#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hq8 n ASP 23 N 0.00 0.69 -0.01 0.00 5.68 -1.26 -3.23 116.55 118.42 3hq8 n ASP 23 Ca 0.00 -1.62 0.13 0.00 -0.50 0.00 0.00 54.79 52.80 3hq8 n ASP 23 Cb 0.00 -0.34 0.47 0.00 -1.14 0.00 0.00 41.12 40.11 3hq8 n ASP 23 CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.20 177.08 3hq8 n GLU 24 N 0.00 0.08 -0.33 0.11 0.00 -1.26 -3.50 120.64 115.74 3hq8 n GLU 24 Ca 0.00 -0.03 0.26 0.00 0.00 0.00 0.00 57.16 57.39 3hq8 n GLU 24 Cb 0.17 -1.50 0.55 0.00 0.00 0.00 0.00 31.44 30.67 3hq8 n GLU 24 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.13 178.38 3hq8 h LEU 25 N 0.07 0.37 -0.25 4.31 5.85 -1.99 -2.20 115.31 121.46 3hq8 h LEU 25 Ca 0.00 0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.83 3hq8 h LEU 25 Cb 0.48 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 3hq8 h LEU 25 CO 0.00 0.05 0.07 -0.61 -0.34 0.00 0.00 178.44 177.61 3hq8 h GLN 26 N 0.31 0.17 0.00 1.25 4.15 -1.88 -1.81 115.11 117.31 3hq8 h GLN 26 Ca 0.61 -0.01 -0.03 0.00 0.77 0.00 0.00 58.65 59.99 3hq8 h GLN 26 Cb 1.70 -0.04 -0.00 0.00 0.21 0.00 0.00 27.48 29.35 3hq8 h GLN 26 CO -0.27 0.11 -0.15 1.96 -1.93 0.00 0.00 178.83 178.55 3hq8 h GLN 27 N 0.18 0.00 -0.41 1.69 4.20 -1.66 0.21 115.11 119.31 3hq8 h GLN 27 Ca 0.11 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.71 3hq8 h GLN 27 Cb 0.09 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.86 3hq8 h GLN 27 CO -0.13 0.15 -0.19 -0.09 -0.67 0.00 0.00 178.83 177.90 3hq8 h ARG 28 N 0.00 0.86 -0.08 1.46 2.43 -1.16 -2.57 114.38 115.32 3hq8 h ARG 28 Ca -0.00 -0.37 -0.12 0.00 -0.81 0.00 0.00 59.98 58.68 3hq8 h ARG 28 Cb 0.71 -0.03 0.01 0.00 -0.42 0.00 0.00 29.97 30.24 3hq8 h ARG 28 CO 0.02 1.01 -0.43 0.00 -1.51 0.00 0.00 179.97 179.06 3hq8 h ALA 29 N 0.82 0.16 0.00 2.80 0.00 -0.77 -3.15 119.26 119.13 3hq8 h ALA 29 Ca 0.09 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.52 3hq8 h ALA 29 Cb 0.75 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.53 3hq8 h ALA 29 CO 0.06 0.29 0.00 1.96 0.00 0.00 0.00 179.25 181.56 3hq8 h GLN 30 N -0.03 0.00 -0.50 0.00 4.20 -0.61 0.42 115.11 118.59 3hq8 h GLN 30 Ca -0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.68 3hq8 h GLN 30 Cb 1.08 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.86 3hq8 h GLN 30 CO 0.09 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.66 3hq8 n GLY 31 N -1.11 2.87 0.00 3.46 0.00 -0.97 -4.44 105.19 105.00 3hq8 n GLY 31 Ca -0.02 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.32 3hq8 n GLY 31 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3hq8 n LEU 32 N 0.79 0.00 0.00 0.99 -0.00 0.12 -5.06 117.00 113.84 3hq8 n LEU 32 Ca 0.19 0.00 -0.07 0.00 -0.00 0.00 0.00 56.01 56.14 3hq8 n LEU 32 Cb 0.65 0.00 -0.02 0.00 -0.00 0.00 0.00 43.42 44.05 3hq8 n LEU 32 CO 0.15 0.00 -0.05 0.49 -0.00 0.00 0.00 177.39 177.98 3hq8 n PHE 33 N -1.21 0.18 -3.64 1.96 3.72 0.32 -2.97 117.46 115.81 3hq8 n PHE 33 Ca 0.00 -0.56 -0.13 0.00 -0.05 0.00 0.00 57.45 56.72 3hq8 n PHE 33 Cb 0.08 -0.05 -0.07 0.00 -0.94 0.00 0.00 39.48 38.50 3hq8 n PHE 33 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 3hq8 s LYS 34 N -2.38 0.78 0.85 -1.08 -0.14 -1.23 -4.84 119.74 111.70 3hq8 s LYS 34 Ca 0.02 0.99 -0.11 0.00 -1.36 0.00 0.00 55.97 55.50 3hq8 s LYS 34 Cb 0.00 0.35 0.10 0.00 -1.68 0.00 0.00 37.83 36.60 3hq8 s LYS 34 CO 0.01 -0.10 1.09 -1.25 -0.76 0.00 0.00 175.35 174.34 3hq8 s PRO 35 N 0.56 1.62 0.09 -1.68 0.04 -1.26 -4.54 135.00 129.83 3hq8 s PRO 35 Ca -0.02 0.82 -0.30 0.00 0.04 0.00 0.00 61.00 61.54 3hq8 s PRO 35 Cb -0.05 -1.85 -0.06 0.00 0.04 0.00 0.00 34.50 32.58 3hq8 s PRO 35 CO -0.02 -1.99 1.20 0.08 0.04 0.00 0.00 177.00 176.31 3hq8 s VAL 36 N -2.99 3.91 0.54 -0.36 1.01 -1.26 -5.00 120.40 116.24 3hq8 s VAL 36 Ca 0.62 1.42 -0.22 0.00 0.00 0.00 0.00 61.98 63.81 3hq8 s VAL 36 Cb -0.17 -3.91 -0.05 0.00 0.00 0.00 0.00 36.38 32.25 3hq8 s VAL 36 CO 0.56 0.14 1.30 -2.16 0.00 0.00 0.00 175.10 174.94 3hq8 s PRO 37 N 0.74 3.23 0.00 2.72 0.04 -1.26 -4.77 135.00 135.71 3hq8 s PRO 37 Ca 0.57 2.08 0.30 0.00 0.04 0.00 0.00 61.00 64.00 3hq8 s PRO 37 Cb -0.30 -2.24 1.60 0.00 0.04 0.00 0.00 34.50 33.60 3hq8 s PRO 37 CO 0.31 -1.07 2.05 0.00 0.04 0.00 0.00 177.00 178.33 3hq8 n ALA 38 N -1.01 2.65 -3.21 8.56 0.00 -1.26 -4.75 120.51 121.49 3hq8 n ALA 38 Ca 0.10 -0.28 -0.17 0.00 0.00 0.00 0.00 53.44 53.09 3hq8 n ALA 38 Cb 0.46 -1.40 -0.15 0.00 0.00 0.00 0.00 19.45 18.36 3hq8 n ALA 38 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3hq8 s LYS 39 N -2.00 0.52 0.12 0.00 1.02 -1.26 -5.03 119.74 113.11 3hq8 s LYS 39 Ca 0.44 -0.11 -0.33 0.00 0.02 0.00 0.00 55.97 55.99 3hq8 s LYS 39 Cb 0.21 -0.55 -0.18 0.00 -0.52 0.00 0.00 37.83 36.79 3hq8 s LYS 39 CO 0.35 0.01 0.74 0.00 -0.92 0.00 0.00 175.35 175.54 3hq8 n ALA 40 N 3.50 -3.17 -1.91 5.17 0.00 -1.26 -4.91 120.51 117.92 3hq8 n ALA 40 Ca -0.20 0.50 -0.40 0.00 0.00 0.00 0.00 53.44 53.34 3hq8 n ALA 40 Cb 0.54 -1.67 -0.05 0.00 0.00 0.00 0.00 19.45 18.27 3hq8 n ALA 40 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3hq8 s PRO 41 N -0.60 4.75 0.04 0.00 0.04 -1.26 -5.03 135.00 132.95 3hq8 s PRO 41 Ca 0.75 1.56 -0.31 0.00 0.04 0.00 0.00 61.00 63.04 3hq8 s PRO 41 Cb -1.07 -3.29 -0.06 0.00 0.04 0.00 0.00 34.50 30.13 3hq8 s PRO 41 CO 0.56 0.34 1.29 0.99 0.04 0.00 0.00 177.00 180.23 3hq8 s THR 42 N -0.77 3.81 0.11 1.26 2.01 -1.26 -4.99 115.64 115.81 3hq8 s THR 42 Ca 0.44 1.26 -0.04 0.00 0.31 0.00 0.00 61.69 63.66 3hq8 s THR 42 Cb -0.27 -3.81 -0.05 0.00 0.01 0.00 0.00 72.50 68.38 3hq8 s THR 42 CO 0.33 0.06 0.34 -0.76 -0.69 0.00 0.00 174.62 173.90 3hq8 s LEU 43 N 1.56 4.30 -0.23 4.42 1.43 -1.26 -5.02 118.68 123.87 3hq8 s LEU 43 Ca 0.61 0.54 -0.34 0.00 -1.03 0.00 0.00 54.13 53.91 3hq8 s LEU 43 Cb -0.31 -3.18 -0.11 0.00 0.03 0.00 0.00 46.19 42.62 3hq8 s LEU 43 CO 0.28 0.10 2.03 0.29 0.23 0.00 0.00 176.35 179.27 3hq8 n LYS 44 N 0.25 1.62 -3.86 1.70 5.02 -1.26 -2.80 118.16 118.83 3hq8 n LYS 44 Ca -0.04 0.53 -0.26 0.00 -2.02 0.00 0.00 58.31 56.53 3hq8 n LYS 44 Cb 0.52 -2.60 0.01 0.00 -0.02 0.00 0.00 35.03 32.94 3hq8 n LYS 44 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hq8 n GLY 45 N 5.37 -0.33 2.72 0.72 0.00 -1.26 -4.91 105.19 107.50 3hq8 n GLY 45 Ca 0.31 0.15 -0.08 0.00 0.00 0.00 0.00 46.02 46.40 3hq8 n GLY 45 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3hq8 n ASN 46 N -2.96 -2.30 -4.77 1.61 5.15 -1.12 -5.16 115.26 105.71 3hq8 n ASN 46 Ca -0.20 -3.28 -0.37 0.00 -0.60 0.00 0.00 54.58 50.13 3hq8 n ASN 46 Cb 0.63 1.75 -0.02 0.00 -0.53 0.00 0.00 39.78 41.62 3hq8 n ASN 46 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 3hq8 s PRO 47 N 0.35 3.91 0.82 1.20 0.04 -1.26 -4.31 135.00 135.75 3hq8 s PRO 47 Ca 0.25 1.72 -0.11 0.00 0.04 0.00 0.00 61.00 62.89 3hq8 s PRO 47 Cb 0.27 -2.48 0.08 0.00 0.04 0.00 0.00 34.50 32.41 3hq8 s PRO 47 CO -0.12 -0.41 1.09 0.00 0.04 0.00 0.00 177.00 177.60 3hq8 s ALA 48 N -1.56 2.03 -0.25 8.56 0.00 -1.26 -5.04 121.76 124.25 3hq8 s ALA 48 Ca 0.61 -0.08 -0.28 0.00 0.00 0.00 0.00 51.96 52.21 3hq8 s ALA 48 Cb -0.27 -3.16 0.16 0.00 0.00 0.00 0.00 23.12 19.84 3hq8 s ALA 48 CO 0.33 -1.92 1.20 -1.54 0.00 0.00 0.00 175.76 173.83 3hq8 s SER 49 N -3.66 -0.22 0.06 0.00 1.04 -1.26 -5.02 113.70 104.63 3hq8 s SER 49 Ca 0.62 0.32 -0.11 0.00 0.48 0.00 0.00 55.95 57.26 3hq8 s SER 49 Cb -0.16 0.29 -0.02 0.00 0.10 0.00 0.00 66.02 66.22 3hq8 s SER 49 CO 0.55 -0.15 0.99 -2.65 0.98 0.00 0.00 173.24 172.96 3hq8 n PRO 50 N 1.10 -0.15 0.26 4.02 -0.01 -1.26 -1.47 135.00 137.49 3hq8 n PRO 50 Ca -0.08 0.98 0.08 0.00 -0.01 0.00 0.00 63.50 64.47 3hq8 n PRO 50 Cb 0.58 -1.45 0.64 0.00 -0.01 0.00 0.00 33.50 33.26 3hq8 n PRO 50 CO 0.00 0.00 0.00 -0.24 -0.01 0.00 0.00 175.50 175.25 3hq8 h VAL 51 N 0.00 0.98 0.00 -1.45 3.04 -1.97 -2.01 116.25 114.84 3hq8 h VAL 51 Ca 0.06 -0.06 -0.18 0.00 -1.01 0.00 0.00 66.70 65.51 3hq8 h VAL 51 Cb 0.14 1.03 -0.03 0.00 -2.01 0.00 0.00 31.29 30.43 3hq8 h VAL 51 CO -0.32 0.02 -0.84 0.50 -1.01 0.00 0.00 177.57 175.91 3hq8 h LYS 52 N 0.00 0.00 -0.02 4.17 3.64 -1.62 -1.22 116.57 121.52 3hq8 h LYS 52 Ca -0.00 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.26 3hq8 h LYS 52 Cb 0.03 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 31.86 3hq8 h LYS 52 CO 0.00 0.84 -0.43 0.28 -2.27 0.00 0.00 179.45 177.87 3hq8 h VAL 53 N 0.00 1.45 -0.28 2.00 2.07 -0.64 -0.05 116.25 120.81 3hq8 h VAL 53 Ca -0.01 -1.94 0.05 0.00 0.82 0.00 0.00 66.70 65.62 3hq8 h VAL 53 Cb 1.59 2.55 -0.05 0.00 -1.52 0.00 0.00 31.29 33.86 3hq8 h VAL 53 CO 0.11 0.56 -0.04 -0.08 0.02 0.00 0.00 177.57 178.14 3hq8 h GLU 54 N -0.21 0.03 -0.52 1.57 4.57 -1.44 0.25 114.58 118.84 3hq8 h GLU 54 Ca -0.05 -0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.13 3hq8 h GLU 54 Cb 1.14 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.70 3hq8 h GLU 54 CO 0.09 0.02 0.30 1.25 -1.18 0.00 0.00 179.01 179.49 3hq8 h LEU 55 N 0.03 0.63 -1.83 1.64 5.85 -1.25 -1.78 115.31 118.60 3hq8 h LEU 55 Ca 0.13 -0.07 0.09 0.00 0.84 0.00 0.00 57.88 58.87 3hq8 h LEU 55 Cb 0.19 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 3hq8 h LEU 55 CO -0.26 0.52 0.29 1.23 -0.34 0.00 0.00 178.44 179.88 3hq8 h GLY 56 N 0.69 0.26 0.41 3.75 0.00 -0.60 -2.28 103.07 105.30 3hq8 h GLY 56 Ca 0.18 -0.08 -0.01 0.00 0.00 0.00 0.00 47.33 47.43 3hq8 h GLY 56 CO -0.03 0.05 -0.08 1.70 0.00 0.00 0.00 176.54 178.18 3hq8 h LYS 57 N 0.20 -0.22 -0.70 4.80 3.64 -0.09 -2.87 116.57 121.33 3hq8 h LYS 57 Ca 0.20 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.60 3hq8 h LYS 57 Cb 0.52 0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.35 3hq8 h LYS 57 CO -0.03 0.20 0.47 0.52 -2.27 0.00 0.00 179.45 178.34 3hq8 h MET 58 N -0.82 0.90 -0.24 1.90 0.00 -1.30 0.34 114.93 115.71 3hq8 h MET 58 Ca -0.02 -0.05 0.02 0.00 0.00 0.00 0.00 59.70 59.64 3hq8 h MET 58 Cb 0.53 -0.20 -0.01 0.00 0.00 0.00 0.00 31.60 31.91 3hq8 h MET 58 CO 0.04 0.59 0.16 -0.07 0.00 0.00 0.00 176.91 177.63 3hq8 h LEU 59 N 0.93 0.20 0.07 1.22 3.38 -1.48 0.32 115.31 119.95 3hq8 h LEU 59 Ca 0.26 -0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.95 3hq8 h LEU 59 Cb -0.06 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 3hq8 h LEU 59 CO -0.06 0.14 -1.45 0.22 0.09 0.00 0.00 178.44 177.38 3hq8 h TYR 60 N 0.24 0.26 -0.02 1.13 3.20 -0.12 -3.12 116.97 118.53 3hq8 h TYR 60 Ca 0.10 -0.19 0.00 0.00 3.14 0.00 0.00 58.73 61.77 3hq8 h TYR 60 Cb 0.09 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.35 3hq8 h TYR 60 CO -0.00 1.23 -0.03 1.19 -1.64 0.00 0.00 178.16 178.91 3hq8 n PHE 61 N -3.35 0.00 -2.63 -3.82 3.72 -0.57 -2.63 117.46 108.18 