.76 124.82 3hq9 s ALA 113 Ca -0.00 -1.65 0.18 0.00 0.00 0.00 0.00 51.96 50.48 3hq9 s ALA 113 Cb 0.01 -3.81 0.59 0.00 0.00 0.00 0.00 23.12 19.91 3hq9 s ALA 113 CO 0.09 -2.63 1.69 0.37 0.00 0.00 0.00 175.76 175.27 3hq9 h GLN 114 N 9.48 0.00 -6.27 0.00 4.15 -1.91 -3.46 115.11 117.10 3hq9 h GLN 114 Ca -0.28 0.00 -0.58 0.00 0.77 0.00 0.00 58.65 58.56 3hq9 h GLN 114 Cb 1.07 0.00 -0.20 0.00 0.21 0.00 0.00 27.48 28.56 3hq9 h GLN 114 CO 1.15 0.42 -0.82 -0.06 -1.93 0.00 0.00 178.83 177.58 3hq9 s PHE 115 N -3.54 1.96 0.22 3.99 0.08 -1.26 -5.04 117.98 114.40 3hq9 s PHE 115 Ca 0.00 -0.42 -0.08 0.00 0.12 0.00 0.00 56.93 56.56 3hq9 s PHE 115 Cb 0.11 -1.02 0.27 0.00 -0.57 0.00 0.00 43.02 41.81 3hq9 s PHE 115 CO 0.70 0.31 1.84 -1.49 -0.10 0.00 0.00 175.22 176.49 3hq9 h TRP 116 N 3.64 0.88 -2.06 0.36 4.06 -1.96 -3.38 115.95 117.49 3hq9 h TRP 116 Ca -0.46 0.03 0.16 0.00 2.06 0.00 0.00 58.89 60.68 3hq9 h TRP 116 Cb 1.19 -0.28 -0.15 0.00 -1.00 0.00 0.00 29.16 28.91 3hq9 h TRP 116 CO 0.65 0.46 0.58 0.16 -3.56 0.00 0.00 178.44 176.73 3hq9 s ASP 117 N -5.74 -0.28 0.00 -3.49 -4.77 -1.26 -0.56 116.67 100.58 3hq9 s ASP 117 Ca -0.13 -0.04 0.00 0.00 -3.30 0.00 0.00 52.55 49.08 3hq9 s ASP 117 Cb 0.17 0.33 0.00 0.00 -1.09 0.00 0.00 42.92 42.33 3hq9 s ASP 117 CO 0.78 -0.54 0.00 0.61 0.70 0.00 0.00 175.17 176.72 3hq9 n GLY 118 N -0.24 -1.86 3.73 2.12 0.00 -0.50 -5.00 105.19 103.43 3hq9 n GLY 118 Ca -0.06 -1.14 -0.41 0.00 0.00 0.00 0.00 46.02 44.40 3hq9 n GLY 118 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hq9 s ARG 119 N -1.69 4.59 0.53 1.61 0.52 -1.26 -1.12 118.95 122.13 3hq9 s ARG 119 Ca 0.00 1.64 0.24 0.00 -0.52 0.00 0.00 55.73 57.09 3hq9 s ARG 119 Cb 0.00 -3.32 1.39 0.00 0.52 0.00 0.00 34.95 33.54 3hq9 s ARG 119 CO 0.00 0.05 2.04 0.00 0.02 0.00 0.00 175.30 177.41 3hq9 h ALA 120 N 5.59 2.33 0.17 2.13 0.00 -1.66 -0.43 119.26 127.39 3hq9 h ALA 120 Ca -0.43 -0.01 -0.34 0.00 0.00 0.00 0.00 54.91 54.13 3hq9 h ALA 120 Cb 1.21 0.03 0.01 0.00 0.00 0.00 0.00 17.79 19.04 3hq9 h ALA 120 CO 0.74 -0.48 -1.67 1.57 0.00 0.00 0.00 179.25 179.41 3hq9 h LYS 121 N 0.00 0.36 -0.17 0.00 2.10 -1.92 -3.36 116.57 113.58 3hq9 h LYS 121 Ca 0.18 -0.62 -0.07 0.00 -2.00 0.00 0.00 60.65 58.14 3hq9 h LYS 121 Cb 0.75 0.23 -0.01 0.00 -0.90 0.00 0.00 32.23 32.30 3hq9 h LYS 121 CO -0.00 1.26 -0.22 -0.44 -2.00 0.00 0.00 179.45 178.05 3hq9 h ASP 122 N 0.10 0.30 -2.56 7.07 5.19 -1.57 -3.55 116.42 121.39 3hq9 h ASP 122 Ca -0.31 -0.08 -0.55 0.00 -0.62 0.00 0.00 57.03 55.47 3hq9 h ASP 122 Cb 2.08 -0.08 -0.01 0.00 0.18 0.00 0.00 39.33 41.51 3hq9 h ASP 122 CO 0.18 0.53 1.14 -0.76 -3.12 0.00 0.00 179.24 177.21 3hq9 s LEU 123 N -8.62 4.22 0.00 1.55 1.43 -0.31 -4.99 118.68 111.96 3hq9 s LEU 123 Ca -0.06 2.19 0.00 0.00 -1.03 0.00 0.00 54.13 55.24 3hq9 s LEU 123 Cb 0.15 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.83 3hq9 s LEU 123 CO 0.76 -1.06 0.00 0.00 0.23 0.00 0.00 176.35 176.28 3hq9 n GLN 132 N 7.38 0.00 -2.93 1.70 6.02 -1.26 -5.11 117.38 123.18 3hq9 n GLN 132 Ca 0.19 0.00 -0.37 0.00 -0.01 0.00 0.00 57.00 56.81 3hq9 n GLN 132 Cb 0.43 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.63 3hq9 n GLN 132 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3hq9 s ALA 133 N -1.59 3.31 0.14 -1.58 0.00 -1.26 -5.00 121.76 115.78 3hq9 s ALA 133 Ca 0.00 0.36 -0.32 0.00 0.00 0.00 0.00 51.96 51.99 3hq9 s ALA 133 Cb 0.00 -3.01 -0.12 0.00 0.00 0.00 0.00 23.12 19.99 3hq9 s ALA 133 CO 0.00 0.25 1.75 -2.30 0.00 0.00 0.00 175.76 175.46 3hq9 n PRO 134 N 0.66 2.58 -0.01 0.00 -0.02 -1.26 -4.87 135.00 132.08 3hq9 n PRO 134 Ca -0.00 0.94 0.04 0.00 -2.02 0.00 0.00 63.50 62.46 3hq9 n PRO 134 Cb 0.50 -2.78 0.42 0.00 -0.02 0.00 0.00 33.50 31.62 3hq9 n PRO 134 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 3hq9 h VAL 135 N 4.26 1.10 0.00 -1.45 -1.51 -1.94 -2.42 116.25 114.29 3hq9 h VAL 135 Ca -0.45 -0.20 0.00 0.00 -1.23 0.00 0.00 66.70 64.82 3hq9 h VAL 135 Cb 1.23 0.48 0.00 0.00 -2.13 0.00 0.00 31.29 30.87 3hq9 h VAL 135 CO 0.94 0.10 0.00 -0.33 -1.23 0.00 0.00 177.57 177.05 3hq9 h GLU 136 N 0.57 0.00 0.00 5.19 3.07 -1.98 -1.11 114.58 120.32 3hq9 h GLU 136 Ca 0.16 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.02 3hq9 h GLU 136 Cb -0.04 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.87 3hq9 h GLU 136 CO -0.04 0.00 -0.90 -1.33 -1.40 0.00 0.00 179.01 175.35 3hq9 n MET 137 N -2.55 0.31 -1.50 2.33 2.81 -0.92 -1.75 117.12 115.85 3hq9 n MET 137 Ca 0.01 0.03 -0.12 0.00 -1.81 0.00 0.00 57.70 55.82 3hq9 n MET 137 Cb 0.24 -1.63 -0.04 0.00 -0.71 0.00 0.00 33.22 31.08 3hq9 n MET 137 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 3hq9 n ASN 138 N -2.05 -4.28 -4.36 7.83 5.15 -0.42 -0.38 115.26 116.76 3hq9 n ASN 138 Ca 0.02 0.23 -0.32 0.00 -0.60 0.00 0.00 54.58 53.92 3hq9 n ASN 138 Cb 0.44 -2.93 -0.15 0.00 -0.53 0.00 0.00 39.78 36.61 3hq9 n ASN 138 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 3hq9 s ASN 139 N -2.80 3.41 0.60 1.20 0.01 -1.26 -4.46 114.94 111.63 3hq9 s ASN 139 Ca 0.00 -0.39 -0.13 0.00 -0.71 0.00 0.00 52.86 51.63 3hq9 s ASN 139 Cb 0.00 -0.67 -0.04 0.00 0.41 0.00 0.00 41.25 40.95 3hq9 s ASN 139 CO 0.00 0.30 1.03 0.42 -1.51 0.00 0.00 177.10 177.34 3hq9 s THR 140 N -0.51 4.36 0.27 1.60 -4.23 -1.26 -4.76 115.64 111.12 3hq9 s THR 140 Ca 0.07 0.92 -0.00 0.00 -1.18 0.00 0.00 61.69 61.50 3hq9 s THR 140 Cb -0.11 -3.65 0.25 0.00 1.34 0.00 0.00 72.50 70.34 3hq9 s THR 140 CO 0.01 -0.85 1.80 -0.65 -0.54 0.00 0.00 174.62 174.39 3hq9 h PRO 141 N 0.07 0.79 -0.28 3.99 0.11 -1.98 -1.07 132.00 133.61 3hq9 h PRO 141 Ca -0.45 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 65.55 3hq9 h PRO 141 Cb 1.20 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 3hq9 h PRO 141 CO 0.60 0.52 -0.07 -0.44 -0.21 0.00 0.00 178.00 178.40 3hq9 h ASP 142 N 0.81 0.43 -0.29 -2.05 3.32 -1.99 -0.67 116.42 115.98 3hq9 h ASP 142 Ca 0.47 -0.09 -0.14 0.00 0.02 0.00 0.00 57.03 57.28 3hq9 h ASP 142 Cb 0.55 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 3hq9 h ASP 142 CO -0.30 0.55 -0.35 1.56 -1.72 0.00 0.00 179.24 178.97 3hq9 h GLN 143 N 0.43 0.83 -0.27 3.56 1.08 -1.61 -0.58 115.11 118.55 3hq9 h GLN 143 Ca 0.09 -0.41 -0.02 0.00 -1.45 0.00 0.00 58.65 56.85 3hq9 h GLN 143 Cb 0.39 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.82 3hq9 h GLN 143 CO 0.02 1.05 0.08 0.28 -0.95 0.00 0.00 178.83 179.30 3hq9 h VAL 144 N 0.69 1.20 -0.83 -0.54 2.07 -0.85 -1.48 116.25 116.51 3hq9 h VAL 144 Ca 0.07 -0.66 -0.03 0.00 0.82 0.00 0.00 66.70 66.90 3hq9 h VAL 144 Cb 0.91 1.13 -0.04 0.00 -1.52 0.00 0.00 31.29 31.78 3hq9 h VAL 144 CO 0.08 0.22 0.40 0.58 0.02 0.00 0.00 177.57 178.87 3hq9 h VAL 145 N 0.27 1.26 -0.72 2.57 2.07 -1.01 -0.87 116.25 119.81 3hq9 h VAL 145 Ca 0.09 -0.71 0.07 0.00 0.82 0.00 0.00 66.70 66.96 3hq9 h VAL 145 Cb 0.26 0.19 -0.06 0.00 -1.52 0.00 0.00 31.29 30.16 3hq9 h VAL 145 CO -0.00 0.30 0.41 0.50 0.02 0.00 0.00 177.57 178.80 3hq9 h LYS 146 N 1.17 0.72 -0.33 1.57 3.64 -0.95 -0.12 116.57 122.28 3hq9 h LYS 146 Ca 0.29 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.58 3hq9 h LYS 146 Cb 0.11 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.75 3hq9 h LYS 146 CO -0.04 0.48 0.05 1.15 -2.27 0.00 0.00 179.45 178.82 3hq9 h THR 147 N 0.74 1.24 -0.71 1.00 2.02 -0.40 -2.37 112.91 114.44 3hq9 h THR 147 Ca 0.33 -0.84 -0.04 0.00 0.77 