#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hq6 h ASP 23 N 0.00 0.83 -0.25 0.00 3.32 -2.05 -2.81 116.42 115.46 3hq6 h ASP 23 Ca 0.00 -0.07 -0.03 0.00 0.02 0.00 0.00 57.03 56.95 3hq6 h ASP 23 Cb 0.00 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.33 3hq6 h ASP 23 CO 0.00 0.68 0.04 -0.33 -1.72 0.00 0.00 179.24 177.91 3hq6 h GLU 24 N 0.93 0.42 -0.55 3.56 5.08 -2.05 -2.59 114.58 119.37 3hq6 h GLU 24 Ca 0.23 -0.11 0.08 0.00 -1.00 0.00 0.00 59.36 58.56 3hq6 h GLU 24 Cb 0.05 -0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.19 3hq6 h GLU 24 CO -0.04 0.54 0.20 1.25 -1.00 0.00 0.00 179.01 179.96 3hq6 h LEU 25 N 0.23 0.19 -0.47 1.33 5.85 -1.99 0.21 115.31 120.65 3hq6 h LEU 25 Ca 0.08 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.86 3hq6 h LEU 25 Cb 0.33 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 3hq6 h LEU 25 CO 0.00 0.13 0.26 -0.61 -0.34 0.00 0.00 178.44 177.89 3hq6 h GLN 26 N 0.37 0.66 -0.30 1.25 4.15 -1.43 -1.08 115.11 118.73 3hq6 h GLN 26 Ca 0.27 -0.07 -0.11 0.00 0.77 0.00 0.00 58.65 59.51 3hq6 h GLN 26 Cb 0.32 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.86 3hq6 h GLN 26 CO -0.28 0.51 -0.27 1.96 -1.93 0.00 0.00 178.83 178.83 3hq6 h GLN 27 N 0.63 0.61 0.21 1.69 4.20 -1.09 -1.52 115.11 119.84 3hq6 h GLN 27 Ca 0.17 -0.25 -0.01 0.00 0.06 0.00 0.00 58.65 58.62 3hq6 h GLN 27 Cb 0.04 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 27.79 3hq6 h GLN 27 CO -0.03 0.82 -0.11 -0.09 -0.67 0.00 0.00 178.83 178.74 3hq6 h ARG 28 N 0.53 -0.29 -0.78 1.46 2.43 -0.55 -1.86 114.38 115.32 3hq6 h ARG 28 Ca 0.07 0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.31 3hq6 h ARG 28 Cb 0.73 0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 30.29 3hq6 h ARG 28 CO 0.06 -0.20 0.47 0.00 -1.51 0.00 0.00 179.97 178.79 3hq6 h ALA 29 N 0.48 1.05 0.00 2.80 0.00 -1.09 -1.48 119.26 121.02 3hq6 h ALA 29 Ca -0.02 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3hq6 h ALA 29 Cb 0.25 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 3hq6 h ALA 29 CO 0.03 0.21 -0.02 1.96 0.00 0.00 0.00 179.25 181.43 3hq6 h GLN 30 N 0.88 0.00 -0.09 0.00 4.20 -1.03 -1.43 115.11 117.64 3hq6 h GLN 30 Ca 0.34 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.92 3hq6 h GLN 30 Cb 0.14 0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.92 3hq6 h GLN 30 CO -0.16 0.02 -0.42 0.78 -0.67 0.00 0.00 178.83 178.38 3hq6 h GLY 31 N 0.12 0.49 0.26 3.46 0.00 -0.44 -3.38 103.07 103.58 3hq6 h GLY 31 Ca -0.00 -0.69 0.00 0.00 0.00 0.00 0.00 47.33 46.64 3hq6 h GLY 31 CO 0.00 0.61 -1.32 1.04 0.00 0.00 0.00 176.54 176.88 3hq6 n LEU 32 N -4.32 0.54 -4.28 3.11 4.32 -0.61 -4.96 117.00 110.81 3hq6 n LEU 32 Ca -0.08 -0.13 -0.15 0.00 -0.02 0.00 0.00 56.01 55.63 3hq6 n LEU 32 Cb 0.55 -0.04 -0.10 0.00 -1.62 0.00 0.00 43.42 42.21 3hq6 n LEU 32 CO 0.44 0.08 -0.25 -0.36 -1.22 0.00 0.00 177.39 176.08 3hq6 s PHE 33 N -3.25 1.40 -0.00 -1.77 0.08 -0.79 -0.86 117.98 112.79 3hq6 s PHE 33 Ca 0.01 -1.25 -0.03 0.00 0.12 0.00 0.00 56.93 55.78 3hq6 s PHE 33 Cb 0.15 -0.78 -0.00 0.00 -0.57 0.00 0.00 43.02 41.81 3hq6 s PHE 33 CO 0.85 -0.44 0.06 0.15 -0.10 0.00 0.00 175.22 175.74 3hq6 s LYS 34 N -4.08 0.27 0.64 0.44 -0.14 -1.24 -4.69 119.74 110.95 3hq6 s LYS 34 Ca 0.38 -0.28 -0.14 0.00 -1.36 0.00 0.00 55.97 54.57 3hq6 s LYS 34 Cb 0.08 0.11 -0.02 0.00 -1.68 0.00 0.00 37.83 36.32 3hq6 s LYS 34 CO 0.13 -0.05 1.06 -1.25 -0.76 0.00 0.00 175.35 174.48 3hq6 s PRO 35 N -0.86 3.13 0.15 -1.68 0.04 -1.26 -4.42 135.00 130.11 3hq6 s PRO 35 Ca -0.09 1.14 -0.33 0.00 0.04 0.00 0.00 61.00 61.76 3hq6 s PRO 35 Cb -0.06 -2.01 -0.13 0.00 0.04 0.00 0.00 34.50 32.35 3hq6 s PRO 35 CO 0.00 -0.96 1.69 0.28 0.04 0.00 0.00 177.00 178.05 3hq6 n VAL 36 N -2.44 0.10 -2.04 -0.36 0.31 -1.26 -4.94 118.33 107.69 3hq6 n VAL 36 Ca 0.08 -0.02 -0.34 0.00 -0.01 0.00 0.00 64.34 64.05 3hq6 n VAL 36 Cb 0.53 -1.80 0.02 0.00 -0.91 0.00 0.00 33.84 31.68 3hq6 n VAL 36 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 3hq6 s PRO 37 N 1.49 3.10 0.00 5.55 0.04 -1.26 -4.77 135.00 139.15 3hq6 s PRO 37 Ca 0.79 1.55 0.02 0.00 0.04 0.00 0.00 61.00 63.40 3hq6 s PRO 37 Cb -0.59 -1.98 0.14 0.00 0.04 0.00 0.00 34.50 32.11 3hq6 s PRO 37 CO 0.37 -1.04 0.45 0.00 0.04 0.00 0.00 177.00 176.82 3hq6 n ALA 38 N -1.75 1.66 -3.59 8.56 0.00 -1.26 -4.76 120.51 119.37 3hq6 n ALA 38 Ca 0.11 -0.01 -0.10 0.00 0.00 0.00 0.00 53.44 53.44 3hq6 n ALA 38 Cb 0.51 -1.04 -0.05 0.00 0.00 0.00 0.00 19.45 18.87 3hq6 n ALA 38 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 3hq6 s LYS 39 N -2.00 0.53 -0.13 0.00 -2.85 -1.26 -5.12 119.74 108.91 3hq6 s LYS 39 Ca 0.03 0.15 -0.39 0.00 -1.00 0.00 0.00 55.97 54.77 3hq6 s LYS 39 Cb 0.02 0.25 -0.16 0.00 -2.06 0.00 0.00 37.83 35.88 3hq6 s LYS 39 CO 0.03 -0.16 1.60 0.00 0.10 0.00 0.00 175.35 176.92 3hq6 n ALA 40 N 0.79 -0.42 -1.75 0.59 0.00 -1.26 -4.92 120.51 113.54 3hq6 n ALA 40 Ca -0.09 0.43 -0.37 0.00 0.00 0.00 0.00 53.44 53.41 3hq6 n ALA 40 Cb 0.58 -2.18 0.03 0.00 0.00 0.00 0.00 19.45 17.88 3hq6 n ALA 40 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3hq6 s PRO 41 N 2.42 3.15 0.20 0.00 0.04 -1.26 -5.02 135.00 134.53 3hq6 s PRO 41 Ca 0.93 1.96 -0.30 0.00 0.04 0.00 0.00 61.00 63.63 3hq6 s PRO 41 Cb -1.01 -2.12 -0.09 0.00 0.04 0.00 0.00 34.50 31.33 3hq6 s PRO 41 CO 0.58 -1.10 1.27 0.99 0.04 0.00 0.00 177.00 178.78 3hq6 s THR 42 N -1.48 3.32 -0.27 1.26 2.01 -1.26 -4.99 115.64 114.23 3hq6 s THR 42 Ca 0.73 1.10 -0.09 0.00 0.31 0.00 0.00 61.69 63.75 3hq6 s THR 42 Cb -0.34 -3.71 -0.03 0.00 0.01 0.00 0.00 72.50 68.44 3hq6 s THR 42 CO 0.38 0.18 0.11 -0.76 -0.69 0.00 0.00 174.62 173.84 3hq6 s LEU 43 N -0.26 3.69 0.13 4.42 1.43 -1.26 -5.06 118.68 121.77 3hq6 s LEU 43 Ca 0.55 -0.19 -0.35 0.00 -1.03 0.00 0.00 54.13 53.11 3hq6 s LEU 43 Cb -0.35 -1.99 -0.15 0.00 0.03 0.00 0.00 46.19 43.73 3hq6 s LEU 43 CO 0.38 -0.06 1.46 1.17 0.23 0.00 0.00 176.35 179.53 3hq6 n LYS 44 N 4.97 1.69 -0.96 1.70 4.81 -1.26 -1.58 118.16 127.53 3hq6 n LYS 44 Ca -0.15 0.61 0.00 0.00 -0.87 0.00 0.00 58.31 57.90 3hq6 n LYS 44 Cb 0.51 -2.31 0.00 0.00 0.02 0.00 0.00 35.03 33.25 3hq6 n LYS 44 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3hq6 n GLY 45 N 2.95 0.44 2.59 3.14 0.00 -1.26 -4.91 105.19 108.15 3hq6 n GLY 45 Ca 0.17 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.05 3hq6 n GLY 45 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3hq6 s ASN 46 N -2.18 -0.15 0.21 1.61 2.47 -0.61 -5.13 114.94 111.16 3hq6 s ASN 46 Ca 0.00 -2.34 -0.30 0.00 0.42 0.00 0.00 52.86 50.64 3hq6 s ASN 46 Cb 0.00 0.84 -0.08 0.00 -1.45 0.00 0.00 41.25 40.55 3hq6 s ASN 46 CO 0.00 -0.10 1.18 -2.16 -3.72 0.00 0.00 177.10 172.30 3hq6 s PRO 47 N 0.50 4.51 0.34 0.43 0.04 -1.26 -4.09 135.00 135.48 3hq6 s PRO 47 Ca 0.31 1.88 -0.28 0.00 0.04 0.00 0.00 61.00 62.95 3hq6 s PRO 47 Cb 0.02 -3.22 -0.13 0.00 0.04 0.00 0.00 34.50 31.21 3hq6 s PRO 47 CO -0.12 -0.03 1.22 0.00 0.04 0.00 0.00 177.00 178.11 3hq6 n ALA 48 N 2.17 0.94 -3.01 8.56 0.00 -1.26 -4.99 120.51 122.91 3hq6 n ALA 48 Ca 0.03 0.36 -0.12 0.00 0.00 0.00 0.00 53.44 53.71 3hq6 n ALA 48 Cb 0.45 -2.20 -0.07 0.00 0.00 0.00 0.00 19.45 17.62 3hq6 n ALA 48 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3hq6 s SER 49 N -0.39 -0.12 0.26 0.00 1.04 -1.26 -5.03 113.70 108.21 3hq6 s SER 49 Ca 0.56 -0.18 -0.06 0.00 0.48 0.00 0.00 55.95 56.75 3hq6 s SER 49 Cb -0.59 0.35 0.47 0.00 0.10 0.00 0.00 66.02 66.34 3hq6 s SER 49 CO 0.61 -0.60 1.46 -2.65 0.98 0.00 0.00 173.24 173.04 3hq6 n PRO 50 N 0.63 -0.08 -0.10 4.02 -0.02 -1.26 -0.25 135.00 137.94 3hq6 n PRO 50 Ca -0.19 1.45 -0.13 0.00 -2.02 0.00 0.00 63.50 62.61 3hq6 n PRO 50 Cb 0.59 -2.18 -0.04 0.00 -0.02 0.00 0.00 33.50 31.85 3hq6 n PRO 50 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 3hq6 h VAL 51 N 0.00 1.30 -0.64 -1.45 3.04 -1.97 0.51 116.25 117.04 3hq6 h VAL 51 Ca 0.46 -1.40 -0.06 0.00 -1.01 0.00 0.00 66.70 64.69 3hq6 h VAL 51 Cb 0.74 1.55 -0.03 0.00 -2.01 0.00 0.00 31.29 31.55 3hq6 h VAL 51 CO -0.95 0.45 0.16 0.50 -1.01 0.00 0.00 177.57 176.72 3hq6 h LYS 52 N 0.43 1.03 -0.55 4.17 3.64 -1.73 0.11 116.57 123.67 3hq6 h LYS 52 Ca 0.05 -0.24 -0.01 0.00 -1.27 0.00 0.00 60.65 59.18 3hq6 h LYS 52 Cb 0.80 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 32.46 3hq6 h LYS 52 CO 0.06 0.92 0.29 0.28 -2.27 0.00 0.00 179.45 178.73 3hq6 h VAL 53 N 0.95 1.17 -0.06 2.00 2.07 -0.32 0.18 116.25 122.23 3hq6 h VAL 53 Ca 0.20 -0.44 -0.14 0.00 0.82 0.00 0.00 66.70 67.14 3hq6 h VAL 53 Cb 0.35 0.45 0.01 0.00 -1.52 0.00 0.00 31.29 30.58 3hq6 h VAL 53 CO 0.00 0.19 -0.50 -0.08 0.02 0.00 0.00 177.57 177.20 3hq6 h GLU 54 N 0.76 0.45 0.11 1.57 4.81 -0.32 -1.85 114.58 120.10 3hq6 h GLU 54 Ca 0.19 -0.40 -0.01 0.00 -0.13 0.00 0.00 59.36 59.02 3hq6 h GLU 54 Cb 0.04 0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.51 3hq6 h GLU 54 CO -0.03 1.04 -0.05 1.25 -0.73 0.00 0.00 179.01 180.49 3hq6 h LEU 55 N -0.00 -0.13 -1.15 1.64 5.85 -0.57 -2.10 115.31 118.84 3hq6 h LEU 55 Ca -0.04 -0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.66 3hq6 h LEU 55 Cb 1.17 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 42.19 3hq6 h LEU 55 CO 0.10 -0.04 0.58 1.23 -0.34 0.00 0.00 178.44 179.96 3hq6 h GLY 56 N -0.20 1.23 0.77 3.75 0.00 -0.66 -1.81 103.07 106.15 3hq6 h GLY 56 Ca -0.02 -0.45 0.02 0.00 0.00 0.00 0.00 47.33 46.89 3hq6 h GLY 56 CO 0.02 0.42 -0.01 1.70 0.00 0.00 0.00 176.54 178.67 3hq6 h LYS 57 N 1.14 0.03 -0.94 4.80 3.64 -1.26 -2.26 116.57 121.73 3hq6 h LYS 57 Ca 0.33 -0.00 0.08 0.00 -1.27 0.00 0.00 60.65 59.78 3hq6 h LYS 57 Cb -0.07 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 31.67 3hq6 h LYS 57 CO -0.08 0.02 0.61 0.52 -2.27 0.00 0.00 179.45 178.24 3hq6 h MET 58 N 0.03 1.01 0.00 1.90 2.86 -0.65 -2.81 114.93 117.26 3hq6 h MET 58 Ca 0.06 -0.06 -0.12 0.00 -2.06 0.00 0.00 59.70 57.52 3hq6 h MET 58 Cb 0.09 -0.23 -0.02 0.00 0.06 0.00 0.00 31.60 31.50 3hq6 h MET 58 CO -0.12 0.67 -0.57 -0.07 1.06 0.00 0.00 176.91 177.87 3hq6 h LEU 59 N 1.04 0.00 -0.61 1.22 3.38 -1.22 -1.89 