3hq8 n PHE 61 Ca -0.13 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.84 3hq8 n PHE 61 Cb 1.02 -0.01 -0.02 0.00 -0.94 0.00 0.00 39.48 39.54 3hq8 n PHE 61 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3hq8 s ASP 62 N -2.04 6.91 0.00 4.37 -1.08 0.11 -4.91 116.67 120.03 3hq8 s ASP 62 Ca 0.33 1.03 0.29 0.00 -0.52 0.00 0.00 52.55 53.68 3hq8 s ASP 62 Cb 0.20 -2.54 1.34 0.00 -1.46 0.00 0.00 42.92 40.46 3hq8 s ASP 62 CO 0.34 -0.91 1.96 -2.65 0.52 0.00 0.00 175.17 174.43 3hq8 n PRO 63 N 6.94 0.22 0.00 4.34 -0.02 -1.26 -3.56 135.00 141.66 3hq8 n PRO 63 Ca 0.12 0.01 0.07 0.00 -2.02 0.00 0.00 63.50 61.69 3hq8 n PRO 63 Cb 0.47 -1.50 0.43 0.00 -0.02 0.00 0.00 33.50 32.88 3hq8 n PRO 63 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3hq8 n ARG 64 N -1.39 0.75 0.04 -0.52 1.74 -1.26 -1.66 116.66 114.37 3hq8 n ARG 64 Ca 0.10 0.00 0.13 0.00 -0.77 0.00 0.00 57.85 57.32 3hq8 n ARG 64 Cb 0.28 -1.30 0.44 0.00 -1.02 0.00 0.00 32.46 30.86 3hq8 n ARG 64 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3hq8 n LEU 65 N -0.80 0.44 -4.89 0.55 4.77 -1.23 -4.81 117.00 111.04 3hq8 n LEU 65 Ca 0.11 0.42 -0.34 0.00 -0.03 0.00 0.00 56.01 56.17 3hq8 n LEU 65 Cb 0.05 -0.36 -0.05 0.00 -2.33 0.00 0.00 43.42 40.73 3hq8 n LEU 65 CO 0.08 -0.05 -0.03 -0.94 -1.33 0.00 0.00 177.39 175.12 3hq8 s SER 66 N -3.70 6.51 0.32 -1.43 1.04 -0.66 -4.47 113.70 111.32 3hq8 s SER 66 Ca 0.11 0.59 0.08 0.00 0.48 0.00 0.00 55.95 57.21 3hq8 s SER 66 Cb 0.16 -2.10 0.80 0.00 0.10 0.00 0.00 66.02 64.98 3hq8 s SER 66 CO 0.60 0.21 1.79 0.00 0.98 0.00 0.00 173.24 176.82 3hq8 h ALA 67 N 3.72 1.77 0.00 5.32 0.00 -1.29 -1.65 119.26 127.13 3hq8 h ALA 67 Ca -0.49 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 3hq8 h ALA 67 Cb 1.19 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 3hq8 h ALA 67 CO 0.68 -0.12 -0.11 0.66 0.00 0.00 0.00 179.25 180.35 3hq8 h SER 68 N 0.71 0.00 -0.20 0.00 4.64 -1.76 0.57 113.55 117.51 3hq8 h SER 68 Ca 0.56 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.79 3hq8 h SER 68 Cb 0.94 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.99 3hq8 h SER 68 CO -0.34 0.11 -0.08 1.41 -0.87 0.00 0.00 176.83 177.07 3hq8 n HIS 69 N -3.18 0.00 0.08 4.77 -0.00 -0.62 -4.49 115.22 111.77 3hq8 n HIS 69 Ca 0.02 0.00 0.04 0.00 -0.00 0.00 0.00 57.72 57.78 3hq8 n HIS 69 Cb 0.46 -1.38 -0.06 0.00 -0.00 0.00 0.00 29.99 29.01 3hq8 n HIS 69 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 3hq8 n LEU 70 N -0.48 0.08 -4.50 2.41 4.77 -1.25 -4.50 117.00 113.53 3hq8 n LEU 70 Ca -0.04 -0.11 -0.33 0.00 -0.03 0.00 0.00 56.01 55.50 3hq8 n LEU 70 Cb 0.28 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.24 3hq8 n LEU 70 CO 0.06 0.02 -0.44 -0.63 -1.33 0.00 0.00 177.39 175.08 3hq8 s ILE 71 N -2.36 3.19 0.26 -0.08 1.01 -1.25 -4.92 121.20 117.04 3hq8 s ILE 71 Ca -0.02 -0.72 0.01 0.00 0.00 0.00 0.00 60.65 59.93 3hq8 s ILE 71 Cb 0.05 -2.27 -0.05 0.00 0.01 0.00 0.00 42.46 40.20 3hq8 s ILE 71 CO 0.32 0.56 0.10 -0.94 0.00 0.00 0.00 174.94 174.98 3hq8 s SER 72 N -0.84 1.22 0.16 3.58 1.04 -1.26 -4.04 113.70 113.56 3hq8 s SER 72 Ca 0.12 -1.39 0.13 0.00 0.48 0.00 0.00 55.95 55.29 3hq8 s SER 72 Cb -0.11 0.17 0.64 0.00 0.10 0.00 0.00 66.02 66.82 3hq8 s SER 72 CO 0.01 -0.74 1.39 0.00 0.98 0.00 0.00 173.24 174.89 3hq8 h ASN 74 N 0.00 0.00 -1.02 0.00 -1.24 -1.76 -1.52 115.58 110.04 3hq8 h ASN 74 Ca 0.00 0.00 0.25 0.00 0.71 0.00 0.00 56.30 57.26 3hq8 h ASN 74 Cb 0.07 0.00 -0.12 0.00 0.73 0.00 0.00 38.32 39.00 3hq8 h ASN 74 CO 0.00 0.42 0.62 0.74 -1.29 0.00 0.00 177.43 177.92 3hq8 h THR 75 N 0.00 0.53 0.00 -3.57 2.02 -1.36 -3.18 112.91 107.34 3hq8 h THR 75 Ca -0.05 -0.18 -0.03 0.00 0.77 0.00 0.00 66.41 66.92 3hq8 h THR 75 Cb 1.36 -0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 67.73 3hq8 h THR 75 CO 0.05 0.10 -1.43 0.00 0.37 0.00 0.00 175.52 174.60 3hq8 n HIS 77 N -1.91 3.47 -2.67 0.00 8.25 -0.57 -2.78 115.22 119.01 3hq8 n HIS 77 Ca -0.04 -3.98 -0.42 0.00 -0.26 0.00 0.00 57.72 53.02 3hq8 n HIS 77 Cb 0.34 -0.70 -0.03 0.00 1.12 0.00 0.00 29.99 30.72 3hq8 n HIS 77 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 3hq8 s ASN 78 N -2.08 6.34 0.47 0.41 3.84 0.33 -4.58 114.94 119.66 3hq8 s ASN 78 Ca 0.36 -0.22 0.33 0.00 0.21 0.00 0.00 52.86 53.54 3hq8 s ASN 78 Cb 0.09 -2.51 1.45 0.00 -0.55 0.00 0.00 41.25 39.73 3hq8 s ASN 78 CO -0.03 -1.48 1.66 -0.37 -2.79 0.00 0.00 177.10 174.10 3hq8 h VAL 79 N 6.08 0.20 0.00 -5.21 -1.51 -1.88 0.23 116.25 114.17 3hq8 h VAL 79 Ca -0.26 -0.04 0.00 0.00 -1.23 0.00 0.00 66.70 65.17 3hq8 h VAL 79 Cb 1.06 0.09 0.00 0.00 -2.13 0.00 0.00 31.29 30.31 3hq8 h VAL 79 CO 1.18 0.02 0.00 0.61 -1.23 0.00 0.00 177.57 178.15 3hq8 n GLY 80 N -1.62 -1.26 1.84 5.19 0.00 -1.26 -3.87 105.19 104.21 3hq8 n GLY 80 Ca 0.35 -0.13 0.01 0.00 0.00 0.00 0.00 46.02 46.25 3hq8 n GLY 80 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hq8 n LEU 81 N -1.33 1.76 -0.73 0.99 4.77 0.09 -4.96 117.00 117.59 3hq8 n LEU 81 Ca 0.12 -2.82 -0.06 0.00 -0.03 0.00 0.00 56.01 53.22 3hq8 n LEU 81 Cb 0.24 0.04 -0.00 0.00 -2.33 0.00 0.00 43.42 41.37 3hq8 n LEU 81 CO 0.22 0.93 -0.08 0.61 -1.33 0.00 0.00 177.39 177.74 3hq8 n GLY 82 N -0.17 0.12 2.27 -0.72 0.00 -1.20 -3.99 105.19 101.50 3hq8 n GLY 82 Ca 0.11 -0.62 -0.04 0.00 0.00 0.00 0.00 46.02 45.48 3hq8 n GLY 82 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hq8 n GLY 83 N -1.03 0.64 0.00 -0.02 0.00 0.60 -4.55 105.19 100.84 3hq8 n GLY 83 Ca -0.08 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.56 3hq8 n GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hq8 n GLY 84 N -1.91 6.17 0.00 -0.02 0.00 -1.25 -1.40 105.19 106.78 3hq8 n GLY 84 Ca -0.04 -1.79 0.00 0.00 0.00 0.00 0.00 46.02 44.19 3hq8 n GLY 84 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3hq8 n ASP 85 N 0.00 0.29 -1.04 1.61 5.75 -1.12 -0.51 116.55 121.53 3hq8 n ASP 85 Ca 0.00 -1.13 -0.14 0.00 -0.01 0.00 0.00 54.79 53.52 3hq8 n ASP 85 Cb 0.00 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.03 3hq8 n ASP 85 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 3hq8 n LEU 86 N -0.06 -0.77 -4.41 -2.12 4.77 -1.26 -5.00 117.00 108.15 3hq8 n LEU 86 Ca 0.00 0.34 -0.26 0.00 -0.03 0.00 0.00 56.01 56.06 3hq8 n LEU 86 Cb 0.40 -2.48 -0.12 0.00 -2.33 0.00 0.00 43.42 38.90 3hq8 n LEU 86 CO 0.00 -0.93 -0.52 -1.10 -1.33 0.00 0.00 177.39 173.50 3hq8 s GLN 87 N -3.09 1.47 0.05 3.23 -1.52 -1.26 -4.83 119.66 113.71 3hq8 s GLN 87 Ca 0.00 -1.50 -0.19 0.00 -1.95 0.00 0.00 55.36 51.72 3hq8 s GLN 87 Cb 0.00 -1.75 -0.09 0.00 -0.22 0.00 0.00 33.01 30.95 3hq8 s GLN 87 CO 0.00 0.38 1.29 0.00 -0.25 0.00 0.00 175.29 176.71 3hq8 h ALA 88 N 3.23 -0.89 -2.25 6.09 0.00 -1.86 -3.39 119.26 120.19 3hq8 h ALA 88 Ca -0.46 -0.08 -0.27 0.00 0.00 0.00 0.00 54.91 54.10 3hq8 h ALA 88 Cb 1.21 0.59 -0.15 0.00 0.00 0.00 0.00 17.79 19.44 3hq8 h ALA 88 CO 0.48 -0.93 -0.69 0.95 0.00 0.00 0.00 179.25 179.07 3hq8 s THR 89 N -4.48 0.78 0.07 0.00 -4.23 -1.26 -3.26 115.64 103.26 3hq8 s THR 89 Ca -0.09 -1.98 -0.15 0.00 -1.18 0.00 0.00 61.69 58.29 3hq8 s THR 89 Cb 0.03 -1.90 -0.06 0.00 1.34 0.00 0.00 72.50 71.91 3hq8 s THR 89 CO 0.32 -0.68 0.49 -0.44 -0.54 0.00 0.00 174.62 173.76 3hq8 s SER 90 N -3.12 6.85 -0.19 3.99 0.01 -1.21 -4.62 113.70 115.41 3hq8 s SER 90 Ca 0.18 1.04 -0.04 0.00 1.31 0.00 0.00 55.95 58.44 3hq8 s SER 90 Cb 0.05 -2.28 -0.02 0.00 0.21 0.00 0.00 66.02 63.99 3hq8 s SER 90 CO -0.00 0.22 -0.04 -0.89 0.41 0.00 0.00 173.24 172.94 3hq8 s THR 91 N -1.25 3.57 0.00 1.44 2.01 -1.26 0.13 115.64 120.28 3hq8 s THR 91 Ca 0.31 -0.45 0.00 0.00 0.31 0.00 0.00 61.69 61.86 3hq8 s THR 91 Cb -0.16 -2.59 0.00 0.00 0.01 0.00 0.00 72.50 69.75 3hq8 s THR 91 CO 0.17 0.45 0.00 0.61 -0.69 0.00 0.00 174.62 175.16 3hq8 n GLY 92 N 4.25 2.34 3.55 4.40 0.00 -1.26 -4.98 105.19 113.50 3hq8 n GLY 92 Ca -0.18 -0.88 -0.46 0.00 0.00 0.00 0.00 46.02 44.50 3hq8 n GLY 92 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3hq8 n HIS 93 N 0.22 0.94 -1.13 1.61 -0.00 -1.18 -0.94 115.22 114.74 3hq8 n HIS 93 Ca 0.00 0.75 -0.05 0.00 0.46 0.00 0.00 57.72 58.89 3hq8 n HIS 93 Cb 0.00 -2.20 -0.02 0.00 -0.12 0.00 0.00 29.99 27.65 3hq8 n HIS 93 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 3hq8 n GLY 94 N 1.57 0.71 2.83 1.57 0.00 -1.26 -2.88 105.19 107.72 3hq8 n GLY 94 Ca 0.13 -0.39 -0.21 0.00 0.00 0.00 0.00 46.02 45.54 3hq8 n GLY 94 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 3hq8 n TRP 95 N -2.70 -1.68 -3.79 1.61 -0.00 -0.11 -4.98 117.44 105.78 3hq8 n TRP 95 Ca -0.05 0.39 -0.36 0.00 -0.00 0.00 0.00 57.50 57.48 3hq8 n TRP 95 Cb 0.23 -4.25 -0.12 0.00 -0.00 0.00 0.00 31.31 27.17 3hq8 n TRP 95 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 177.69 176.55 3hq8 s GLN 96 N -5.51 3.74 0.88 5.87 2.00 -1.14 -5.00 119.66 120.50 3hq8 s GLN 96 Ca 0.23 -0.44 -0.13 0.00 -2.00 0.00 0.00 55.36 53.02 3hq8 s GLN 96 Cb -0.10 -3.34 0.04 0.00 0.80 0.00 0.00 33.01 30.41 3hq8 s GLN 96 CO 0.28 -0.12 0.63 1.63 -0.50 0.00 0.00 175.29 177.21 3hq8 n LYS 97 N 4.72 -0.14 -3.49 1.67 5.02 -1.26 -4.37 118.16 120.32 3hq8 n LYS 97 Ca -0.16 0.01 -0.21 0.00 -2.02 0.00 0.00 58.31 55.93 3hq8 n LYS 97 Cb 0.52 -2.00 -0.01 0.00 -0.02 0.00 0.00 35.03 33.52 3hq8 n LYS 97 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3hq8 s GLY 98 N -2.00 2.10 0.21 0.72 0.00 0.35 -4.89 107.32 103.82 3hq8 s GLY 98 Ca 0.62 -1.77 0.10 0.00 0.00 0.00 0.00 44.72 43.67 3hq8 s GLY 98 CO 0.62 -1.73 1.46 -0.56 0.00 0.00 0.00 173.10 172.89 3hq8 h PRO 99 N 0.79 0.00 -6.20 2.90 0.13 -1.96 -3.41 132.00 124.24 3hq8 h PRO 99 Ca -0.38 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.14 3hq8 h PRO 99 Cb 1.28 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 32.15 3hq8 h PRO 99 CO 0.53 0.76 -0.85 1.03 -0.23 0.00 0.00 178.00 179.24 3hq8 s ARG 100 N -3.14 1.50 0.31 0.86 1.81 -1.26 -4.69 118.95 114.34 3hq8 s ARG 100 Ca 0.00 -0.95 -0.29 0.00 -1.72 0.00 0.00 55.73 52.77 3hq8 s ARG 100 Cb 0.11 -1.61 -0.12 0.00 -0.45 0.00 0.00 34.95 32.88 3hq8 s ARG 100 CO 0.78 0.41 1.47 -1.71 -0.68 0.00 0.00 175.30 175.58 3hq8 n ASN 101 N 1.91 3.41 -4.70 0.23 2.85 0.01 -3.29 115.26 115.68 3hq8 n ASN 101 Ca -0.17 1.18 -0.42 0.00 -0.11 0.00 0.00 54.58 55.06 3hq8 n ASN 101 Cb 0.53 -1.55 -0.03 0.00 1.24 0.00 0.00 39.78 39.97 3hq8 n ASN 101 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3hq8 s ALA 102 N -0.50 3.59 0.59 5.20 0.00 -1.26 -4.97 121.76 124.41 3hq8 s ALA 102 Ca 0.60 0.99 -0.07 0.00 0.00 0.00 0.00 51.96 53.49 3hq8 s ALA 102 Cb -0.53 -3.59 -0.00 0.00 0.00 0.00 0.00 23.12 18.99 3hq8 s ALA 102 CO 0.55 -0.85 0.92 -1.25 0.00 0.00 0.00 175.76 175.14 3hq8 s PRO 103 N 2.04 3.08 0.31 0.00 0.04 -1.26 -4.74 135.00 134.48 3hq8 s PRO 103 Ca 0.65 0.17 -0.27 0.00 0.04 0.00 0.00 61.00 61.59 3hq8 s PRO 103 Cb -0.34 -2.23 -0.09 0.00 0.04 0.00 0.00 34.50 31.87 3hq8 s PRO 103 CO 0.28 -0.65 1.00 -0.08 0.04 0.00 0.00 177.00 177.59 3hq8 s THR 104 N -3.02 3.93 0.22 1.26 -1.32 -1.26 -4.63 115.64 110.82 3hq8 s THR 104 Ca 0.53 1.72 0.04 0.00 -1.21 0.00 0.00 61.69 62.77 3hq8 s THR 104 Cb -0.11 -4.01 -0.06 0.00 -1.51 0.00 0.00 72.50 66.82 3hq8 s THR 104 CO 0.47 0.25 1.53 1.62 -2.21 0.00 0.00 174.62 176.28 3hq8 h VAL 105 N 2.76 1.39 -2.57 5.08 3.04 -1.47 -3.39 116.25 121.09 3hq8 h VAL 105 Ca -0.47 -2.05 -0.52 0.00 -1.01 0.00 0.00 66.70 62.65 3hq8 h VAL 105 Cb 1.20 2.05 0.05 0.00 -2.01 0.00 0.00 31.29 32.58 3hq8 h VAL 105 CO 0.66 0.61 1.09 -0.76 -1.01 0.00 0.00 177.57 178.15 3hq8 s LEU 106 N -7.89 4.39 0.00 3.16 1.43 -1.26 -0.31 118.68 118.20 3hq8 s LEU 106 Ca -0.04 2.81 0.00 0.00 -1.03 0.00 0.00 54.13 55.87 3hq8 s LEU 106 Cb 0.12 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.76 3hq8 s LEU 106 CO 0.80 -1.00 0.00 0.59 0.23 0.00 0.00 176.35 176.97 3hq8 n ASN 107 N 5.12 -3.59 0.14 2.29 5.03 -0.64 -4.84 115.26 118.77 3hq8 n ASN 107 Ca 0.17 0.00 0.19 0.00 0.87 0.00 0.00 54.58 55.81 3hq8 n ASN 107 Cb 0.37 -3.07 0.78 0.00 -1.02 0.00 0.00 39.78 36.84 3hq8 n ASN 107 CO 0.00 0.00 0.00 0.77 -1.83 0.00 0.00 177.26 176.20 3hq8 h SER 108 N 0.00 0.00 0.00 6.41 4.64 -0.87 0.42 113.55 124.15 3hq8 h SER 108 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hq8 h SER 108 Cb 0.