0.00 0.00 66.41 66.63 3hq9 h THR 147 Cb 0.22 1.15 -0.03 0.00 -1.74 0.00 0.00 68.15 67.74 3hq9 h THR 147 CO -0.19 0.28 0.29 -0.07 0.37 0.00 0.00 175.52 176.20 3hq9 h LEU 148 N 0.38 0.97 -1.96 2.58 3.38 -0.91 -2.49 115.31 117.26 3hq9 h LEU 148 Ca 0.10 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 3hq9 h LEU 148 Cb 0.36 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 3hq9 h LEU 148 CO 0.01 0.87 -0.05 0.78 0.09 0.00 0.00 178.44 180.14 3hq9 h ASN 149 N 1.01 0.00 0.79 -0.43 2.35 -0.86 -2.55 115.58 115.88 3hq9 h ASN 149 Ca 0.24 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.99 3hq9 h ASN 149 Cb 0.19 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.56 3hq9 h ASN 149 CO -0.02 0.05 0.00 -1.54 -1.65 0.00 0.00 177.43 174.27 3hq9 n SER 150 N -3.25 0.00 -4.07 5.81 3.41 -0.91 -4.60 113.62 110.01 3hq9 n SER 150 Ca -0.01 0.28 -0.33 0.00 -0.26 0.00 0.00 58.87 58.56 3hq9 n SER 150 Cb 0.23 -0.42 -0.14 0.00 -0.26 0.00 0.00 64.21 63.62 3hq9 n SER 150 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3hq9 s ILE 151 N -2.85 2.52 0.37 -1.33 1.01 -0.96 -4.28 121.20 115.68 3hq9 s ILE 151 Ca 0.18 -2.01 0.11 0.00 0.00 0.00 0.00 60.65 58.92 3hq9 s ILE 151 Cb 0.18 -2.70 0.33 0.00 0.01 0.00 0.00 42.46 40.29 3hq9 s ILE 151 CO 0.47 -0.42 1.85 -0.65 0.00 0.00 0.00 174.94 176.19 3hq9 h PRO 152 N 7.77 0.61 -0.66 2.79 0.11 -1.83 -1.10 132.00 139.69 3hq9 h PRO 152 Ca -0.11 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.94 3hq9 h PRO 152 Cb 1.03 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 31.98 3hq9 h PRO 152 CO 0.54 0.40 0.32 -0.44 -0.21 0.00 0.00 178.00 178.61 3hq9 h ASP 153 N 0.63 0.84 -0.34 -2.05 5.19 -1.93 0.09 116.42 118.85 3hq9 h ASP 153 Ca 0.47 -0.08 -0.07 0.00 -0.62 0.00 0.00 57.03 56.72 3hq9 h ASP 153 Cb 0.86 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 40.14 3hq9 h ASP 153 CO -0.22 0.71 -0.07 1.88 -3.12 0.00 0.00 179.24 178.41 3hq9 h TYR 154 N 0.93 0.72 -0.46 4.55 0.05 -1.49 -0.92 116.97 120.35 3hq9 h TYR 154 Ca 0.23 -0.15 0.05 0.00 0.05 0.00 0.00 58.73 58.90 3hq9 h TYR 154 Cb 0.09 -0.18 -0.05 0.00 1.01 0.00 0.00 36.73 37.61 3hq9 h TYR 154 CO 0.01 0.81 0.20 0.28 -1.05 0.00 0.00 178.16 178.40 3hq9 h VAL 155 N 0.43 0.91 -0.74 -2.88 2.07 -0.99 0.44 116.25 115.50 3hq9 h VAL 155 Ca 0.09 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.47 3hq9 h VAL 155 Cb 0.57 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 30.78 3hq9 h VAL 155 CO 0.03 0.07 0.46 0.00 0.02 0.00 0.00 177.57 178.16 3hq9 h ALA 156 N 1.27 0.94 -0.57 1.67 0.00 -0.90 -1.30 119.26 120.36 3hq9 h ALA 156 Ca 0.21 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 3hq9 h ALA 156 Cb 0.16 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3hq9 h ALA 156 CO -0.18 0.38 0.08 -0.07 0.00 0.00 0.00 179.25 179.46 3hq9 h LEU 157 N 1.00 0.89 -0.99 0.00 3.38 -0.59 -2.13 115.31 116.87 3hq9 h LEU 157 Ca 0.27 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.98 3hq9 h LEU 157 Cb -0.07 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.42 3hq9 h LEU 157 CO -0.05 0.91 0.09 -0.26 0.09 0.00 0.00 178.44 179.21 3hq9 h PHE 158 N 0.88 0.86 -0.11 1.13 0.04 -0.48 0.63 116.94 119.88 3hq9 h PHE 158 Ca 0.18 -0.09 -0.09 0.00 2.80 0.00 0.00 57.97 60.77 3hq9 h PHE 158 Cb 0.41 -0.25 -0.01 0.00 2.20 0.00 0.00 35.95 38.30 3hq9 h PHE 158 CO 0.03 0.74 -0.32 0.87 -0.60 0.00 0.00 178.31 179.03 3hq9 h LYS 159 N 0.79 0.21 0.16 1.51 1.57 -0.93 -0.79 116.57 119.09 3hq9 h LYS 159 Ca 0.17 -0.08 -0.30 0.00 -1.87 0.00 0.00 60.65 58.57 3hq9 h LYS 159 Cb 0.35 -0.01 0.02 0.00 0.08 0.00 0.00 32.23 32.66 3hq9 h LYS 159 CO 0.01 0.51 -1.31 0.87 -0.57 0.00 0.00 179.45 178.96 3hq9 h LYS 160 N 0.18 0.40 0.00 3.15 1.57 -0.96 -3.14 116.57 117.77 3hq9 h LYS 160 Ca 0.02 -0.65 -0.14 0.00 -1.87 0.00 0.00 60.65 58.01 3hq9 h LYS 160 Cb 0.66 0.24 -0.02 0.00 0.08 0.00 0.00 32.23 33.18 3hq9 h LYS 160 CO 0.05 1.30 -0.69 0.00 -0.57 0.00 0.00 179.45 179.54 3hq9 h ALA 161 N 0.43 0.58 -2.11 3.86 0.00 -0.74 -3.36 119.26 117.92 3hq9 h ALA 161 Ca -0.18 -0.63 -0.55 0.00 0.00 0.00 0.00 54.91 53.56 3hq9 h ALA 161 Cb 2.01 -0.11 -0.41 0.00 0.00 0.00 0.00 17.79 19.29 3hq9 h ALA 161 CO 0.23 0.86 -0.92 1.19 0.00 0.00 0.00 179.25 180.61 3hq9 n PHE 162 N -3.31 1.70 -1.28 0.00 3.72 -0.31 -4.83 117.46 113.14 3hq9 n PHE 162 Ca 0.01 -3.87 -0.32 0.00 -0.05 0.00 0.00 57.45 53.23 3hq9 n PHE 162 Cb 0.79 -0.45 0.09 0.00 -0.94 0.00 0.00 39.48 38.98 3hq9 n PHE 162 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 3hq9 s PRO 163 N -2.39 2.18 -1.30 -1.08 0.04 -1.19 -3.68 135.00 127.59 3hq9 s PRO 163 Ca 0.41 1.29 0.00 0.00 0.04 0.00 0.00 61.00 62.74 3hq9 s PRO 163 Cb 0.25 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.91 3hq9 s PRO 163 CO -0.09 -1.72 0.00 0.41 0.04 0.00 0.00 177.00 175.65 3hq9 n GLY 164 N -0.82 0.42 3.17 0.56 0.00 -1.26 -5.00 105.19 102.26 3hq9 n GLY 164 Ca 0.10 -0.33 -0.31 0.00 0.00 0.00 0.00 46.02 45.48 3hq9 n GLY 164 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hq9 s GLU 165 N -4.12 2.83 0.14 1.61 2.02 -1.24 -5.04 118.70 114.89 3hq9 s GLU 165 Ca 0.00 -0.80 -0.27 0.00 0.02 0.00 0.00 54.97 53.92 3hq9 s GLU 165 Cb 0.00 -2.22 -0.03 0.00 0.10 0.00 0.00 34.13 31.99 3hq9 s GLU 165 CO 0.00 0.08 1.59 -0.22 0.02 0.00 0.00 175.26 176.73 3hq9 h LYS 166 N 7.01 -0.40 -3.77 1.61 3.64 -1.94 -3.32 116.57 119.39 3hq9 h LYS 166 Ca -0.26 0.03 -0.62 0.00 -1.27 0.00 0.00 60.65 58.53 3hq9 h LYS 166 Cb 1.21 0.09 -0.40 0.00 -0.41 0.00 0.00 32.23 32.72 3hq9 h LYS 166 CO 0.50 -0.27 -0.73 0.34 -2.27 0.00 0.00 179.45 177.02 3hq9 s ASP 167 N -4.93 4.20 0.00 4.20 -1.08 -1.26 -4.98 116.67 112.81 3hq9 s ASP 167 Ca -0.15 -2.09 0.29 0.00 -0.52 0.00 0.00 52.55 50.08 3hq9 s ASP 167 Cb 0.10 -1.18 1.47 0.00 -1.46 0.00 0.00 42.92 41.85 3hq9 s ASP 167 CO 0.65 -0.36 2.02 -0.81 0.52 0.00 0.00 175.17 177.19 3hq9 n PRO 168 N 4.29 0.39 -2.91 4.34 -0.04 -1.25 -4.56 135.00 135.26 3hq9 n PRO 168 Ca 0.02 0.01 -0.44 0.00 -0.04 0.00 0.00 63.50 63.05 3hq9 n PRO 168 Cb 0.40 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.35 3hq9 n PRO 168 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3hq9 s VAL 169 N -2.60 4.87 0.20 0.52 1.01 -1.26 -4.75 120.40 118.38 3hq9 s VAL 169 Ca 0.27 -2.30 0.09 0.00 0.00 0.00 0.00 61.98 60.04 3hq9 s VAL 169 Cb 0.20 -4.91 -0.04 0.00 0.00 0.00 0.00 36.38 31.63 3hq9 s VAL 169 CO 0.46 -1.63 -0.17 0.42 0.00 0.00 0.00 175.10 174.17 3hq9 s THR 170 N 2.11 1.91 0.28 3.92 -4.23 -1.26 -4.99 115.64 113.39 3hq9 s THR 170 Ca 0.41 -2.09 -0.02 0.00 -1.18 0.00 0.00 61.69 58.81 3hq9 s THR 170 Cb -0.03 -1.99 0.21 0.00 1.34 0.00 0.00 72.50 72.04 3hq9 s THR 170 CO -0.02 -0.41 1.90 0.15 -0.54 0.00 0.00 174.62 175.70 3hq9 h PHE 171 N 2.88 0.99 -0.58 3.99 3.57 -1.92 -0.33 116.94 125.54 3hq9 h PHE 171 Ca -0.41 -0.03 -0.11 0.00 3.53 0.00 0.00 57.97 60.96 3hq9 h PHE 171 Cb 1.22 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 39.62 3hq9 h PHE 171 CO 0.71 0.71 -0.05 0.22 -2.23 0.00 0.00 178.31 177.67 3hq9 h ASP 172 N 1.01 1.05 -0.45 0.41 3.58 -1.96 -1.11 116.42 118.94 3hq9 h ASP 172 Ca 0.25 -0.33 -0.12 0.00 0.42 0.00 0.00 57.03 57.25 3hq9 h ASP 172 Cb 0.06 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 40.81 3hq9 h ASP 172 CO -0.04 1.13 -0.19 0.78 -2.88 0.00 0.00 179.24 178.04 3hq9 h ASN 173 N 0.95 0.97 -0.29 2.28 2.35 -1.77 -0.75 115.58 119.32 3hq9 