115.31 117.23 3hq6 h LEU 59 Ca 0.42 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.24 3hq6 h LEU 59 Cb 0.26 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 3hq6 h LEU 59 CO -0.17 0.57 -0.63 0.22 0.09 0.00 0.00 178.44 178.52 3hq6 h TYR 60 N 0.00 0.31 -0.01 1.13 3.20 -1.16 -3.01 116.97 117.42 3hq6 h TYR 60 Ca -0.01 -0.12 0.00 0.00 3.14 0.00 0.00 58.73 61.74 3hq6 h TYR 60 Cb 1.38 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 39.60 3hq6 h TYR 60 CO 0.00 0.80 -0.27 1.19 -1.64 0.00 0.00 178.16 178.24 3hq6 n PHE 61 N -3.85 0.00 -2.92 -3.82 3.72 -1.10 -1.40 117.46 108.08 3hq6 n PHE 61 Ca -0.02 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.94 3hq6 n PHE 61 Cb 0.64 -0.07 -0.05 0.00 -0.94 0.00 0.00 39.48 39.06 3hq6 n PHE 61 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3hq6 s ASP 62 N -2.41 6.33 0.00 4.37 -1.08 -0.72 -4.83 116.67 118.33 3hq6 s ASP 62 Ca 0.25 -0.41 0.16 0.00 -0.52 0.00 0.00 52.55 52.03 3hq6 s ASP 62 Cb 0.19 -2.40 0.91 0.00 -1.46 0.00 0.00 42.92 40.16 3hq6 s ASP 62 CO 0.50 -1.10 1.42 -0.81 0.52 0.00 0.00 175.17 175.71 3hq6 n PRO 63 N 7.06 0.38 0.00 4.34 -0.04 -1.26 -2.63 135.00 142.86 3hq6 n PRO 63 Ca 0.00 0.06 0.15 0.00 -0.04 0.00 0.00 63.50 63.67 3hq6 n PRO 63 Cb 0.47 -1.50 0.81 0.00 -0.04 0.00 0.00 33.50 33.24 3hq6 n PRO 63 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3hq6 n ARG 64 N -1.13 0.62 0.04 0.54 1.74 -1.26 -2.32 116.66 114.89 3hq6 n ARG 64 Ca 0.10 0.00 0.01 0.00 -0.77 0.00 0.00 57.85 57.20 3hq6 n ARG 64 Cb 0.09 -1.50 0.35 0.00 -1.02 0.00 0.00 32.46 30.38 3hq6 n ARG 64 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 3hq6 h LEU 65 N 0.00 0.40 -9.82 0.55 3.38 -1.79 -3.44 115.31 104.60 3hq6 h LEU 65 Ca 0.00 -0.06 -0.49 0.00 0.09 0.00 0.00 57.88 57.42 3hq6 h LEU 65 Cb 0.18 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 3hq6 h LEU 65 CO 0.00 0.46 0.29 -0.94 0.09 0.00 0.00 178.44 178.34 3hq6 s SER 66 N -6.78 7.40 0.54 -0.43 1.04 -0.98 -4.64 113.70 109.85 3hq6 s SER 66 Ca -0.07 1.78 0.24 0.00 0.48 0.00 0.00 55.95 58.39 3hq6 s SER 66 Cb 0.16 -2.55 1.52 0.00 0.10 0.00 0.00 66.02 65.24 3hq6 s SER 66 CO 0.75 0.05 2.16 0.00 0.98 0.00 0.00 173.24 177.18 3hq6 h ALA 67 N 3.65 1.59 0.00 5.32 0.00 -1.22 -0.61 119.26 128.00 3hq6 h ALA 67 Ca -0.46 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3hq6 h ALA 67 Cb 1.20 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.98 3hq6 h ALA 67 CO 0.66 0.06 -0.73 -1.13 0.00 0.00 0.00 179.25 178.11 3hq6 n SER 68 N -4.01 0.67 -1.02 0.00 3.41 -1.26 0.20 113.62 111.60 3hq6 n SER 68 Ca -0.03 0.02 -0.10 0.00 -0.26 0.00 0.00 58.87 58.50 3hq6 n SER 68 Cb 0.14 0.33 -0.02 0.00 -0.26 0.00 0.00 64.21 64.40 3hq6 n SER 68 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3hq6 n HIS 69 N -2.05 -0.30 -0.05 7.33 -0.00 -0.24 -4.57 115.22 115.34 3hq6 n HIS 69 Ca 0.03 0.00 -0.06 0.00 -0.00 0.00 0.00 57.72 57.69 3hq6 n HIS 69 Cb 0.44 -2.27 -0.06 0.00 -0.00 0.00 0.00 29.99 28.09 3hq6 n HIS 69 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 3hq6 n LEU 70 N -1.36 1.43 -4.47 2.41 4.77 -1.25 -4.72 117.00 113.82 3hq6 n LEU 70 Ca -0.11 -0.03 -0.33 0.00 -0.03 0.00 0.00 56.01 55.50 3hq6 n LEU 70 Cb 0.50 -0.07 -0.13 0.00 -2.33 0.00 0.00 43.42 41.39 3hq6 n LEU 70 CO 0.15 0.44 -0.39 -0.63 -1.33 0.00 0.00 177.39 175.62 3hq6 s ILE 71 N -2.21 3.57 0.50 -0.08 1.01 -1.26 -4.96 121.20 117.77 3hq6 s ILE 71 Ca -0.09 -0.48 0.05 0.00 0.00 0.00 0.00 60.65 60.13 3hq6 s ILE 71 Cb 0.03 -2.53 0.00 0.00 0.01 0.00 0.00 42.46 39.98 3hq6 s ILE 71 CO 0.30 0.52 0.28 -0.94 0.00 0.00 0.00 174.94 175.10 3hq6 s SER 72 N 0.16 4.52 0.22 3.58 1.04 -1.26 -4.06 113.70 117.90 3hq6 s SER 72 Ca -0.04 -1.25 -0.08 0.00 0.48 0.00 0.00 55.95 55.07 3hq6 s SER 72 Cb -0.14 0.16 0.17 0.00 0.10 0.00 0.00 66.02 66.30 3hq6 s SER 72 CO 0.04 -0.90 1.81 0.00 0.98 0.00 0.00 173.24 175.16 3hq6 h ASN 74 N 1.16 0.32 -0.98 0.00 -1.24 -1.72 -0.27 115.58 112.85 3hq6 h ASN 74 Ca 0.28 -0.01 0.19 0.00 0.71 0.00 0.00 56.30 57.47 3hq6 h ASN 74 Cb 0.13 -0.08 -0.18 0.00 0.73 0.00 0.00 38.32 38.92 3hq6 h ASN 74 CO -0.03 0.23 -0.27 0.74 -1.29 0.00 0.00 177.43 176.80 3hq6 h THR 75 N 0.38 0.01 -0.01 -3.57 2.02 -1.82 -2.67 112.91 107.26 3hq6 h THR 75 Ca 0.12 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.30 3hq6 h THR 75 Cb 0.02 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 66.45 3hq6 h THR 75 CO -0.03 0.00 -0.35 0.00 0.37 0.00 0.00 175.52 175.51 3hq6 n HIS 77 N -0.36 1.68 -2.90 0.00 8.25 -0.15 -2.96 115.22 118.78 3hq6 n HIS 77 Ca 0.05 -3.87 -0.42 0.00 -0.26 0.00 0.00 57.72 53.22 3hq6 n HIS 77 Cb 0.28 -0.41 -0.04 0.00 1.12 0.00 0.00 29.99 30.94 3hq6 n HIS 77 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 3hq6 s ASN 78 N -1.63 6.68 0.64 0.41 3.84 -0.46 -4.35 114.94 120.07 3hq6 s ASN 78 Ca 0.36 0.66 0.42 0.00 0.21 0.00 0.00 52.86 54.51 3hq6 s ASN 78 Cb 0.12 -2.43 2.22 0.00 -0.55 0.00 0.00 41.25 40.62 3hq6 s ASN 78 CO -0.09 -0.68 2.29 -0.37 -2.79 0.00 0.00 177.10 175.46 3hq6 h VAL 79 N 5.66 0.00 -0.02 -5.21 -1.51 -1.87 0.38 116.25 113.67 3hq6 h VAL 79 Ca -0.24 -0.09 0.00 0.00 -1.23 0.00 0.00 66.70 65.15 3hq6 h VAL 79 Cb 1.09 1.07 0.00 0.00 -2.13 0.00 0.00 31.29 31.32 3hq6 h VAL 79 CO 0.91 0.00 -0.16 0.61 -1.23 0.00 0.00 177.57 177.70 3hq6 n GLY 80 N -0.90 0.55 2.34 5.19 0.00 -1.26 -4.42 105.19 106.69 3hq6 n GLY 80 Ca -0.02 -0.65 -0.23 0.00 0.00 0.00 0.00 46.02 45.12 3hq6 n GLY 80 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hq6 n LEU 81 N 0.74 4.43 -1.09 0.99 4.77 -0.39 -4.92 117.00 121.54 3hq6 n LEU 81 Ca 0.13 -4.84 -0.14 0.00 -0.03 0.00 0.00 56.01 51.12 3hq6 n LEU 81 Cb 0.53 -0.31 -0.06 0.00 -2.33 0.00 0.00 43.42 41.25 3hq6 n LEU 81 CO 0.20 2.09 -0.14 0.61 -1.33 0.00 0.00 177.39 178.82 3hq6 n GLY 82 N -0.55 1.46 2.43 -0.72 0.00 -1.25 -3.57 105.19 103.01 3hq6 n GLY 82 Ca 0.37 -0.27 -0.01 0.00 0.00 0.00 0.00 46.02 46.11 3hq6 n GLY 82 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hq6 n GLY 83 N -1.02 0.36 0.00 -0.02 0.00 -0.02 -4.68 105.19 99.81 3hq6 n GLY 83 Ca -0.14 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.82 3hq6 n GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hq6 n GLY 84 N -1.26 6.66 0.05 -0.02 0.00 -1.23 -1.49 105.19 107.90 3hq6 n GLY 84 Ca -0.01 -1.94 0.01 0.00 0.00 0.00 0.00 46.02 44.08 3hq6 n GLY 84 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3hq6 n ASP 85 N 0.00 1.09 0.00 1.61 5.75 -1.16 -1.36 116.55 122.49 3hq6 n ASP 85 Ca 0.00 -1.71 0.00 0.00 -0.01 0.00 0.00 54.79 53.07 3hq6 n ASP 85 Cb 0.00 -0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.03 3hq6 n ASP 85 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 3hq6 n LEU 86 N -0.35 0.91 -4.95 -2.12 4.77 -1.26 -4.98 117.00 109.02 3hq6 n LEU 86 Ca 0.01 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.75 3hq6 n LEU 86 Cb 0.42 -2.19 -0.02 0.00 -2.33 0.00 0.00 43.42 39.30 3hq6 n LEU 86 CO 0.00 -0.85 0.02 -1.10 -1.33 0.00 0.00 177.39 174.13 3hq6 s GLN 87 N -1.70 3.47 0.07 3.23 -1.52 -1.26 -4.74 119.66 117.21 3hq6 s GLN 87 Ca 0.00 -0.52 -0.30 0.00 -1.95 0.00 0.00 55.36 52.58 3hq6 s GLN 87 Cb 0.00 -2.84 -0.18 0.00 -0.22 0.00 0.00 33.01 29.77 3hq6 s GLN 87 CO 0.00 0.37 1.59 0.00 -0.25 0.00 0.00 175.29 177.01 3hq6 h ALA 88 N 1.47 -0.72 -2.83 6.09 0.00 -1.89 -3.41 119.26 117.97 3hq6 h ALA 88 Ca -0.50 -0.17 -0.15 0.00 0.00 0.00 0.00 54.91 54.09 3hq6 h ALA 88 Cb 1.21 0.28 -0.20 0.00 0.00 0.00 0.00 17.79 19.08 3hq6 h ALA 88 CO 0.64 -0.88 -0.62 0.95 0.00 0.00 0.00 179.25 179.34 3hq6 s THR 89 N -5.90 0.11 0.25 0.00 -4.23 -1.26 -3.37 115.64 101.23 3hq6 s THR 89 Ca -0.16 -0.91 -0.04 0.00 -1.18 0.00 0.00 61.69 59.40 3hq6 s THR 89 Cb 0.04 -0.44 -0.02 0.00 1.34 0.00 0.00 72.50 73.41 3hq6 s THR 89 CO 0.61 -0.50 0.30 -0.94 -0.54 0.00 0.00 174.62 173.56 3hq6 s SER 90 N -1.58 0.36 -0.42 3.99 1.04 -0.15 -4.83 113.70 112.11 3hq6 s SER 90 Ca -0.13 -1.31 0.02 0.00 0.48 0.00 0.00 55.95 55.01 3hq6 s SER 90 Cb -0.07 0.50 0.12 0.00 0.10 0.00 0.00 66.02 66.67 3hq6 s SER 90 CO -0.01 -1.03 0.18 -0.89 0.98 0.00 0.00 173.24 172.48 3hq6 s THR 91 N -3.87 1.81 -0.09 2.02 2.01 -1.26 -1.08 115.64 115.18 3hq6 s THR 91 Ca 0.33 -2.53 0.14 0.00 0.31 0.00 0.00 61.69 59.94 3hq6 s THR 91 Cb 0.03 -2.29 -0.20 0.00 0.01 0.00 0.00 72.50 70.05 3hq6 s THR 91 CO 0.14 -0.77 0.17 0.61 -0.69 0.00 0.00 174.62 174.08 3hq6 n GLY 92 N 3.79 -0.70 3.48 4.40 0.00 -1.26 -5.06 105.19 109.84 3hq6 n GLY 92 Ca 0.05 -0.29 -0.32 0.00 0.00 0.00 0.00 46.02 45.46 3hq6 n GLY 92 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3hq6 s HIS 93 N -2.64 2.68 -0.95 1.61 3.76 -1.26 -4.06 115.29 114.43 3hq6 s HIS 93 Ca -0.06 -0.17 0.12 0.00 -0.15 0.00 0.00 55.06 54.79 3hq6 s HIS 93 Cb 0.07 -1.58 0.50 0.00 1.11 0.00 0.00 32.58 32.67 3hq6 s HIS 93 CO 0.60 0.22 1.37 0.41 -0.85 0.00 0.00 174.74 176.49 3hq6 n GLY 94 N 2.04 -0.89 0.00 -2.22 0.00 0.02 -1.97 105.19 102.17 3hq6 n GLY 94 Ca -0.17 -0.02 0.13 0.00 0.00 0.00 0.00 46.02 45.96 3hq6 n GLY 94 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 3hq6 n TRP 95 N -1.56 0.00 -2.67 1.61 2.14 -1.26 -4.85 117.44 110.85 3hq6 n TRP 95 Ca 0.02 0.00 -0.41 0.00 2.07 0.00 0.00 57.50 59.18 3hq6 n TRP 95 Cb 0.13 -0.42 -0.04 0.00 -0.81 0.00 0.00 31.31 30.17 3hq6 n TRP 95 CO 0.00 0.00 0.00 -0.65 2.07 0.00 0.00 177.69 179.11 3hq6 s GLN 96 N -2.83 4.62 0.24 -2.67 -0.21 -0.83 -4.92 119.66 113.05 3hq6 s GLN 96 Ca 0.18 1.51 0.23 0.00 0.02 0.00 0.00 55.36 57.29 3hq6 s GLN 96 Cb 0.18 -3.39 0.08 0.00 1.00 0.00 0.00 33.01 30.88 3hq6 s GLN 96 CO 0.46 0.07 1.16 0.87 -2.12 0.00 0.00 175.29 175.73 3hq6 h LYS 97 N 6.00 0.00 -2.90 2.91 1.79 -1.90 -3.48 116.57 118.99 3hq6 h LYS 97 Ca -0.42 0.00 0.05 0.00 -2.18 0.00 0.00 60.65 58.10 3hq6 h LYS 97 Cb 1.21 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.83 3hq6 h LYS 97 CO 0.74 0.00 0.30 0.20 -1.08 0.00 0.00 179.45 179.60 3hq6 s GLY 98 N -4.28 0.10 0.36 3.86 0.00 -1.26 -5.16 107.32 100.94 3hq6 s GLY 98 Ca 0.01 -0.45 -0.27 0.00 0.00 0.00 0.00 44.72 44.02 3hq6 s GLY 98 CO 0.76 0.00 1.19 -1.05 0.00 