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 3hq8 h SER 108 CO 0.00 0.00 0.17 1.62 -0.87 0.00 0.00 176.83 177.75 3hq8 h VAL 109 N 0.00 0.00 0.00 0.95 3.04 -1.85 -0.49 116.25 117.90 3hq8 h VAL 109 Ca 0.15 0.00 -0.19 0.00 -1.01 0.00 0.00 66.70 65.65 3hq8 h VAL 109 Cb 0.85 0.81 -0.03 0.00 -2.01 0.00 0.00 31.29 30.91 3hq8 h VAL 109 CO -0.00 0.00 -1.56 0.49 -1.01 0.00 0.00 177.57 175.48 3hq8 n PHE 110 N -2.95 0.84 -2.37 3.17 3.72 0.14 -4.95 117.46 115.05 3hq8 n PHE 110 Ca -0.02 0.28 -0.41 0.00 -0.05 0.00 0.00 57.45 57.24 3hq8 n PHE 110 Cb 0.23 -1.06 -0.03 0.00 -0.94 0.00 0.00 39.48 37.68 3hq8 n PHE 110 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 3hq8 s ASN 111 N -5.70 7.07 -0.13 4.37 0.01 -0.19 -4.93 114.94 115.43 3hq8 s ASN 111 Ca -0.04 2.19 0.06 0.00 -0.71 0.00 0.00 52.86 54.36 3hq8 s ASN 111 Cb 0.09 -2.60 -0.23 0.00 0.41 0.00 0.00 41.25 38.91 3hq8 s ASN 111 CO 0.82 -0.41 0.31 0.35 -1.51 0.00 0.00 177.10 176.66 3hq8 n THR 112 N 2.92 1.60 -2.43 1.60 -2.24 0.20 -4.88 114.28 111.06 3hq8 n THR 112 Ca 0.06 -0.73 -0.43 0.00 -2.27 0.00 0.00 64.05 60.68 3hq8 n THR 112 Cb 0.45 -1.21 -0.02 0.00 -2.10 0.00 0.00 70.33 67.44 3hq8 n THR 112 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hq8 s ALA 113 N -2.55 3.62 -0.11 6.98 0.00 0.73 -4.94 121.76 125.49 3hq8 s ALA 113 Ca -0.16 0.51 0.20 0.00 0.00 0.00 0.00 51.96 52.51 3hq8 s ALA 113 Cb 0.07 -3.59 -0.28 0.00 0.00 0.00 0.00 23.12 19.32 3hq8 s ALA 113 CO 0.77 -1.06 0.37 1.04 0.00 0.00 0.00 175.76 176.88 3hq8 n GLN 114 N 6.22 0.67 -4.27 0.00 6.02 -1.26 -4.87 117.38 119.88 3hq8 n GLN 114 Ca 0.13 -0.08 -0.17 0.00 -0.01 0.00 0.00 57.00 56.88 3hq8 n GLN 114 Cb 0.45 -1.56 -0.10 0.00 1.02 0.00 0.00 30.24 30.05 3hq8 n GLN 114 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 3hq8 s PHE 115 N -3.07 1.43 0.16 1.08 0.08 -1.26 -5.06 117.98 111.34 3hq8 s PHE 115 Ca -0.08 -0.64 -0.17 0.00 0.12 0.00 0.00 56.93 56.16 3hq8 s PHE 115 Cb 0.10 -0.71 0.08 0.00 -0.57 0.00 0.00 43.02 41.92 3hq8 s PHE 115 CO 0.87 0.18 1.70 -1.49 -0.10 0.00 0.00 175.22 176.38 3hq8 h TRP 116 N 2.95 -0.02 -1.51 0.36 4.06 -1.96 -3.40 115.95 116.43 3hq8 h TRP 116 Ca -0.38 0.03 0.09 0.00 2.06 0.00 0.00 58.89 60.69 3hq8 h TRP 116 Cb 1.20 0.06 -0.25 0.00 -1.00 0.00 0.00 29.16 29.17 3hq8 h TRP 116 CO 0.67 -0.06 0.56 0.16 -3.56 0.00 0.00 178.44 176.21 3hq8 s ASP 117 N -5.26 -0.36 0.05 -3.49 -4.77 -1.26 -1.10 116.67 100.49 3hq8 s ASP 117 Ca -0.13 0.51 -0.26 0.00 -3.30 0.00 0.00 52.55 49.37 3hq8 s ASP 117 Cb 0.13 0.46 0.09 0.00 -1.09 0.00 0.00 42.92 42.51 3hq8 s ASP 117 CO 0.71 -0.24 1.20 -0.83 0.70 0.00 0.00 175.17 176.71 3hq8 s GLY 118 N -0.59 -0.06 0.49 2.12 0.00 -0.79 -5.00 107.32 103.48 3hq8 s GLY 118 Ca 0.01 -0.06 -0.22 0.00 0.00 0.00 0.00 44.72 44.45 3hq8 s GLY 118 CO -0.03 4.35 1.23 0.50 0.00 0.00 0.00 173.10 179.16 3hq8 s ARG 119 N -2.09 3.55 0.16 2.90 0.52 -1.26 0.13 118.95 122.86 3hq8 s ARG 119 Ca 0.26 1.92 -0.15 0.00 -0.52 0.00 0.00 55.73 57.24 3hq8 s ARG 119 Cb -0.01 -2.35 0.04 0.00 0.52 0.00 0.00 34.95 33.15 3hq8 s ARG 119 CO 0.01 -0.76 1.81 0.00 0.02 0.00 0.00 175.30 176.37 3hq8 h ALA 120 N 1.85 0.54 -0.53 2.13 0.00 -1.88 -2.60 119.26 118.77 3hq8 h ALA 120 Ca -0.50 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.44 3hq8 h ALA 120 Cb 1.26 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.87 3hq8 h ALA 120 CO 0.59 -0.05 0.28 0.87 0.00 0.00 0.00 179.25 180.94 3hq8 h LYS 121 N 0.53 0.52 -0.39 0.00 6.56 -1.93 0.31 116.57 122.18 3hq8 h LYS 121 Ca 0.17 -0.03 0.08 0.00 -1.06 0.00 0.00 60.65 59.81 3hq8 h LYS 121 Cb -0.01 -0.12 -0.09 0.00 -0.57 0.00 0.00 32.23 31.44 3hq8 h LYS 121 CO -0.06 0.35 -0.23 -0.44 -2.06 0.00 0.00 179.45 177.00 3hq8 h ASP 122 N 0.54 -0.77 0.14 0.86 5.19 -1.87 -2.58 116.42 117.93 3hq8 h ASP 122 Ca 0.23 0.16 -0.18 0.00 -0.62 0.00 0.00 57.03 56.62 3hq8 h ASP 122 Cb 0.12 0.39 -0.00 0.00 0.18 0.00 0.00 39.33 40.02 3hq8 h ASP 122 CO -0.15 -0.25 -0.69 -0.07 -3.12 0.00 0.00 179.24 174.96 3hq8 h LEU 123 N -0.16 0.58 0.00 1.55 3.38 -1.22 -3.39 115.31 116.05 3hq8 h LEU 123 Ca 0.19 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.80 3hq8 h LEU 123 Cb 0.46 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.04 3hq8 h LEU 123 CO -0.49 1.10 0.00 0.00 0.09 0.00 0.00 178.44 179.14 3hq8 n ALA 124 N -2.53 0.00 -2.41 1.53 0.00 0.08 -3.44 120.51 113.74 3hq8 n ALA 124 Ca -0.04 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.00 3hq8 n ALA 124 Cb 0.68 0.15 -0.03 0.00 0.00 0.00 0.00 19.45 20.25 3hq8 n ALA 124 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3hq8 s GLU 125 N -0.97 3.05 0.00 0.00 8.01 -1.26 -4.38 118.70 123.16 3hq8 s GLU 125 Ca 0.00 -0.06 0.00 0.00 0.01 0.00 0.00 54.97 54.92 3hq8 s GLU 125 Cb 0.00 -4.30 0.00 0.00 -4.31 0.00 0.00 34.13 25.52 3hq8 s GLU 125 CO 0.00 -2.33 0.00 1.04 0.01 0.00 0.00 175.26 173.98 3hq8 n GLN 126 N 9.30 0.00 -0.41 1.61 1.13 -1.22 -4.96 117.38 122.83 3hq8 n GLN 126 Ca 0.09 0.00 0.34 0.00 -1.94 0.00 0.00 57.00 55.49 3hq8 n GLN 126 Cb 0.50 -0.22 0.65 0.00 0.11 0.00 0.00 30.24 31.28 3hq8 n GLN 126 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3hq8 h ALA 127 N 0.00 2.78 -0.00 -1.58 0.00 -1.85 0.26 119.26 118.87 3hq8 h ALA 127 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3hq8 h ALA 127 Cb 0.00 0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3hq8 h ALA 127 CO 0.00 -1.27 -0.77 1.17 0.00 0.00 0.00 179.25 178.38 3hq8 n LYS 128 N -4.49 0.21 0.00 0.00 4.81 -1.26 -4.98 118.16 112.45 3hq8 n LYS 128 Ca 0.32 -0.16 0.00 0.00 -0.87 0.00 0.00 58.31 57.60 3hq8 n LYS 128 Cb 1.28 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 34.84 3hq8 n LYS 128 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3hq8 n GLY 129 N 1.48 1.08 0.00 3.14 0.00 0.91 -5.03 105.19 106.77 3hq8 n GLY 129 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 3hq8 n GLY 129 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3hq8 n PRO 130 N 0.00 0.00 -2.35 1.61 -0.02 -1.26 -5.00 135.00 127.98 3hq8 n PRO 130 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3hq8 n PRO 130 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 3hq8 n PRO 130 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 3hq8 n VAL 131 N 0.00 -0.76 0.00 -1.45 0.24 -1.26 -5.08 118.33 110.02 3hq8 n VAL 131 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 3hq8 n VAL 131 Cb 0.00 -1.91 0.00 0.00 -1.47 0.00 0.00 33.84 30.46 3hq8 n VAL 131 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 3hq8 n GLN 132 N 2.18 0.00 -2.36 7.34 -0.06 -1.26 -4.90 117.38 118.32 3hq8 n GLN 132 Ca 0.00 0.00 -0.01 0.00 -2.00 0.00 0.00 57.00 54.99 3hq8 n GLN 132 Cb 0.00 0.00 -0.00 0.00 -4.06 0.00 0.00 30.24 26.18 3hq8 n GLN 132 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 3hq8 n ALA 133 N 0.00 -3.38 -1.66 1.69 0.00 -1.26 -4.90 120.51 111.00 3hq8 n ALA 133 Ca 0.00 0.53 -0.50 0.00 0.00 0.00 0.00 53.44 53.47 3hq8 n ALA 133 Cb 0.00 -1.06 -0.05 0.00 0.00 0.00 0.00 19.45 18.34 3hq8 n ALA 133 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3hq8 n PRO 134 N 0.60 1.72 0.00 0.00 -0.02 -1.26 -4.79 135.00 131.24 3hq8 n PRO 134 Ca -0.04 0.62 0.07 0.00 -2.02 0.00 0.00 63.50 62.13 3hq8 n PRO 134 Cb 0.06 -2.36 0.40 0.00 -0.02 0.00 0.00 33.50 31.58 3hq8 n PRO 134 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3hq8 n LYS 135 N 4.23 0.51 0.10 -0.52 5.02 -1.26 -2.23 118.16 124.00 3hq8 n LYS 135 Ca 0.20 0.00 -0.03 0.00 -2.02 0.00 0.00 58.31 56.47 3hq8 n LYS 135 Cb 0.24 -1.41 -0.05 0.00 -0.02 0.00 0.00 35.03 33.78 3hq8 n LYS 135 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 3hq8 h GLU 136 N 0.00 0.00 -0.00 1.97 3.07 -1.97 -3.30 114.58 114.35 3hq8 h GLU 136 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3hq8 h GLU 136 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3hq8 h GLU 136 CO 0.00 0.76 -0.68 -1.33 -1.40 0.00 0.00 179.01 176.37 3hq8 n MET 137 N -3.29 0.13 -2.05 2.33 2.81 -0.95 -3.10 117.12 113.00 3hq8 n MET 137 Ca 0.01 -0.09 -0.21 0.00 -1.81 0.00 0.00 57.70 55.60 3hq8 n MET 137 Cb 0.85 -1.50 -0.04 0.00 -0.71 0.00 0.00 33.22 31.81 3hq8 n MET 137 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 3hq8 n ASN 138 N -1.36 -5.74 -4.79 7.83 4.05 -1.24 -1.07 115.26 112.93 3hq8 n ASN 138 Ca 0.06 0.21 -0.22 0.00 0.45 0.00 0.00 54.58 55.08 3hq8 n ASN 138 Cb 0.34 -4.89 -0.05 0.00 1.23 0.00 0.00 39.78 36.41 3hq8 n ASN 138 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 177.26 174.41 3hq8 s ASN 139 N -2.37 5.28 0.20 1.20 0.01 -1.26 -4.32 114.94 113.68 3hq8 s ASN 139 Ca 0.00 -0.38 0.05 0.00 -0.71 0.00 0.00 52.86 51.82 3hq8 s ASN 139 Cb 0.00 -1.21 -0.04 0.00 0.41 0.00 0.00 41.25 40.41 3hq8 s ASN 139 CO 0.00 -0.09 0.22 0.42 -1.51 0.00 0.00 177.10 176.14 3hq8 s THR 140 N -2.21 4.76 0.50 1.60 -4.23 -1.26 -4.90 115.64 109.91 3hq8 s THR 140 Ca 0.34 -1.10 0.22 0.00 -1.18 0.00 0.00 61.69 59.98 3hq8 s THR 140 Cb -0.07 -3.51 0.38 0.00 1.34 0.00 0.00 72.50 70.64 3hq8 s THR 140 CO 0.24 -0.22 1.98 -0.65 -0.54 0.00 0.00 174.62 175.43 3hq8 h PRO 141 N 1.85 0.11 0.47 3.99 0.11 -1.95 -0.60 132.00 135.98 3hq8 h PRO 141 Ca -0.49 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.59 3hq8 h PRO 141 Cb 1.22 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3hq8 h PRO 141 CO 0.63 0.07 -0.22 -0.44 -0.21 0.00 0.00 178.00 177.83 3hq8 h ASP 142 N 0.12 -0.53 -0.83 -2.05 5.19 -2.00 -2.44 116.42 113.88 3hq8 h ASP 142 Ca 0.28 -0.05 0.14 0.00 -0.62 0.00 0.00 57.03 56.78 3hq8 h ASP 142 Cb 0.94 0.14 -0.06 0.00 0.18 0.00 0.00 39.33 40.53 3hq8 h ASP 142 CO -0.03 -0.27 0.54 1.56 -3.12 0.00 0.00 179.24 177.91 3hq8 h GLN 143 N -0.77 0.56 0.33 3.56 4.20 -1.56 -0.24 115.11 121.19 3hq8 h GLN 143 Ca -0.06 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.60 3hq8 h GLN 143 Cb 0.55 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.21 3hq8 h GLN 143 CO 0.11 0.37 -0.16 0.28 -0.67 0.00 0.00 178.83 178.75 3hq8 h VAL 144 N 0.58 0.67 -0.61 -0.54 2.07 -1.15 -2.64 116.25 114.63 3hq8 h VAL 144 Ca 0.41 -0.46 0.12 0.00 0.82 0.00 0.00 66.70 67.59 3hq8 h VAL 144 Cb 0.76 0.91 -0.10 0.00 -1.52 0.00 0.00 31.29 31.34 3hq8 h VAL 144 CO -0.16 0.09 0.05 0.58 0.02 0.00 0.00 177.57 178.15 3hq8 h VAL 145 N -0.71 0.55 -0.99 2.57 2.07 -0.90 -0.37 116.25 118.46 3hq8 h VAL 145 Ca -0.05 -0.06 0.07 0.00 0.82 0.00 0.00 66.70 67.48 3hq8 h VAL 145 Cb 0.49 0.36 -0.07 0.00 -1.52 0.00 0.00 31.29 30.56 3hq8 h VAL 145 CO 0.08 0.03 0.64 0.50 0.02 0.00 0.00 177.57 178.84 3hq8 h LYS 146 N 0.17 1.12 -0.30 1.57 3.64 -1.08 -0.34 116.57 121.36 3hq8 h LYS 146 Ca 0.32 -0.07 -0.09 0.00 -1.27 0.00 0.00 60.65 59.55 3hq8 h LYS 146 Cb 0.51 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 3hq8 h LYS 146 CO -0.48 0.74 -0.16 1.15 -2.27 0.00 0.00 179.45 178.44 3hq8 h THR 147 N 1.16 1.30 0.00 1.00 2.02 -0.73 -2.69 112.91 114.97 3hq8 h THR 147 Ca 0.43 -1.26 -0.04 0.00 0.77 0.00 0.00 66.41 66.31 3hq8 h THR 147 Cb 0.18 1.48 -0.01 0.00 -1.74 0.00 0.00 68.15 68.07 3hq8 h THR 147 CO -0.17 0.40 -0.18 -0.07 0.37 0.00 0.00 175.52 175.87 3hq8 h LEU 148 N 0.38 0.00 0.00 2.58 4.07 -0.83 -2.71 115.31 118.79 3hq8 h LEU 148 Ca 0.06 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.02 3hq8 h LEU 148 Cb 0.68 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.42 3hq8 h LEU 148 CO 0.05 0.18 0.00 0.59 -1.08 0.00 0.00 178.44 178.17 3hq8 n ASN 149 N -3.31 0.00 0.05 -0.43 3.02 -0.18 -3.14 115.26 111.27 3hq8 n ASN 149 Ca 0.00 0.47 0.02 0.00 -0.03 0.00 0.00 54.58 55.04 3hq8 n ASN 149 Cb 0.42 -0.49 -0.07 0.00 -0.61 0.00 0.00 39.78 39.04 3hq8 n ASN 149 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 3hq8 h SER 150 N 0.00 0.00 -3.41 6.41 4.64 -1.23 -3.44 113.55 116.52 3hq8 h SER 150 Ca 0.00 0.00 -0.76 0.00 -0.47 0.00 0.00 61.79 60.56 3hq8 h SER 150 Cb 0.42 0.00 -0.24 0.00 -0.31 0.00 0.00 62.40 62.27 3hq8 h SER 150 CO 0.00 0.49 0.16 -0.63 -0.87 0.00 0.00 176.83 175.99 3hq8 s ILE 151 N -2.99 5.34 0.38 0.95 1.01 -1.19 -4.68 121.20 120.04 3hq8 s ILE 151 Ca -0.02 -2.05 0.18 0.00 0.00 0.00 0.00 60.65 58.75 3hq8 s ILE 151 Cb 0.09 -4.50 0.38 0.00 0.01 0.00 0.00 42.46 38.44 3hq8 s ILE 151 CO 0.81 -1.09 1.75 -0.65 0.00 0.00 0.00 174.94 175.76 3hq8 h PRO 152 N 8.24 0.39 -0.77 2.79 0.11 -1.85 0.59 132.00 141.50 3hq8 h PRO 152 Ca 0.02 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 66.06 3hq8 h PRO 152 Cb 1.05 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.04 3hq8 h PRO 152 CO 0.88 0.26 0.30 -0.44 -0.21 0.00 0.00 178.00 178.79 3hq8 h ASP 153 N 0.40 1.06 0.23 -2.05 3.32 -1.93 -2.18 116.42 115.28 3hq8 h ASP 153 Ca 0.63 -0.16 -0.01 0.00 0.02 0.00 0.00 57.03 57.50 3hq8 h ASP 153 Cb 1.54 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 40.82 3hq8 h ASP 153 CO -0.35 0.94 -0.11 1.88 -1.72 0.00 0.00 179.24 179.89 3hq8 h TYR 154 N 1.12 -0.28 -0.87 4.55 0.05 -1.17 -2.54 116.97 117.82 3hq8 h TYR 154 Ca 0.26 -0.01 0.14 0.00 0.05 0.00 0.00 58.73 59.18 3hq8 h TYR 154 Cb 0.22 0.09 -0.15 0.00 1.01 0.00 0.00 36.73 37.90 3hq8 h TYR 154 CO 0.02 -0.02 -0.35 0.28 -1.05 0.00 0.00 178.16 177.04 3hq8 h VAL 155 N -0.52 0.06 -0.93 -2.88 2.07 -1.31 0.37 116.25 113.12 3hq8 h VAL 155 Ca -0.03 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.63 3hq8 h VAL 155 Cb 0.39 0.06 -0.08 0.00 -1.52 0.00 0.00 31.29 30.14 3hq8 h VAL 155 CO 0.05 0.00 0.59 0.00 0.02 0.00 0.00 177.57 178.23 3hq8 h ALA 156 N 1.36 1.75 0.00 1.67 0.00 -1.32 -2.33 119.26 120.38 3hq8 h ALA 156 Ca 0.33 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 55.15 3hq8 h ALA 156 Cb 0.59 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 3hq8 h ALA 156 CO -0.90 -0.00 -0.55 -0.07 0.00 0.00 0.00 179.25 177.73 3hq8 h LEU 157 N 0.77 0.00 -0.42 0.00 3.38 0.13 -0.55 115.31 118.62 3hq8 h LEU 157 Ca 0.47 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 58.26 3hq8 h LEU 157 Cb 0.68 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.43 3hq8 h LEU 157 CO -0.23 0.55 -0.63 -0.26 0.09 0.00 0.00 178.44 177.96 3hq8 h PHE 158 N 0.00 0.75 -0.01 1.13 0.04 -0.75 -0.94 116.94 117.16 3hq8 h PHE 158 Ca -0.01 -0.29 -0.12 0.00 2.80 0.00 0.00 57.97 60.35 3hq8 h PHE 158 Cb 1.09 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 39.09 3hq8 h PHE 158 CO 0.00 1.05 -0.58 0.87 -0.60 0.00 0.00 178.31 179.05 3hq8 h LYS 159 N 0.43 0.03 0.00 1.51 1.57 -1.24 0.25 116.57 119.11 3hq8 h LYS 159 Ca -0.01 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 3hq8 h LYS 159 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.51 3hq8 h LYS 159 CO 0.12 0.60 -0.08 0.87 -0.57 0.00 0.00 179.45 180.39 3hq8 h LYS 160 N 0.02 0.00 0.05 3.15 1.57 -0.97 -3.15 116.57 117.24 3hq8 h LYS 160 Ca -0.01 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.42 3hq8 h LYS 160 Cb 1.03 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.30 3hq8 h LYS 160 CO 0.08 0.00 -2.11 0.00 -0.57 0.00 0.00 179.45 176.84 3hq8 n ALA 161 N -2.10 1.23 -3.65 3.86 0.00 -0.37 -4.45 120.51 115.03 3hq8 n ALA 161 Ca 0.04 -0.85 -0.27 0.00 0.00 0.00 0.00 53.44 52.35 3hq8 n ALA 161 Cb 0.53 -0.50 -0.10 0.00 0.00 0.00 0.00 19.45 19.37 3hq8 n ALA 161 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3hq8 n PHE 162 N -3.24 2.31 0.13 0.00 3.72 0.84 -4.93 117.46 116.29 3hq8 n PHE 162 Ca -0.33 -4.04 -0.01 0.00 -0.05 0.00 0.00 57.45 53.02 3hq8 n PHE 162 Cb 1.05 -0.43 0.16 0.00 -0.94 0.00 0.00 39.48 39.32 3hq8 n PHE 162 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3hq8 h PRO 163 N 5.07 0.00 0.40 -1.08 0.13 -1.76 -3.13 132.00 131.63 3hq8 h PRO 163 Ca 0.18 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.30 3hq8 h PRO 163 Cb 0.77 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.87 3hq8 h PRO 163 CO 0.66 0.63 -0.44 0.78 -0.23 0.00 0.00 178.00 179.40 3hq8 h GLY 164 N 1.98 -1.05 -4.00 1.56 0.00 -1.94 -3.47 103.07 96.14 3hq8 h GLY 164 Ca -0.01 0.51 -0.51 0.00 0.00 0.00 0.00 47.33 47.32 3hq8 h GLY 164 CO 0.08 -0.33 0.54 -0.54 0.00 0.00 0.00 176.54 176.28 3hq8 s GLU 165 N -5.92 4.53 0.16 4.80 2.02 -1.18 -4.98 118.70 118.12 3hq8 s GLU 165 Ca -0.17 1.88 -0.30 0.00 0.02 0.00 0.00 54.97 56.40 3hq8 s GLU 165 Cb 0.05 -3.20 -0.04 0.00 0.10 0.00 0.00 34.13 31.03 3hq8 s GLU 165 CO 0.62 0.01 1.55 0.87 0.02 0.00 0.00 175.26 178.33 3hq8 h LYS 166 N 4.54 -0.14 -3.05 1.61 1.57 -1.91 -3.34 116.57 115.85 3hq8 h LYS 166 Ca -0.46 0.01 -0.62 0.00 -1.87 0.00 0.00 60.65 57.71 3hq8 h LYS 166 Cb 1.21 0.03 -0.41 0.00 0.08 0.00 0.00 32.23 33.15 3hq8 h LYS 166 CO 0.71 -0.09 -0.69 0.34 -0.57 0.00 0.00 179.45 179.15 3hq8 s ASP 167 N -5.32 3.89 0.32 0.86 2.15 -1.26 -4.97 116.67 112.34 3hq8 s ASP 167 Ca -0.13 -3.10 0.14 0.00 0.43 0.00 0.00 52.55 49.89 3hq8 s ASP 167 Cb 0.11 -1.28 0.49 0.00 -0.30 0.00 0.00 42.92 41.94 3hq8 s ASP 167 CO 0.63 -0.20 1.67 1.55 -0.17 0.00 0.00 175.17 178.65 3hq8 h PRO 168 N 6.20 0.00 -5.01 4.34 0.14 -1.85 -3.38 132.00 132.44 3hq8 h PRO 168 Ca 0.04 0.00 -0.38 0.00 0.14 0.00 0.00 66.00 65.80 3hq8 h PRO 168 Cb 0.87 0.00 0.07 0.00 0.14 0.00 0.00 31.00 32.08 3hq8 h PRO 168 CO 0.59 0.51 1.01 0.28 0.14 0.00 0.00 178.00 180.52 3hq8 n VAL 169 N -3.70 0.41 -4.41 1.56 0.31 -1.26 -4.63 118.33 106.62 3hq8 n VAL 169 Ca -0.01 -0.39 -0.27 0.00 -0.01 0.00 0.00 64.34 63.66 3hq8 n VAL 169 Cb 0.57 -2.06 -0.11 0.00 -0.91 0.00 0.00 33.84 31.33 3hq8 n VAL 169 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 3hq8 s THR 170 N 10.61 2.47 0.30 2.52 -4.23 -1.26 -4.98 115.64 121.07 3hq8 s THR 170 Ca 0.72 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 59.27 3hq8 s THR 170 Cb 0.07 -2.19 0.30 0.00 1.34 0.00 0.00 72.50 72.01 3hq8 s THR 170 CO 0.25 -0.12 1.84 0.15 -0.54 0.00 0.00 174.62 176.19 3hq8 h PHE 171 N 3.14 1.05 -0.23 3.99 3.57 -1.88 -1.23 116.94 125.35 3hq8 h PHE 171 Ca -0.46 0.03 -0.17 0.00 3.53 0.00 0.00 57.97 60.90 3hq8 h PHE 171 Cb 1.21 -0.33 -0.00 0.00 2.79 0.00 0.00 35.95 39.61 3hq8 h PHE 171 CO 0.69 0.39 -0.55 0.22 -2.23 0.00 0.00 178.31 176.83 3hq8 h ASP 172 N 0.89 0.76 0.54 0.41 3.58 -1.93 0.23 116.42 120.89 3hq8 h ASP 172 Ca 0.49 -0.41 -0.06 0.00 0.42 0.00 0.00 57.03 57.47 3hq8 h ASP 172 Cb 0.59 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 41.41 3hq8 h ASP 172 CO -0.26 1.15 -0.30 0.78 -2.88 0.00 0.00 179.24 177.73 3hq8 h ASN 173 N 0.52 0.00 0.32 2.28 2.35 -1.66 -0.40 115.58 118.99 3hq8 h ASN 173 Ca 0.01 0.00 -0.33 0.00 -0.55 0.00 0.00 56.30 55.43 3hq8 h ASN 173 Cb 1.12 0.00 0.02 0.00 0.05 0.00 0.00 38.32 39.51 3hq8 h ASN 173 CO 0.11 0.30 -1.54 0.00 -1.65 0.00 0.00 177.43 174.65 3hq8 h MET 174 N 0.00 0.43 -0.22 0.81 -0.00 -0.72 -1.27 114.93 113.95 3hq8 h MET 174 Ca -0.00 -0.73 -0.05 0.00 -0.00 0.00 0.00 59.70 58.92 3hq8 h MET 174 Cb 0.65 0.27 -0.01 0.00 -0.00 0.00 0.00 31.60 32.51 3hq8 h MET 174 CO 0.04 1.34 -0.08 0.00 -0.00 0.00 0.00 176.91 178.21 3hq8 h ALA 175 N 0.25 1.46 -0.40 -3.00 0.00 -0.86 -0.89 119.26 115.81 3hq8 h ALA 175 Ca -0.27 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 3hq8 h ALA 175 Cb 2.11 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.77 3hq8 h ALA 175 CO 0.22 0.38 0.13 0.87 0.00 0.00 0.00 179.25 180.86 3hq8 h LYS 176 N 0.33 0.62 0.01 0.00 1.57 -1.00 0.88 116.57 118.98 3hq8 h LYS 176 Ca 0.07 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3hq8 h LYS 176 Cb 0.35 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.56 3hq8 h LYS 176 CO 0.02 0.61 -0.01 0.00 -0.57 0.00 0.00 179.45 179.49 3hq8 h ALA 177 N 0.98 -0.02 -0.78 3.86 0.00 -0.79 -1.40 119.26 121.11 3hq8 h ALA 177 Ca 0.13 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3hq8 h ALA 177 Cb 0.24 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 3hq8 h ALA 177 CO -0.01 -0.52 0.41 0.82 0.00 0.00 0.00 179.25 179.95 3hq8 h ILE 178 N -0.03 1.23 -0.52 0.00 2.04 -1.11 -2.60 