h ASN 173 Ca 0.16 -0.35 0.06 0.00 -0.55 0.00 0.00 56.30 55.62 3hq9 h ASN 173 Cb 0.62 -0.27 -0.06 0.00 0.05 0.00 0.00 38.32 38.66 3hq9 h ASN 173 CO 0.04 1.13 -0.12 -0.03 -1.65 0.00 0.00 177.43 176.80 3hq9 h MET 174 N 0.83 -0.07 -0.80 0.81 4.05 -0.80 -0.39 114.93 118.57 3hq9 h MET 174 Ca 0.11 0.00 0.03 0.00 -0.28 0.00 0.00 59.70 59.57 3hq9 h MET 174 Cb 0.75 0.02 -0.05 0.00 -0.80 0.00 0.00 31.60 31.52 3hq9 h MET 174 CO 0.06 -0.04 0.51 0.00 0.23 0.00 0.00 176.91 177.67 3hq9 h ALA 175 N 1.18 1.04 -0.74 0.39 0.00 -0.97 -1.32 119.26 118.85 3hq9 h ALA 175 Ca 0.15 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3hq9 h ALA 175 Cb 0.30 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 3hq9 h ALA 175 CO -0.34 0.34 0.43 0.87 0.00 0.00 0.00 179.25 180.54 3hq9 h LYS 176 N 1.00 1.02 -0.24 0.00 1.57 -0.59 0.38 116.57 119.71 3hq9 h LYS 176 Ca 0.32 -0.11 -0.02 0.00 -1.87 0.00 0.00 60.65 58.97 3hq9 h LYS 176 Cb -0.01 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.09 3hq9 h LYS 176 CO -0.11 0.74 0.09 0.00 -0.57 0.00 0.00 179.45 179.60 3hq9 h ALA 177 N 1.22 0.31 -0.85 3.86 0.00 -0.63 -1.58 119.26 121.59 3hq9 h ALA 177 Ca 0.26 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 55.10 3hq9 h ALA 177 Cb 0.00 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.64 3hq9 h ALA 177 CO -0.05 -0.08 0.53 0.82 0.00 0.00 0.00 179.25 180.47 3hq9 h ILE 178 N 0.23 1.07 -0.48 0.00 2.04 -0.96 -2.59 117.51 116.82 3hq9 h ILE 178 Ca 0.08 -0.34 -0.09 0.00 1.00 0.00 0.00 64.86 65.51 3hq9 h ILE 178 Cb 0.20 -0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 36.25 3hq9 h ILE 178 CO -0.01 0.18 -0.07 -0.33 0.00 0.00 0.00 178.15 177.93 3hq9 h GLU 179 N 0.99 0.85 -0.28 2.37 5.08 -0.51 0.14 114.58 123.21 3hq9 h GLU 179 Ca 0.36 -0.27 -0.08 0.00 -1.00 0.00 0.00 59.36 58.37 3hq9 h GLU 179 Cb 0.12 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 3hq9 h GLU 179 CO -0.15 0.89 -0.17 -0.39 -1.00 0.00 0.00 179.01 178.18 3hq9 h VAL 180 N 0.77 1.24 -0.23 3.13 -1.51 -0.98 -0.17 116.25 118.50 3hq9 h VAL 180 Ca 0.13 -1.12 -0.04 0.00 -1.23 0.00 0.00 66.70 64.45 3hq9 h VAL 180 Cb 0.56 1.22 -0.01 0.00 -2.13 0.00 0.00 31.29 30.94 3hq9 h VAL 180 CO 0.03 0.36 -0.01 0.15 -1.23 0.00 0.00 177.57 176.88 3hq9 h PHE 181 N 0.45 0.46 -0.42 5.19 3.57 -1.02 -3.07 116.94 122.11 3hq9 h PHE 181 Ca 0.08 -0.08 0.05 0.00 3.53 0.00 0.00 57.97 61.54 3hq9 h PHE 181 Cb 0.56 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.16 3hq9 h PHE 181 CO 0.02 0.60 0.28 0.93 -2.23 0.00 0.00 178.31 177.91 3hq9 h GLU 182 N 0.18 0.35 0.00 1.11 5.08 -0.33 -0.96 114.58 120.02 3hq9 h GLU 182 Ca 0.07 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 3hq9 h GLU 182 Cb 0.43 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.60 3hq9 h GLU 182 CO 0.01 0.23 -0.03 0.00 -1.00 0.00 0.00 179.01 178.23 3hq9 h ALA 183 N 1.77 1.26 0.00 3.43 0.00 -0.93 -0.61 119.26 124.17 3hq9 h ALA 183 Ca 0.18 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3hq9 h ALA 183 Cb 0.25 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3hq9 h ALA 183 CO -0.04 0.04 -0.18 0.25 0.00 0.00 0.00 179.25 179.31 3hq9 n THR 184 N -3.49 0.32 -2.23 0.00 -2.24 -0.37 -4.26 114.28 102.01 3hq9 n THR 184 Ca -0.02 -0.17 -0.42 0.00 -2.27 0.00 0.00 64.05 61.17 3hq9 n THR 184 Cb 0.13 -0.37 0.00 0.00 -2.10 0.00 0.00 70.33 67.99 3hq9 n THR 184 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3hq9 n LEU 185 N -1.94 7.22 -4.48 3.22 4.77 -0.24 -4.90 117.00 120.65 3hq9 n LEU 185 Ca 0.05 -4.78 -0.24 0.00 -0.03 0.00 0.00 56.01 51.02 3hq9 n LEU 185 Cb 0.40 -1.42 -0.10 0.00 -2.33 0.00 0.00 43.42 39.97 3hq9 n LEU 185 CO 0.31 1.68 -0.47 0.27 -1.33 0.00 0.00 177.39 177.85 3hq9 s ILE 186 N -0.42 2.56 -0.57 -0.08 -4.36 -1.26 -0.73 121.20 116.34 3hq9 s ILE 186 Ca 0.45 -2.30 0.05 0.00 -0.26 0.00 0.00 60.65 58.58 3hq9 s ILE 186 Cb 0.13 -2.33 0.18 0.00 1.25 0.00 0.00 42.46 41.69 3hq9 s ILE 186 CO -0.03 -0.36 0.46 0.35 0.24 0.00 0.00 174.94 175.60 3hq9 n THR 187 N -0.52 0.45 -1.26 8.37 -2.24 -1.26 -4.55 114.28 113.27 3hq9 n THR 187 Ca -0.06 -4.29 -0.29 0.00 -2.27 0.00 0.00 64.05 57.14 3hq9 n THR 187 Cb 0.59 -1.96 0.18 0.00 -2.10 0.00 0.00 70.33 67.04 3hq9 n THR 187 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3hq9 s PRO 188 N -0.94 0.22 -1.13 -0.78 0.04 -1.26 -4.09 135.00 127.05 3hq9 s PRO 188 Ca 0.30 0.29 0.00 0.00 0.04 0.00 0.00 61.00 61.63 3hq9 s PRO 188 Cb 0.02 -1.73 0.00 0.00 0.04 0.00 0.00 34.50 32.83 3hq9 s PRO 188 CO -0.17 -2.83 0.00 -0.25 0.04 0.00 0.00 177.00 173.80 3hq9 n ASP 189 N -4.20 -4.14 -4.60 6.66 8.00 -1.26 -1.21 116.55 115.80 3hq9 n ASP 189 Ca 0.07 0.18 -0.33 0.00 0.71 0.00 0.00 54.79 55.42 3hq9 n ASP 189 Cb 0.58 -2.91 0.13 0.00 -0.02 0.00 0.00 41.12 38.90 3hq9 n ASP 189 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3hq9 n SER 190 N 0.02 -0.09 -0.34 -2.24 3.41 -1.26 -4.66 113.62 108.46 3hq9 n SER 190 Ca -0.12 0.49 0.07 0.00 -0.26 0.00 0.00 58.87 59.06 3hq9 n SER 190 Cb 0.46 -1.40 0.24 0.00 -0.26 0.00 0.00 64.21 63.25 3hq9 n SER 190 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 3hq9 h PRO 191 N -1.20 0.85 -0.64 4.33 0.11 -1.72 -0.76 132.00 132.96 3hq9 h PRO 191 Ca -0.45 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.56 3hq9 h PRO 191 Cb 1.30 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 32.19 3hq9 h PRO 191 CO 0.42 0.56 0.18 0.35 -0.21 0.00 0.00 178.00 179.30 3hq9 h PHE 192 N 0.87 1.02 -0.73 0.65 3.57 -1.56 -0.60 116.94 120.16 3hq9 h PHE 192 Ca 0.49 -0.10 -0.05 0.00 3.53 0.00 0.00 57.97 61.84 3hq9 h PHE 192 Cb 0.56 -0.30 -0.03 0.00 2.79 0.00 0.00 35.95 38.97 3hq9 h PHE 192 CO -0.02 0.82 0.25 -0.44 -2.23 0.00 0.00 178.31 176.69 3hq9 h ASP 193 N 0.95 1.03 -0.67 0.41 5.19 -1.45 0.19 116.42 122.06 3hq9 h ASP 193 Ca 0.21 -0.18 -0.02 0.00 -0.62 0.00 0.00 57.03 56.42 3hq9 h ASP 193 Cb 0.30 -0.27 -0.03 0.00 0.18 0.00 0.00 39.33 39.51 3hq9 h ASP 193 CO -0.00 0.94 0.34 1.56 -3.12 0.00 0.00 179.24 178.95 3hq9 h GLN 194 N 1.07 0.98 -0.15 3.56 4.20 -0.72 -0.96 115.11 123.10 3hq9 h GLN 194 Ca 0.24 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.81 3hq9 h GLN 194 Cb 0.26 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 3hq9 h GLN 194 CO -0.01 0.76 0.06 -0.92 -0.67 0.00 0.00 178.83 178.05 3hq9 h TYR 195 N 0.98 0.23 -0.46 2.96 3.20 -0.55 -1.36 116.97 121.97 3hq9 h TYR 195 Ca 0.24 -0.02 0.02 0.00 3.14 0.00 0.00 58.73 62.12 3hq9 h TYR 195 Cb 0.09 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.27 3hq9 h TYR 195 CO 0.01 0.30 0.30 -0.07 -1.64 0.00 0.00 178.16 177.07 3hq9 h LEU 196 N 0.09 0.46 0.00 2.82 3.38 -0.53 -1.44 115.31 120.09 3hq9 h LEU 196 Ca 0.05 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3hq9 h LEU 196 Cb 0.17 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.81 3hq9 h LEU 196 CO -0.00 0.32 0.00 0.29 0.09 0.00 0.00 178.44 179.14 3hq9 n LYS 197 N -4.47 0.20 0.00 1.13 5.02 -0.41 -4.88 118.16 114.76 3hq9 n LYS 197 Ca 0.05 0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.35 3hq9 n LYS 197 Cb 0.13 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.64 3hq9 n LYS 197 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hq9 n GLY 198 N 1.27 0.98 3.46 0.72 0.00 -0.54 -5.07 105.19 106.01 3hq9 n GLY 198 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 3hq9 n GLY 198 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3hq9 