0.00 0.00 173.10 174.01 3hq6 n PRO 99 N -0.51 1.81 -4.04 2.90 -0.02 -1.26 -4.94 135.00 128.95 3hq6 n PRO 99 Ca -0.06 0.64 -0.08 0.00 -2.02 0.00 0.00 63.50 61.98 3hq6 n PRO 99 Cb 0.60 -2.21 -0.10 0.00 -0.02 0.00 0.00 33.50 31.77 3hq6 n PRO 99 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3hq6 s ARG 100 N -1.92 0.55 0.06 -0.52 1.81 -0.25 -4.80 118.95 113.87 3hq6 s ARG 100 Ca 0.59 -1.01 -0.30 0.00 -1.72 0.00 0.00 55.73 53.28 3hq6 s ARG 100 Cb -0.57 0.19 -0.08 0.00 -0.45 0.00 0.00 34.95 34.04 3hq6 s ARG 100 CO 0.60 -0.11 1.73 1.21 -0.68 0.00 0.00 175.30 178.05 3hq6 s ASN 101 N -2.49 6.55 -0.14 0.23 3.84 0.35 -0.98 114.94 122.31 3hq6 s ASN 101 Ca 0.00 2.53 -0.29 0.00 0.21 0.00 0.00 52.86 55.32 3hq6 s ASN 101 Cb 0.03 -2.55 -0.06 0.00 -0.55 0.00 0.00 41.25 38.11 3hq6 s ASN 101 CO -0.07 -0.94 2.14 0.00 -2.79 0.00 0.00 177.10 175.43 3hq6 s ALA 102 N 3.11 3.00 0.69 1.71 0.00 -1.26 -4.94 121.76 124.07 3hq6 s ALA 102 Ca 0.77 0.95 -0.15 0.00 0.00 0.00 0.00 51.96 53.53 3hq6 s ALA 102 Cb -0.40 -4.00 0.02 0.00 0.00 0.00 0.00 23.12 18.73 3hq6 s ALA 102 CO 0.34 -2.41 1.14 -1.25 0.00 0.00 0.00 175.76 173.58 3hq6 s PRO 103 N 5.75 2.54 0.46 0.00 0.04 -1.26 -4.58 135.00 137.94 3hq6 s PRO 103 Ca 0.96 1.50 -0.24 0.00 0.04 0.00 0.00 61.00 63.26 3hq6 s PRO 103 Cb -0.36 -1.91 -0.08 0.00 0.04 0.00 0.00 34.50 32.20 3hq6 s PRO 103 CO 0.37 -1.47 1.34 -0.08 0.04 0.00 0.00 177.00 177.19 3hq6 s THR 104 N -2.26 2.39 -0.10 1.26 -1.32 -1.26 -4.64 115.64 109.71 3hq6 s THR 104 Ca 0.69 0.33 0.27 0.00 -1.21 0.00 0.00 61.69 61.77 3hq6 s THR 104 Cb -0.23 -3.18 0.33 0.00 -1.51 0.00 0.00 72.50 67.90 3hq6 s THR 104 CO 0.43 0.03 1.79 1.62 -2.21 0.00 0.00 174.62 176.29 3hq6 h VAL 105 N 2.12 0.15 -2.86 5.08 3.04 -1.54 -3.41 116.25 118.84 3hq6 h VAL 105 Ca -0.50 -0.90 -0.53 0.00 -1.01 0.00 0.00 66.70 63.75 3hq6 h VAL 105 Cb 1.26 1.79 0.02 0.00 -2.01 0.00 0.00 31.29 32.35 3hq6 h VAL 105 CO 0.61 0.07 0.85 -0.76 -1.01 0.00 0.00 177.57 177.33 3hq6 s LEU 106 N -6.31 4.35 -0.38 3.16 1.43 -1.26 -2.11 118.68 117.56 3hq6 s LEU 106 Ca 0.03 2.36 0.00 0.00 -1.03 0.00 0.00 54.13 55.49 3hq6 s LEU 106 Cb 0.08 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.72 3hq6 s LEU 106 CO 0.62 -0.76 0.00 0.59 0.23 0.00 0.00 176.35 177.02 3hq6 n ASN 107 N 4.78 -5.45 -0.26 2.29 5.03 -0.43 -4.86 115.26 116.37 3hq6 n ASN 107 Ca 0.13 0.09 0.10 0.00 0.87 0.00 0.00 54.58 55.77 3hq6 n ASN 107 Cb 0.42 -3.26 0.36 0.00 -1.02 0.00 0.00 39.78 36.27 3hq6 n ASN 107 CO 0.00 0.00 0.00 0.77 -1.83 0.00 0.00 177.26 176.20 3hq6 h SER 108 N 0.00 0.68 -0.45 6.41 4.64 -1.66 -2.49 113.55 120.68 3hq6 h SER 108 Ca -0.07 0.03 0.13 0.00 -0.47 0.00 0.00 61.79 61.41 3hq6 h SER 108 Cb 0.91 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 62.87 3hq6 h SER 108 CO 0.11 0.38 0.71 1.62 -0.87 0.00 0.00 176.83 178.78 3hq6 h VAL 109 N 0.74 0.14 -0.01 0.95 3.04 -1.84 0.21 116.25 119.49 3hq6 h VAL 109 Ca 0.42 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.11 3hq6 h VAL 109 Cb 0.58 0.39 0.00 0.00 -2.01 0.00 0.00 31.29 30.24 3hq6 h VAL 109 CO -0.18 0.00 -0.66 0.49 -1.01 0.00 0.00 177.57 176.21 3hq6 n PHE 110 N -3.25 0.00 -2.36 3.17 3.72 -0.94 -4.95 117.46 112.85 3hq6 n PHE 110 Ca 0.09 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.18 3hq6 n PHE 110 Cb 0.88 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.40 3hq6 n PHE 110 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 3hq6 s ASN 111 N -2.64 6.49 0.00 4.37 0.01 0.06 -4.92 114.94 118.31 3hq6 s ASN 111 Ca 0.15 1.42 0.00 0.00 -0.71 0.00 0.00 52.86 53.72 3hq6 s ASN 111 Cb 0.17 -2.45 0.00 0.00 0.41 0.00 0.00 41.25 39.38 3hq6 s ASN 111 CO 0.67 -0.62 0.00 0.35 -1.51 0.00 0.00 177.10 175.99 3hq6 n THR 112 N -1.85 0.00 -3.01 1.60 -2.24 0.18 -4.95 114.28 104.01 3hq6 n THR 112 Ca 0.05 -0.11 -0.44 0.00 -2.27 0.00 0.00 64.05 61.28 3hq6 n THR 112 Cb 0.54 0.58 -0.04 0.00 -2.10 0.00 0.00 70.33 69.30 3hq6 n THR 112 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hq6 s ALA 113 N -1.44 3.29 -0.14 6.98 0.00 -0.72 -4.92 121.76 124.81 3hq6 s ALA 113 Ca 0.00 -2.02 0.17 0.00 0.00 0.00 0.00 51.96 50.12 3hq6 s ALA 113 Cb 0.00 -3.65 -0.09 0.00 0.00 0.00 0.00 23.12 19.38 3hq6 s ALA 113 CO 0.00 -2.49 0.95 0.37 0.00 0.00 0.00 175.76 174.59 3hq6 h GLN 114 N 9.32 0.00 -6.41 0.00 4.15 -1.92 -3.46 115.11 116.78 3hq6 h GLN 114 Ca -0.29 0.00 -0.63 0.00 0.77 0.00 0.00 58.65 58.50 3hq6 h GLN 114 Cb 1.08 0.00 -0.13 0.00 0.21 0.00 0.00 27.48 28.64 3hq6 h GLN 114 CO 1.12 0.28 -0.69 -0.06 -1.93 0.00 0.00 178.83 177.55 3hq6 s PHE 115 N -2.98 2.78 -0.02 3.99 0.08 -1.26 -5.05 117.98 115.52 3hq6 s PHE 115 Ca -0.02 -0.15 -0.24 0.00 0.12 0.00 0.00 56.93 56.64 3hq6 s PHE 115 Cb 0.09 -1.38 -0.19 0.00 -0.57 0.00 0.00 43.02 40.96 3hq6 s PHE 115 CO 0.80 0.49 1.21 -1.49 -0.10 0.00 0.00 175.22 176.13 3hq6 h TRP 116 N 3.01 0.19 -1.93 0.36 -0.00 -1.96 -3.39 115.95 112.24 3hq6 h TRP 116 Ca -0.47 -0.07 -0.01 0.00 -0.00 0.00 0.00 58.89 58.33 3hq6 h TRP 116 Cb 1.19 -0.04 -0.20 0.00 -0.00 0.00 0.00 29.16 30.12 3hq6 h TRP 116 CO 0.62 0.70 0.30 0.16 -0.00 0.00 0.00 178.44 180.23 3hq6 s ASP 117 N -6.00 -0.56 0.00 -3.49 -4.77 -1.26 -0.72 116.67 99.87 3hq6 s ASP 117 Ca -0.15 0.57 0.00 0.00 -3.30 0.00 0.00 52.55 49.66 3hq6 s ASP 117 Cb 0.02 0.47 0.00 0.00 -1.09 0.00 0.00 42.92 42.32 3hq6 s ASP 117 CO 0.72 -0.55 0.00 0.61 0.70 0.00 0.00 175.17 176.64 3hq6 n GLY 118 N 0.75 -1.62 3.76 2.12 0.00 -0.47 -4.99 105.19 104.75 3hq6 n GLY 118 Ca -0.16 -1.07 -0.41 0.00 0.00 0.00 0.00 46.02 44.38 3hq6 n GLY 118 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hq6 s ARG 119 N -1.46 4.31 0.23 1.61 0.52 -1.26 -0.87 118.95 122.04 3hq6 s ARG 119 Ca 0.00 2.26 -0.07 0.00 -0.52 0.00 0.00 55.73 57.40 3hq6 s ARG 119 Cb 0.00 -3.08 0.21 0.00 0.52 0.00 0.00 34.95 32.60 3hq6 s ARG 119 CO 0.00 -0.28 1.85 0.00 0.02 0.00 0.00 175.30 176.89 3hq6 h ALA 120 N 3.91 1.15 -0.09 2.13 0.00 -1.31 -1.46 119.26 123.59 3hq6 h ALA 120 Ca -0.48 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.29 3hq6 h ALA 120 Cb 1.22 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 3hq6 h ALA 120 CO 0.69 0.67 0.05 0.87 0.00 0.00 0.00 179.25 181.53 3hq6 h LYS 121 N 1.25 0.13 -0.52 0.00 1.57 -1.91 -2.71 116.57 114.38 3hq6 h LYS 121 Ca 0.31 -0.02 0.10 0.00 -1.87 0.00 0.00 60.65 59.18 3hq6 h LYS 121 Cb 0.05 -0.02 -0.11 0.00 0.08 0.00 0.00 32.23 32.23 3hq6 h LYS 121 CO -0.05 0.17 -0.23 -0.44 -0.57 0.00 0.00 179.45 178.33 3hq6 h ASP 122 N 0.05 -0.80 -0.08 0.86 5.19 -1.83 -2.63 116.42 117.18 3hq6 h ASP 122 Ca 0.03 0.19 -0.06 0.00 -0.62 0.00 0.00 57.03 56.57 3hq6 h ASP 122 Cb 0.08 0.44 -0.01 0.00 0.18 0.00 0.00 39.33 40.01 3hq6 h ASP 122 CO -0.01 -0.25 -0.13 -0.07 -3.12 0.00 0.00 179.24 175.67 3hq6 h LEU 123 N -0.11 0.39 -1.52 1.55 3.38 -1.16 -1.99 115.31 115.85 3hq6 h LEU 123 Ca 0.24 -0.09 0.08 0.00 0.09 0.00 0.00 57.88 58.20 3hq6 h LEU 123 Cb 0.48 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.09 3hq6 h LEU 123 CO -0.59 0.55 0.43 0.00 0.09 0.00 0.00 178.44 178.92 3hq6 h ALA 124 N 1.49 1.87 -0.00 1.53 0.00 -1.14 -2.73 119.26 120.27 3hq6 h ALA 124 Ca 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3hq6 h ALA 124 Cb 0.46 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.11 3hq6 h ALA 124 CO 0.03 0.01 -0.76 0.39 0.00 0.00 0.00 179.25 178.92 3hq6 n GLU 125 N -4.48 0.15 -2.15 0.00 1.02 -0.88 -4.97 120.64 109.33 3hq6 n GLU 125 Ca 0.10 -0.12 -0.42 0.00 -0.02 0.00 0.00 57.16 56.70 3hq6 n GLU 125 Cb 0.30 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.19 3hq6 n GLU 125 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 3hq6 s GLN 126 N -2.93 4.32 0.23 3.49 -0.21 -0.80 -4.97 119.66 118.79 3hq6 s GLN 126 Ca 0.11 2.10 -0.30 0.00 0.02 0.00 0.00 55.36 57.29 3hq6 s GLN 126 Cb 0.17 -3.23 -0.09 0.00 1.00 0.00 0.00 33.01 30.86 3hq6 s GLN 126 CO 0.77 -0.42 1.38 0.00 -2.12 0.00 0.00 175.29 174.90 3hq6 s ALA 127 N 0.91 3.58 0.28 6.09 0.00 -1.26 -5.02 121.76 126.34 3hq6 s ALA 127 Ca 0.64 1.23 0.01 0.00 0.00 0.00 0.00 51.96 53.84 3hq6 s ALA 127 Cb -0.38 -3.52 0.03 0.00 0.00 0.00 0.00 23.12 19.25 3hq6 s ALA 127 CO 0.32 -0.65 0.20 0.36 0.00 0.00 0.00 175.76 176.00 3hq6 n LYS 128 N 2.45 0.71 0.00 0.00 2.85 -1.26 -4.99 118.16 117.93 3hq6 n LYS 128 Ca 0.06 -0.68 0.00 0.00 -1.05 0.00 0.00 58.31 56.64 3hq6 n LYS 128 Cb 0.41 -0.10 0.00 0.00 -0.65 0.00 0.00 35.03 34.70 3hq6 n LYS 128 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3hq6 n GLY 129 N 3.31 0.52 0.20 2.58 0.00 -1.26 -4.87 105.19 105.67 3hq6 n GLY 129 Ca 0.04 -0.67 -0.02 0.00 0.00 0.00 0.00 46.02 45.37 3hq6 n GLY 129 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3hq6 h PRO 130 N 0.00 0.11 0.04 1.61 0.11 -1.96 -1.43 132.00 130.47 3hq6 h PRO 130 Ca 0.00 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.10 3hq6 h PRO 130 Cb 0.00 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.09 3hq6 h PRO 130 CO 0.00 0.07 -0.02 0.28 -0.21 0.00 0.00 178.00 178.12 3hq6 h VAL 131 N 0.11 1.02 -0.68 3.15 2.07 -1.95 -2.55 116.25 117.42 3hq6 h VAL 131 Ca 0.26 -0.18 0.03 0.00 0.82 0.00 0.00 66.70 67.63 3hq6 h VAL 131 Cb 0.40 1.14 -0.04 0.00 -1.52 0.00 0.00 31.29 31.26 3hq6 h VAL 131 CO -0.44 0.05 0.42 1.56 0.02 0.00 0.00 177.57 179.18 3hq6 h GLN 132 N -0.13 0.80 0.00 1.57 7.50 -1.88 -2.50 115.11 120.47 3hq6 h GLN 132 Ca -0.01 -0.05 -0.09 0.00 0.50 0.00 0.00 58.65 59.00 3hq6 h GLN 132 Cb 0.11 -0.18 -0.01 0.00 0.05 0.00 0.00 27.48 27.45 3hq6 h GLN 132 CO 0.01 0.53 -0.44 0.00 -1.50 0.00 0.00 178.83 177.43 3hq6 h ALA 133 N 1.30 0.98 0.15 3.87 0.00 -1.12 -1.31 119.26 123.13 3hq6 h ALA 133 Ca 0.28 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3hq6 h ALA 133 Cb 0.03 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3hq6 h ALA 133 CO -0.11 0.55 -0.07 1.03 0.00 0.00 0.00 179.25 180.64 3hq6 h SER 134 N 0.00 -0.17 0.13 0.00 0.87 -1.37 0.13 113.55 113.14 3hq6 h SER 134 Ca -0.00 -0.35 -0.03 0.00 -1.23 0.00 0.00 61.79 60.18 3hq6 h SER 134 Cb 0.96 0.04 -0.00 0.00 -0.44 0.00 0.00 62.40 62.96 3hq6 h SER 134 CO 0.06 0.41 -0.13 0.58 -0.53 0.00 0.00 176.83 177.21 3hq6 h VAL 135 N -0.91 1.09 0.00 2.23 2.07 -1.36 -0.71 116.25 118.67 3hq6 h VAL 135 Ca -0.02 -0.44 -0.11 0.00 0.82 0.00 0.00 66.70 66.95 3hq6 h VAL 135 Cb 0.51 1.