117.51 116.53 3hq8 h ILE 178 Ca 0.00 -0.61 -0.00 0.00 1.00 0.00 0.00 64.86 65.25 3hq8 h ILE 178 Cb 0.03 0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 36.29 3hq8 h ILE 178 CO -0.00 0.27 0.31 -0.33 0.00 0.00 0.00 178.15 178.39 3hq8 h GLU 179 N 1.09 0.70 -0.58 2.37 5.08 -0.60 -1.86 114.58 120.79 3hq8 h GLU 179 Ca 0.27 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.54 3hq8 h GLU 179 Cb 0.06 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.13 3hq8 h GLU 179 CO -0.04 0.51 0.27 0.28 -1.00 0.00 0.00 179.01 179.03 3hq8 h VAL 180 N 0.69 1.21 -0.36 3.13 2.07 -0.88 -1.42 116.25 120.70 3hq8 h VAL 180 Ca 0.18 -0.61 -0.15 0.00 0.82 0.00 0.00 66.70 66.95 3hq8 h VAL 180 Cb -0.01 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 3hq8 h VAL 180 CO -0.03 0.24 -0.37 0.15 0.02 0.00 0.00 177.57 177.58 3hq8 h PHE 181 N 0.79 1.06 -0.52 1.57 3.57 -1.48 -2.81 116.94 119.12 3hq8 h PHE 181 Ca 0.20 -0.32 0.11 0.00 3.53 0.00 0.00 57.97 61.49 3hq8 h PHE 181 Cb 0.13 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 38.62 3hq8 h PHE 181 CO 0.00 1.13 0.36 0.93 -2.23 0.00 0.00 178.31 178.50 3hq8 h GLU 182 N 0.68 0.21 -0.01 1.11 5.08 -1.18 0.43 114.58 120.90 3hq8 h GLU 182 Ca 0.05 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3hq8 h GLU 182 Cb 0.96 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.17 3hq8 h GLU 182 CO 0.09 0.14 0.01 0.00 -1.00 0.00 0.00 179.01 178.25 3hq8 h ALA 183 N 1.74 1.34 -0.00 3.43 0.00 -0.98 -1.67 119.26 123.11 3hq8 h ALA 183 Ca 0.25 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 3hq8 h ALA 183 Cb 0.68 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3hq8 h ALA 183 CO -0.04 -0.02 -0.20 0.25 0.00 0.00 0.00 179.25 179.24 3hq8 n THR 184 N -3.55 0.00 -2.14 0.00 -2.24 0.15 -4.41 114.28 102.09 3hq8 n THR 184 Ca -0.03 -0.05 -0.42 0.00 -2.27 0.00 0.00 64.05 61.28 3hq8 n THR 184 Cb 0.09 0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.33 3hq8 n THR 184 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3hq8 n LEU 185 N -1.07 6.96 -4.74 3.22 4.77 -0.63 -4.93 117.00 120.58 3hq8 n LEU 185 Ca 0.11 -4.57 -0.26 0.00 -0.03 0.00 0.00 56.01 51.26 3hq8 n LEU 185 Cb 0.31 -1.50 -0.07 0.00 -2.33 0.00 0.00 43.42 39.83 3hq8 n LEU 185 CO 0.27 1.45 -0.17 0.27 -1.33 0.00 0.00 177.39 177.87 3hq8 s ILE 186 N 0.78 2.07 -0.43 -0.08 -4.36 -1.26 -1.62 121.20 116.30 3hq8 s ILE 186 Ca 0.44 -1.76 0.09 0.00 -0.26 0.00 0.00 60.65 59.16 3hq8 s ILE 186 Cb 0.12 -2.83 0.29 0.00 1.25 0.00 0.00 42.46 41.29 3hq8 s ILE 186 CO -0.03 0.00 0.64 0.35 0.24 0.00 0.00 174.94 176.14 3hq8 n THR 187 N -1.25 0.09 -1.18 8.37 -2.24 -1.26 -4.44 114.28 112.38 3hq8 n THR 187 Ca -0.04 -4.44 -0.29 0.00 -2.27 0.00 0.00 64.05 57.01 3hq8 n THR 187 Cb 0.65 -1.44 0.20 0.00 -2.10 0.00 0.00 70.33 67.64 3hq8 n THR 187 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3hq8 s PRO 188 N -1.86 -0.21 -1.47 -0.78 0.04 -1.26 -3.79 135.00 125.67 3hq8 s PRO 188 Ca 0.38 0.23 0.00 0.00 0.04 0.00 0.00 61.00 61.65 3hq8 s PRO 188 Cb 0.23 -1.69 0.00 0.00 0.04 0.00 0.00 34.50 33.08 3hq8 s PRO 188 CO -0.09 -3.10 0.00 -0.25 0.04 0.00 0.00 177.00 173.60 3hq8 n ASP 189 N -4.38 -5.07 -4.68 6.66 9.92 -1.26 -1.67 116.55 116.06 3hq8 n ASP 189 Ca 0.08 0.34 -0.45 0.00 -0.53 0.00 0.00 54.79 54.24 3hq8 n ASP 189 Cb 0.58 -3.79 -0.04 0.00 -0.64 0.00 0.00 41.12 37.24 3hq8 n ASP 189 CO 0.00 0.00 0.00 -0.24 0.13 0.00 0.00 177.20 177.09 3hq8 n SER 190 N -0.71 3.24 -0.05 -2.24 2.88 -1.26 -4.67 113.62 110.81 3hq8 n SER 190 Ca -0.14 1.10 -0.01 0.00 -1.33 0.00 0.00 58.87 58.48 3hq8 n SER 190 Cb 0.52 -1.46 -0.01 0.00 -0.75 0.00 0.00 64.21 62.51 3hq8 n SER 190 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 3hq8 n PRO 191 N 3.15 -0.05 0.18 -1.46 -0.02 -1.24 0.80 135.00 136.37 3hq8 n PRO 191 Ca 0.15 0.18 -0.15 0.00 -2.02 0.00 0.00 63.50 61.66 3hq8 n PRO 191 Cb 0.31 -0.26 -0.07 0.00 -0.02 0.00 0.00 33.50 33.46 3hq8 n PRO 191 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 3hq8 h PHE 192 N 0.00 -0.89 -0.83 6.00 3.57 -1.69 0.19 116.94 123.28 3hq8 h PHE 192 Ca 0.02 0.01 0.20 0.00 3.53 0.00 0.00 57.97 61.72 3hq8 h PHE 192 Cb 0.04 0.36 -0.12 0.00 2.79 0.00 0.00 35.95 39.02 3hq8 h PHE 192 CO -0.12 -0.46 0.29 -0.44 -2.23 0.00 0.00 178.31 175.35 3hq8 h ASP 193 N -0.65 0.16 -0.49 0.41 3.32 0.14 0.55 116.42 119.85 3hq8 h ASP 193 Ca -0.00 0.16 0.00 0.00 0.02 0.00 0.00 57.03 57.21 3hq8 h ASP 193 Cb 0.61 0.18 -0.02 0.00 0.22 0.00 0.00 39.33 40.31 3hq8 h ASP 193 CO -0.10 -0.03 0.33 1.56 -1.72 0.00 0.00 179.24 179.27 3hq8 h GLN 194 N 0.33 0.65 -0.68 3.56 1.08 -0.65 -0.72 115.11 118.69 3hq8 h GLN 194 Ca 0.50 -0.04 0.13 0.00 -1.45 0.00 0.00 58.65 57.79 3hq8 h GLN 194 Cb 0.92 -0.15 -0.09 0.00 -0.05 0.00 0.00 27.48 28.11 3hq8 h GLN 194 CO -0.54 0.44 0.21 -0.92 -0.95 0.00 0.00 178.83 177.07 3hq8 h TYR 195 N 0.67 0.34 -0.34 2.96 3.20 0.31 -2.49 116.97 121.62 3hq8 h TYR 195 Ca 0.18 0.04 -0.05 0.00 3.14 0.00 0.00 58.73 62.03 3hq8 h TYR 195 Cb -0.07 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.14 3hq8 h TYR 195 CO -0.04 0.01 0.01 -0.07 -1.64 0.00 0.00 178.16 176.43 3hq8 h LEU 196 N 0.34 0.59 -2.23 2.82 3.38 -0.33 -3.06 115.31 116.81 3hq8 h LEU 196 Ca 0.36 -0.30 0.02 0.00 0.09 0.00 0.00 57.88 58.05 3hq8 h LEU 196 Cb 0.55 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 3hq8 h LEU 196 CO -0.41 0.75 0.26 0.11 0.09 0.00 0.00 178.44 179.24 3hq8 h LYS 197 N 0.41 0.00 0.00 1.13 1.57 -0.69 -3.45 116.57 115.54 3hq8 h LYS 197 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 3hq8 h LYS 197 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.75 3hq8 h LYS 197 CO 0.02 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.31 3hq8 n GLY 198 N -1.24 0.65 3.56 3.86 0.00 -1.08 -5.09 105.19 105.85 3hq8 n GLY 198 Ca -0.01 0.09 -0.49 0.00 0.00 0.00 0.00 46.02 45.62 3hq8 n GLY 198 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3hq8 n LYS 199 N 0.00 1.60 -0.10 1.61 4.01 -1.20 -4.89 118.16 119.19 3hq8 n LYS 199 Ca 0.00 0.50 -0.12 0.00 -0.51 0.00 0.00 58.31 58.18 3hq8 n LYS 199 Cb 0.00 -2.67 -0.04 0.00 -0.51 0.00 0.00 35.03 31.81 3hq8 n LYS 199 CO 0.00 0.00 0.00 -0.22 -1.11 0.00 0.00 177.40 176.07 3hq8 h LYS 200 N 11.83 0.60 0.00 1.97 3.64 -1.90 -3.09 116.57 129.62 3hq8 h LYS 200 Ca -0.37 -0.26 0.00 0.00 -1.27 0.00 0.00 60.65 58.75 3hq8 h LYS 200 Cb 1.29 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.09 3hq8 h LYS 200 CO 0.98 0.83 0.00 0.36 -2.27 0.00 0.00 179.45 179.36 3hq8 n LYS 201 N -4.42 0.91 0.28 1.90 0.00 -1.26 -3.66 118.16 111.90 3hq8 n LYS 201 Ca -0.03 0.00 0.18 0.00 -0.00 0.00 0.00 58.31 58.45 3hq8 n LYS 201 Cb 0.37 -1.26 0.95 0.00 -0.00 0.00 0.00 35.03 35.08 3hq8 n LYS 201 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3hq8 h ALA 202 N 3.34 1.49 -3.34 0.58 0.00 -1.88 -3.39 119.26 116.06 3hq8 h ALA 202 Ca 0.00 -0.00 -0.64 0.00 0.00 0.00 0.00 54.91 54.26 3hq8 h ALA 202 Cb 0.00 0.01 -0.22 0.00 0.00 0.00 0.00 17.79 17.58 3hq8 h ALA 202 CO 0.00 -0.14 -0.68 -0.51 0.00 0.00 0.00 179.25 177.92 3hq8 s LEU 203 N -7.12 3.18 1.09 0.00 1.43 -1.24 -4.76 118.68 111.26 3hq8 s LEU 203 Ca -0.05 -0.14 -0.17 0.00 -1.03 0.00 0.00 54.13 52.75 3hq8 s LEU 203 Cb 0.14 -1.75 0.24 0.00 0.03 0.00 0.00 46.19 44.84 3hq8 s LEU 203 CO 0.49 0.19 1.15 1.51 0.23 0.00 0.00 176.35 179.92 3hq8 s ASP 204 N 0.21 1.92 0.04 2.29 1.47 -1.26 -4.73 116.67 116.61 3hq8 s ASP 204 Ca -0.03 0.71 -0.09 0.00 1.18 0.00 0.00 52.55 54.32 3hq8 s ASP 204 Cb -0.14 -1.04 -0.02 0.00 -0.34 0.00 0.00 42.92 41.38 3hq8 s ASP 204 CO 0.03 -3.51 1.15 1.23 0.68 0.00 0.00 175.17 174.75 3hq8 h GLY 205 N -2.16 -2.11 1.75 2.12 0.00 -2.00 -2.22 103.07 98.45 3hq8 h GLY 205 Ca -0.47 1.02 0.03 0.00 0.00 0.00 0.00 47.33 47.91 3hq8 h GLY 205 CO 0.43 -0.71 0.09 1.70 0.00 0.00 0.00 176.54 178.05 3hq8 h LYS 206 N -0.02 0.00 -0.14 4.80 3.64 -1.96 -1.83 116.57 121.05 3hq8 h LYS 206 Ca 0.04 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.30 3hq8 h LYS 206 Cb 0.12 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 3hq8 h LYS 206 CO -0.24 0.00 -0.36 1.96 -2.27 0.00 0.00 179.45 178.54 3hq8 h GLN 207 N 0.00 0.50 -0.27 1.90 4.20 -1.70 -1.07 115.11 118.66 3hq8 h GLN 207 Ca 0.06 -0.34 -0.01 0.00 0.06 0.00 0.00 58.65 58.42 3hq8 h GLN 207 Cb 0.24 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 3hq8 h GLN 207 CO -0.00 0.96 0.14 1.15 -0.67 0.00 0.00 178.83 180.41 3hq8 h THR 208 N 0.12 1.09 -0.00 -0.54 2.02 -0.85 0.28 112.91 115.03 3hq8 h THR 208 Ca -0.00 -0.23 -0.23 0.00 0.77 0.00 0.00 66.41 66.71 3hq8 h THR 208 Cb 0.97 0.73 0.01 0.00 -1.74 0.00 0.00 68.15 68.12 3hq8 h THR 208 CO 0.08 0.10 -0.95 0.00 0.37 0.00 0.00 175.52 175.11 3hq8 h ALA 209 N 1.79 0.33 -0.21 6.16 0.00 -1.33 -1.25 119.26 124.75 3hq8 h ALA 209 Ca 0.10 -0.70 -0.01 0.00 0.00 0.00 0.00 54.91 54.30 3hq8 h ALA 209 Cb 0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3hq8 h ALA 209 CO -0.02 0.79 0.11 0.78 0.00 0.00 0.00 179.25 180.91 3hq8 h GLY 210 N 1.08 0.32 0.96 0.00 0.00 -0.58 -1.66 103.07 103.19 3hq8 h GLY 210 Ca -0.09 -0.15 -0.02 0.00 0.00 0.00 0.00 47.33 47.07 3hq8 h GLY 210 CO 0.17 0.15 0.20 -2.00 0.00 0.00 0.00 176.54 175.06 3hq8 h LEU 211 N 0.22 0.58 -0.12 3.11 5.85 -0.43 0.96 115.31 125.47 3hq8 h LEU 211 Ca 0.07 -0.14 0.02 0.00 0.84 0.00 0.00 57.88 58.67 3hq8 h LEU 211 Cb 0.10 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 3hq8 h LEU 211 CO -0.01 0.56 -0.19 0.50 -0.34 0.00 0.00 178.44 178.96 3hq8 h LYS 212 N 0.57 -0.14 -0.11 1.25 1.63 -1.20 -2.50 116.57 116.06 3hq8 h LYS 212 Ca 0.15 0.01 0.05 0.00 -0.85 0.00 0.00 60.65 60.00 3hq8 h LYS 212 Cb 0.14 0.03 -0.06 0.00 -0.60 0.00 0.00 32.23 31.74 3hq8 h LYS 212 CO -0.02 -0.09 -0.29 -0.07 -3.45 0.00 0.00 179.45 175.52 3hq8 h LEU 213 N -0.15 -0.91 -1.34 5.20 3.38 -1.11 -1.29 115.31 119.10 3hq8 h LEU 213 Ca 0.02 0.13 0.47 0.00 0.09 0.00 0.00 57.88 58.60 3hq8 h LEU 213 Cb 0.21 0.39 -0.15 0.00 0.09 0.00 0.00 40.66 41.20 3hq8 h LEU 213 CO -0.20 -0.34 0.84 0.15 0.09 0.00 0.00 178.44 178.98 3hq8 h PHE 214 N -0.38 0.55 0.00 1.13 3.57 -0.66 0.52 116.94 121.68 3hq8 h PHE 214 Ca 0.09 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.62 3hq8 h PHE 214 Cb 0.52 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.13 3hq8 h PHE 214 CO -0.37 -0.31 -0.01 -0.07 -2.23 0.00 0.00 178.31 175.31 3hq8 h LEU 215 N 0.00 0.00 -2.11 0.59 3.38 -0.82 -1.21 115.31 115.15 3hq8 h LEU 215 Ca 0.88 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.90 3hq8 h LEU 215 Cb 2.76 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 43.50 3hq8 h LEU 215 CO -0.51 0.47 0.32 0.44 0.09 0.00 0.00 178.44 179.24 3hq8 h