s LYS 199 N 0.00 3.32 0.30 1.61 2.20 -0.55 -4.89 119.74 121.74 3hq9 s LYS 199 Ca 0.00 -1.20 0.04 0.00 -0.36 0.00 0.00 55.97 54.46 3hq9 s LYS 199 Cb 0.00 -4.56 0.67 0.00 -1.51 0.00 0.00 37.83 32.43 3hq9 s LYS 199 CO 0.00 -1.83 1.82 0.87 -0.36 0.00 0.00 175.35 175.85 3hq9 h LYS 200 N 9.31 0.83 -0.03 4.03 1.57 -1.87 -1.12 116.57 129.29 3hq9 h LYS 200 Ca -0.09 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 3hq9 h LYS 200 Cb 1.05 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 33.17 3hq9 h LYS 200 CO 1.17 0.55 0.00 1.63 -0.57 0.00 0.00 179.45 182.23 3hq9 n LYS 201 N -4.67 1.14 0.25 3.15 5.02 -1.26 -2.86 118.16 118.93 3hq9 n LYS 201 Ca 0.21 -0.22 0.10 0.00 -2.02 0.00 0.00 58.31 56.38 3hq9 n LYS 201 Cb 0.46 -1.32 0.69 0.00 -0.02 0.00 0.00 35.03 34.84 3hq9 n LYS 201 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hq9 h ALA 202 N 3.70 1.96 -3.15 7.82 0.00 -1.51 -3.39 119.26 124.69 3hq9 h ALA 202 Ca 0.00 -0.00 -0.63 0.00 0.00 0.00 0.00 54.91 54.28 3hq9 h ALA 202 Cb 0.10 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 17.76 3hq9 h ALA 202 CO 0.00 -0.05 -0.54 -0.51 0.00 0.00 0.00 179.25 178.15 3hq9 s LEU 203 N -8.81 3.99 0.00 0.00 1.43 -1.14 -4.77 118.68 109.39 3hq9 s LEU 203 Ca -0.05 0.20 -0.18 0.00 -1.03 0.00 0.00 54.13 53.08 3hq9 s LEU 203 Cb 0.17 -2.00 0.25 0.00 0.03 0.00 0.00 46.19 44.64 3hq9 s LEU 203 CO 0.65 0.25 1.17 -0.90 0.23 0.00 0.00 176.35 177.75 3hq9 n ASP 204 N 3.04 -0.84 -0.23 2.29 5.68 -1.26 -4.72 116.55 120.51 3hq9 n ASP 204 Ca -0.17 -1.32 -0.06 0.00 -0.50 0.00 0.00 54.79 52.74 3hq9 n ASP 204 Cb 0.53 -0.96 0.04 0.00 -1.14 0.00 0.00 41.12 39.59 3hq9 n ASP 204 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 3hq9 h GLY 205 N -2.08 0.93 0.89 6.12 0.00 -1.98 -0.17 103.07 106.79 3hq9 h GLY 205 Ca -0.40 -0.40 -0.07 0.00 0.00 0.00 0.00 47.33 46.45 3hq9 h GLY 205 CO 0.27 0.39 -0.09 1.70 0.00 0.00 0.00 176.54 178.81 3hq9 h LYS 206 N 0.86 0.58 -0.62 4.80 3.64 -1.96 -1.33 116.57 122.55 3hq9 h LYS 206 Ca 0.23 -0.23 -0.04 0.00 -1.27 0.00 0.00 60.65 59.33 3hq9 h LYS 206 Cb 0.00 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.77 3hq9 h LYS 206 CO -0.04 0.79 0.21 1.96 -2.27 0.00 0.00 179.45 180.10 3hq9 h GLN 207 N 0.34 0.93 -0.52 1.90 4.20 -1.77 0.35 115.11 120.54 3hq9 h GLN 207 Ca 0.07 -0.17 -0.10 0.00 0.06 0.00 0.00 58.65 58.52 3hq9 h GLN 207 Cb 0.59 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.20 3hq9 h GLN 207 CO 0.03 0.78 -0.06 1.15 -0.67 0.00 0.00 178.83 180.07 3hq9 h THR 208 N 0.91 1.27 -0.60 -0.54 2.02 -0.83 0.39 112.91 115.52 3hq9 h THR 208 Ca 0.21 -1.19 -0.03 0.00 0.77 0.00 0.00 66.41 66.17 3hq9 h THR 208 Cb 0.23 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 67.59 3hq9 h THR 208 CO -0.01 0.42 0.23 0.00 0.37 0.00 0.00 175.52 176.53 3hq9 h ALA 209 N 0.92 1.28 -0.62 6.16 0.00 -0.86 -1.88 119.26 124.27 3hq9 h ALA 209 Ca 0.14 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 3hq9 h ALA 209 Cb 0.61 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 3hq9 h ALA 209 CO 0.04 0.53 0.01 0.78 0.00 0.00 0.00 179.25 180.61 3hq9 h GLY 210 N 0.98 1.17 0.94 0.00 0.00 -0.50 -1.90 103.07 103.76 3hq9 h GLY 210 Ca 0.20 -0.85 -0.02 0.00 0.00 0.00 0.00 47.33 46.67 3hq9 h GLY 210 CO -0.02 0.78 0.15 -2.00 0.00 0.00 0.00 176.54 175.46 3hq9 h LEU 211 N 0.99 0.46 -0.55 3.11 5.85 -0.58 0.11 115.31 124.70 3hq9 h LEU 211 Ca 0.18 -0.14 0.06 0.00 0.84 0.00 0.00 57.88 58.82 3hq9 h LEU 211 Cb 0.55 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.41 3hq9 h LEU 211 CO 0.03 0.47 0.26 0.50 -0.34 0.00 0.00 178.44 179.36 3hq9 h LYS 212 N 0.41 0.47 -0.67 1.25 3.64 -1.11 -1.59 116.57 118.98 3hq9 h LYS 212 Ca 0.12 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.43 3hq9 h LYS 212 Cb 0.15 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.83 3hq9 h LYS 212 CO -0.01 0.31 0.29 -0.07 -2.27 0.00 0.00 179.45 177.70 3hq9 h LEU 213 N 0.49 0.91 -1.15 5.20 3.38 -1.10 0.69 115.31 123.71 3hq9 h LEU 213 Ca 0.26 -0.16 0.06 0.00 0.09 0.00 0.00 57.88 58.12 3hq9 h LEU 213 Cb 0.21 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.67 3hq9 h LEU 213 CO -0.21 0.82 0.58 0.15 0.09 0.00 0.00 178.44 179.88 3hq9 h PHE 214 N 0.94 1.04 0.00 1.13 3.57 -0.02 0.12 116.94 123.72 3hq9 h PHE 214 Ca 0.23 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.75 3hq9 h PHE 214 Cb 0.18 -0.34 0.00 0.00 2.79 0.00 0.00 35.95 38.57 3hq9 h PHE 214 CO 0.01 0.56 -0.01 -0.07 -2.23 0.00 0.00 178.31 176.57 3hq9 h LEU 215 N 1.04 0.00 -1.19 0.59 3.38 -1.07 -2.01 115.31 116.05 3hq9 h LEU 215 Ca 0.38 -0.89 -0.07 0.00 0.09 0.00 0.00 57.88 57.39 3hq9 h LEU 215 Cb 0.16 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 3hq9 h LEU 215 CO -0.13 0.89 -0.14 0.44 0.09 0.00 0.00 178.44 179.58 3hq9 h ASP 216 N -0.88 0.38 0.75 -0.43 3.32 -0.62 -2.11 116.42 116.83 3hq9 h ASP 216 Ca -0.00 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.96 3hq9 h ASP 216 Cb 0.89 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.34 3hq9 h ASP 216 CO 0.00 0.55 -0.13 0.29 -1.72 0.00 0.00 179.24 178.23 3hq9 n LYS 217 N -4.21 0.14 -0.46 3.56 4.76 0.39 -4.93 118.16 117.40 3hq9 n LYS 217 Ca 0.00 -0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.41 3hq9 n LYS 217 Cb 0.31 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.00 3hq9 n LYS 217 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3hq9 n GLY 218 N 1.45 0.76 0.37 0.72 0.00 -0.79 -4.85 105.19 102.84 3hq9 n GLY 218 Ca 0.08 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.19 3hq9 n GLY 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hq9 h VAL 220 N 0.88 0.02 -0.88 0.00 3.04 -1.77 -1.40 116.25 116.14 3hq9 h VAL 220 Ca 0.47 -0.14 0.05 0.00 -1.01 0.00 0.00 66.70 66.08 3hq9 h VAL 220 Cb 0.56 1.13 -0.05 0.00 -2.01 0.00 0.00 31.29 30.92 3hq9 h VAL 220 CO -0.24 0.00 0.57 0.00 -1.01 0.00 0.00 177.57 176.90 3hq9 h ALA 221 N 2.00 1.51 0.00 3.17 0.00 -1.57 -2.87 119.26 121.50 3hq9 h ALA 221 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3hq9 h ALA 221 Cb 0.13 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3hq9 h ALA 221 CO 0.00 0.37 -1.57 0.00 0.00 0.00 0.00 179.25 178.05 3hq9 n HIS 223 N -1.94 3.10 -4.20 0.00 -0.00 -0.58 -4.32 115.22 107.29 3hq9 n HIS 223 Ca -0.02 -3.74 -0.11 0.00 -0.00 0.00 0.00 57.72 53.85 3hq9 n HIS 223 Cb 0.34 -0.40 -0.02 0.00 -0.00 0.00 0.00 29.99 29.91 3hq9 n HIS 223 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3hq9 n GLY 224 N -0.19 3.90 7.00 -1.41 0.00 -1.09 -3.96 105.19 109.45 3hq9 n GLY 224 Ca 0.30 -2.26 0.00 0.00 0.00 0.00 0.00 46.02 44.06 3hq9 n GLY 224 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hq9 n GLY 225 N 2.95 -0.75 0.37 -0.02 0.00 -0.42 -1.33 105.19 105.99 3hq9 n GLY 225 Ca -0.07 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.79 3hq9 n GLY 225 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3hq9 h LEU 226 N 0.00 1.07 -2.68 0.99 7.12 -1.85 -2.79 115.31 117.17 3hq9 h LEU 226 Ca 0.00 -0.01 0.00 0.00 0.13 0.00 0.00 57.88 58.00 3hq9 h LEU 226 Cb 0.00 -0.24 0.00 0.00 -0.53 0.00 0.00 40.66 39.89 3hq9 h LEU 226 CO 0.00 0.72 0.00 -3.20 -0.13 0.00 0.00 178.44 175.83 3hq9 n ASN 227 N -4.46 3.21 -3.78 1.25 5.15 -1.26 -4.62 115.26 110.75 3hq9 n ASN 227 Ca 0.13 -1.96 -0.26 0.00 -0.60 0.00 0.00 54.58 51.89 3hq9 n ASN 227 Cb 0.11 -0.29 0.02 0.00 -0.53 0.00 0.00 