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 3hq6 h VAL 135 CO 0.03 0.13 -0.51 -0.33 0.02 0.00 0.00 177.57 176.91 3hq6 h GLU 136 N 0.00 0.00 0.01 1.57 5.08 -1.34 -1.17 114.58 118.73 3hq6 h GLU 136 Ca -0.00 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.29 3hq6 h GLU 136 Cb 0.23 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.49 3hq6 h GLU 136 CO 0.02 0.51 -0.30 1.98 -1.00 0.00 0.00 179.01 180.22 3hq6 h MET 137 N 0.00 0.18 -0.17 2.33 4.05 -1.28 -3.37 114.93 116.67 3hq6 h MET 137 Ca -0.01 -0.21 0.00 0.00 -0.28 0.00 0.00 59.70 59.21 3hq6 h MET 137 Cb 0.96 0.06 0.00 0.00 -0.80 0.00 0.00 31.60 31.83 3hq6 h MET 137 CO 0.07 0.97 0.00 0.09 0.23 0.00 0.00 176.91 178.27 3hq6 n ASN 138 N -4.46 1.53 -1.23 1.39 3.02 -0.33 -4.98 115.26 110.19 3hq6 n ASN 138 Ca -0.10 -1.72 0.00 0.00 -0.03 0.00 0.00 54.58 52.73 3hq6 n ASN 138 Cb 0.54 -0.11 0.00 0.00 -0.61 0.00 0.00 39.78 39.60 3hq6 n ASN 138 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3hq6 n ASN 139 N 0.24 -0.12 -4.45 6.41 2.85 -0.44 -0.74 115.26 119.02 3hq6 n ASN 139 Ca 0.15 -1.04 -0.25 0.00 -0.11 0.00 0.00 54.58 53.33 3hq6 n ASN 139 Cb 0.30 0.18 -0.11 0.00 1.24 0.00 0.00 39.78 41.40 3hq6 n ASN 139 CO 0.00 0.00 0.00 0.42 -2.11 0.00 0.00 177.26 175.57 3hq6 s THR 140 N -2.25 2.41 0.53 -0.44 -4.23 -1.26 -4.19 115.64 106.21 3hq6 s THR 140 Ca 0.02 -2.24 0.18 0.00 -1.18 0.00 0.00 61.69 58.47 3hq6 s THR 140 Cb -0.00 -2.22 0.29 0.00 1.34 0.00 0.00 72.50 71.91 3hq6 s THR 140 CO 0.00 -0.28 2.14 -0.65 -0.54 0.00 0.00 174.62 175.29 3hq6 h PRO 141 N 2.68 0.00 -0.45 3.99 0.11 -1.92 -2.14 132.00 134.27 3hq6 h PRO 141 Ca -0.43 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.64 3hq6 h PRO 141 Cb 1.24 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 3hq6 h PRO 141 CO 0.55 0.00 0.10 -0.44 -0.21 0.00 0.00 178.00 178.00 3hq6 h ASP 142 N 0.00 0.69 -0.20 -2.05 5.19 -1.99 -1.65 116.42 116.41 3hq6 h ASP 142 Ca 0.03 -0.24 -0.21 0.00 -0.62 0.00 0.00 57.03 55.99 3hq6 h ASP 142 Cb 0.11 -0.18 0.01 0.00 0.18 0.00 0.00 39.33 39.44 3hq6 h ASP 142 CO -0.00 0.75 -0.69 1.56 -3.12 0.00 0.00 179.24 177.73 3hq6 h GLN 143 N 0.59 0.83 -0.13 3.56 1.08 -1.88 -2.12 115.11 117.03 3hq6 h GLN 143 Ca 0.14 -0.61 -0.01 0.00 -1.45 0.00 0.00 58.65 56.72 3hq6 h GLN 143 Cb 0.33 0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.87 3hq6 h GLN 143 CO 0.00 1.23 0.04 0.28 -0.95 0.00 0.00 178.83 179.44 3hq6 h VAL 144 N 0.59 1.18 -0.94 -0.54 2.07 -1.30 -2.21 116.25 115.09 3hq6 h VAL 144 Ca -0.03 -0.54 0.09 0.00 0.82 0.00 0.00 66.70 67.04 3hq6 h VAL 144 Cb 1.31 1.29 -0.07 0.00 -1.52 0.00 0.00 31.29 32.30 3hq6 h VAL 144 CO 0.15 0.16 0.59 0.58 0.02 0.00 0.00 177.57 179.07 3hq6 h VAL 145 N 0.03 0.99 -0.57 2.57 2.07 -1.34 -0.93 116.25 119.07 3hq6 h VAL 145 Ca 0.04 -0.35 -0.03 0.00 0.82 0.00 0.00 66.70 67.18 3hq6 h VAL 145 Cb 0.22 -0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 29.85 3hq6 h VAL 145 CO -0.00 0.18 0.22 0.50 0.02 0.00 0.00 177.57 178.49 3hq6 h LYS 146 N 1.01 0.83 0.04 1.57 3.64 -1.23 0.54 116.57 122.97 3hq6 h LYS 146 Ca 0.44 -0.13 -0.00 0.00 -1.27 0.00 0.00 60.65 59.68 3hq6 h LYS 146 Cb 0.31 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 3hq6 h LYS 146 CO -0.22 0.69 -0.02 1.15 -2.27 0.00 0.00 179.45 178.79 3hq6 h THR 147 N 0.82 1.24 -0.88 1.00 2.02 -0.70 -2.49 112.91 113.92 3hq6 h THR 147 Ca 0.19 -0.90 -0.02 0.00 0.77 0.00 0.00 66.41 66.45 3hq6 h THR 147 Cb 0.18 1.83 -0.04 0.00 -1.74 0.00 0.00 68.15 68.38 3hq6 h THR 147 CO -0.02 0.23 0.48 -0.07 0.37 0.00 0.00 175.52 176.51 3hq6 h LEU 148 N -0.45 1.09 -0.73 2.58 3.38 -1.10 -1.98 115.31 118.10 3hq6 h LEU 148 Ca -0.01 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.87 3hq6 h LEU 148 Cb 0.41 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.89 3hq6 h LEU 148 CO 0.01 0.87 0.00 0.59 0.09 0.00 0.00 178.44 180.00 3hq6 n ASN 149 N -4.33 0.52 -0.67 -0.43 3.02 0.17 -2.54 115.26 111.00 3hq6 n ASN 149 Ca 0.09 0.66 0.13 0.00 -0.03 0.00 0.00 54.58 55.43 3hq6 n ASN 149 Cb 0.10 -0.76 0.35 0.00 -0.61 0.00 0.00 39.78 38.86 3hq6 n ASN 149 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3hq6 n SER 150 N -2.11 2.10 -4.05 6.41 3.41 -0.74 -4.65 113.62 113.98 3hq6 n SER 150 Ca 0.01 -1.70 -0.32 0.00 -0.26 0.00 0.00 58.87 56.61 3hq6 n SER 150 Cb 0.17 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 63.97 3hq6 n SER 150 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3hq6 s ILE 151 N -2.00 2.34 0.32 -1.33 1.01 -1.05 -4.45 121.20 116.03 3hq6 s ILE 151 Ca 0.34 -2.06 0.09 0.00 0.00 0.00 0.00 60.65 59.01 3hq6 s ILE 151 Cb 0.21 -2.60 0.38 0.00 0.01 0.00 0.00 42.46 40.45 3hq6 s ILE 151 CO 0.32 -0.40 1.49 -2.65 0.00 0.00 0.00 174.94 173.70 3hq6 n PRO 152 N 4.35 -0.07 0.06 2.79 -0.02 -1.26 -0.86 135.00 139.98 3hq6 n PRO 152 Ca -0.03 1.38 0.01 0.00 -2.02 0.00 0.00 63.50 62.84 3hq6 n PRO 152 Cb 0.42 -2.30 0.34 0.00 -0.02 0.00 0.00 33.50 31.94 3hq6 n PRO 152 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3hq6 h ASP 153 N 0.00 0.36 0.06 2.55 5.19 -1.94 0.33 116.42 122.98 3hq6 h ASP 153 Ca 0.66 -0.07 -0.12 0.00 -0.62 0.00 0.00 57.03 56.88 3hq6 h ASP 153 Cb 1.54 -0.10 0.01 0.00 0.18 0.00 0.00 39.33 40.97 3hq6 h ASP 153 CO -0.83 0.48 -0.51 1.88 -3.12 0.00 0.00 179.24 177.14 3hq6 h TYR 154 N 0.37 0.39 -0.56 4.55 0.05 -1.26 -2.65 116.97 117.86 3hq6 h TYR 154 Ca 0.08 -0.26 0.11 0.00 0.05 0.00 0.00 58.73 58.71 3hq6 h TYR 154 Cb 0.37 -0.03 -0.11 0.00 1.01 0.00 0.00 36.73 37.97 3hq6 h TYR 154 CO 0.01 1.15 -0.19 0.28 -1.05 0.00 0.00 178.16 178.35 3hq6 h VAL 155 N -0.48 0.35 -0.98 -2.88 2.07 -1.21 -0.92 116.25 112.19 3hq6 h VAL 155 Ca -0.08 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.53 3hq6 h VAL 155 Cb 1.34 0.35 -0.07 0.00 -1.52 0.00 0.00 31.29 31.39 3hq6 h VAL 155 CO 0.10 0.00 0.63 0.00 0.02 0.00 0.00 177.57 178.32 3hq6 h ALA 156 N 1.40 1.50 -0.17 1.67 0.00 -0.93 -1.33 119.26 121.40 3hq6 h ALA 156 Ca 0.26 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.10 3hq6 h ALA 156 Cb 0.46 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 3hq6 h ALA 156 CO -0.60 0.30 -0.16 -0.07 0.00 0.00 0.00 179.25 178.71 3hq6 h LEU 157 N 1.04 0.43 -1.04 0.00 3.38 -0.85 -2.52 115.31 115.75 3hq6 h LEU 157 Ca 0.46 -0.48 0.10 0.00 0.09 0.00 0.00 57.88 58.05 3hq6 h LEU 157 Cb 0.36 -0.12 -0.08 0.00 0.09 0.00 0.00 40.66 40.91 3hq6 h LEU 157 CO -0.21 0.82 0.63 -0.26 0.09 0.00 0.00 178.44 179.51 3hq6 h PHE 158 N 0.05 1.14 -0.32 1.13 0.04 -0.90 -0.22 116.94 117.86 3hq6 h PHE 158 Ca 0.03 0.03 -0.11 0.00 2.80 0.00 0.00 57.97 60.72 3hq6 h PHE 158 Cb 0.70 -0.37 -0.01 0.00 2.20 0.00 0.00 35.95 38.46 3hq6 h PHE 158 CO 0.08 0.52 -0.25 0.87 -0.60 0.00 0.00 178.31 178.93 3hq6 h LYS 159 N 1.05 0.63 -0.34 1.51 1.57 -1.16 -0.02 116.57 119.81 3hq6 h LYS 159 Ca 0.46 -0.25 -0.15 0.00 -1.87 0.00 0.00 60.65 58.85 3hq6 h LYS 159 Cb 0.36 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.63 3hq6 h LYS 159 CO -0.22 0.82 -0.36 0.87 -0.57 0.00 0.00 179.45 179.99 3hq6 h LYS 160 N 0.55 0.84 -0.00 3.15 1.57 -1.23 -3.05 116.57 118.40 3hq6 h LYS 160 Ca 0.08 -0.45 -0.13 0.00 -1.87 0.00 0.00 60.65 58.27 3hq6 h LYS 160 Cb 0.71 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.03 3hq6 h LYS 160 CO 0.05 1.09 -0.64 0.00 -0.57 0.00 0.00 179.45 179.39 3hq6 h ALA 161 N 0.74 0.94 -2.08 3.86 0.00 -1.00 -3.38 119.26 118.34 3hq6 h ALA 161 Ca 0.05 -0.58 -0.56 0.00 0.00 0.00 0.00 54.91 53.83 3hq6 h ALA 161 Cb 0.95 -0.10 -0.40 0.00 0.00 0.00 0.00 17.79 18.24 3hq6 h ALA 161 CO 0.09 0.79 -0.96 1.19 0.00 0.00 0.00 179.25 180.37 3hq6 n PHE 162 N -3.79 1.18 0.50 0.00 3.72 -0.03 -4.88 117.46 114.16 3hq6 n PHE 162 Ca -0.01 -3.80 0.10 0.00 -0.05 0.00 0.00 57.45 53.69 3hq6 n PHE 162 Cb 0.63 -0.43 0.42 0.00 -0.94 0.00 0.00 39.48 39.16 3hq6 n PHE 162 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 3hq6 n PRO 163 N 0.85 0.11 0.00 -1.08 -0.04 -1.15 -3.20 135.00 130.49 3hq6 n PRO 163 Ca 0.25 0.31 0.14 0.00 -0.04 0.00 0.00 63.50 64.16 3hq6 n PRO 163 Cb 0.51 -1.69 0.61 0.00 -0.04 0.00 0.00 33.50 32.90 3hq6 n PRO 163 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3hq6 n GLY 164 N 0.19 -0.48 3.25 0.55 0.00 -1.26 -4.79 105.19 102.66 3hq6 n GLY 164 Ca 0.03 -0.35 -0.30 0.00 0.00 0.00 0.00 46.02 45.40 3hq6 n GLY 164 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hq6 s GLU 165 N -2.16 2.14 0.03 1.61 2.02 -1.19 -5.06 118.70 116.09 3hq6 s GLU 165 Ca 0.37 -0.83 -0.25 0.00 0.02 0.00 0.00 54.97 54.27 3hq6 s GLU 165 Cb 0.21 -1.93 -0.18 0.00 0.10 0.00 0.00 34.13 32.33 3hq6 s GLU 165 CO 0.39 0.42 1.48 -0.22 0.02 0.00 0.00 175.26 177.35 3hq6 h LYS 166 N 5.85 -0.02 -3.93 1.61 3.64 -1.89 -3.35 116.57 118.49 3hq6 h LYS 166 Ca -0.36 0.00 -0.72 0.00 -1.27 0.00 0.00 60.65 58.30 3hq6 h LYS 166 Cb 1.15 0.01 -0.32 0.00 -0.41 0.00 0.00 32.23 32.66 3hq6 h LYS 166 CO 0.47 0.24 -0.30 0.34 -2.27 0.00 0.00 179.45 177.93 3hq6 s ASP 167 N -5.43 5.67 0.00 4.20 2.15 -1.26 -4.96 116.67 117.04 3hq6 s ASP 167 Ca -0.15 -2.47 0.28 0.00 0.43 0.00 0.00 52.55 50.65 3hq6 s ASP 167 Cb 0.04 -1.97 1.15 0.00 -0.30 0.00 0.00 42.92 41.84 3hq6 s ASP 167 CO 0.66 -0.52 1.82 -0.81 -0.17 0.00 0.00 175.17 176.15 3hq6 n PRO 168 N 4.10 0.54 -2.62 4.34 -0.04 -1.26 -4.61 135.00 135.46 3hq6 n PRO 168 Ca 0.03 -0.19 -0.43 0.00 -0.04 0.00 0.00 63.50 62.88 3hq6 n PRO 168 Cb 0.41 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.36 3hq6 n PRO 168 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3hq6 s VAL 169 N -2.59 4.17 0.13 0.52 1.01 -1.26 -4.75 120.40 117.63 3hq6 s VAL 169 Ca 0.25 -1.74 0.06 0.00 0.00 0.00 0.00 61.98 60.55 3hq6 s VAL 169 Cb 0.20 -5.14 -0.04 0.00 0.00 0.00 0.00 36.38 31.40 3hq6 s VAL 169 CO 0.50 -1.97 -0.14 0.42 0.00 0.00 0.00 175.10 173.92 3hq6 s THR 170 N 4.12 1.38 0.27 3.92 -4.23 -1.26 -5.00 115.64 114.83 3hq6 s THR 170 Ca 0.51 -1.76 -0.01 