ASP 216 N -0.92 0.00 0.27 -0.43 3.32 0.19 0.16 116.42 119.01 3hq8 h ASP 216 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3hq8 h ASP 216 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 3hq8 h ASP 216 CO 0.00 0.00 -0.63 0.29 -1.72 0.00 0.00 179.24 177.18 3hq8 n LYS 217 N -3.39 0.18 -0.77 3.56 4.76 0.16 -4.97 118.16 117.69 3hq8 n LYS 217 Ca 0.02 -0.13 0.00 0.00 -2.87 0.00 0.00 58.31 55.33 3hq8 n LYS 217 Cb 0.43 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.12 3hq8 n LYS 217 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3hq8 n GLY 218 N 1.48 0.54 0.25 0.72 0.00 0.55 -4.95 105.19 103.78 3hq8 n GLY 218 Ca 0.06 -0.67 -0.04 0.00 0.00 0.00 0.00 46.02 45.38 3hq8 n GLY 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hq8 n VAL 220 N -4.73 1.58 -0.07 0.00 3.14 -1.10 -2.66 118.33 114.49 3hq8 n VAL 220 Ca 0.06 0.39 -0.01 0.00 -2.96 0.00 0.00 64.34 61.83 3hq8 n VAL 220 Cb 0.10 -1.33 0.25 0.00 -1.06 0.00 0.00 33.84 31.80 3hq8 n VAL 220 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3hq8 h ALA 221 N 2.14 1.32 0.00 1.55 0.00 -1.76 -2.87 119.26 119.64 3hq8 h ALA 221 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3hq8 h ALA 221 Cb 0.06 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.66 3hq8 h ALA 221 CO 0.00 0.48 -1.12 0.00 0.00 0.00 0.00 179.25 178.61 3hq8 n HIS 223 N -1.61 3.32 -4.51 0.00 -0.00 -1.09 -3.96 115.22 107.37 3hq8 n HIS 223 Ca -0.01 -2.96 -0.25 0.00 -0.00 0.00 0.00 57.72 54.51 3hq8 n HIS 223 Cb 0.10 -0.24 -0.10 0.00 -0.00 0.00 0.00 29.99 29.75 3hq8 n HIS 223 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.34 176.54 3hq8 s GLY 224 N -3.26 2.11 0.00 -1.41 0.00 -1.09 -4.30 107.32 99.37 3hq8 s GLY 224 Ca 0.49 -2.05 0.00 0.00 0.00 0.00 0.00 44.72 43.16 3hq8 s GLY 224 CO -0.19 -1.98 0.00 0.61 0.00 0.00 0.00 173.10 171.54 3hq8 n GLY 225 N -0.74 -0.52 0.18 0.20 0.00 -1.16 -2.65 105.19 100.50 3hq8 n GLY 225 Ca -0.05 -2.18 -0.02 0.00 0.00 0.00 0.00 46.02 43.77 3hq8 n GLY 225 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3hq8 h LEU 226 N 0.00 0.18 -1.17 0.99 5.85 -1.88 -3.12 115.31 116.16 3hq8 h LEU 226 Ca 0.00 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.63 3hq8 h LEU 226 Cb 0.00 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 40.98 3hq8 h LEU 226 CO 0.00 0.64 -0.09 -3.20 -0.34 0.00 0.00 178.44 175.45 3hq8 n ASN 227 N -3.97 1.68 -3.40 1.25 5.15 -1.26 -4.74 115.26 109.96 3hq8 n ASN 227 Ca -0.02 -1.34 -0.19 0.00 -0.60 0.00 0.00 54.58 52.44 3hq8 n ASN 227 Cb 0.52 0.19 0.04 0.00 -0.53 0.00 0.00 39.78 40.01 3hq8 n ASN 227 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 3hq8 n LEU 228 N 0.28 -4.63 0.00 1.20 4.32 -1.18 -3.58 117.00 113.42 3hq8 n LEU 228 Ca 0.06 -0.72 0.00 0.00 -0.02 0.00 0.00 56.01 55.33 3hq8 n LEU 228 Cb 0.26 -2.84 0.00 0.00 -1.62 0.00 0.00 43.42 39.22 3hq8 n LEU 228 CO 0.10 0.02 0.00 0.61 -1.22 0.00 0.00 177.39 176.90 3hq8 n GLY 229 N -1.52 -0.91 2.59 -0.72 0.00 -1.09 -1.96 105.19 101.58 3hq8 n GLY 229 Ca -0.08 -2.21 0.00 0.00 0.00 0.00 0.00 46.02 43.73 3hq8 n GLY 229 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hq8 n GLY 230 N -0.17 0.92 0.00 -0.02 0.00 0.27 -4.12 105.19 102.07 3hq8 n GLY 230 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 3hq8 n GLY 230 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hq8 n THR 231 N -2.06 0.00 -4.39 2.61 -2.24 -1.25 -0.19 114.28 106.75 3hq8 n THR 231 Ca 0.00 -0.18 -0.20 0.00 -2.27 0.00 0.00 64.05 61.40 3hq8 n THR 231 Cb 0.00 0.51 -0.10 0.00 -2.10 0.00 0.00 70.33 68.63 3hq8 n THR 231 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3hq8 s GLY 232 N -2.41 1.79 0.02 3.38 0.00 -1.26 -4.57 107.32 104.27 3hq8 s GLY 232 Ca -0.01 -1.89 0.08 0.00 0.00 0.00 0.00 44.72 42.89 3hq8 s GLY 232 CO 0.24 -1.76 -0.23 -0.19 0.00 0.00 0.00 173.10 171.16 3hq8 s TYR 233 N -3.26 2.43 -0.13 1.90 2.02 -1.26 -1.89 117.35 117.16 3hq8 s TYR 233 Ca 0.31 -0.35 -0.11 0.00 -0.37 0.00 0.00 57.07 56.55 3hq8 s TYR 233 Cb 0.06 -1.45 0.04 0.00 -0.40 0.00 0.00 41.96 40.20 3hq8 s TYR 233 CO 0.12 0.14 0.34 -0.06 -1.57 0.00 0.00 175.55 174.51 3hq8 s PHE 234 N -0.80 -0.39 -0.93 2.71 0.08 -0.30 -4.88 117.98 113.48 3hq8 s PHE 234 Ca 0.12 0.93 -0.17 0.00 0.12 0.00 0.00 56.93 57.94 3hq8 s PHE 234 Cb -0.10 0.13 -0.10 0.00 -0.57 0.00 0.00 43.02 42.38 3hq8 s PHE 234 CO 0.02 -0.20 2.05 -0.35 -0.10 0.00 0.00 175.22 176.64 3hq8 n PRO 235 N 3.12 1.90 -3.66 0.24 -0.04 -1.26 -0.36 135.00 134.94 3hq8 n PRO 235 Ca -0.15 -1.87 -0.08 0.00 -0.04 0.00 0.00 63.50 61.36 3hq8 n PRO 235 Cb 0.57 -2.85 -0.09 0.00 -0.04 0.00 0.00 33.50 31.08 3hq8 n PRO 235 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3hq8 s PHE 236 N 4.28 -0.79 -0.04 0.54 0.08 -1.25 -1.38 117.98 119.41 3hq8 s PHE 236 Ca 0.52 1.52 0.02 0.00 0.12 0.00 0.00 56.93 59.11 3hq8 s PHE 236 Cb 0.13 0.31 0.01 0.00 -0.57 0.00 0.00 43.02 42.91 3hq8 s PHE 236 CO 0.05 -0.47 -0.08 0.20 -0.10 0.00 0.00 175.22 174.82 3hq8 s GLY 237 N 2.51 0.55 -0.44 4.36 0.00 -0.38 -4.59 107.32 109.34 3hq8 s GLY 237 Ca -0.02 -0.22 -0.29 0.00 0.00 0.00 0.00 44.72 44.19 3hq8 s GLY 237 CO -0.13 0.19 1.19 0.14 0.00 0.00 0.00 173.10 174.49 3hq8 s VAL 238 N 0.61 4.19 0.33 1.40 1.01 -1.26 -0.60 120.40 126.08 3hq8 s VAL 238 Ca -0.10 1.25 0.05 0.00 0.00 0.00 0.00 61.98 63.18 3hq8 s VAL 238 Cb -0.13 -4.49 -0.07 0.00 0.00 0.00 0.00 36.38 31.70 3hq8 s VAL 238 CO 0.01 -0.87 0.03 0.68 0.00 0.00 0.00 175.10 174.95 3hq8 s VAL 239 N 4.51 1.41 1.00 2.92 -7.23 -0.32 -4.87 120.40 117.83 3hq8 s VAL 239 Ca 0.50 -2.02 -0.12 0.00 -1.81 0.00 0.00 61.98 58.54 3hq8 s VAL 239 Cb -0.09 -2.78 0.19 0.00 0.56 0.00 0.00 36.38 34.26 3hq8 s VAL 239 CO 0.29 -0.05 1.08 -0.70 -0.31 0.00 0.00 175.10 175.42 3hq8 s GLU 240 N -3.83 0.37 0.00 4.82 -6.30 -1.26 -2.17 118.70 110.33 3hq8 s GLU 240 Ca 0.35 1.01 0.00 0.00 -2.50 0.00 0.00 54.97 53.84 3hq8 s GLU 240 Cb 0.08 -1.69 0.00 0.00 0.00 0.00 0.00 34.13 32.52 3hq8 s GLU 240 CO 0.15 -2.90 0.00 1.17 0.02 0.00 0.00 175.26 173.70 3hq8 n LYS 241 N -4.36 0.00 0.00 4.30 4.81 -1.26 -4.75 118.16 116.89 3hq8 n LYS 241 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.51 3hq8 n LYS 241 Cb 0.54 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.59 3hq8 n LYS 241 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3hq8 n GLY 253 N 0.00 0.00 0.16 3.14 0.00 -1.26 -4.95 105.19 102.29 3hq8 n GLY 253 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 3hq8 n GLY 253 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3hq8 h ARG 254 N 1.19 0.00 -6.31 1.61 3.08 -2.00 -3.47 114.38 108.48 3hq8 h ARG 254 Ca 0.00 0.00 -0.62 0.00 0.07 0.00 0.00 59.98 59.43 3hq8 h ARG 254 Cb 0.00 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 29.90 3hq8 h ARG 254 CO 0.00 0.00 -0.76 -0.06 -1.07 0.00 0.00 179.97 178.08 3hq8 s PHE 255 N -3.28 2.35 0.23 3.04 0.08 -1.26 -4.66 117.98 114.49 3hq8 s PHE 255 Ca 0.06 -0.32 -0.19 0.00 0.12 0.00 0.00 56.93 56.60 3hq8 s PHE 255 Cb 0.09 -1.06 0.03 0.00 -0.57 0.00 0.00 43.02 41.51 3hq8 s PHE 255 CO 0.54 0.65 0.61 0.00 -0.10 0.00 0.00 175.22 176.93 3hq8 s ALA 256 N -2.26 -1.06 0.13 5.36 0.00 -0.92 -4.92 121.76 118.09 3hq8 s ALA 256 Ca 0.28 -0.25 -0.11 0.00 0.00 0.00 0.00 51.96 51.87 3hq8 s ALA 256 Cb -0.06 0.89 -0.06 0.00 0.00 0.00 0.00 23.12 23.88 3hq8 s ALA 256 CO 0.14 -0.91 0.48 0.08 0.00 0.00 0.00 175.76 175.56 3hq8 s VAL 257 N -3.90 4.98 0.04 0.00 1.01 -1.26 -1.18 120.40 120.09 3hq8 s VAL 257 Ca 0.11 0.58 0.04 0.00 0.00 0.00 0.00 61.98 62.70 3hq8 s VAL 257 Cb -0.03 -3.67 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 3hq8 s VAL 257 CO 0.02 0.20 -0.11 0.28 0.00 0.00 0.00 175.10 175.49 3hq8 s THR 258 N -1.51 0.82 -0.21 3.92 -1.32 0.23 -4.91 115.64 112.66 3hq8 s THR 258 Ca 0.38 -0.91 -0.20 0.00 -1.21 0.00 0.00 61.69 59.74 3hq8 s THR 258 Cb -0.14 -0.78 -0.03 0.00 -1.51 0.00 0.00 72.50 70.05 3hq8 s THR 258 CO 0.19 -0.11 0.61 0.21 -2.21 0.00 0.00 174.62 173.32 3hq8 s ASN 259 N -1.14 6.65 -0.19 8.08 2.47 -1.26 -1.25 114.94 128.30 3hq8 s ASN 259 Ca -0.02 0.79 0.15 0.00 0.42 0.00 0.00 52.86 54.20 3hq8 s ASN 259 Cb -0.08 -2.34 0.45 0.00 -1.45 0.00 0.00 41.25 37.83 3hq8 s ASN 259 CO 0.01 -0.28 1.33 0.35 -3.72 0.00 0.00 177.10 174.80 3hq8 n THR 260 N 4.76 2.21 -0.17 -5.21 -2.24 -0.48 -4.71 114.28 108.44 3hq8 n THR 260 Ca -0.02 -2.27 -0.09 0.00 -2.27 0.00 0.00 64.05 59.41 3hq8 n THR 260 Cb 0.50 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.47 3hq8 n THR 260 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hq8 h ALA 261 N 1.04 0.62 -0.09 6.98 0.00 -1.79 -1.26 119.26 124.77 3hq8 h ALA 261 Ca 0.04 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.77 3hq8 h ALA 261 Cb 1.32 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 3hq8 h ALA 261 CO 0.17 0.29 -0.05 1.17 0.00 0.00 0.00 179.25 180.83 3hq8 n LYS 262 N -4.51 -0.04 0.14 0.00 4.81 -1.26 0.24 118.16 117.54 3hq8 n LYS 262 Ca 0.01 0.35 0.13 0.00 -0.87 0.00 0.00 58.31 57.93 3hq8 n LYS 262 Cb 0.20 -0.52 0.48 0.00 0.02 0.00 0.00 35.03 35.21 3hq8 n LYS 262 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 3hq8 h ASP 263 N 0.00 0.00 -1.55 3.14 3.32 -1.80 -3.46 116.42 116.07 3hq8 h ASP 263 Ca 0.01 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.89 3hq8 h ASP 263 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 3hq8 h ASP 263 CO -0.08 0.00 -0.23 -0.62 -1.72 0.00 0.00 179.24 176.59 3hq8 n GLU 264 N -2.34 -1.15 -4.13 3.56 1.02 0.14 -5.02 120.64 112.72 3hq8 n GLU 264 Ca 0.03 0.41 -0.35 0.00 -0.02 0.00 0.00 57.16 57.23 3hq8 n GLU 264 Cb 0.29 -4.32 -0.08 0.00 -0.02 0.00 0.00 31.44 27.31 3hq8 n GLU 264 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 3hq8 s TYR 265 N -2.55 3.34 0.14 -0.32 5.04 -0.85 -2.80 117.35 119.35 3hq8 s TYR 265 Ca 0.04 0.30 0.05 0.00 -2.44 0.00 0.00 57.07 55.03 3hq8 s TYR 265 Cb -0.02 -1.82 -0.04 0.00 0.35 0.00 0.00 41.96 40.43 3hq8 s TYR 265 CO 0.05 0.58 -0.12 0.14 -1.34 0.00 0.00 175.55 174.87 3hq8 s VAL 266 N -1.04 1.25 0.05 3.14 -7.23 0.12 -4.25 120.40 112.44 3hq8 s VAL 266 Ca 0.17 -1.95 0.03 0.00 -1.81 0.00 0.00 61.98 58.42 3hq8 s VAL 266 Cb -0.12 -1.74 -0.03 0.00 0.56 0.00 0.00 36.38 35.06 3hq8 s VAL 266 CO 0.07 -0.63 -0.10 -0.36 -0.31 0.00 0.00 175.10 173.77 3hq8 s PHE 267 N -2.91 0.88 0.01 2.82 0.08 0.51 -1.89 117.98 117.48 3hq8 s PHE 267 Ca 0.14 -0.47 -0.30 0.00 0.12 0.00 0.00 56.93 56.42 3hq8 s PHE 267 Cb -0.00 -0.51 -0.05 0.00 -0.57 0.00 0.00 43.02 41.89 3hq8 s PHE 267 CO 0.02 -0.03 1.24 0.50 -0.10 0.00 0.00 175.22 176.85 3hq8 s ARG 268 N -1.58 4.37 -0.42 0.44 3.52 -0.25 -1.15 118.95 123.88 3hq8 s ARG 268 Ca -0.06 1.78 -0.25 0.00 -0.13 0.00 0.00 55.73 