39.78 39.08 3hq9 n ASN 227 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 3hq9 n LEU 228 N 0.96 -2.75 0.00 1.20 4.32 -0.96 -2.96 117.00 116.81 3hq9 n LEU 228 Ca 0.16 -0.96 0.00 0.00 -0.02 0.00 0.00 56.01 55.19 3hq9 n LEU 228 Cb 0.49 -2.42 0.00 0.00 -1.62 0.00 0.00 43.42 39.88 3hq9 n LEU 228 CO 0.11 0.43 0.00 0.61 -1.22 0.00 0.00 177.39 177.33 3hq9 n GLY 229 N -1.76 0.03 1.43 -0.72 0.00 -0.44 -1.15 105.19 102.58 3hq9 n GLY 229 Ca -0.22 -2.29 0.00 0.00 0.00 0.00 0.00 46.02 43.51 3hq9 n GLY 229 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hq9 n GLY 230 N -0.03 0.74 0.00 -0.02 0.00 0.50 -4.16 105.19 102.22 3hq9 n GLY 230 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3hq9 n GLY 230 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hq9 n THR 231 N -2.33 0.00 -4.30 2.61 -2.24 -1.26 -1.31 114.28 105.44 3hq9 n THR 231 Ca 0.00 -0.30 -0.20 0.00 -2.27 0.00 0.00 64.05 61.28 3hq9 n THR 231 Cb 0.00 0.88 -0.13 0.00 -2.10 0.00 0.00 70.33 68.98 3hq9 n THR 231 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3hq9 s GLY 232 N -0.89 0.86 -0.10 3.38 0.00 -1.26 -4.55 107.32 104.75 3hq9 s GLY 232 Ca 0.00 -0.92 -0.02 0.00 0.00 0.00 0.00 44.72 43.78 3hq9 s GLY 232 CO 0.00 -0.91 -0.02 -0.19 0.00 0.00 0.00 173.10 171.98 3hq9 s TYR 233 N -1.00 3.09 0.02 1.90 2.02 -1.26 -1.75 117.35 120.37 3hq9 s TYR 233 Ca 0.01 0.04 0.01 0.00 -0.37 0.00 0.00 57.07 56.76 3hq9 s TYR 233 Cb -0.09 -1.83 -0.02 0.00 -0.40 0.00 0.00 41.96 39.63 3hq9 s TYR 233 CO 0.02 0.31 -0.04 -0.06 -1.57 0.00 0.00 175.55 174.20 3hq9 s PHE 234 N -0.52 0.39 -1.02 2.71 0.08 -0.02 -4.90 117.98 114.70 3hq9 s PHE 234 Ca 0.09 -0.38 -0.08 0.00 0.12 0.00 0.00 56.93 56.67 3hq9 s PHE 234 Cb -0.12 -0.25 -0.11 0.00 -0.57 0.00 0.00 43.02 41.97 3hq9 s PHE 234 CO 0.02 -0.10 3.09 -0.35 -0.10 0.00 0.00 175.22 177.78 3hq9 n PRO 235 N 1.95 3.21 -3.72 0.24 -0.04 -1.26 -0.92 135.00 134.46 3hq9 n PRO 235 Ca -0.20 -1.99 -0.13 0.00 -0.04 0.00 0.00 63.50 61.13 3hq9 n PRO 235 Cb 0.56 -2.49 -0.13 0.00 -0.04 0.00 0.00 33.50 31.39 3hq9 n PRO 235 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3hq9 s PHE 236 N 1.17 -0.31 0.04 0.54 0.08 -1.26 -0.63 117.98 117.61 3hq9 s PHE 236 Ca 0.67 0.75 -0.00 0.00 0.12 0.00 0.00 56.93 58.46 3hq9 s PHE 236 Cb 0.24 -0.00 -0.03 0.00 -0.57 0.00 0.00 43.02 42.65 3hq9 s PHE 236 CO -0.06 -0.24 -0.03 0.20 -0.10 0.00 0.00 175.22 174.99 3hq9 s GLY 237 N 1.47 0.41 -0.08 4.36 0.00 -0.91 -4.38 107.32 108.18 3hq9 s GLY 237 Ca -0.07 -1.00 -0.19 0.00 0.00 0.00 0.00 44.72 43.46 3hq9 s GLY 237 CO -0.08 -1.10 0.53 0.14 0.00 0.00 0.00 173.10 172.60 3hq9 s VAL 238 N -3.04 5.11 0.07 1.40 1.01 -1.26 -0.56 120.40 123.14 3hq9 s VAL 238 Ca -0.01 1.08 0.01 0.00 0.00 0.00 0.00 61.98 63.06 3hq9 s VAL 238 Cb 0.02 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 3hq9 s VAL 238 CO -0.07 0.34 -0.06 0.68 0.00 0.00 0.00 175.10 176.00 3hq9 s VAL 239 N 0.42 0.56 0.15 2.92 -7.23 -0.15 -4.94 120.40 112.13 3hq9 s VAL 239 Ca 0.29 -1.66 -0.30 0.00 -1.81 0.00 0.00 61.98 58.50 3hq9 s VAL 239 Cb -0.16 -1.33 -0.07 0.00 0.56 0.00 0.00 36.38 35.38 3hq9 s VAL 239 CO 0.13 -0.76 1.13 -0.70 -0.31 0.00 0.00 175.10 174.59 3hq9 s GLU 240 N -3.19 4.55 -0.10 4.82 2.12 -1.26 -1.19 118.70 124.45 3hq9 s GLU 240 Ca 0.04 1.74 -0.11 0.00 0.36 0.00 0.00 54.97 57.01 3hq9 s GLU 240 Cb 0.01 -3.29 -0.04 0.00 0.26 0.00 0.00 34.13 31.08 3hq9 s GLU 240 CO -0.04 -0.01 -0.21 0.36 -0.54 0.00 0.00 175.26 174.82 3hq9 n LYS 241 N 2.71 0.31 -0.24 4.30 2.85 -1.26 -4.91 118.16 121.91 3hq9 n LYS 241 Ca 0.04 0.12 0.00 0.00 -1.05 0.00 0.00 58.31 57.42 3hq9 n LYS 241 Cb 0.46 -1.03 0.00 0.00 -0.65 0.00 0.00 35.03 33.81 3hq9 n LYS 241 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3hq9 n GLY 253 N 1.62 0.00 0.14 2.58 0.00 -1.26 -5.04 105.19 103.23 3hq9 n GLY 253 Ca -0.08 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.05 3hq9 n GLY 253 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3hq9 h ARG 254 N 0.06 0.00 -6.47 1.61 2.43 -1.99 -3.46 114.38 106.55 3hq9 h ARG 254 Ca 0.00 0.00 -0.64 0.00 -0.81 0.00 0.00 59.98 58.53 3hq9 h ARG 254 Cb 0.00 0.00 -0.17 0.00 -0.42 0.00 0.00 29.97 29.38 3hq9 h ARG 254 CO 0.00 0.02 -0.79 -0.06 -1.51 0.00 0.00 179.97 177.63 3hq9 s PHE 255 N -3.30 2.34 0.12 2.20 0.08 -1.26 -4.65 117.98 113.50 3hq9 s PHE 255 Ca 0.01 -0.33 -0.17 0.00 0.12 0.00 0.00 56.93 56.56 3hq9 s PHE 255 Cb 0.08 -1.11 0.04 0.00 -0.57 0.00 0.00 43.02 41.46 3hq9 s PHE 255 CO 0.76 0.57 0.41 0.00 -0.10 0.00 0.00 175.22 176.86 3hq9 s ALA 256 N -1.93 -0.97 0.08 5.36 0.00 -0.33 -4.86 121.76 119.10 3hq9 s ALA 256 Ca 0.24 -0.00 -0.30 0.00 0.00 0.00 0.00 51.96 51.90 3hq9 s ALA 256 Cb -0.07 0.69 -0.05 0.00 0.00 0.00 0.00 23.12 23.69 3hq9 s ALA 256 CO 0.12 -0.64 1.02 0.08 0.00 0.00 0.00 175.76 176.34 3hq9 s VAL 257 N -3.75 4.45 0.14 0.00 1.01 -1.26 -0.98 120.40 120.01 3hq9 s VAL 257 Ca 0.02 1.92 0.09 0.00 0.00 0.00 0.00 61.98 64.02 3hq9 s VAL 257 Cb 0.02 -4.23 -0.04 0.00 0.00 0.00 0.00 36.38 32.13 3hq9 s VAL 257 CO -0.12 0.24 -0.17 0.28 0.00 0.00 0.00 175.10 175.33 3hq9 s THR 258 N 0.39 2.82 -0.27 3.92 -1.32 0.28 -4.90 115.64 116.56 3hq9 s THR 258 Ca 0.50 -1.64 -0.19 0.00 -1.21 0.00 0.00 61.69 59.16 3hq9 s THR 258 Cb -0.24 -2.32 -0.02 0.00 -1.51 0.00 0.00 72.50 68.40 3hq9 s THR 258 CO 0.30 0.01 0.55 0.21 -2.21 0.00 0.00 174.62 173.48 3hq9 s ASN 259 N -2.39 6.46 -0.06 8.08 3.84 -1.26 -2.14 114.94 127.48 3hq9 s ASN 259 Ca 0.20 0.52 0.13 0.00 0.21 0.00 0.00 52.86 53.92 3hq9 s ASN 259 Cb -0.10 -2.30 0.39 0.00 -0.55 0.00 0.00 41.25 38.70 3hq9 s ASN 259 CO 0.11 -0.33 1.32 0.35 -2.79 0.00 0.00 177.10 175.77 3hq9 n THR 260 N 5.20 1.42 -0.05 -5.21 -2.24 0.19 -4.65 114.28 108.95 3hq9 n THR 260 Ca -0.03 -1.27 -0.01 0.00 -2.27 0.00 0.00 64.05 60.47 3hq9 n THR 260 Cb 0.49 0.26 0.27 0.00 -2.10 0.00 0.00 70.33 69.25 3hq9 n THR 260 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hq9 h ALA 261 N 2.07 1.34 -0.14 6.98 0.00 -1.76 -1.45 119.26 126.31 3hq9 h ALA 261 Ca 0.00 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 3hq9 h ALA 261 Cb 0.98 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 3hq9 h ALA 261 CO 0.08 0.47 0.07 1.57 0.00 0.00 0.00 179.25 181.43 3hq9 h LYS 262 N 0.62 0.18 -0.01 0.00 -0.00 -1.93 0.04 116.57 115.47 3hq9 h LYS 262 Ca 0.14 -0.01 0.00 0.00 -0.00 0.00 0.00 60.65 60.77 3hq9 h LYS 262 Cb 0.29 -0.04 0.00 0.00 -0.00 0.00 0.00 32.23 32.48 3hq9 h LYS 262 CO 0.00 0.14 -0.01 -0.25 -0.00 0.00 0.00 179.45 179.34 3hq9 n ASP 263 N -4.49 0.71 -3.87 7.07 8.00 -0.57 -4.93 116.55 118.48 3hq9 n ASP 263 Ca -0.01 -1.21 -0.28 0.00 0.71 0.00 0.00 54.79 54.00 3hq9 n ASP 263 Cb 0.10 -0.00 0.03 0.00 -0.02 0.00 0.00 41.12 41.22 3hq9 n ASP 263 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3hq9 n GLU 264 N -0.46 -5.32 -4.59 -1.24 1.02 0.00 -4.96 120.64 105.10 3hq9 n GLU 264 Ca 0.21 0.60 -0.25 0.00 -0.02 0.00 0.00 57.16 57.70 3hq9 n GLU 264 Cb 0.23 -5.39 -0.14 0.00 -0.02 0.00 0.00 31.44 26.12 3hq9 n GLU 264 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 3hq9 s TYR 265 N -3.41 1.73 0.07 -0.32 5.04 -1.10 -1.70 117.35 117.67 3hq9 s TYR 265 Ca 0.49 -0.37 -0.01 0.00 -2.44 0.00 0.00 57.07 54.74 3hq9 s TYR 265 Cb -0.25 -1.03 -0.04 0.00 0.35 0.00 0.00 41.96 40.99 3hq9 s TYR 265 CO 0.83 0.09 -0.01 0.14 -1.34 0.00 0.00 175.55 175.26 3hq9 s VAL 266 N -0.82 0.22 0.02 3.14 -7.23 -0.27 -4.35 120.40 111.10 3hq9 s VAL 266 Ca 0.07 -1.84 0.05 0.00 -1.81 0.00 0.00 61.98 58.44 3hq9 s VAL 266 Cb -0.09 -1.65 -0.02 0.00 0.56 0.00 0.00 36.38 35.18 3hq9 s VAL 266 CO 0.02 -0.87 -0.14 -0.36 -0.31 0.00 0.00 175.10 173.43 3hq9 s PHE 267 N -3.93 1.28 0.27 2.82 0.08 -0.09 -1.41 117.98 116.98 3hq9 s PHE 267 Ca 0.11 -0.31 -0.30 0.00 0.12 0.00 0.00 56.93 56.55 3hq9 s PHE 267 Cb 0.08 -0.78 -0.10 0.00 -0.57 0.00 0.00 43.02 41.64 3hq9 s PHE 267 CO -0.07 0.02 1.47 0.50 -0.10 0.00 0.00 175.22 177.04 3hq9 s ARG 268 N -0.85 4.24 -0.50 0.44 3.52 0.28 -0.84 118.95 125.24 3hq9 s ARG 268 Ca 0.03 2.36 -0.27 0.00 -0.13 0.00 0.00 55.73 57.73 3hq9 s ARG 268 Cb -0.07 -3.09 0.03 0.00 -1.56 0.00 0.00 34.95 30.26 3hq9 s ARG 268 CO 0.01 -0.46 1.02 0.00 -0.81 0.00 0.00 175.30 175.06 3hq9 s ALA 269 N -0.09 3.17 0.65 6.12 0.00 -0.72 -4.92 121.76 125.97 3hq9 s ALA 269 Ca 0.59 -0.79 -0.16 0.00 0.00 0.00 0.00 51.96 51.61 3hq9 s ALA 269 Cb -0.43 -3.78 -0.00 0.00 0.00 0.00 0.00 23.12 18.91 3hq9 s ALA 269 CO 0.45 -2.25 1.13 -2.14 0.00 0.00 0.00 175.76 172.95 3hq9 s PRO 270 N 4.13 2.79 0.18 0.00 0.02 -1.26 -0.37 135.00 140.48 3hq9 s PRO 270 Ca 0.40 1.47 -0.33 0.00 0.02 0.00 0.00 61.00 62.55 3hq9 s PRO 270 Cb -0.09 -1.94 -0.14 0.00 0.02 0.00 0.00 34.50 32.34 3hq9 s PRO 270 CO 0.27 -1.27 1.49 0.45 -0.33 0.00 0.00 177.00 177.60 3hq9 n SER 271 N -2.30 2.78 -0.87 2.53 2.88 -1.26 -3.92 113.62 113.46 3hq9 n SER 271 Ca 0.11 1.11 0.11 0.00 -1.33 0.00 0.00 58.87 58.87 3hq9 n SER 271 Cb 0.52 -1.39 0.28 0.00 -0.75 0.00 0.00 64.21 62.86 3hq9 n SER 271 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 3hq9 n LEU 272 N 2.89 2.60 -4.75 2.46 4.77 -0.30 -4.86 117.00 119.82 3hq9 n LEU 272 Ca 0.15 -1.11 -0.41 0.00 -0.03 0.00 0.00 56.01 54.61 3hq9 n LEU 272 Cb 0.28 -0.18 -0.02 0.00 -2.33 0.00 0.00 43.42 41.17 3hq9 n LEU 272 CO 0.63 0.56 1.20 -0.13 -1.33 0.00 0.00 177.39 178.32 3hq9 s ARG 273 N -1.63 4.16 -1.57 3.23 0.52 -1.25 -1.65 118.95 120.76 3hq9 s ARG 273 Ca 0.35 2.51 0.00 0.00 -0.52 0.00 0.00 55.73 58.07 3hq9 s ARG 273 Cb 0.20 -3.04 0.00 0.00 0.52 0.00 0.00 34.95 32.63 3hq9 s ARG 273 CO 0.29 -0.57 0.00 0.09 0.02 0.00 0.00 175.30 175.13 3hq9 n ASN 274 N 2.11 -5.56 -0.03 0.23 3.02 -0.66 -4.86 115.26 109.50 3hq9 n ASN 274 Ca 0.07 0.37 0.14 0.00 -0.03 0.00 0.00 54.58 55.12 3hq9 n ASN 274 Cb 0.38 -4.36 0.56 0.00 -0.61 0.00 0.00 39.78 35.74 3hq9 n ASN 274 CO 0.00 0.00 0.00 1.62 -2.62 0.00 0.00 177.26 176.26 3hq9 h VAL 275 N 0.00 0.87 0.00 2.41 3.04 -1.58 -0.12 116.25 120.87 3hq9 h VAL 275 Ca -0.30 -0.10 -0.00 0.00 -1.01 0.00 0.00 66.70 65.29 3hq9 h VAL 275 Cb 1.22 0.56 -0.00 0.00 -2.01 0.00 0.00 31.29 31.07 3hq9 h VAL 275 CO 0.44 0.05 -0.01 0.00 -1.01 0.00 0.00 177.57 177.05 3hq9 h ALA 276 N 1.73 1.04 -0.15 3.17 0.00 -1.84 -2.18 119.26 121.03 3hq9 h ALA 276 Ca 0.25 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3hq9 h ALA 276 Cb 0.61 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.39 3hq9 h ALA 276 CO -0.05 0.01 0.00 0.44 0.00 0.00 0.00 179.25 179.64 3hq9 n ILE 277 N -3.15 1.46 -1.33 0.00 -5.35 -0.07 -4.60 119.36 106.32 3hq9 n ILE 277 Ca -0.02 -1.45 0.07 0.00 -0.27 0.00 0.00 62.75 61.08 3hq9 n ILE 277 Cb 0.14 0.19 0.18 0.00 -1.74 0.00 0.00 39.64 38.41 3hq9 n ILE 277 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 3hq9 n THR 278 N -0.43 2.09 -1.13 7.28 -2.24 -0.82 -4.55 114.28 114.50 3hq9 n THR 278 Ca 0.11 -2.72 -0.35 0.00 -2.27 0.00 0.00 64.05 58.82 3hq9 n THR 278 Cb 0.51 -0.25 0.09 0.00 -2.10 0.00 0.00 70.33 68.59 3hq9 n THR 278 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hq9 n TYR 279 N -1.23 -0.73 -1.50 4.78 0.18 -1.25 -4.62 117.16 112.78 3hq9 n TYR 279 Ca 0.19 0.32 -0.30 0.00 1.88 0.00 0.00 57.90 59.99 3hq9 n TYR 279 Cb 0.70 -1.90 0.23 0.00 -0.38 0.00 0.00 39.34 37.99 3hq9 n TYR 279 CO 0.00 0.00 0.00 -1.25 -2.08 0.00 0.00 176.86 173.53 3hq9 s PRO 280 N -3.14 -0.64 0.26 -3.48 0.04 -1.26 -4.47 135.00 122.30 3hq9 s PRO 280 Ca 0.64 -0.37 0.11 0.00 0.04 0.00 0.00 61.00 61.42 3hq9 s PRO 280 Cb -0.31 -1.69 -0.05 0.00 0.04 0.00 0.00 34.50 32.50 3hq9 s PRO 280 CO 0.60 -3.28 -0.15 0.71 0.04 0.00 0.00 177.00 174.92 3hq9 s TYR 281 N -3.49 2.42 0.10 0.56 2.02 0.12 -4.78 117.35 114.30 3hq9 s TYR 281 Ca 0.75 -0.30 0.00 0.00 -0.37 0.00 0.00 57.07 57.15 3hq9 s TYR 281 Cb -0.05 -1.08 0.00 0.00 -0.40 0.00 0.00 41.96 40.43 3hq9 s TYR 281 CO 0.55 0.65 0.00 1.19 -1.57 0.00 0.00 175.55 176.37 3hq9 n PHE 282 N -0.51 -0.82 0.27 2.71 3.72 -1.26 -2.25 117.46 119.32 3hq9 n PHE 282 Ca -0.07 0.43 0.11 0.00 -0.05 0.00 0.00 57.45 57.87 3hq9 n PHE 282 Cb 0.59 -0.75 0.75 0.00 -0.94 0.00 0.00 39.48 39.13 3hq9 n PHE 282 CO 0.00 0.00 0.00 1.12 -0.05 0.00 0.00 176.76 177.83 3hq9 h HIS 283 N -0.30 0.00 -0.02 1.38 2.07 -1.94 -1.83 115.15 114.50 3hq9 h HIS 283 Ca -0.02 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.50 3hq9 h HIS 283 Cb 0.30 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.28 3hq9 h HIS 283 CO -0.05 0.01 -0.15 -1.13 -3.07 0.00 0.00 177.93 173.54 3hq9 n SER 284 N -4.22 2.52 -2.58 3.10 3.41 -1.26 -0.59 113.62 113.99 3hq9 n SER 284 Ca -0.03 -1.76 -0.21 0.00 -0.26 0.00 0.00 58.87 56.61 3hq9 n SER 284 Cb 0.10 0.16 0.01 0.00 -0.26 0.00 0.00 64.21 64.22 3hq9 n SER 284 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hq9 n GLY 285 N 1.27 -0.47 0.15 5.00 0.00 -0.69 -4.39 105.19 106.05 3hq9 n GLY 285 Ca 0.11 0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.28 3hq9 n GLY 285 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3hq9 h VAL 286 N -0.61 0.00 -3.12 1.61 -1.51 -1.72 -3.41 116.25 107.49 3hq9 h VAL 286 Ca -0.50 -0.81 -0.67 0.00 -1.23 0.00 0.00 66.70 63.50 3hq9 h VAL 286 Cb 1.36 1.62 -0.34 0.00 -2.13 0.00 0.00 31.29 31.80 3hq9 h VAL 286 CO 0.56 0.00 -0.86 -0.69 -1.23 0.00 0.00 177.57 175.35 3hq9 s VAL 287 N -3.21 2.08 -0.07 7.19 1.01 -1.22 -4.97 120.40 121.20 3hq9 s VAL 287 Ca 0.06 -0.95 0.14 0.00 0.00 0.00 0.00 61.98 61.23 3hq9 s VAL 287 Cb 0.09 -1.86 -0.23 0.00 0.00 0.00 0.00 36.38 34.38 3hq9 s VAL 287 CO 0.69 0.54 0.57 0.79 0.00 0.00 0.00 175.10 177.69 3hq9 n TRP 288 N 4.42 0.83 -2.92 5.22 7.02 -1.26 0.15 117.44 130.89 3hq9 n TRP 288 Ca -0.21 0.30 -0.41 0.00 -1.02 0.00 0.00 57.50 56.16 3hq9 n TRP 288 Cb 0.51 -1.14 -0.04 0.00 -2.42 0.00 0.00 31.31 28.21 3hq9 n TRP 288 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 3hq9 s SER 289 N -5.96 7.01 0.22 -0.99 0.15 -1.26 -4.78 113.70 108.10 3hq9 s SER 289 Ca -0.05 1.24 -0.08 0.00 0.70 0.00 0.00 55.95 57.76 3hq9 s SER 289 Cb 0.08 -2.45 0.19 0.00 -1.71 0.00 0.00 66.02 62.13 3hq9 s SER 289 CO 0.83 -0.29 1.85 0.25 1.20 0.00 0.00 173.24 177.08 3hq9 h LEU 290 N 7.62 1.08 -0.99 3.45 5.85 -1.96 -0.52 115.31 129.83 3hq9 h LEU 290 Ca -0.35 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.28 3hq9 h LEU 290 Cb 1.16 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 41.87 3hq9 h LEU 290 CO 0.80 0.86 0.62 0.50 -0.34 0.00 0.00 178.44 180.88 3hq9 h LYS 291 N 1.21 1.31 -0.53 1.25 3.64 -1.93 -0.23 116.57 121.28 3hq9 h LYS 291 Ca 0.30 -0.10 -0.10 0.00 -1.27 0.00 0.00 60.65 59.49 3hq9 h LYS 291 Cb 0.02 -0.28 -0.02 0.00 -0.41 0.00 0.00 32.23 31.54 3hq9 h LYS 291 CO -0.05 0.89 -0.05 1.49 -2.27 0.00 0.00 179.45 179.45 3hq9 h GLU 292 N 1.34 0.95 -0.48 1.90 4.81 -1.78 -0.75 114.58 120.57 3hq9 h GLU 292 Ca 0.35 -0.31 -0.03 0.00 -0.13 0.00 