0.00 -1.18 0.00 0.00 61.69 59.25 3hq6 s THR 170 Cb 0.02 -1.59 0.26 0.00 1.34 0.00 0.00 72.50 72.54 3hq6 s THR 170 CO 0.03 -0.42 1.84 0.15 -0.54 0.00 0.00 174.62 175.68 3hq6 h PHE 171 N 3.44 1.07 -0.39 3.99 3.57 -1.92 -1.23 116.94 125.48 3hq6 h PHE 171 Ca -0.40 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.00 3hq6 h PHE 171 Cb 1.20 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 39.59 3hq6 h PHE 171 CO 0.66 0.45 -0.29 0.22 -2.23 0.00 0.00 178.31 177.11 3hq6 h ASP 172 N 0.97 0.88 0.15 0.41 3.58 -1.96 -2.88 116.42 117.57 3hq6 h ASP 172 Ca 0.46 -0.35 -0.20 0.00 0.42 0.00 0.00 57.03 57.36 3hq6 h ASP 172 Cb 0.40 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 41.21 3hq6 h ASP 172 CO -0.25 1.10 -0.76 0.78 -2.88 0.00 0.00 179.24 177.24 3hq6 h ASN 173 N 0.71 0.61 -0.91 2.28 2.35 -1.77 -2.16 115.58 116.70 3hq6 h ASN 173 Ca 0.08 -0.41 0.15 0.00 -0.55 0.00 0.00 56.30 55.58 3hq6 h ASN 173 Cb 0.84 -0.18 -0.10 0.00 0.05 0.00 0.00 38.32 38.94 3hq6 h ASN 173 CO 0.07 1.17 0.51 -0.03 -1.65 0.00 0.00 177.43 177.50 3hq6 h MET 174 N 0.35 0.69 -0.24 0.81 1.85 -1.25 -0.71 114.93 116.42 3hq6 h MET 174 Ca -0.04 -0.04 -0.09 0.00 -0.61 0.00 0.00 59.70 58.91 3hq6 h MET 174 Cb 1.35 -0.16 -0.00 0.00 0.43 0.00 0.00 31.60 33.22 3hq6 h MET 174 CO 0.14 0.46 -0.22 0.00 -0.40 0.00 0.00 176.91 176.89 3hq6 h ALA 175 N 1.57 0.36 0.12 0.39 0.00 -1.30 -2.19 119.26 118.21 3hq6 h ALA 175 Ca 0.49 -0.36 0.01 0.00 0.00 0.00 0.00 54.91 55.05 3hq6 h ALA 175 Cb 0.68 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 3hq6 h ALA 175 CO -0.35 0.31 -0.19 0.87 0.00 0.00 0.00 179.25 179.89 3hq6 h LYS 176 N 0.29 -0.36 -0.36 0.00 1.57 -1.13 0.48 116.57 117.06 3hq6 h LYS 176 Ca 0.04 0.02 0.08 0.00 -1.87 0.00 0.00 60.65 58.92 3hq6 h LYS 176 Cb 0.76 0.08 -0.08 0.00 0.08 0.00 0.00 32.23 33.07 3hq6 h LYS 176 CO 0.06 -0.24 -0.23 0.00 -0.57 0.00 0.00 179.45 178.46 3hq6 h ALA 177 N 0.44 -0.01 -0.55 3.86 0.00 -1.11 -0.66 119.26 121.22 3hq6 h ALA 177 Ca 0.02 0.12 0.08 0.00 0.00 0.00 0.00 54.91 55.13 3hq6 h ALA 177 Cb 0.38 0.52 -0.07 0.00 0.00 0.00 0.00 17.79 18.63 3hq6 h ALA 177 CO -0.09 -0.62 0.19 0.82 0.00 0.00 0.00 179.25 179.55 3hq6 h ILE 178 N -0.18 0.79 -0.52 0.00 2.04 -1.21 -2.22 117.51 116.20 3hq6 h ILE 178 Ca 0.18 -0.12 -0.06 0.00 1.00 0.00 0.00 64.86 65.85 3hq6 h ILE 178 Cb 0.46 0.39 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 3hq6 h ILE 178 CO -0.46 0.07 0.07 -0.33 0.00 0.00 0.00 178.15 177.49 3hq6 h GLU 179 N 0.36 0.84 -0.03 2.37 5.08 -0.19 0.26 114.58 123.27 3hq6 h GLU 179 Ca 0.27 -0.20 -0.09 0.00 -1.00 0.00 0.00 59.36 58.34 3hq6 h GLU 179 Cb 0.32 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 3hq6 h GLU 179 CO -0.28 0.79 -0.40 0.28 -1.00 0.00 0.00 179.01 178.40 3hq6 h VAL 180 N 0.79 1.30 0.25 3.13 2.07 -1.01 -1.09 116.25 121.68 3hq6 h VAL 180 Ca 0.16 -1.41 -0.01 0.00 0.82 0.00 0.00 66.70 66.26 3hq6 h VAL 180 Cb 0.38 1.72 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 3hq6 h VAL 180 CO 0.01 0.41 -0.12 0.15 0.02 0.00 0.00 177.57 178.04 3hq6 h PHE 181 N 0.05 -0.31 -1.12 1.57 3.57 -0.76 -3.09 116.94 116.86 3hq6 h PHE 181 Ca 0.00 -0.01 0.31 0.00 3.53 0.00 0.00 57.97 61.81 3hq6 h PHE 181 Cb 0.73 0.10 -0.08 0.00 2.79 0.00 0.00 35.95 39.49 3hq6 h PHE 181 CO 0.00 -0.03 0.75 0.93 -2.23 0.00 0.00 178.31 177.73 3hq6 h GLU 182 N -0.56 0.23 0.00 1.11 5.08 -0.77 -2.02 114.58 117.64 3hq6 h GLU 182 Ca -0.03 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 3hq6 h GLU 182 Cb 0.41 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.61 3hq6 h GLU 182 CO 0.06 0.15 -0.14 0.00 -1.00 0.00 0.00 179.01 178.08 3hq6 h ALA 183 N 1.55 1.44 0.00 3.43 0.00 -1.11 -0.53 119.26 124.03 3hq6 h ALA 183 Ca 0.61 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.37 3hq6 h ALA 183 Cb 1.86 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.63 3hq6 h ALA 183 CO -0.22 0.18 -0.09 1.79 0.00 0.00 0.00 179.25 180.90 3hq6 h THR 184 N 0.00 0.18 -0.82 0.00 1.35 -1.37 -3.40 112.91 108.84 3hq6 h THR 184 Ca -0.00 -1.09 -0.71 0.00 -0.55 0.00 0.00 66.41 64.06 3hq6 h THR 184 Cb 0.32 1.94 -0.09 0.00 -1.73 0.00 0.00 68.15 68.60 3hq6 h THR 184 CO 0.02 0.09 2.37 0.18 -0.25 0.00 0.00 175.52 177.93 3hq6 n LEU 185 N -3.14 5.77 -4.21 3.87 4.77 -0.21 -4.84 117.00 119.01 3hq6 n LEU 185 Ca 0.03 -4.14 -0.12 0.00 -0.03 0.00 0.00 56.01 51.74 3hq6 n LEU 185 Cb 0.51 -1.68 -0.10 0.00 -2.33 0.00 0.00 43.42 39.82 3hq6 n LEU 185 CO 0.34 0.66 -0.37 0.27 -1.33 0.00 0.00 177.39 176.95 3hq6 s ILE 186 N 3.13 0.80 -0.49 -0.08 -4.36 -1.26 -1.31 121.20 117.63 3hq6 s ILE 186 Ca 0.49 -1.98 0.06 0.00 -0.26 0.00 0.00 60.65 58.95 3hq6 s ILE 186 Cb 0.07 -1.85 0.20 0.00 1.25 0.00 0.00 42.46 42.13 3hq6 s ILE 186 CO 0.01 -0.72 0.47 0.35 0.24 0.00 0.00 174.94 175.28 3hq6 n THR 187 N -0.14 -0.05 -1.13 8.37 -2.24 -1.26 -4.39 114.28 113.45 3hq6 n THR 187 Ca -0.10 -4.10 -0.29 0.00 -2.27 0.00 0.00 64.05 57.29 3hq6 n THR 187 Cb 0.61 -1.90 0.20 0.00 -2.10 0.00 0.00 70.33 67.15 3hq6 n THR 187 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3hq6 s PRO 188 N -0.90 -0.21 -1.42 -0.78 0.04 -1.26 -4.39 135.00 126.09 3hq6 s PRO 188 Ca 0.33 0.30 0.00 0.00 0.04 0.00 0.00 61.00 61.67 3hq6 s PRO 188 Cb 0.07 -1.68 0.00 0.00 0.04 0.00 0.00 34.50 32.93 3hq6 s PRO 188 CO -0.15 -3.11 0.00 -0.25 0.04 0.00 0.00 177.00 173.53 3hq6 n ASP 189 N -4.40 -4.73 -4.62 6.66 8.00 -1.26 -1.46 116.55 114.73 3hq6 n ASP 189 Ca 0.08 0.09 -0.35 0.00 0.71 0.00 0.00 54.79 55.31 3hq6 n ASP 189 Cb 0.58 -3.79 0.09 0.00 -0.02 0.00 0.00 41.12 37.98 3hq6 n ASP 189 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3hq6 n SER 190 N -0.86 0.55 -0.27 -2.24 3.41 -1.26 -4.66 113.62 108.29 3hq6 n SER 190 Ca -0.18 0.65 0.08 0.00 -0.26 0.00 0.00 58.87 59.16 3hq6 n SER 190 Cb 0.61 -1.42 0.22 0.00 -0.26 0.00 0.00 64.21 63.36 3hq6 n SER 190 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 3hq6 h PRO 191 N -0.34 0.36 -0.51 4.33 0.11 -1.73 -0.63 132.00 133.60 3hq6 h PRO 191 Ca -0.47 -0.02 0.10 0.00 0.11 0.00 0.00 66.00 65.72 3hq6 h PRO 191 Cb 1.33 -0.08 -0.09 0.00 0.11 0.00 0.00 31.00 32.27 3hq6 h PRO 191 CO 0.47 0.24 -0.05 0.35 -0.21 0.00 0.00 178.00 178.80 3hq6 h PHE 192 N 0.37 -0.12 -0.11 0.65 3.57 -1.54 -1.79 116.94 117.97 3hq6 h PHE 192 Ca 0.46 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.94 3hq6 h PHE 192 Cb 0.78 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.64 3hq6 h PHE 192 CO -0.19 -0.16 -0.18 -0.44 -2.23 0.00 0.00 178.31 175.11 3hq6 h ASP 193 N 0.07 0.17 0.96 0.41 5.19 -1.42 -0.37 116.42 121.43 3hq6 h ASP 193 Ca 0.25 -0.04 -0.16 0.00 -0.62 0.00 0.00 57.03 56.46 3hq6 h ASP 193 Cb 0.39 -0.05 -0.02 0.00 0.18 0.00 0.00 39.33 39.83 3hq6 h ASP 193 CO -0.46 0.37 -0.77 1.56 -3.12 0.00 0.00 179.24 176.81 3hq6 h GLN 194 N 0.17 0.00 -0.13 3.56 1.08 -1.04 -1.98 115.11 116.77 3hq6 h GLN 194 Ca 0.03 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.21 3hq6 h GLN 194 Cb 0.42 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.85 3hq6 h GLN 194 CO 0.03 0.77 0.01 -0.92 -0.95 0.00 0.00 178.83 177.77 3hq6 h TYR 195 N 0.00 0.25 -0.11 2.96 3.20 -0.56 -1.58 116.97 121.13 3hq6 h TYR 195 Ca -0.01 -0.04 0.01 0.00 3.14 0.00 0.00 58.73 61.83 3hq6 h TYR 195 Cb 1.46 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 39.66 3hq6 h TYR 195 CO 0.00 0.43 0.07 -0.07 -1.64 0.00 0.00 178.16 176.96 3hq6 h LEU 196 N -0.01 0.09 -0.47 2.82 3.38 -0.80 -1.77 115.31 118.55 3hq6 h LEU 196 Ca 0.04 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3hq6 h LEU 196 Cb 0.33 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3hq6 h LEU 196 CO 0.00 0.06 0.00 0.29 0.09 0.00 0.00 178.44 178.89 3hq6 n LYS 197 N -4.52 1.31 0.00 1.13 5.02 -0.77 -4.89 118.16 115.45 3hq6 n LYS 197 Ca -0.01 -0.46 0.00 0.00 -2.02 0.00 0.00 58.31 55.81 3hq6 n LYS 197 Cb 0.11 -1.41 0.00 0.00 -0.02 0.00 0.00 35.03 33.72 3hq6 n LYS 197 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hq6 n GLY 198 N 1.00 4.00 3.51 0.72 0.00 -0.67 -5.07 105.19 108.69 3hq6 n GLY 198 Ca 0.18 -0.71 -0.42 0.00 0.00 0.00 0.00 46.02 45.06 3hq6 n GLY 198 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3hq6 s LYS 199 N 0.00 3.24 0.33 1.61 2.20 -0.61 -4.87 119.74 121.64 3hq6 s LYS 199 Ca 0.00 -0.38 0.07 0.00 -0.36 0.00 0.00 55.97 55.30 3hq6 s LYS 199 Cb 0.00 -4.14 0.57 0.00 -1.51 0.00 0.00 37.83 32.75 3hq6 s LYS 199 CO 0.00 -1.79 1.78 0.87 -0.36 0.00 0.00 175.35 175.85 3hq6 h LYS 200 N 9.61 0.25 0.00 4.03 1.57 -1.86 -0.63 116.57 129.54 3hq6 h LYS 200 Ca -0.27 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.41 3hq6 h LYS 200 Cb 1.06 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.36 3hq6 h LYS 200 CO 1.18 0.53 0.00 1.17 -0.57 0.00 0.00 179.45 181.76 3hq6 n LYS 201 N -4.12 0.80 0.12 3.15 0.00 -1.26 -3.13 118.16 113.71 3hq6 n LYS 201 Ca -0.01 0.00 0.09 0.00 0.00 0.00 0.00 58.31 58.39 3hq6 n LYS 201 Cb 0.40 -1.50 0.58 0.00 0.00 0.00 0.00 35.03 34.50 3hq6 n LYS 201 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3hq6 h ALA 202 N 3.62 1.99 -2.81 3.14 0.00 -1.42 -3.40 119.26 120.39 3hq6 h ALA 202 Ca 0.00 -0.01 -0.64 0.00 0.00 0.00 0.00 54.91 54.26 3hq6 h ALA 202 Cb 0.01 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 17.68 3hq6 h ALA 202 CO 0.00 -0.04 -0.44 -0.51 0.00 0.00 0.00 179.25 178.26 3hq6 s LEU 203 N -9.17 4.35 0.00 0.00 1.43 -1.18 -4.80 118.68 109.30 3hq6 s LEU 203 Ca -0.06 0.47 -0.14 0.00 -1.03 0.00 0.00 54.13 53.38 3hq6 s LEU 203 Cb 0.18 -2.15 0.19 0.00 0.03 0.00 0.00 46.19 44.43 3hq6 s LEU 203 CO 0.70 0.33 0.95 -0.90 0.23 0.00 0.00 176.35 177.66 3hq6 n ASP 204 N 2.41 -0.52 -0.25 2.29 5.68 -1.26 -4.81 116.55 120.10 3hq6 n ASP 204 Ca -0.18 -1.25 -0.07 0.00 -0.50 0.00 0.00 54.79 52.79 3hq6 n ASP 204 Cb 0.54 -0.77 0.04 0.00 -1.14 0.00 0.00 41.12 39.79 3hq6 n ASP 204 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 3hq6 h GLY 205 N -1.59 1.14 1.68 6.12 0.00 -1.97 -1.13 103.07 107.32 3hq6 h GLY 205 Ca -0.32 -0.67 -0.23 0.00 0.00 0.00 0.00 47.33 46.11 3hq6 h GLY 205 CO 0.22 0.63 -1.02 1.70 0.00 0.00 