57.06 3hq8 s ARG 268 Cb -0.10 -3.45 0.02 0.00 -1.56 0.00 0.00 34.95 29.86 3hq8 s ARG 268 CO 0.01 -0.38 0.91 0.00 -0.81 0.00 0.00 175.30 175.02 3hq8 s ALA 269 N 1.69 3.31 0.31 6.12 0.00 -0.79 -4.96 121.76 127.43 3hq8 s ALA 269 Ca 0.59 -0.68 -0.02 0.00 0.00 0.00 0.00 51.96 51.86 3hq8 s ALA 269 Cb -0.28 -3.57 -0.04 0.00 0.00 0.00 0.00 23.12 19.22 3hq8 s ALA 269 CO 0.26 -1.85 0.53 -1.25 0.00 0.00 0.00 175.76 173.46 3hq8 s PRO 270 N 3.58 3.54 -0.19 0.00 0.04 -1.26 0.98 135.00 141.68 3hq8 s PRO 270 Ca 0.37 -0.21 -0.29 0.00 0.04 0.00 0.00 61.00 60.90 3hq8 s PRO 270 Cb -0.11 -2.67 -0.04 0.00 0.04 0.00 0.00 34.50 31.71 3hq8 s PRO 270 CO 0.23 0.19 1.84 0.45 0.04 0.00 0.00 177.00 179.76 3hq8 s SER 271 N -3.64 6.10 -0.11 6.66 0.15 -1.24 -4.17 113.70 117.45 3hq8 s SER 271 Ca 0.41 1.82 0.06 0.00 0.70 0.00 0.00 55.95 58.94 3hq8 s SER 271 Cb -0.10 -2.53 0.34 0.00 -1.71 0.00 0.00 66.02 62.03 3hq8 s SER 271 CO 0.33 -1.45 1.05 0.18 1.20 0.00 0.00 173.24 174.55 3hq8 n LEU 272 N 9.31 3.10 -4.75 3.45 4.77 -0.83 -4.84 117.00 127.21 3hq8 n LEU 272 Ca 0.22 -1.57 -0.41 0.00 -0.03 0.00 0.00 56.01 54.22 3hq8 n LEU 272 Cb 0.45 -0.58 -0.03 0.00 -2.33 0.00 0.00 43.42 40.93 3hq8 n LEU 272 CO 0.66 0.43 1.02 -0.13 -1.33 0.00 0.00 177.39 178.04 3hq8 s ARG 273 N -1.73 4.35 -0.48 3.23 0.52 -1.26 -3.11 118.95 120.47 3hq8 s ARG 273 Ca 0.23 2.16 0.00 0.00 -0.52 0.00 0.00 55.73 57.60 3hq8 s ARG 273 Cb 0.18 -3.15 0.00 0.00 0.52 0.00 0.00 34.95 32.50 3hq8 s ARG 273 CO 0.07 -0.29 0.00 0.09 0.02 0.00 0.00 175.30 175.19 3hq8 n ASN 274 N 2.20 -4.04 0.26 0.23 3.02 -0.98 -4.91 115.26 111.05 3hq8 n ASN 274 Ca 0.05 0.11 0.15 0.00 -0.03 0.00 0.00 54.58 54.86 3hq8 n ASN 274 Cb 0.42 -1.93 0.68 0.00 -0.61 0.00 0.00 39.78 38.33 3hq8 n ASN 274 CO 0.00 0.00 0.00 1.62 -2.62 0.00 0.00 177.26 176.26 3hq8 h VAL 275 N 0.00 0.28 -0.39 2.41 3.04 -1.80 0.23 116.25 120.03 3hq8 h VAL 275 Ca -0.09 -0.65 0.05 0.00 -1.01 0.00 0.00 66.70 64.99 3hq8 h VAL 275 Cb 0.46 1.51 -0.02 0.00 -2.01 0.00 0.00 31.29 31.23 3hq8 h VAL 275 CO 0.13 0.09 0.26 0.00 -1.01 0.00 0.00 177.57 177.05 3hq8 h ALA 276 N 1.91 1.94 -0.01 3.17 0.00 -1.86 -3.31 119.26 121.10 3hq8 h ALA 276 Ca -0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 3hq8 h ALA 276 Cb 0.50 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 3hq8 h ALA 276 CO 0.01 -0.00 -0.45 0.44 0.00 0.00 0.00 179.25 179.25 3hq8 n ILE 277 N -4.48 2.19 -2.48 0.00 -5.35 0.06 -4.72 119.36 104.58 3hq8 n ILE 277 Ca 0.04 -3.15 0.00 0.00 -0.27 0.00 0.00 62.75 59.37 3hq8 n ILE 277 Cb 0.21 -0.24 0.05 0.00 -1.74 0.00 0.00 39.64 37.92 3hq8 n ILE 277 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 3hq8 n THR 278 N -1.15 0.93 -1.42 7.28 -2.24 -1.18 -4.51 114.28 111.99 3hq8 n THR 278 Ca 0.19 -2.24 -0.32 0.00 -2.27 0.00 0.00 64.05 59.41 3hq8 n THR 278 Cb 0.69 0.78 0.08 0.00 -2.10 0.00 0.00 70.33 69.79 3hq8 n THR 278 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 3hq8 s TYR 279 N -2.06 2.42 0.99 4.78 -0.85 -1.26 -4.64 117.35 116.72 3hq8 s TYR 279 Ca 0.33 1.59 -0.14 0.00 -0.52 0.00 0.00 57.07 58.33 3hq8 s TYR 279 Cb 0.36 -3.19 0.18 0.00 0.38 0.00 0.00 41.96 39.70 3hq8 s TYR 279 CO -0.09 -1.97 1.15 -1.25 -1.52 0.00 0.00 175.55 171.86 3hq8 s PRO 280 N -4.42 0.49 0.12 -3.49 0.04 -1.26 -4.40 135.00 122.08 3hq8 s PRO 280 Ca 0.66 0.15 0.03 0.00 0.04 0.00 0.00 61.00 61.87 3hq8 s PRO 280 Cb -0.21 -1.78 -0.04 0.00 0.04 0.00 0.00 34.50 32.52 3hq8 s PRO 280 CO 0.49 -2.61 0.18 0.71 0.04 0.00 0.00 177.00 175.82 3hq8 s TYR 281 N -3.27 3.35 0.00 0.56 2.02 0.11 -4.77 117.35 115.34 3hq8 s TYR 281 Ca 0.67 0.11 0.00 0.00 -0.37 0.00 0.00 57.07 57.48 3hq8 s TYR 281 Cb -0.13 -1.64 0.00 0.00 -0.40 0.00 0.00 41.96 39.79 3hq8 s TYR 281 CO 0.54 0.54 0.00 1.19 -1.57 0.00 0.00 175.55 176.25 3hq8 n PHE 282 N -0.07 -0.55 0.01 2.71 3.72 -1.26 -2.49 117.46 119.54 3hq8 n PHE 282 Ca -0.07 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.30 3hq8 n PHE 282 Cb 0.53 0.00 0.22 0.00 -0.94 0.00 0.00 39.48 39.29 3hq8 n PHE 282 CO 0.00 0.00 0.00 1.12 -0.05 0.00 0.00 176.76 177.83 3hq8 h HIS 283 N 0.00 0.53 -0.01 1.38 2.07 -1.96 -2.79 115.15 114.37 3hq8 h HIS 283 Ca 0.00 -0.10 0.00 0.00 -2.85 0.00 0.00 60.37 57.42 3hq8 h HIS 283 Cb 0.00 -0.14 0.00 0.00 2.57 0.00 0.00 27.41 29.84 3hq8 h HIS 283 CO 0.00 0.65 -0.51 -1.13 -3.07 0.00 0.00 177.93 173.88 3hq8 n SER 284 N -4.16 1.62 -3.10 3.10 3.41 -1.26 -0.81 113.62 112.42 3hq8 n SER 284 Ca 0.00 -1.31 -0.18 0.00 -0.26 0.00 0.00 58.87 57.12 3hq8 n SER 284 Cb 0.37 0.59 0.07 0.00 -0.26 0.00 0.00 64.21 64.98 3hq8 n SER 284 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hq8 n GLY 285 N 1.32 -0.29 0.26 5.00 0.00 -1.05 -4.34 105.19 106.09 3hq8 n GLY 285 Ca 0.07 0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.28 3hq8 n GLY 285 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3hq8 n VAL 286 N -4.22 0.00 -3.97 1.61 0.24 -1.04 -4.43 118.33 106.52 3hq8 n VAL 286 Ca -0.10 -0.14 -0.30 0.00 -2.04 0.00 0.00 64.34 61.77 3hq8 n VAL 286 Cb 0.59 0.62 -0.16 0.00 -1.47 0.00 0.00 33.84 33.42 3hq8 n VAL 286 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3hq8 s VAL 287 N -2.59 1.44 -0.34 3.34 1.01 -1.23 -4.99 120.40 117.05 3hq8 s VAL 287 Ca 0.20 -0.78 0.23 0.00 0.00 0.00 0.00 61.98 61.63 3hq8 s VAL 287 Cb 0.19 -1.51 0.09 0.00 0.00 0.00 0.00 36.38 35.15 3hq8 s VAL 287 CO 0.58 0.23 1.22 -0.50 0.00 0.00 0.00 175.10 176.63 3hq8 h TRP 288 N 8.04 0.00 -3.52 5.22 4.06 -1.90 0.34 115.95 128.20 3hq8 h TRP 288 Ca -0.29 0.00 -0.61 0.00 2.06 0.00 0.00 58.89 60.05 3hq8 h TRP 288 Cb 1.11 0.00 -0.13 0.00 -1.00 0.00 0.00 29.16 29.14 3hq8 h TRP 288 CO 0.48 0.00 -0.38 0.45 -3.56 0.00 0.00 178.44 175.43 3hq8 s SER 289 N -5.41 6.26 0.12 -3.49 0.15 -1.26 -4.85 113.70 105.22 3hq8 s SER 289 Ca 0.02 0.29 0.11 0.00 0.70 0.00 0.00 55.95 57.08 3hq8 s SER 289 Cb 0.09 -2.16 0.56 0.00 -1.71 0.00 0.00 66.02 62.80 3hq8 s SER 289 CO 0.75 0.01 1.35 -0.11 1.20 0.00 0.00 173.24 176.45 3hq8 n LEU 290 N 4.30 0.24 -0.09 3.45 7.94 -1.26 -0.66 117.00 130.92 3hq8 n LEU 290 Ca -0.12 0.59 -0.15 0.00 -1.11 0.00 0.00 56.01 55.22 3hq8 n LEU 290 Cb 0.52 -0.60 -0.08 0.00 0.53 0.00 0.00 43.42 43.79 3hq8 n LEU 290 CO 0.37 -0.59 -0.47 1.17 -1.11 0.00 0.00 177.39 176.75 3hq8 n LYS 291 N -1.80 0.52 -0.09 1.96 4.81 -1.26 -3.23 118.16 119.06 3hq8 n LYS 291 Ca 0.00 0.55 -0.07 0.00 -0.87 0.00 0.00 58.31 57.92 3hq8 n LYS 291 Cb 0.07 -1.72 -0.01 0.00 0.02 0.00 0.00 35.03 33.39 3hq8 n LYS 291 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 3hq8 h GLU 292 N -1.00 -0.21 -0.34 1.64 4.81 -1.86 -1.70 114.58 115.93 3hq8 h GLU 292 Ca -0.22 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.06 3hq8 h GLU 292 Cb 1.00 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.41 3hq8 h GLU 292 CO -0.13 -0.14 0.23 0.00 -0.73 0.00 0.00 179.01 178.24 3hq8 h ALA 293 N 0.89 1.91 -0.36 2.92 0.00 -1.07 0.12 119.26 123.67 3hq8 h ALA 293 Ca 0.17 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 3hq8 h ALA 293 Cb 0.48 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3hq8 h ALA 293 CO -0.46 0.05 -0.21 0.28 0.00 0.00 0.00 179.25 178.91 3hq8 h VAL 294 N 0.33 1.27 -0.10 0.00 2.07 -1.38 -2.98 116.25 115.46 3hq8 h VAL 294 Ca 0.14 -1.28 -0.15 0.00 0.82 0.00 0.00 66.70 66.23 3hq8 h VAL 294 Cb 0.15 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 3hq8 h VAL 294 CO -0.03 0.42 -0.59 0.00 0.02 0.00 0.00 177.57 177.40 3hq8 h ALA 295 N 1.16 0.82 0.00 1.67 0.00 -0.18 -2.52 119.26 120.21 3hq8 h ALA 295 Ca 0.09 -0.53 -0.04 0.00 0.00 0.00 0.00 54.91 54.43 3hq8 h ALA 295 Cb 0.69 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 3hq8 h ALA 295 CO 0.05 0.71 -0.20 0.28 0.00 0.00 0.00 179.25 180.09 3hq8 h VAL 296 N 0.24 0.81 -0.03 0.00 2.07 -0.75 -3.03 116.25 115.56 3hq8 h VAL 296 Ca -0.00 -0.78 0.00 0.00 0.82 0.00 0.00 66.70 66.73 3hq8 h VAL 296 Cb 1.09 1.47 0.00 0.00 -1.52 0.00 0.00 31.29 32.33 3hq8 h VAL 296 CO 0.10 0.19 -0.04 0.80 0.02 0.00 0.00 177.57 178.64 3hq8 n MET 297 N -3.82 2.03 -3.05 1.57 1.56 -1.05 -4.29 117.12 110.08 3hq8 n MET 297 Ca -0.02 -1.75 -0.44 0.00 -0.27 0.00 0.00 57.70 55.22 3hq8 n MET 297 Cb 0.30 -1.43 -0.00 0.00 2.15 0.00 0.00 33.22 34.24 3hq8 n MET 297 CO 0.00 0.00 0.00 0.20 -0.73 0.00 0.00 175.97 175.44 3hq8 s GLY 298 N -1.92 2.60 0.06 -5.12 0.00 -0.98 -4.99 107.32 96.98 3hq8 s GLY 298 Ca 0.25 -3.46 0.06 0.00 0.00 0.00 0.00 44.72 41.58 3hq8 s GLY 298 CO 0.31 1.85 -0.13 -0.45 0.00 0.00 0.00 173.10 174.68 3hq8 s SER 299 N 2.47 4.21 0.25 1.64 0.15 -1.25 -4.45 113.70 116.72 3hq8 s SER 299 Ca 0.39 -0.36 -0.11 0.00 0.70 0.00 0.00 55.95 56.57 3hq8 s SER 299 Cb -0.05 -0.80 0.36 0.00 -1.71 0.00 0.00 66.02 63.82 3hq8 s SER 299 CO -0.03 0.23 1.58 0.00 1.20 0.00 0.00 173.24 176.22 3hq8 h ALA 300 N 4.15 0.51 -1.00 5.45 0.00 -1.93 -1.42 119.26 125.02 3hq8 h ALA 300 Ca -0.48 0.33 0.27 0.00 0.00 0.00 0.00 54.91 55.03 3hq8 h ALA 300 Cb 1.16 0.71 -0.13 0.00 0.00 0.00 0.00 17.79 19.53 3hq8 h ALA 300 CO 0.50 -0.43 0.57 1.96 0.00 0.00 0.00 179.25 181.85 3hq8 h GLN 301 N -0.01 0.45 -0.11 0.00 1.08 -1.92 0.89 115.11 115.49 3hq8 h GLN 301 Ca 0.41 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.58 3hq8 h GLN 301 Cb 0.63 -0.10 0.00 0.00 -0.05 0.00 0.00 27.48 27.96 3hq8 h GLN 301 CO -0.90 0.30 0.00 1.19 -0.95 0.00 0.00 178.83 178.47 3hq8 n PHE 302 N -4.97 0.13 -2.92 2.96 3.72 -0.63 -4.93 117.46 110.82 3hq8 n PHE 302 Ca 0.29 -0.06 -0.11 0.00 -0.05 0.00 0.00 57.45 57.51 3hq8 n PHE 302 Cb 0.84 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 39.43 3hq8 n PHE 302 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hq8 n GLY 303 N 1.19 -0.17 3.11 1.37 0.00 0.31 -5.01 105.19 105.99 3hq8 n GLY 303 Ca 0.17 -0.02 -0.16 0.00 0.00 0.00 0.00 46.02 46.01 3hq8 n GLY 303 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hq8 s ILE 304 N -3.25 0.84 -0.02 -0.61 1.01 -0.66 -5.01 121.20 113.50 3hq8 s ILE 304 Ca 0.05 -1.07 0.02 0.00 0.00 0.00 0.00 60.65 59.65 3hq8 s ILE 304 Cb -0.01 -0.83 0.01 0.00 0.01 0.00 0.00 42.46 41.64 3hq8 s ILE 304 CO 0.50 -0.21 -0.06 -0.75 0.00 0.00 0.00 174.94 174.42 3hq8 s LYS 305 N -1.43 0.67 -0.01 2.79 2.20 -1.26 -3.75 119.74 118.95 3hq8 s LYS 305 Ca -0.04 -0.18 0.03 0.00 -0.36 0.00 0.00 55.97 55.42 3hq8 s LYS 305 Cb -0.09 -0.67 -0.01 0.00 -1.51 0.00 0.00 37.83 35.55 3hq8 s LYS 305 CO 0.01 0.04 -0.11 -0.51 -0.36 0.00 0.00 175.35 174.43 3hq8 s LEU 306 N 0.33 1.97 0.40 5.43 1.43 -1.26 -5.03 118.68 121.94 3hq8 s LEU 306 Ca -0.04 -0.20 0.00 0.00 -1.03 0.00 0.00 54.13 52.86 3hq8 s LEU 306 Cb -0.08 -0.58 -0.02 0.00 0.03 0.00 0.00 46.19 45.54 3hq8 s LEU 306 CO -0.00 0.12 0.61 -0.94 