0.00 59.36 59.25 3hq9 h GLU 292 Cb -0.11 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.17 3hq9 h GLU 292 CO -0.07 0.97 0.20 0.00 -0.73 0.00 0.00 179.01 179.38 3hq9 h ALA 293 N 1.07 0.62 -0.48 2.92 0.00 -0.50 -0.40 119.26 122.49 3hq9 h ALA 293 Ca 0.15 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.94 3hq9 h ALA 293 Cb 0.58 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 3hq9 h ALA 293 CO 0.04 0.22 0.28 0.28 0.00 0.00 0.00 179.25 180.06 3hq9 h VAL 294 N 0.63 1.03 -0.86 0.00 2.07 -0.91 -1.99 116.25 116.23 3hq9 h VAL 294 Ca 0.16 -0.19 0.02 0.00 0.82 0.00 0.00 66.70 67.51 3hq9 h VAL 294 Cb 0.18 0.43 -0.05 0.00 -1.52 0.00 0.00 31.29 30.33 3hq9 h VAL 294 CO -0.01 0.10 0.57 0.00 0.02 0.00 0.00 177.57 178.24 3hq9 h ALA 295 N 1.22 1.11 -0.88 1.67 0.00 -0.66 -0.99 119.26 120.73 3hq9 h ALA 295 Ca 0.20 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.09 3hq9 h ALA 295 Cb 0.04 -0.33 -0.05 0.00 0.00 0.00 0.00 17.79 17.45 3hq9 h ALA 295 CO -0.10 0.46 0.57 0.28 0.00 0.00 0.00 179.25 180.46 3hq9 h VAL 296 N 1.14 1.15 0.00 0.00 2.07 -0.84 -2.16 116.25 117.61 3hq9 h VAL 296 Ca 0.33 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.47 3hq9 h VAL 296 Cb -0.08 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 29.63 3hq9 h VAL 296 CO -0.09 0.20 0.00 0.23 0.02 0.00 0.00 177.57 177.94 3hq9 n MET 297 N -4.53 0.18 -1.29 1.57 2.81 -0.53 -3.77 117.12 111.57 3hq9 n MET 297 Ca 0.11 0.34 -0.37 0.00 -1.81 0.00 0.00 57.70 55.97 3hq9 n MET 297 Cb 0.08 -1.80 -0.02 0.00 -0.71 0.00 0.00 33.22 30.77 3hq9 n MET 297 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3hq9 n GLY 298 N 0.33 3.83 3.69 3.03 0.00 -0.49 -4.93 105.19 110.65 3hq9 n GLY 298 Ca 0.03 -1.36 -0.35 0.00 0.00 0.00 0.00 46.02 44.34 3hq9 n GLY 298 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3hq9 s SER 299 N 3.11 5.33 0.61 1.61 0.15 -1.22 -4.40 113.70 118.88 3hq9 s SER 299 Ca 0.55 0.15 0.31 0.00 0.70 0.00 0.00 55.95 57.66 3hq9 s SER 299 Cb 0.15 -1.57 1.75 0.00 -1.71 0.00 0.00 66.02 64.63 3hq9 s SER 299 CO -0.04 0.36 2.12 0.00 1.20 0.00 0.00 173.24 176.87 3hq9 h ALA 300 N 5.34 1.66 -0.22 5.45 0.00 -1.91 -0.10 119.26 129.48 3hq9 h ALA 300 Ca -0.49 -0.00 0.06 0.00 0.00 0.00 0.00 54.91 54.48 3hq9 h ALA 300 Cb 1.19 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 3hq9 h ALA 300 CO 0.56 -0.26 0.19 1.96 0.00 0.00 0.00 179.25 181.70 3hq9 h GLN 301 N 0.00 0.00 -0.23 0.00 1.08 -1.90 -1.35 115.11 112.71 3hq9 h GLN 301 Ca 0.07 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.27 3hq9 h GLN 301 Cb 0.44 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.87 3hq9 h GLN 301 CO -0.00 0.00 0.00 1.19 -0.95 0.00 0.00 178.83 179.07 3hq9 n PHE 302 N -4.12 0.29 -1.61 2.96 3.72 -0.14 -4.95 117.46 113.61 3hq9 n PHE 302 Ca 0.02 -0.20 -0.10 0.00 -0.05 0.00 0.00 57.45 57.13 3hq9 n PHE 302 Cb 0.33 -0.01 -0.03 0.00 -0.94 0.00 0.00 39.48 38.83 3hq9 n PHE 302 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hq9 n GLY 303 N 1.03 0.74 3.66 1.37 0.00 -0.51 -5.02 105.19 106.47 3hq9 n GLY 303 Ca 0.13 -0.53 -0.35 0.00 0.00 0.00 0.00 46.02 45.28 3hq9 n GLY 303 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hq9 s ILE 304 N -2.42 4.37 -0.04 -0.61 1.01 -0.66 -4.96 121.20 117.90 3hq9 s ILE 304 Ca 0.00 -0.21 0.04 0.00 0.00 0.00 0.00 60.65 60.48 3hq9 s ILE 304 Cb 0.00 -2.87 -0.00 0.00 0.01 0.00 0.00 42.46 39.59 3hq9 s ILE 304 CO 0.00 0.57 -0.16 -0.75 0.00 0.00 0.00 174.94 174.60 3hq9 s LYS 305 N -0.56 1.64 -0.09 2.79 2.20 -1.26 -3.20 119.74 121.26 3hq9 s LYS 305 Ca 0.10 -0.58 0.02 0.00 -0.36 0.00 0.00 55.97 55.14 3hq9 s LYS 305 Cb -0.12 -1.46 0.01 0.00 -1.51 0.00 0.00 37.83 34.76 3hq9 s LYS 305 CO 0.02 0.26 -0.13 -0.51 -0.36 0.00 0.00 175.35 174.63 3hq9 s LEU 306 N -0.03 1.63 0.93 5.43 1.43 -1.26 -5.03 118.68 121.77 3hq9 s LEU 306 Ca -0.02 -0.36 -0.12 0.00 -1.03 0.00 0.00 54.13 52.61 3hq9 s LEU 306 Cb -0.10 -0.95 0.15 0.00 0.03 0.00 0.00 46.19 45.31 3hq9 s LEU 306 CO 0.01 0.01 1.09 -0.94 0.23 0.00 0.00 176.35 176.76 3hq9 s SER 307 N 0.92 3.22 0.21 2.29 1.04 -1.26 -4.82 113.70 115.31 3hq9 s SER 307 Ca -0.09 1.42 -0.09 0.00 0.48 0.00 0.00 55.95 57.67 3hq9 s SER 307 Cb -0.15 -2.09 0.26 0.00 0.10 0.00 0.00 66.02 64.13 3hq9 s SER 307 CO 0.00 -2.79 1.80 -0.78 0.98 0.00 0.00 173.24 172.46 3hq9 h ASP 308 N -1.65 0.54 -0.81 7.02 3.58 -2.00 -0.96 116.42 122.13 3hq9 h ASP 308 Ca -0.51 0.03 -0.03 0.00 0.42 0.00 0.00 57.03 56.94 3hq9 h ASP 308 Cb 1.30 -0.07 -0.04 0.00 1.72 0.00 0.00 39.33 42.24 3hq9 h ASP 308 CO 0.55 0.34 0.37 0.44 -2.88 0.00 0.00 179.24 178.07 3hq9 h ASP 309 N 0.68 1.08 -0.24 2.28 3.32 -1.99 -0.79 116.42 120.75 3hq9 h ASP 309 Ca 0.31 -0.14 -0.03 0.00 0.02 0.00 0.00 57.03 57.19 3hq9 h ASP 309 Cb 0.22 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 3hq9 h ASP 309 CO -0.20 0.92 0.04 -0.33 -1.72 0.00 0.00 179.24 177.96 3hq9 h GLU 310 N 1.16 0.40 -0.86 3.56 5.08 -1.81 -0.88 114.58 121.23 3hq9 h GLU 310 Ca 0.28 -0.10 0.02 0.00 -1.00 0.00 0.00 59.36 58.56 3hq9 h GLU 310 Cb 0.15 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.30 3hq9 h GLU 310 CO -0.03 0.52 0.56 0.77 -1.00 0.00 0.00 179.01 179.83 3hq9 h SER 311 N 0.21 0.94 -0.55 1.42 0.02 -0.99 -0.64 113.55 113.96 3hq9 h SER 311 Ca 0.07 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 3hq9 h SER 311 Cb 0.32 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.61 3hq9 h SER 311 CO 0.00 0.66 0.36 -0.08 -1.14 0.00 0.00 176.83 176.64 3hq9 h GLU 312 N 1.11 0.73 -0.45 3.45 4.81 -0.91 0.43 114.58 123.76 3hq9 h GLU 312 Ca 0.33 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.48 3hq9 h GLU 312 Cb -0.05 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.15 3hq9 h GLU 312 CO -0.10 0.49 0.16 0.00 -0.73 0.00 0.00 179.01 178.83 3hq9 h ALA 313 N 1.19 0.58 -0.36 2.92 0.00 -0.71 -0.76 119.26 122.12 3hq9 h ALA 313 Ca 0.20 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 3hq9 h ALA 313 Cb -0.07 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 3hq9 h ALA 313 CO -0.04 0.21 0.17 0.82 0.00 0.00 0.00 179.25 180.41 3hq9 h ILE 314 N 0.58 1.17 -0.95 0.00 2.04 -0.94 -0.76 117.51 118.65 3hq9 h ILE 314 Ca 0.15 -0.50 0.06 0.00 1.00 0.00 0.00 64.86 65.56 3hq9 h ILE 314 Cb 0.23 0.83 -0.06 0.00 -0.74 0.00 0.00 36.82 37.08 3hq9 h ILE 314 CO -0.01 0.18 0.61 0.00 0.00 0.00 0.00 178.15 178.94 3hq9 h ALA 315 N 1.02 1.30 -0.06 1.87 0.00 -0.61 0.87 119.26 123.65 3hq9 h ALA 315 Ca 0.12 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.02 3hq9 h ALA 315 Cb 0.14 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3hq9 h ALA 315 CO -0.01 0.42 0.01 0.00 0.00 0.00 0.00 179.25 179.66 3hq9 h ALA 316 N 1.42 0.06 -0.58 0.00 0.00 -0.70 -1.74 119.26 117.73 3hq9 h ALA 316 Ca 0.40 0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.43 3hq9 h ALA 316 Cb 0.12 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.84 3hq9 h ALA 316 CO -0.16 -0.46 0.14 0.35 0.00 0.00 0.00 179.25 179.12 3hq9 h PHE 317 N 0.04 0.22 -0.01 0.00 3.57 -0.47 -1.70 116.94 118.59 3hq9 h PHE 317 Ca 0.03 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.57 3hq9 h PHE 317 Cb 0.02 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 38.75 3hq9 h PHE 317 CO -0.10 -0.01 0.01 -0.07 -2.23 0.00 0.00 178.31 175.91 3hq9 h LEU 318 N 0.28 0.00 -2.31 0.59 3.38 -0.35 0.44 115.31 117.33 3hq9 h LEU 318 