0.23 0.00 0.00 176.35 176.37 3hq8 s SER 307 N -0.16 6.10 0.14 2.29 1.04 -1.26 -4.85 113.70 117.00 3hq8 s SER 307 Ca 0.03 0.40 -0.30 0.00 0.48 0.00 0.00 55.95 56.55 3hq8 s SER 307 Cb -0.05 -1.83 -0.06 0.00 0.10 0.00 0.00 66.02 64.18 3hq8 s SER 307 CO -0.00 -0.48 1.56 -0.78 0.98 0.00 0.00 173.24 174.52 3hq8 h ASP 308 N 0.58 -1.62 -0.63 7.02 3.58 -2.01 0.40 116.42 123.73 3hq8 h ASP 308 Ca -0.48 0.22 0.12 0.00 0.42 0.00 0.00 57.03 57.32 3hq8 h ASP 308 Cb 1.23 0.68 -0.04 0.00 1.72 0.00 0.00 39.33 42.92 3hq8 h ASP 308 CO 0.59 -0.40 0.43 0.44 -2.88 0.00 0.00 179.24 177.42 3hq8 h ASP 309 N -0.40 0.31 0.07 2.28 5.19 -1.97 0.40 116.42 122.30 3hq8 h ASP 309 Ca 0.10 0.01 -0.00 0.00 -0.62 0.00 0.00 57.03 56.52 3hq8 h ASP 309 Cb 0.61 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.06 3hq8 h ASP 309 CO -0.56 0.18 -0.03 -0.33 -3.12 0.00 0.00 179.24 175.38 3hq8 h GLU 310 N 0.34 -0.09 -0.85 3.56 5.08 -1.18 0.15 114.58 121.60 3hq8 h GLU 310 Ca 0.30 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.65 3hq8 h GLU 310 Cb 0.71 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.94 3hq8 h GLU 310 CO -0.08 0.43 0.48 0.77 -1.00 0.00 0.00 179.01 179.61 3hq8 h SER 311 N -0.66 1.05 -0.46 1.42 0.02 0.28 -0.68 113.55 114.52 3hq8 h SER 311 Ca -0.01 -0.09 -0.04 0.00 -0.84 0.00 0.00 61.79 60.81 3hq8 h SER 311 Cb 0.55 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.80 3hq8 h SER 311 CO 0.01 0.83 0.15 -0.08 -1.14 0.00 0.00 176.83 176.61 3hq8 h GLU 312 N 1.18 0.77 0.00 3.45 4.22 -0.22 -2.60 114.58 121.39 3hq8 h GLU 312 Ca 0.30 -0.14 -0.14 0.00 0.08 0.00 0.00 59.36 59.46 3hq8 h GLU 312 Cb 0.00 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 3hq8 h GLU 312 CO -0.05 0.68 -0.69 0.00 -2.18 0.00 0.00 179.01 176.77 3hq8 h ALA 313 N 1.41 0.72 -0.18 2.92 0.00 -0.17 -2.73 119.26 121.22 3hq8 h ALA 313 Ca 0.17 -0.62 -0.04 0.00 0.00 0.00 0.00 54.91 54.42 3hq8 h ALA 313 Cb 0.24 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3hq8 h ALA 313 CO -0.01 0.86 -0.05 0.82 0.00 0.00 0.00 179.25 180.87 3hq8 h ILE 314 N 0.00 1.29 -0.62 0.00 2.04 -0.89 -2.28 117.51 117.05 3hq8 h ILE 314 Ca -0.01 -1.03 0.12 0.00 1.00 0.00 0.00 64.86 64.95 3hq8 h ILE 314 Cb 1.33 1.59 -0.09 0.00 -0.74 0.00 0.00 36.82 38.92 3hq8 h ILE 314 CO 0.09 0.31 0.10 0.00 0.00 0.00 0.00 178.15 178.65 3hq8 h ALA 315 N 0.72 0.72 -0.74 1.87 0.00 -1.54 0.75 119.26 121.04 3hq8 h ALA 315 Ca 0.05 0.15 0.16 0.00 0.00 0.00 0.00 54.91 55.26 3hq8 h ALA 315 Cb 0.49 0.22 -0.11 0.00 0.00 0.00 0.00 17.79 18.39 3hq8 h ALA 315 CO 0.02 -0.33 0.21 0.00 0.00 0.00 0.00 179.25 179.14 3hq8 h ALA 316 N 1.51 0.99 0.01 0.00 0.00 -1.29 0.95 119.26 121.43 3hq8 h ALA 316 Ca 0.33 0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.40 3hq8 h ALA 316 Cb 0.51 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.50 3hq8 h ALA 316 CO -0.44 -0.32 -0.00 0.35 0.00 0.00 0.00 179.25 178.83 3hq8 h PHE 317 N 0.30 -0.01 0.00 0.00 3.57 -0.53 -2.78 116.94 117.49 3hq8 h PHE 317 Ca 0.42 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.92 3hq8 h PHE 317 Cb 0.71 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.45 3hq8 h PHE 317 CO -0.24 0.35 0.00 -0.07 -2.23 0.00 0.00 178.31 176.12 3hq8 h LEU 318 N -0.37 0.00 -1.70 0.59 3.38 0.14 0.62 115.31 117.97 3hq8 h LEU 318 Ca -0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 3hq8 h LEU 318 Cb 0.37 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 3hq8 h LEU 318 CO 0.00 0.00 -0.17 1.23 0.09 0.00 0.00 178.44 179.59 3hq8 h GLY 319 N 0.00 0.00 -0.86 0.83 0.00 -0.56 -2.78 103.07 99.71 3hq8 h GLY 319 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3hq8 h GLY 319 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.40 3hq8 n SER 320 N -3.72 1.55 -0.48 0.19 3.41 0.22 -3.45 113.62 111.33 3hq8 n SER 320 Ca -0.02 -1.81 0.12 0.00 -0.26 0.00 0.00 58.87 56.90 3hq8 n SER 320 Cb 0.29 -0.14 0.45 0.00 -0.26 0.00 0.00 64.21 64.54 3hq8 n SER 320 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3hq8 n LEU 321 N 0.28 1.47 -4.60 1.04 4.77 -1.05 -1.97 117.00 116.93 3hq8 n LEU 321 Ca 0.14 -0.58 -0.40 0.00 -0.03 0.00 0.00 56.01 55.14 3hq8 n LEU 321 Cb 0.28 -0.07 -0.08 0.00 -2.33 0.00 0.00 43.42 41.23 3hq8 n LEU 321 CO 0.10 0.29 0.19 -0.89 -1.33 0.00 0.00 177.39 175.75 3hq8 s THR 322 N -1.87 5.09 0.57 -5.08 2.01 -1.22 -2.32 115.64 112.82 3hq8 s THR 322 Ca 0.34 0.69 0.07 0.00 0.31 0.00 0.00 61.69 63.10 3hq8 s THR 322 Cb 0.18 -3.81 0.06 0.00 0.01 0.00 0.00 72.50 68.94 3hq8 s THR 322 CO 0.28 0.05 0.56 -0.83 -0.69 0.00 0.00 174.62 174.00 3hq8 s GLY 323 N 1.61 2.13 -0.25 4.40 0.00 -1.26 -4.27 107.32 109.68 3hq8 s GLY 323 Ca 0.19 -1.57 -0.28 0.00 0.00 0.00 0.00 44.72 43.06 3hq8 s GLY 323 CO 0.10 -1.86 2.17 0.54 0.00 0.00 0.00 173.10 174.05 3hq8 s LYS 324 N -4.45 3.09 0.29 2.90 1.02 -0.67 -4.91 119.74 117.02 3hq8 s LYS 324 Ca 0.44 1.90 -0.29 0.00 0.02 0.00 0.00 55.97 58.04 3hq8 s LYS 324 Cb -0.03 -4.36 -0.10 0.00 -0.52 0.00 0.00 37.83 32.81 3hq8 s LYS 324 CO 0.28 -2.15 1.35 -0.65 -0.92 0.00 0.00 175.35 173.27 3hq8 s GLN 325 N 6.37 4.33 0.32 1.68 -1.52 -1.26 -4.29 119.66 125.28 3hq8 s GLN 325 Ca 0.97 2.23 -0.29 0.00 -1.95 0.00 0.00 55.36 56.33 3hq8 s GLN 325 Cb -0.31 -3.09 -0.10 0.00 -0.22 0.00 0.00 33.01 29.29 3hq8 s GLN 325 CO 0.34 -0.28 1.39 -2.14 -0.25 0.00 0.00 175.29 174.36 3hq8 s PRO 326 N -1.16 4.27 -0.40 2.91 0.02 -1.26 -4.99 135.00 134.38 3hq8 s PRO 326 Ca 0.53 2.33 -0.21 0.00 0.02 0.00 0.00 61.00 63.68 3hq8 s PRO 326 Cb -0.40 -3.05 0.01 0.00 0.02 0.00 0.00 34.50 31.08 3hq8 s PRO 326 CO 0.48 -0.34 0.65 0.15 -0.33 0.00 0.00 177.00 177.61 3hq8 s LYS 327 N -1.49 3.48 -0.03 5.54 1.02 -1.26 -5.02 119.74 121.97 3hq8 s LYS 327 Ca 0.53 -0.15 -0.01 0.00 0.02 0.00 0.00 55.97 56.35 3hq8 s LYS 327 Cb -0.42 -3.88 0.03 0.00 -0.52 0.00 0.00 37.83 33.04 3hq8 s LYS 327 CO 0.53 -0.88 0.04 0.08 -0.92 0.00 0.00 175.35 174.20 3hq8 s VAL 328 N 2.79 -0.04 -0.03 3.17 1.01 -1.26 -5.12 120.40 120.92 3hq8 s VAL 328 Ca 0.24 0.31 -0.30 0.00 0.00 0.00 0.00 61.98 62.23 3hq8 s VAL 328 Cb -0.14 -0.16 -0.05 0.00 0.00 0.00 0.00 36.38 36.03 3hq8 s VAL 328 CO 0.17 0.15 1.43 -0.69 0.00 0.00 0.00 175.10 176.16 3hq8 s VAL 329 N 1.68 3.77 0.20 2.92 1.01 -1.26 -4.96 120.40 123.76 3hq8 s VAL 329 Ca -0.01 1.09 -0.32 0.00 0.00 0.00 0.00 61.98 62.73 3hq8 s VAL 329 Cb -0.12 -3.70 -0.13 0.00 0.00 0.00 0.00 36.38 32.43 3hq8 s VAL 329 CO -0.03 -0.03 1.66 0.00 0.00 0.00 0.00 175.10 176.70 3hq8 n TYR 330 N 5.88 2.60 -2.01 5.22 9.36 -1.26 -4.94 117.16 132.02 3hq8 n TYR 330 Ca 0.14 0.14 -0.32 0.00 3.32 0.00 0.00 57.90 61.17 3hq8 n TYR 330 Cb 0.44 -2.62 0.01 0.00 -0.63 0.00 0.00 39.34 36.53 3hq8 n TYR 330 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 3hq8 s PRO 331 N 0.89 3.33 -0.21 2.98 0.04 -1.26 -5.05 135.00 135.73 3hq8 s PRO 331 Ca 0.75 1.13 -0.06 0.00 0.04 0.00 0.00 61.00 62.86 3hq8 s PRO 331 Cb -0.56 -2.04 -0.03 0.00 0.04 0.00 0.00 34.50 31.91 3hq8 s PRO 331 CO 0.36 -0.79 0.02 0.42 0.04 0.00 0.00 177.00 177.05 3hq8 s ILE 332 N -2.58 4.13 -0.10 0.56 1.01 -1.26 -5.05 121.20 117.92 3hq8 s ILE 332 Ca 0.62 -0.25 -0.02 0.00 0.00 0.00 0.00 60.65 61.00 3hq8 s ILE 332 Cb -0.15 -2.88 -0.03 0.00 0.01 0.00 0.00 42.46 39.41 3hq8 s ILE 332 CO 0.39 0.41 -0.02 -0.04 0.00 0.00 0.00 174.94 175.68 3hq8 s MET 333 N 1.07 3.10 0.52 2.79 -1.94 -1.26 -5.05 119.30 118.53 3hq8 s MET 333 Ca 0.03 -0.46 -0.21 0.00 -1.71 0.00 0.00 55.69 53.34 3hq8 s MET 333 Cb -0.14 -2.79 -0.06 0.00 2.01 0.00 0.00 34.83 33.85 3hq8 s MET 333 CO 0.02 0.59 1.21 -1.25 -0.01 0.00 0.00 175.02 175.58 3hq8 s PRO 334 N -0.58 3.39 0.30 2.03 0.04 -1.26 -4.93 135.00 134.00 3hq8 s PRO 334 Ca 0.09 1.85 -0.26 0.00 0.04 0.00 0.00 61.00 62.72 3hq8 s PRO 334 Cb -0.12 -2.20 -0.15 0.00 0.04 0.00 0.00 34.50 32.07 3hq8 s PRO 334 CO 0.02 -0.87 0.71 0.00 0.04 0.00 0.00 177.00 176.90 3hq8 n ALA 335 N -0.98 -1.46 -1.11 8.56 0.00 -1.26 -5.03 120.51 119.24 3hq8 n ALA 335 Ca 0.10 0.34 -0.29 0.00 0.00 0.00 0.00 53.44 53.59 3hq8 n ALA 335 Cb 0.48 -1.81 0.19 0.00 0.00 0.00 0.00 19.45 18.31 3hq8 n ALA 335 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3hq8 s SER 336 N -0.81 2.16 0.25 0.00 0.01 -1.26 -4.84 113.70 109.22 3hq8 s SER 336 Ca 0.61 1.10 -0.05 0.00 1.31 0.00 0.00 55.95 58.92 3hq8 s SER 336 Cb -0.75 -1.72 -0.02 0.00 0.21 0.00 0.00 66.02 63.75 3hq8 s SER 336 CO 0.58 -3.41 0.33 0.42 0.41 0.00 0.00 173.24 171.58 3hq8 s THR 337 N -2.94 0.00 0.13 1.44 -4.23 -1.26 -5.02 115.64 103.76 3hq8 s THR 337 Ca 0.66 -1.70 -0.06 0.00 -1.18 0.00 0.00 61.69 59.41 3hq8 s THR 337 Cb -0.18 -2.41 0.19 0.00 1.34 0.00 0.00 72.50 71.44 3hq8 s THR 337 CO 0.58 0.00 0.80 0.47 -0.54 0.00 0.00 174.62 175.93 3hq8 n ASP 338 N -0.59 -0.25 -0.15 3.99 8.00 -1.26 -0.38 116.55 125.91 3hq8 n ASP 338 Ca 0.01 0.89 -0.09 0.00 0.71 0.00 0.00 54.79 56.30 3hq8 n ASP 338 Cb 0.63 -0.24 0.05 0.00 -0.02 0.00 0.00 41.12 41.54 3hq8 n ASP 338 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hq8 h ALA 339 N 0.89 0.82 -1.96 2.24 0.00 -1.97 -3.45 119.26 115.83 3hq8 h ALA 339 Ca 0.22 -0.35 -0.64 0.00 0.00 0.00 0.00 54.91 54.14 3hq8 h ALA 339 Cb 0.34 -0.18 0.03 0.00 0.00 0.00 0.00 17.79 17.98 3hq8 h ALA 339 CO -0.52 0.65 0.90 2.41 0.00 0.00 0.00 179.25 182.70 3hq8 n THR 340 N -4.14 0.31 -1.09 0.00 -1.04 0.49 -4.90 114.28 103.91 3hq8 n THR 340 Ca 0.01 -0.06 -0.30 0.00 -2.04 0.00 0.00 64.05 61.67 3hq8 n THR 340 Cb 0.41 -1.54 0.15 0.00 -1.82 0.00 0.00 70.33 67.52 3hq8 n THR 340 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 3hq8 s PRO 341 N 2.71 1.17 0.25 -2.82 0.02 -1.26 -4.81 135.00 130.26 3hq8 s PRO 341 Ca 0.89 0.97 -0.05 0.00 0.02 0.00 0.00 61.00 62.83 3hq8 s PRO 341 Cb -0.79 -1.79 -0.06 0.00 0.02 0.00 0.00 34.50 31.89 3hq8 s PRO 341 CO 0.50 -2.34 0.52 1.03 -0.33 0.00 0.00 177.00 176.38 3hq8 s ARG 342 N -4.85 3.66 0.38 5.54 1.81 -1.26 -5.04 118.95 119.19 3hq8 s ARG 342 Ca 0.64 0.02 -0.26 0.00 -1.72 0.00 0.00 55.73 54.41 3hq8 s ARG 342 Cb -0.19 -2.69 -0.11 0.00 -0.45 0.00 0.00 34.95 31.51 3hq8 s ARG 342 CO 0.58 0.28 1.20 -2.30 -0.68 0.00 0.00 175.30 174.38 3hq8 n PRO 343 N -0.62 1.82 -3.95 3.54 -0.02 -1.26 -5.00 135.00 129.51 3hq8 n PRO 343 Ca -0.02 0.64 -0.32 0.00 -2.02 0.00 0.00 63.50 61.79 3hq8 n PRO 343 Cb 0.53 -2.25 -0.14 0.00 -0.02 0.00 0.00 33.50 31.63 3hq8 n PRO 343 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3hq8 s ARG 344 N -2.00 1.66 0.00 -0.52 0.52 0.20 -4.96 118.95 113.84 3hq8 s ARG 344 Ca 0.59 -1.93 0.32 0.00 -0.52 0.00 0.00 55.73 54.20 3hq8 s ARG 344 Cb -0.55 -3.32 1.86 0.00 0.52 0.00 0.00 34.95 33.46 3hq8 s ARG 344 CO 0.59 -0.99 2.20 1.28 0.02 0.00 0.00 175.30 178.41