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 3hq9 h LEU 318 Cb 0.43 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 3hq9 h LEU 318 CO -0.37 0.00 0.00 1.23 0.09 0.00 0.00 178.44 179.39 3hq9 h GLY 319 N 0.00 0.00 1.55 0.83 0.00 -0.42 -1.97 103.07 103.06 3hq9 h GLY 319 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 3hq9 h GLY 319 CO -0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.40 3hq9 n SER 320 N -4.08 0.00 -0.71 0.19 3.41 0.14 -2.94 113.62 109.63 3hq9 n SER 320 Ca -0.03 0.01 0.11 0.00 -0.26 0.00 0.00 58.87 58.69 3hq9 n SER 320 Cb 0.09 -0.28 0.32 0.00 -0.26 0.00 0.00 64.21 64.08 3hq9 n SER 320 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3hq9 n LEU 321 N -1.28 2.13 -4.63 1.04 4.77 -0.74 -1.49 117.00 116.81 3hq9 n LEU 321 Ca 0.09 -0.91 -0.43 0.00 -0.03 0.00 0.00 56.01 54.73 3hq9 n LEU 321 Cb 0.14 -0.15 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 3hq9 n LEU 321 CO 0.14 0.46 0.89 -0.89 -1.33 0.00 0.00 177.39 176.66 3hq9 s THR 322 N -1.70 4.55 0.37 -5.08 2.01 -1.15 -1.65 115.64 112.99 3hq9 s THR 322 Ca 0.33 1.62 0.02 0.00 0.31 0.00 0.00 61.69 63.98 3hq9 s THR 322 Cb 0.18 -4.37 0.07 0.00 0.01 0.00 0.00 72.50 68.39 3hq9 s THR 322 CO 0.27 -0.45 0.51 0.61 -0.69 0.00 0.00 174.62 174.87 3hq9 n GLY 323 N 3.95 1.19 3.68 4.40 0.00 -1.26 -4.31 105.19 112.84 3hq9 n GLY 323 Ca 0.11 -2.07 -0.42 0.00 0.00 0.00 0.00 46.02 43.63 3hq9 n GLY 323 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hq9 s LYS 324 N -3.72 4.21 0.37 1.61 1.02 -0.35 -4.88 119.74 118.00 3hq9 s LYS 324 Ca 0.36 2.22 -0.25 0.00 0.02 0.00 0.00 55.97 58.31 3hq9 s LYS 324 Cb -0.02 -3.74 -0.09 0.00 -0.52 0.00 0.00 37.83 33.46 3hq9 s LYS 324 CO 0.23 -0.75 1.03 -0.65 -0.92 0.00 0.00 175.35 174.30 3hq9 s GLN 325 N 3.11 4.30 0.46 1.68 -1.52 -1.26 -4.26 119.66 122.17 3hq9 s GLN 325 Ca 0.72 1.51 -0.23 0.00 -1.95 0.00 0.00 55.36 55.40 3hq9 s GLN 325 Cb -0.36 -2.67 -0.07 0.00 -0.22 0.00 0.00 33.01 29.69 3hq9 s GLN 325 CO 0.30 -0.02 1.23 -2.14 -0.25 0.00 0.00 175.29 174.41 3hq9 s PRO 326 N -2.29 3.71 -0.38 2.91 0.02 -1.26 -4.98 135.00 132.72 3hq9 s PRO 326 Ca 0.55 1.94 -0.15 0.00 0.02 0.00 0.00 61.00 63.35 3hq9 s PRO 326 Cb -0.22 -2.47 0.00 0.00 0.02 0.00 0.00 34.50 31.83 3hq9 s PRO 326 CO 0.28 -0.64 0.34 0.15 -0.33 0.00 0.00 177.00 176.81 3hq9 s LYS 327 N -2.61 3.27 -0.13 5.54 -0.14 -1.26 -5.00 119.74 119.41 3hq9 s LYS 327 Ca 0.63 -0.71 0.01 0.00 -1.36 0.00 0.00 55.97 54.54 3hq9 s LYS 327 Cb -0.33 -3.89 0.02 0.00 -1.68 0.00 0.00 37.83 31.95 3hq9 s LYS 327 CO 0.40 -0.66 -0.14 0.08 -0.76 0.00 0.00 175.35 174.28 3hq9 s VAL 328 N 1.90 1.48 -0.15 3.17 1.01 -1.26 -5.10 120.40 121.45 3hq9 s VAL 328 Ca 0.09 -0.60 -0.29 0.00 0.00 0.00 0.00 61.98 61.17 3hq9 s VAL 328 Cb -0.17 -1.38 -0.00 0.00 0.00 0.00 0.00 36.38 34.82 3hq9 s VAL 328 CO 0.12 0.44 1.04 -0.69 0.00 0.00 0.00 175.10 176.00 3hq9 s VAL 329 N 1.29 4.70 0.16 2.92 1.01 -1.26 -4.98 120.40 124.24 3hq9 s VAL 329 Ca -0.00 2.00 -0.33 0.00 0.00 0.00 0.00 61.98 63.65 3hq9 s VAL 329 Cb -0.14 -4.29 -0.13 0.00 0.00 0.00 0.00 36.38 31.83 3hq9 s VAL 329 CO -0.06 -0.07 1.68 0.00 0.00 0.00 0.00 175.10 176.65 3hq9 n TYR 330 N 5.58 2.52 -2.43 5.22 9.36 -1.26 -4.92 117.16 131.23 3hq9 n TYR 330 Ca 0.10 0.11 -0.39 0.00 3.32 0.00 0.00 57.90 61.05 3hq9 n TYR 330 Cb 0.47 -2.63 -0.03 0.00 -0.63 0.00 0.00 39.34 36.52 3hq9 n TYR 330 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 3hq9 s PRO 331 N 1.40 4.33 -0.37 2.98 0.04 -1.26 -5.00 135.00 137.10 3hq9 s PRO 331 Ca 0.78 1.74 -0.19 0.00 0.04 0.00 0.00 61.00 63.37 3hq9 s PRO 331 Cb -0.58 -2.85 0.01 0.00 0.04 0.00 0.00 34.50 31.11 3hq9 s PRO 331 CO 0.36 -0.05 0.58 0.42 0.04 0.00 0.00 177.00 178.35 3hq9 s ILE 332 N -1.38 4.94 0.03 0.56 -1.09 -1.26 -5.03 121.20 117.97 3hq9 s ILE 332 Ca 0.52 0.34 -0.03 0.00 -2.23 0.00 0.00 60.65 59.24 3hq9 s ILE 332 Cb -0.29 -4.06 -0.04 0.00 -1.58 0.00 0.00 42.46 36.49 3hq9 s ILE 332 CO 0.37 -0.34 0.24 -0.04 -1.23 0.00 0.00 174.94 173.93 3hq9 s MET 333 N 2.58 3.50 0.52 2.79 -1.94 -1.26 -5.04 119.30 120.45 3hq9 s MET 333 Ca 0.21 -0.25 -0.17 0.00 -1.71 0.00 0.00 55.69 53.77 3hq9 s MET 333 Cb -0.15 -3.05 -0.08 0.00 2.01 0.00 0.00 34.83 33.57 3hq9 s MET 333 CO 0.15 0.63 1.00 -1.25 -0.01 0.00 0.00 175.02 175.54 3hq9 s PRO 334 N -2.09 3.85 0.48 2.03 0.04 -1.26 -4.99 135.00 133.05 3hq9 s PRO 334 Ca 0.31 1.07 -0.24 0.00 0.04 0.00 0.00 61.00 62.18 3hq9 s PRO 334 Cb -0.13 -2.12 -0.07 0.00 0.04 0.00 0.00 34.50 32.23 3hq9 s PRO 334 CO 0.21 -0.36 1.34 0.00 0.04 0.00 0.00 177.00 178.23 3hq9 s ALA 335 N -2.46 3.03 0.98 8.56 0.00 -1.26 -5.02 121.76 125.59 3hq9 s ALA 335 Ca 0.61 1.31 -0.12 0.00 0.00 0.00 0.00 51.96 53.76 3hq9 s ALA 335 Cb -0.12 -3.54 0.18 0.00 0.00 0.00 0.00 23.12 19.64 3hq9 s ALA 335 CO 0.29 -1.14 1.08 -1.12 0.00 0.00 0.00 175.76 174.87 3hq9 s SER 336 N -0.84 2.65 0.47 0.00 0.01 -1.26 -4.86 113.70 109.87 3hq9 s SER 336 Ca 0.65 1.55 0.03 0.00 1.31 0.00 0.00 55.95 59.48 3hq9 s SER 336 Cb -0.39 -2.21 -0.01 0.00 0.21 0.00 0.00 66.02 63.61 3hq9 s SER 336 CO 0.49 -3.17 0.09 0.42 0.41 0.00 0.00 173.24 171.48 3hq9 s THR 337 N -2.78 0.70 0.55 1.44 -4.23 -1.26 -5.01 115.64 105.06 3hq9 s THR 337 Ca 0.65 -2.00 0.42 0.00 -1.18 0.00 0.00 61.69 59.58 3hq9 s THR 337 Cb -0.20 -2.18 0.43 0.00 1.34 0.00 0.00 72.50 71.89 3hq9 s THR 337 CO 0.59 0.00 2.29 -0.78 -0.54 0.00 0.00 174.62 176.18 3hq9 h ASP 338 N 1.55 0.00 0.99 3.99 3.58 -1.99 -1.14 116.42 123.41 3hq9 h ASP 338 Ca -0.38 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.07 3hq9 h ASP 338 Cb 1.30 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.35 3hq9 h ASP 338 CO 0.61 0.00 -0.13 0.00 -2.88 0.00 0.00 179.24 176.84 3hq9 n ALA 339 N -2.10 2.58 -2.38 -0.78 0.00 -1.26 -4.87 120.51 111.70 3hq9 n ALA 339 Ca -0.02 -0.14 -0.42 0.00 0.00 0.00 0.00 53.44 52.86 3hq9 n ALA 339 Cb 0.12 -1.39 -0.03 0.00 0.00 0.00 0.00 19.45 18.15 3hq9 n ALA 339 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3hq9 s THR 340 N -3.03 4.15 0.45 0.00 2.01 -0.43 -4.83 115.64 113.95 3hq9 s THR 340 Ca 0.12 1.61 -0.24 0.00 0.31 0.00 0.00 61.69 63.50 3hq9 s THR 340 Cb 0.17 -4.03 -0.10 0.00 0.01 0.00 0.00 72.50 68.55 3hq9 s THR 340 CO 0.59 0.16 1.07 -2.65 -0.69 0.00 0.00 174.62 173.10 3hq9 n PRO 341 N 3.52 1.44 -2.02 4.92 -0.02 -1.26 -4.90 135.00 136.68 3hq9 n PRO 341 Ca 0.07 0.52 -0.32 0.00 -2.02 0.00 0.00 63.50 61.75 3hq9 n PRO 341 Cb 0.47 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 3hq9 n PRO 341 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3hq9 s ARG 342 N -2.17 3.61 0.50 -0.52 1.81 -1.26 -5.01 118.95 115.91 3hq9 s ARG 342 Ca 0.64 0.88 -0.23 0.00 -1.72 0.00 0.00 55.73 55.31 3hq9 s ARG 342 Cb -0.52 -2.08 -0.07 0.00 -0.45 0.00 0.00 34.95 31.82 3hq9 s ARG 342 CO 0.56 -0.56 1.28 -2.30 -0.68 0.00 0.00 175.30 173.60 3hq9 n PRO 343 N -2.35 1.71 -4.08 3.54 -0.02 -1.26 -4.98 135.00 127.56 3hq9 n PRO 343 Ca 0.07 0.62 -0.32 0.00 -2.02 0.00 0.00 63.50 61.85 3hq9 n PRO 343 Cb 0.54 -2.45 -0.15 0.00 -0.02 0.00 0.00 33.50 31.41 3hq9 n PRO 343 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3hq9 s ARG 344 N -2.59 2.49 0.00 -0.52 0.52 -0.20 -4.98 118.95 113.67 3hq9 s ARG 344 Ca 0.67 -1.08 0.21 0.00 -0.52 0.00 0.00 55.73 55.01 3hq9 s ARG 344 Cb -0.45 -2.70 0.16 0.00 0.52 0.00 0.00 34.95 32.48 3hq9 s ARG 344 CO 0.53 -0.42 1.16 1.28 0.02 0.00 0.00 175.30 177.87