0.00 176.54 178.07 3hq6 h LYS 206 N 1.00 0.26 -0.52 4.80 3.64 -1.95 -2.34 116.57 121.48 3hq6 h LYS 206 Ca 0.22 -0.34 -0.04 0.00 -1.27 0.00 0.00 60.65 59.22 3hq6 h LYS 206 Cb 0.29 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.20 3hq6 h LYS 206 CO -0.01 1.08 0.15 1.96 -2.27 0.00 0.00 179.45 180.37 3hq6 h GLN 207 N 0.12 0.81 0.33 1.90 4.20 -1.80 -1.02 115.11 119.65 3hq6 h GLN 207 Ca -0.08 -0.18 -0.02 0.00 0.06 0.00 0.00 58.65 58.43 3hq6 h GLN 207 Cb 1.70 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 29.36 3hq6 h GLN 207 CO 0.16 0.76 -0.16 1.15 -0.67 0.00 0.00 178.83 180.07 3hq6 h THR 208 N 0.71 0.69 -1.00 -0.54 2.02 -1.23 -2.21 112.91 111.35 3hq6 h THR 208 Ca 0.17 -0.17 0.20 0.00 0.77 0.00 0.00 66.41 67.38 3hq6 h THR 208 Cb 0.30 0.78 -0.10 0.00 -1.74 0.00 0.00 68.15 67.38 3hq6 h THR 208 CO -0.00 0.03 0.61 0.00 0.37 0.00 0.00 175.52 176.54 3hq6 h ALA 209 N 0.10 1.79 -0.98 6.16 0.00 -1.44 -2.06 119.26 122.84 3hq6 h ALA 209 Ca -0.05 0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.96 3hq6 h ALA 209 Cb 0.40 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 3hq6 h ALA 209 CO 0.08 -0.17 0.64 0.78 0.00 0.00 0.00 179.25 180.58 3hq6 h GLY 210 N 0.68 1.40 0.74 0.00 0.00 -0.66 -2.36 103.07 102.87 3hq6 h GLY 210 Ca 0.58 -0.50 -0.01 0.00 0.00 0.00 0.00 47.33 47.40 3hq6 h GLY 210 CO -0.36 0.46 0.00 -2.00 0.00 0.00 0.00 176.54 174.63 3hq6 h LEU 211 N 1.28 0.12 -0.03 3.11 5.85 -0.81 0.15 115.31 124.98 3hq6 h LEU 211 Ca 0.37 -0.31 0.04 0.00 0.84 0.00 0.00 57.88 58.82 3hq6 h LEU 211 Cb -0.07 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 40.88 3hq6 h LEU 211 CO -0.10 0.40 -0.28 0.50 -0.34 0.00 0.00 178.44 178.62 3hq6 h LYS 212 N -0.16 -0.39 -0.31 1.25 1.63 -1.38 0.21 116.57 117.41 3hq6 h LYS 212 Ca 0.02 0.03 0.05 0.00 -0.85 0.00 0.00 60.65 59.90 3hq6 h LYS 212 Cb 0.34 0.09 -0.04 0.00 -0.60 0.00 0.00 32.23 32.01 3hq6 h LYS 212 CO 0.00 -0.26 0.04 -0.07 -3.45 0.00 0.00 179.45 175.71 3hq6 h LEU 213 N -0.41 -0.04 -0.63 5.20 3.38 -1.39 0.37 115.31 121.79 3hq6 h LEU 213 Ca 0.07 0.06 0.10 0.00 0.09 0.00 0.00 57.88 58.20 3hq6 h LEU 213 Cb 0.51 0.09 -0.08 0.00 0.09 0.00 0.00 40.66 41.27 3hq6 h LEU 213 CO -0.26 0.01 0.22 0.15 0.09 0.00 0.00 178.44 178.66 3hq6 h PHE 214 N 0.14 0.39 0.69 1.13 3.57 -0.40 0.35 116.94 122.81 3hq6 h PHE 214 Ca 0.15 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.64 3hq6 h PHE 214 Cb 0.18 -0.08 0.01 0.00 2.79 0.00 0.00 35.95 38.84 3hq6 h PHE 214 CO -0.19 0.08 -0.33 -0.07 -2.23 0.00 0.00 178.31 175.56 3hq6 h LEU 215 N 0.40 -0.79 -0.92 0.59 3.38 -0.58 -1.09 115.31 116.30 3hq6 h LEU 215 Ca 0.32 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.26 3hq6 h LEU 215 Cb 0.42 0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.33 3hq6 h LEU 215 CO -0.33 -0.45 0.41 0.44 0.09 0.00 0.00 178.44 178.60 3hq6 h ASP 216 N -1.11 1.07 0.93 -0.43 3.32 0.09 -1.21 116.42 119.08 3hq6 h ASP 216 Ca -0.09 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 56.84 3hq6 h ASP 216 Cb 0.74 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.02 3hq6 h ASP 216 CO 0.16 0.89 -0.02 0.29 -1.72 0.00 0.00 179.24 178.83 3hq6 n LYS 217 N -4.32 0.04 -0.64 3.56 4.76 0.12 -4.92 118.16 116.77 3hq6 n LYS 217 Ca 0.08 -0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.52 3hq6 n LYS 217 Cb 0.13 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.82 3hq6 n LYS 217 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3hq6 n GLY 218 N 1.48 0.62 0.37 0.72 0.00 -0.46 -4.86 105.19 103.07 3hq6 n GLY 218 Ca 0.08 -0.58 0.13 0.00 0.00 0.00 0.00 46.02 45.65 3hq6 n GLY 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hq6 h VAL 220 N 0.67 0.01 -0.28 0.00 3.04 -1.80 -1.63 116.25 116.25 3hq6 h VAL 220 Ca 0.49 -0.16 0.04 0.00 -1.01 0.00 0.00 66.70 66.06 3hq6 h VAL 220 Cb 0.84 1.16 -0.04 0.00 -2.01 0.00 0.00 31.29 31.24 3hq6 h VAL 220 CO -0.24 0.00 0.06 0.00 -1.01 0.00 0.00 177.57 176.38 3hq6 h ALA 221 N 2.00 0.30 0.00 3.17 0.00 -1.78 -2.81 119.26 120.13 3hq6 h ALA 221 Ca -0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3hq6 h ALA 221 Cb 0.16 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3hq6 h ALA 221 CO 0.00 -0.35 -1.32 0.00 0.00 0.00 0.00 179.25 177.58 3hq6 n HIS 223 N -2.42 3.57 -3.68 0.00 8.25 -0.66 -4.31 115.22 115.98 3hq6 n HIS 223 Ca -0.01 -3.83 0.00 0.00 -0.26 0.00 0.00 57.72 53.62 3hq6 n HIS 223 Cb 0.54 -0.42 0.00 0.00 1.12 0.00 0.00 29.99 31.23 3hq6 n HIS 223 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hq6 n GLY 224 N -0.23 5.20 7.00 -1.41 0.00 -1.07 -3.95 105.19 110.73 3hq6 n GLY 224 Ca 0.31 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 44.29 3hq6 n GLY 224 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hq6 n GLY 225 N 4.04 -1.01 0.31 -0.02 0.00 -0.04 -2.32 105.19 106.14 3hq6 n GLY 225 Ca 0.00 -1.18 0.01 0.00 0.00 0.00 0.00 46.02 44.84 3hq6 n GLY 225 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3hq6 h LEU 226 N 0.00 0.66 -2.34 0.99 5.85 -1.87 -3.00 115.31 115.60 3hq6 h LEU 226 Ca 0.00 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.66 3hq6 h LEU 226 Cb 0.00 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 40.86 3hq6 h LEU 226 CO 0.00 0.56 0.00 -3.20 -0.34 0.00 0.00 178.44 175.46 3hq6 n ASN 227 N -4.37 2.80 -3.69 1.25 5.15 -1.26 -4.60 115.26 110.53 3hq6 n ASN 227 Ca 0.04 -1.84 -0.23 0.00 -0.60 0.00 0.00 54.58 51.95 3hq6 n ASN 227 Cb 0.13 -0.18 0.03 0.00 -0.53 0.00 0.00 39.78 39.22 3hq6 n ASN 227 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 3hq6 n LEU 228 N 0.81 -3.15 0.00 1.20 4.32 -1.08 -3.00 117.00 116.11 3hq6 n LEU 228 Ca 0.12 -0.87 0.00 0.00 -0.02 0.00 0.00 56.01 55.25 3hq6 n LEU 228 Cb 0.43 -2.61 0.00 0.00 -1.62 0.00 0.00 43.42 39.63 3hq6 n LEU 228 CO 0.10 0.40 0.00 0.61 -1.22 0.00 0.00 177.39 177.28 3hq6 n GLY 229 N -1.62 0.03 1.39 -0.72 0.00 -0.98 -1.75 105.19 101.55 3hq6 n GLY 229 Ca -0.25 -2.27 0.00 0.00 0.00 0.00 0.00 46.02 43.50 3hq6 n GLY 229 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hq6 n GLY 230 N 0.00 0.67 0.00 -0.02 0.00 0.13 -4.06 105.19 101.90 3hq6 n GLY 230 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3hq6 n GLY 230 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hq6 n THR 231 N -2.66 0.00 -4.40 2.61 -2.24 -1.26 -0.64 114.28 105.69 3hq6 n THR 231 Ca 0.00 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.51 3hq6 n THR 231 Cb 0.00 -0.11 -0.12 0.00 -2.10 0.00 0.00 70.33 68.00 3hq6 n THR 231 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3hq6 s GLY 232 N -1.56 1.69 -0.05 3.38 0.00 -1.26 -4.49 107.32 105.03 3hq6 s GLY 232 Ca 0.00 -1.58 -0.12 0.00 0.00 0.00 0.00 44.72 43.02 3hq6 s GLY 232 CO 0.00 -1.60 0.32 -0.19 0.00 0.00 0.00 173.10 171.63 3hq6 s TYR 233 N -1.56 3.66 0.01 1.90 2.02 -1.26 -2.01 117.35 120.11 3hq6 s TYR 233 Ca 0.20 0.82 -0.02 0.00 -0.37 0.00 0.00 57.07 57.70 3hq6 s TYR 233 Cb -0.08 -2.19 -0.01 0.00 -0.40 0.00 0.00 41.96 39.27 3hq6 s TYR 233 CO 0.10 0.63 0.02 -0.06 -1.57 0.00 0.00 175.55 174.67 3hq6 s PHE 234 N -0.90 0.16 0.00 2.71 0.08 0.74 -4.89 117.98 115.88 3hq6 s PHE 234 Ca 0.20 -0.33 -0.03 0.00 0.12 0.00 0.00 56.93 56.90 3hq6 s PHE 234 Cb -0.15 -0.12 -0.12 0.00 -0.57 0.00 0.00 43.02 42.06 3hq6 s PHE 234 CO 0.10 -0.19 2.59 -0.35 -0.10 0.00 0.00 175.22 177.27 3hq6 n PRO 235 N 1.80 1.37 -4.16 0.24 -0.04 -1.26 -0.82 135.00 132.13 3hq6 n PRO 235 Ca -0.22 -0.46 -0.18 0.00 -0.04 0.00 0.00 63.50 62.60 3hq6 n PRO 235 Cb 0.56 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.36 3hq6 n PRO 235 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3hq6 s PHE 236 N 0.67 0.63 0.04 0.54 0.08 -1.26 0.54 117.98 119.22 3hq6 s PHE 236 Ca 0.31 -0.15 0.00 0.00 0.12 0.00 0.00 56.93 57.21 3hq6 s PHE 236 Cb 0.15 -0.54 -0.03 0.00 -0.57 0.00 0.00 43.02 42.03 3hq6 s PHE 236 CO 0.00 -0.13 -0.04 0.20 -0.10 0.00 0.00 175.22 175.16 3hq6 s GLY 237 N 0.60 0.38 -0.26 4.36 0.00 -0.91 -4.38 107.32 107.12 3hq6 s GLY 237 Ca -0.08 -0.85 -0.08 0.00 0.00 0.00 0.00 44.72 43.72 3hq6 s GLY 237 CO -0.00 -0.93 0.10 0.14 0.00 0.00 0.00 173.10 172.41 3hq6 s VAL 238 N -2.31 4.59 0.31 1.40 1.01 -1.26 0.00 120.40 124.14 3hq6 s VAL 238 Ca -0.07 -0.08 0.03 0.00 0.00 0.00 0.00 61.98 61.87 3hq6 s VAL 238 Cb -0.04 -3.16 -0.06 0.00 0.00 0.00 0.00 36.38 33.13 3hq6 s VAL 238 CO -0.04 0.32 0.07 0.68 0.00 0.00 0.00 175.10 176.13 3hq6 s VAL 239 N 1.64 0.97 0.18 2.92 -7.23 -0.67 -4.88 120.40 113.32 3hq6 s VAL 239 Ca 0.06 -2.00 -0.32 0.00 -1.81 0.00 0.00 61.98 57.92 3hq6 s VAL 239 Cb -0.15 -2.72 -0.10 0.00 0.56 0.00 0.00 36.38 33.96 3hq6 s VAL 239 CO 0.06 0.00 1.60 -1.61 -0.31 0.00 0.00 175.10 174.84 3hq6 s GLU 240 N -3.92 4.19 0.00 4.82 2.02 -1.26 -1.24 118.70 123.31 3hq6 s GLU 240 Ca 0.36 2.42 0.00 0.00 0.02 0.00 0.00 54.97 57.77 3hq6 s GLU 240 Cb 0.08 -3.14 0.00 0.00 0.10 0.00 0.00 34.13 31.18 3hq6 s GLU 240 CO 0.15 -0.64 0.00 1.17 0.02 0.00 0.00 175.26 175.96 3hq6 n LYS 241 N 3.96 0.00 0.00 1.61 4.81 -1.26 -4.80 118.16 122.47 3hq6 n LYS 241 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.58 3hq6 n LYS 241 Cb 0.38 -0.06 0.00 0.00 0.02 0.00 0.00 35.03 35.37 3hq6 n LYS 241 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3hq6 n GLY 253 N 2.92 0.00 0.49 3.14 0.00 -1.26 -5.04 105.19 105.44 3hq6 n GLY 253 Ca 0.00 0.00 0.41 0.00 0.00 0.00 0.00 46.02 46.43 3hq6 n GLY 253 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3hq6 n ARG 254 N 0.00 -0.03 -4.33 1.61 0.63 -1.26 -4.79 116.66 108.49 3hq6 n ARG 254 Ca 0.00 1.18 -0.28 0.00 -0.92 0.00 0.00 57.85 57.83 3hq6 n ARG 254 Cb 0.00 -2.38 -0.11 0.00 0.45 0.00 0.00 32.46 30.42 3hq6 n ARG 254 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 3hq6 s PHE 255 N -5.11 2.51 0.02 -0.14 0.08 -1.26 -4.63 117.98 109.44 3hq6 s PHE 255 Ca -0.07 -0.28 -0.13 0.00 0.12 0.00 0.00 56.93 56.58 3hq6 s PHE 255 Cb 0.29 -1.26 0.02 0.00 -0.57 0.00 0.00 43.02 41.49 3hq6 s PHE 255 CO 0.80 0.47 0.27 0.00 -0.10 0.00 0.00 175.22 176.66 3hq6 s ALA 256 N -1.51 -0.63 0.31 5.36 0.00 -0.38 -4.78 121.76 120.13 3hq6 s ALA 256 Ca 0.21 0.04 -0.29 0.00 0.00 0.00 0.00 51.96 51.93 3hq6 s ALA 256 Cb -0.09 0.22 -0.11 0.00 0.00 0.00 0.00 23.12 23.14 3hq6 s ALA 256 CO 0.12 -0.34 1.45 0.08 0.00 0.00 0.00 175.76 177.06 3hq6 s VAL 257 N -2.09 2.43 -0.07 0.00 1.01 -1.26 -1.67 120.40 118.75 3hq6 s VAL 257 Ca -0.08 0.39 0.03 0.00 0.00 0.00 0.00 61.98 62.31 3hq6 s VAL 257 Cb -0.03 -3.25 0.01 0.00 0.00 0.00 0.00 36.38 33.11 3hq6 s VAL 257 CO -0.01 0.08 -0.15 0.28 0.00 0.00 0.00 175.10 175.30 3hq6 s THR 258 N -0.53 1.32 0.10 3.92 -1.32 0.10 -4.93 115.64 114.30 3hq6 s THR 258 Ca 0.56 -0.60 -0.31 0.00 -1.21 0.00 0.00 61.69 60.13 3hq6 s THR 258 Cb -0.43 -1.18 -0.09 0.00 -1.51 0.00 0.00 72.50 69.29 3hq6 s THR 258 CO 0.51 0.39 1.63 0.54 -2.21 0.00 0.00 174.62 175.49 3hq6 s ASN 259 N 0.52 6.59 -0.12 8.08 2.20 -1.26 -2.14 114.94 128.80 3hq6 s ASN 259 Ca -0.14 2.55 0.17 0.00 -0.94 0.00 0.00 52.86 54.50 3hq6 s ASN 259 Cb -0.15 -2.57 0.27 0.00 -2.00 0.00 0.00 41.25 36.79 3hq6 s ASN 259 CO 0.04 -0.87 1.14 0.35 -2.94 0.00 0.00 177.10 174.82 3hq6 n THR 260 N 4.47 1.74 0.09 0.54 -2.24 0.19 -4.77 114.28 114.30 3hq6 n THR 260 Ca 0.15 -2.11 -0.04 0.00 -2.27 0.00 0.00 64.05 59.78 3hq6 n THR 260 Cb 0.40 -0.17 0.14 0.00 -2.10 0.00 0.00 70.33 68.59 3hq6 n THR 260 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hq6 h ALA 261 N 0.05 0.89 0.00 6.98 0.00 -1.77 -2.61 119.26 122.80 3hq6 h ALA 261 Ca -0.00 -0.53 -0.06 0.00 0.00 0.00 0.00 54.91 54.32 3hq6 h ALA 261 Cb 1.04 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 3hq6 h ALA 261 CO 0.00 0.72 -0.28 1.57 0.00 0.00 0.00 179.25 181.26 3hq6 h LYS 262 N 0.15 0.00 -0.12 0.00 2.10 -1.93 -1.22 116.57 115.56 3hq6 h LYS 262 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3hq6 h LYS 262 Cb 1.08 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.41 3hq6 h LYS 262 CO 0.09 0.28 0.00 -0.25 -2.00 0.00 0.00 179.45 177.57 3hq6 n ASP 263 N -3.97 0.90 -4.14 7.07 8.00 -1.01 -4.94 116.55 118.45 3hq6 n ASP 263 Ca -0.02 -1.70 -0.34 0.00 0.71 0.00 0.00 54.79 53.44 3hq6 n ASP 263 Cb 0.35 -0.08 -0.02 0.00 -0.02 0.00 0.00 41.12 41.36 3hq6 n ASP 263 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3hq6 n GLU 264 N -0.14 -3.63 -5.08 -1.24 1.02 -0.46 -4.89 120.64 106.23 3hq6 n GLU 264 Ca 0.12 0.42 -0.32 0.00 -0.02 0.00 0.00 57.16 57.36 3hq6 n GLU 264 Cb 0.19 -5.12 -0.14 0.00 -0.02 0.00 0.00 31.44 26.34 3hq6 n GLU 264 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 3hq6 s TYR 265 N -3.35 2.54 0.08 -0.32 5.04 -1.03 -0.81 117.35 119.50 3hq6 s TYR 265 Ca 0.66 -0.31 0.01 0.00 -2.44 0.00 0.00 57.07 55.00 3hq6 s TYR 265 Cb -0.35 -1.58 -0.04 0.00 0.35 0.00 0.00 41.96 40.34 3hq6 s TYR 265 CO 0.91 0.07 -0.06 0.14 -1.34 0.00 0.00 175.55 175.27 3hq6 s VAL 266 N -0.64 0.57 0.03 3.14 -7.23 -0.05 -4.40 120.40 111.82 3hq6 s VAL 266 Ca 0.10 -1.79 0.03 0.00 -1.81 0.00 0.00 61.98 58.51 3hq6 s VAL 266 Cb -0.11 -1.50 -0.02 0.00 0.56 0.00 0.00 36.38 35.32 3hq6 s VAL 266 CO 0.00 -0.84 -0.11 -0.36 -0.31 0.00 0.00 175.10 173.49 3hq6 s PHE 267 N -3.39 0.92 0.27 2.82 0.08 0.00 -1.37 117.98 117.32 3hq6 s PHE 267 Ca 0.08 -0.33 -0.29 0.00 0.12 0.00 0.00 56.93 56.50 3hq6 s PHE 267 Cb 0.04 -0.56 -0.10 0.00 -0.57 0.00 0.00 43.02 41.83 3hq6 s PHE 267 CO -0.05 -0.01 1.29 0.50 -0.10 0.00 0.00 175.22 176.85 3hq6 s ARG 268 N -1.00 4.40 -0.69 0.44 3.52 0.11 -0.18 118.95 125.55 3hq6 s ARG 268 Ca -0.01 2.10 -0.23 0.00 -0.13 0.00 0.00 55.73 57.46 3hq6 s ARG 268 Cb -0.07 -3.14 0.07 0.00 -1.56 0.00 0.00 34.95 30.25 3hq6 s ARG 268 CO 0.01 -0.17 1.03 0.00 -0.81 0.00 0.00 175.30 175.36 3hq6 s ALA 269 N -0.61 3.06 0.50 6.12 0.00 -0.85 -4.93 121.76 125.05 3hq6 s ALA 269 Ca 0.52 -1.81 -0.22 0.00 0.00 0.00 0.00 51.96 50.45 3hq6 s ALA 269 Cb -0.38 -3.95 -0.06 0.00 0.00 0.00 0.00 23.12 18.74 3hq6 s ALA 269 CO 0.45 -2.89 1.25 -2.14 0.00 0.00 0.00 175.76 172.44 3hq6 s PRO 270 N 4.30 3.45 0.09 0.00 0.02 -1.26 0.20 135.00 141.80 3hq6 s PRO 270 Ca 0.25 1.98 -0.37 0.00 0.02 0.00 0.00 61.00 62.89 3hq6 s PRO 270 Cb -0.15 -2.32 -0.17 0.00 0.02 0.00 0.00 34.50 31.89 3hq6 s PRO 270 CO 0.10 -0.87 1.30 0.45 -0.33 0.00 0.00 177.00 177.65 3hq6 n SER 271 N -0.78 1.47 -0.82 2.53 2.88 -1.26 -4.06 113.62 113.59 3hq6 n SER 271 Ca 0.09 1.12 0.09 0.00 -1.33 0.00 0.00 58.87 58.85 3hq6 n SER 271 Cb 0.47 -1.17 0.27 0.00 -0.75 0.00 0.00 64.21 63.03 3hq6 n SER 271 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 3hq6 n LEU 272 N 2.39 2.42 -4.77 2.46 4.77 -0.71 -4.86 117.00 118.69 3hq6 n LEU 272 Ca 0.18 -1.12 -0.40 0.00 -0.03 0.00 0.00 56.01 54.64 3hq6 n LEU 272 Cb 0.19 -0.23 -0.02 0.00 -2.33 0.00 0.00 43.42 41.03 3hq6 n LEU 272 CO 0.62 0.56 0.97 -0.13 -1.33 0.00 0.00 177.39 178.08 3hq6 s ARG 273 N -1.54 4.26 -1.64 3.23 0.52 -1.25 -1.91 118.95 120.62 3hq6 s ARG 273 Ca 0.33 2.20 0.00 0.00 -0.52 0.00 0.00 55.73 57.75 3hq6 s ARG 273 Cb 0.18 -2.99 0.00 0.00 0.52 0.00 0.00 34.95 32.66 3hq6 s ARG 273 CO 0.25 -0.26 0.00 0.09 0.02 0.00 0.00 175.30 175.40 3hq6 n ASN 274 N 0.63 -4.79 0.24 0.23 3.02 -0.41 -4.87 115.26 109.30 3hq6 n ASN 274 Ca 0.01 0.25 0.08 0.00 -0.03 0.00 0.00 54.58 54.88 3hq6 n ASN 274 Cb 0.42 -4.16 0.58 0.00 -0.61 0.00 0.00 39.78 36.01 3hq6 n ASN 274 CO 0.00 0.00 0.00 1.62 -2.62 0.00 0.00 177.26 176.26 3hq6 h VAL 275 N 0.00 0.94 0.00 2.41 3.04 -1.66 -1.66 116.25 119.32 3hq6 h VAL 275 Ca -0.38 -0.62 -0.00 0.00 -1.01 0.00 0.00 66.70 64.69 3hq6 h VAL 275 Cb 1.21 1.35 -0.00 0.00 -2.01 0.00 0.00 31.29 31.84 3hq6 h VAL 275 CO 0.50 0.17 -0.00 0.00 -1.01 0.00 0.00 177.57 177.22 3hq6 h ALA 276 N 1.83 1.02 -0.12 3.17 0.00 -1.86 -2.77 119.26 120.53 3hq6 h ALA 276 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3hq6 h ALA 276 Cb 0.34 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3hq6 h ALA 276 CO 0.02 0.00 0.00 0.44 0.00 0.00 0.00 179.25 179.72 3hq6 n ILE 277 N -3.12 1.04 -1.89 0.00 -5.35 -0.63 -4.61 119.36 104.79 3hq6 n ILE 277 Ca -0.02 -1.04 0.03 0.00 -0.27 0.00 0.00 62.75 61.45 3hq6 n ILE 277 Cb 0.14 0.47 0.14 0.00 -1.74 0.00 0.00 39.64 38.65 3hq6 n ILE 277 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 3hq6 n THR 278 N -0.19 1.66 -0.89 7.28 -2.24 -1.05 -4.44 114.28 114.42 3hq6 n THR 278 Ca 0.04 -2.76 -0.32 0.00 -2.27 0.00 0.00 64.05 58.75 3hq6 n THR 278 Cb 0.33 0.04 0.15 0.00 -2.10 0.00 0.00 70.33 68.75 3hq6 n THR 278 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 3hq6 s TYR 279 N -2.48 1.73 1.01 4.78 -0.85 -1.26 -4.68 117.35 115.60 3hq6 s TYR 279 Ca 0.38 1.74 -0.16 0.00 -0.52 0.00 0.00 57.07 58.51 3hq6 s TYR 279 Cb 0.38 -3.39 0.20 0.00 0.38 0.00 0.00 41.96 39.54 3hq6 s TYR 279 CO -0.09 -2.78 1.22 -1.25 -1.52 0.00 0.00 175.55 171.14 3hq6 s PRO 280 N -4.46 0.31 0.28 -3.49 0.04 -1.26 -4.44 135.00 121.98 3hq6 s PRO 280 Ca 0.69 -0.15 0.08 0.00 0.04 0.00 0.00 61.00 61.65 3hq6 s PRO 280 Cb -0.25 -1.78 -0.04 0.00 0.04 0.00 0.00 34.50 32.47 3hq6 s PRO 280 CO 0.55 -2.67 0.16 0.71 0.04 0.00 0.00 177.00 175.78 3hq6 s TYR 281 N -3.52 2.93 0.12 0.56 2.02 0.12 -4.82 117.35 114.76 3hq6 s TYR 281 Ca 0.70 -0.20 0.00 0.00 -0.37 0.00 0.00 57.07 57.20 3hq6 s TYR 281 Cb -0.08 -1.44 0.00 0.00 -0.40 0.00 0.00 41.96 40.04 3hq6 s TYR 281 CO 0.54 0.47 0.00 1.19 -1.57 0.00 0.00 175.55 176.17 3hq6 n PHE 282 N -1.14 -1.11 0.20 2.71 3.72 -1.26 -2.06 117.46 118.51 3hq6 n PHE 282 Ca -0.06 0.57 0.06 0.00 -0.05 0.00 0.00 57.45 57.97 3hq6 n PHE 282 Cb 0.59 -1.01 0.39 0.00 -0.94 0.00 0.00 39.48 38.50 3hq6 n PHE 282 CO 0.00 0.00 0.00 1.12 -0.05 0.00 0.00 176.76 177.83 3hq6 h HIS 283 N -0.41 0.00 -0.23 1.38 2.07 -1.94 -2.37 115.15 113.66 3hq6 h HIS 283 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 3hq6 h HIS 283 Cb 0.40 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.38 3hq6 h HIS 283 CO -0.65 0.34 0.00 -1.13 -3.07 0.00 0.00 177.93 173.42 3hq6 n SER 284 N -3.59 2.87 -3.94 3.10 3.41 -1.26 -0.49 113.62 113.72 3hq6 n SER 284 Ca -0.01 -1.84 -0.29 0.00 -0.26 0.00 0.00 58.87 56.47 3hq6 n SER 284 Cb 0.47 -0.14 0.01 0.00 -0.26 0.00 0.00 64.21 64.29 3hq6 n SER 284 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hq6 n GLY 285 N 1.06 -0.43 0.13 5.00 0.00 -0.89 -4.58 105.19 105.47 3hq6 n GLY 285 Ca 0.14 0.17 0.11 0.00 0.00 0.00 0.00 46.02 46.44 3hq6 n GLY 285 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3hq6 h VAL 286 N -1.93 0.01 -3.13 1.61 -1.51 -1.69 -3.42 116.25 106.19 3hq6 h VAL 286 Ca -0.59 -1.01 -0.67 0.00 -1.23 0.00 0.00 66.70 63.19 3hq6 h VAL 286 Cb 1.37 1.57 -0.34 0.00 -2.13 0.00 0.00 31.29 31.76 3hq6 h VAL 286 CO 0.67 0.00 -0.86 -0.69 -1.23 0.00 0.00 177.57 175.46 3hq6 s VAL 287 N -3.34 2.08 -0.14 7.19 1.01 -1.21 -4.96 120.40 121.02 3hq6 s VAL 287 Ca 0.00 -0.95 0.19 0.00 0.00 0.00 0.00 61.98 61.22 3hq6 s VAL 287 Cb 0.09 -1.85 -0.15 0.00 0.00 0.00 0.00 36.38 34.46 3hq6 s VAL 287 CO 0.78 0.54 0.73 0.79 0.00 0.00 0.00 175.10 177.94 3hq6 n TRP 288 N 4.37 0.69 -3.53 5.22 7.02 -1.26 0.12 117.44 130.07 3hq6 n TRP 288 Ca -0.21 0.22 -0.37 0.00 -1.02 0.00 0.00 57.50 56.13 3hq6 n TRP 288 Cb 0.51 -0.94 -0.07 0.00 -2.42 0.00 0.00 31.31 28.39 3hq6 n TRP 288 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 3hq6 s SER 289 N -5.41 6.54 0.13 -0.99 0.15 -1.26 -4.82 113.70 108.04 3hq6 s SER 289 Ca -0.04 0.64 -0.10 0.00 0.70 0.00 0.00 55.95 57.15 3hq6 s SER 289 Cb 0.10 -2.20 -0.07 0.00 -1.71 0.00 0.00 66.02 62.13 3hq6 s SER 289 CO 0.83 0.16 1.37 0.25 1.20 0.00 0.00 173.24 177.05 3hq6 h LEU 290 N 6.14 0.85 -1.27 3.45 5.85 -1.96 -1.20 115.31 127.17 3hq6 h LEU 290 Ca -0.44 -0.52 0.06 0.00 0.84 0.00 0.00 57.88 57.82 3hq6 h LEU 290 Cb 1.18 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 41.91 3hq6 h LEU 290 CO 0.71 1.30 0.53 0.50 -0.34 0.00 0.00 178.44 181.14 3hq6 h LYS 291 N 0.52 0.86 -0.18 1.25 3.64 -1.94 -1.15 116.57 119.57 3hq6 h LYS 291 Ca -0.03 -0.05 -0.20 0.00 -1.27 0.00 0.00 60.65 59.10 3hq6 h LYS 291 Cb 1.30 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 3hq6 h LYS 291 CO 0.14 0.57 -0.68 1.49 -2.27 0.00 0.00 179.45 178.70 3hq6 h GLU 292 N 0.89 0.70 -0.76 1.90 4.57 -1.81 -2.54 114.58 117.53 3hq6 h GLU 292 Ca 0.35 -0.52 0.01 0.00 -1.18 0.00 0.00 59.36 58.02 3hq6 h GLU 292 Cb 0.22 0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 28.87 3hq6 h GLU 292 CO -0.12 1.14 0.50 0.00 -1.18 0.00 0.00 179.01 179.35 3hq6 h ALA 293 N 0.72 0.97 -0.27 2.92 0.00 -1.00 0.29 119.26 122.90 3hq6 h ALA 293 Ca -0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 3hq6 h ALA 293 Cb 1.28 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 3hq6 h ALA 293 CO 0.14 0.36 0.08 0.28 0.00 0.00 0.00 179.25 180.11 3hq6 h VAL 294 N 1.02 1.13 0.09 0.00 2.07 -1.17 -1.63 116.25 117.75 3hq6 h VAL 294 Ca 0.28 -0.43 -0.27 0.00 0.82 0.00 0.00 66.70 67.11 3hq6 h VAL 294 Cb -0.09 0.84 0.01 0.00 -1.52 0.00 0.00 31.29 30.53 3hq6 h VAL 294 CO -0.07 0.16 -1.16 0.00 0.02 0.00 0.00 177.57 176.52 3hq6 h ALA 295 N 1.71 0.15 -0.78 1.67 0.00 -0.85 -2.42 119.26 118.74 3hq6 h ALA 295 Ca 0.09 -0.80 0.05 0.00 0.00 0.00 0.00 54.91 54.25 3hq6 h ALA 295 Cb 0.13 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 3hq6 h ALA 295 CO -0.01 0.85 0.51 0.28 0.00 0.00 0.00 179.25 180.88 3hq6 h VAL 296 N 0.17 1.07 0.00 0.00 2.07 -0.16 -2.44 116.25 116.96 3hq6 h VAL 296 Ca -0.13 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.08 3hq6 h VAL 296 Cb 1.84 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 31.72 3hq6 h VAL 296 CO 0.20 0.16 0.00 0.23 0.02 0.00 0.00 177.57 178.18 3hq6 n MET 297 N -4.47 0.26 -2.63 1.57 2.81 -0.64 -3.82 117.12 110.20 3hq6 n MET 297 Ca 0.11 0.06 -0.42 0.00 -1.81 0.00 0.00 57.70 55.64 3hq6 n MET 297 Cb 0.18 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.20 3hq6 n MET 297 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3hq6 n GLY 298 N 0.87 5.38 3.83 3.03 0.00 -0.92 -4.91 105.19 112.48 3hq6 n GLY 298 Ca 0.10 -2.45 -0.35 0.00 0.00 0.00 0.00 46.02 43.32 3hq6 n GLY 298 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3hq6 s SER 299 N -0.89 6.01 0.43 1.61 0.15 -1.19 -4.23 113.70 115.59 3hq6 s SER 299 Ca 0.38 0.30 0.18 0.00 0.70 0.00 0.00 55.95 57.51 3hq6 s SER 299 Cb 0.12 -1.84 1.10 0.00 -1.71 0.00 0.00 66.02 63.69 3hq6 s SER 299 CO -0.00 0.33 1.88 0.00 1.20 0.00 0.00 173.24 176.65 3hq6 h ALA 300 N 4.47 2.22 -0.25 5.45 0.00 -1.92 -1.84 119.26 127.39 3hq6 h ALA 300 Ca -0.51 0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.48 3hq6 h ALA 300 Cb 1.20 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 3hq6 h ALA 300 CO 0.61 -0.47 0.19 1.96 0.00 0.00 0.00 179.25 181.54 3hq6 h GLN 301 N 0.38 0.00 -0.01 0.00 1.08 -1.93 0.47 115.11 115.09 3hq6 h GLN 301 Ca 0.43 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.63 3hq6 h GLN 301 Cb 1.09 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.52 3hq6 h GLN 301 CO -0.14 0.00 -0.59 1.19 -0.95 0.00 0.00 178.83 178.34 3hq6 n PHE 302 N -4.34 0.00 -1.08 2.96 3.72 -0.77 -4.96 117.46 112.98 3hq6 n PHE 302 Ca 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.43 3hq6 n PHE 302 Cb 0.34 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.88 3hq6 n PHE 302 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hq6 n GLY 303 N 1.40 0.50 3.71 1.37 0.00 0.15 -5.04 105.19 107.29 3hq6 n GLY 303 Ca 0.07 -0.90 -0.35 0.00 0.00 0.00 0.00 46.02 44.84 3hq6 n GLY 303 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hq6 s ILE 304 N -2.00 4.91 -0.08 -0.61 1.01 -0.77 -4.96 121.20 118.70 3hq6 s ILE 304 Ca 0.00 -0.00 0.05 0.00 0.00 0.00 0.00 60.65 60.70 3hq6 s ILE 304 Cb 0.00 -3.16 -0.01 0.00 0.01 0.00 0.00 42.46 39.30 3hq6 s ILE 304 CO 0.00 0.53 -0.24 -0.75 0.00 0.00 0.00 174.94 174.48 3hq6 s LYS 305 N -0.24 2.80 -0.05 2.79 2.20 -1.26 -3.16 119.74 122.80 3hq6 s LYS 305 Ca 0.08 -0.89 0.04 0.00 -0.36 0.00 0.00 55.97 54.85 3hq6 s LYS 305 Cb -0.12 -2.24 -0.00 0.00 -1.51 0.00 0.00 37.83 33.96 3hq6 s LYS 305 CO 0.01 0.29 -0.18 -0.51 -0.36 0.00 0.00 175.35 174.60 3hq6 s LEU 306 N 0.07 1.90 0.68 5.43 1.43 -1.26 -5.04 118.68 121.89 3hq6 s LEU 306 Ca -0.11 -0.38 -0.11 0.00 -1.03 0.00 0.00 54.13 52.50 3hq6 s LEU 306 Cb -0.16 -1.03 -0.00 0.00 0.03 0.00 0.00 46.19 45.03 3hq6 s LEU 306 CO 0.06 0.14 1.06 -0.94 0.23 0.00 0.00 176.35 176.90 3hq6 s SER 307 N 0.16 5.65 0.22 2.29 1.04 -1.26 -4.85 113.70 116.95 3hq6 s SER 307 Ca -0.07 1.40 -0.14 0.00 0.48 0.00 0.00 55.95 57.61 3hq6 s SER 307 Cb -0.13 -2.31 0.26 0.00 0.10 0.00 0.00 66.02 63.94 3hq6 s SER 307 CO 0.03 -1.24 1.60 -0.78 0.98 0.00 0.00 173.24 173.83 3hq6 h ASP 308 N -0.58 -0.80 -0.54 7.02 1.82 -2.00 -0.01 116.42 121.32 3hq6 h ASP 308 Ca -0.44 0.22 -0.05 0.00 -0.39 0.00 0.00 57.03 56.37 3hq6 h ASP 308 Cb 1.22 0.49 -0.02 0.00 0.68 0.00 0.00 39.33 41.69 3hq6 h ASP 308 CO 0.61 -0.26 0.16 0.44 -1.61 0.00 0.00 179.24 178.58 3hq6 h ASP 309 N -0.04 0.80 -0.70 2.28 5.19 -1.99 -2.87 116.42 119.09 3hq6 h ASP 309 Ca 0.33 -0.21 0.04 0.00 -0.62 0.00 0.00 57.03 56.56 3hq6 h ASP 309 Cb 0.54 -0.21 -0.05 0.00 0.18 0.00 0.00 39.33 39.80 3hq6 h ASP 309 CO -0.75 0.80 0.43 -0.33 -3.12 0.00 0.00 179.24 176.28 3hq6 h GLU 310 N 0.75 0.82 0.00 3.56 5.08 -1.65 0.12 114.58 123.26 3hq6 h GLU 310 Ca 0.17 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.45 3hq6 h GLU 310 Cb 0.30 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 3hq6 h GLU 310 CO -0.00 0.54 -0.16 0.77 -1.00 0.00 0.00 179.01 179.16 3hq6 h SER 311 N 0.84 0.00 0.40 1.42 0.02 -1.03 -2.26 113.55 112.94 3hq6 h SER 311 Ca 0.29 0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 60.92 3hq6 h SER 311 Cb 0.05 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.60 3hq6 h SER 311 CO -0.12 0.16 -1.50 -0.08 -1.14 0.00 0.00 176.83 174.15 3hq6 h GLU 312 N 0.00 0.35 -0.60 3.45 4.22 -1.10 -2.60 114.58 118.30 3hq6 h GLU 312 Ca -0.00 -0.60 -0.05 0.00 0.08 0.00 0.00 59.36 58.79 3hq6 h GLU 312 Cb 0.40 0.22 -0.03 0.00 0.50 0.00 0.00 28.75 29.85 3hq6 h GLU 312 CO 0.02 1.25 0.19 0.00 -2.18 0.00 0.00 179.01 178.30 3hq6 h ALA 313 N 0.36 0.78 0.09 2.92 0.00 -0.38 -1.71 119.26 121.33 3hq6 h ALA 313 Ca -0.24 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.47 3hq6 h ALA 313 Cb 2.06 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.62 3hq6 h ALA 313 CO 0.20 0.44 -0.04 0.82 0.00 0.00 0.00 179.25 180.67 3hq6 h ILE 314 N 0.85 1.15 -0.89 0.00 2.04 -1.52 -0.66 117.51 118.48 3hq6 h ILE 314 Ca 0.19 -1.06 0.24 0.00 1.00 0.00 0.00 64.86 65.23 3hq6 h ILE 314 Cb 0.28 1.82 -0.16 0.00 -0.74 0.00 0.00 36.82 38.02 3hq6 h ILE 314 CO -0.01 0.25 0.09 0.00 0.00 0.00 0.00 178.15 178.49 3hq6 h ALA 315 N 0.20 1.11 -0.67 1.87 0.00 -1.50 0.37 119.26 120.65 3hq6 h ALA 315 Ca -0.01 0.28 0.01 0.00 0.00 0.00 0.00 54.91 55.19 3hq6 h ALA 315 Cb 0.51 0.46 -0.04 0.00 0.00 0.00 0.00 17.79 18.72 3hq6 h ALA 315 CO 0.02 -0.51 0.43 0.00 0.00 0.00 0.00 179.25 179.20 3hq6 h ALA 316 N 1.85 0.85 -0.71 0.00 0.00 -1.00 -1.80 119.26 118.45 3hq6 h ALA 316 Ca 0.54 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.45 3hq6 h ALA 316 Cb 1.08 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.57 3hq6 h ALA 316 CO -0.77 0.24 0.44 0.35 0.00 0.00 0.00 179.25 179.51 3hq6 h PHE 317 N 0.88 0.81 0.00 0.00 3.57 0.12 -2.52 116.94 119.80 3hq6 h PHE 317 Ca 0.25 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.71 3hq6 h PHE 317 Cb -0.07 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 38.40 3hq6 h PHE 317 CO -0.03 0.45 -0.30 -0.07 -2.23 0.00 0.00 178.31 176.13 3hq6 h LEU 318 N 0.84 0.00 -2.00 0.59 3.38 -0.28 0.94 115.31 118.78 3hq6 h LEU 318 Ca 0.29 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.32 3hq6 h LEU 318 Cb 0.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 3hq6 h LEU 318 CO -0.12 0.30 0.37 1.23 0.09 0.00 0.00 178.44 180.31 3hq6 h GLY 319 N 0.97 0.00 -0.12 0.83 0.00 -0.88 -1.10 103.07 102.78 3hq6 h GLY 319 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3hq6 h GLY 319 CO 0.04 0.00 -0.09 -1.14 0.00 0.00 0.00 176.54 175.35 3hq6 n SER 320 N -3.30 1.25 -0.21 0.19 3.41 0.32 -3.87 113.62 111.41 3hq6 n SER 320 Ca 0.02 -1.23 0.15 0.00 -0.26 0.00 0.00 58.87 57.54 3hq6 n SER 320 Cb 0.48 0.04 0.73 0.00 -0.26 0.00 0.00 64.21 65.20 3hq6 n SER 320 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3hq6 n LEU 321 N -0.19 0.66 -4.65 1.04 4.77 -0.42 -1.40 117.00 116.81 3hq6 n LEU 321 Ca 0.17 -0.23 -0.42 0.00 -0.03 0.00 0.00 56.01 55.50 3hq6 n LEU 321 Cb 0.34 -0.01 -0.04 0.00 -2.33 0.00 0.00 43.42 41.39 3hq6 n LEU 321 CO 0.20 0.11 0.70 -0.89 -1.33 0.00 0.00 177.39 176.18 3hq6 s THR 322 N -1.99 4.81 0.48 -5.08 2.01 -1.25 -1.29 115.64 113.33 3hq6 s THR 322 Ca 0.42 1.67 0.06 0.00 0.31 0.00 0.00 61.69 64.15 3hq6 s THR 322 Cb 0.21 -4.16 0.06 0.00 0.01 0.00 0.00 72.50 68.62 3hq6 s THR 322 CO 0.34 -0.08 0.51 0.61 -0.69 0.00 0.00 174.62 175.30 3hq6 n GLY 323 N 3.63 2.40 3.66 4.40 0.00 -1.26 -4.29 105.19 113.73 3hq6 n GLY 323 Ca 0.07 -2.25 -0.44 0.00 0.00 0.00 0.00 46.02 43.40 3hq6 n GLY 323 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3hq6 n LYS 324 N -1.83 2.55 -2.20 1.61 5.02 -0.53 -4.91 118.16 117.87 3hq6 n LYS 324 Ca 0.06 0.92 -0.41 0.00 -2.02 0.00 0.00 58.31 56.86 3hq6 n LYS 324 Cb 0.53 -2.91 -0.03 0.00 -0.02 0.00 0.00 35.03 32.59 3hq6 n LYS 324 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 3hq6 s GLN 325 N 4.57 4.41 0.41 1.97 -1.52 -1.26 -4.19 119.66 124.06 3hq6 s GLN 325 Ca 0.92 2.10 -0.25 0.00 -1.95 0.00 0.00 55.36 56.18 3hq6 s GLN 325 Cb -0.51 -3.13 -0.08 0.00 -0.22 0.00 0.00 33.01 29.07 3hq6 s GLN 325 CO 0.45 -0.15 1.23 -1.25 -0.25 0.00 0.00 175.29 175.32 3hq6 s PRO 326 N -1.17 3.95 -0.58 2.91 0.04 -1.26 -4.95 135.00 133.93 3hq6 s PRO 326 Ca 0.51 1.99 -0.23 0.00 0.04 0.00 0.00 61.00 63.31 3hq6 s PRO 326 Cb -0.38 -2.67 0.06 0.00 0.04 0.00 0.00 34.50 31.55 3hq6 s PRO 326 CO 0.46 -0.45 0.90 0.15 0.04 0.00 0.00 177.00 178.10 3hq6 s LYS 327 N -2.33 3.21 -0.14 4.56 1.02 -1.26 -5.01 119.74 119.79 3hq6 s LYS 327 Ca 0.58 -0.58 -0.00 0.00 0.02 0.00 0.00 55.97 55.99 3hq6 s LYS 327 Cb -0.34 -4.13 -0.01 0.00 -0.52 0.00 0.00 37.83 32.83 3hq6 s LYS 327 CO 0.43 -1.57 -0.14 0.08 -0.92 0.00 0.00 175.35 173.24 3hq6 s VAL 328 N 3.77 2.93 -0.09 3.17 1.01 -1.26 -5.10 120.40 124.82 3hq6 s VAL 328 Ca 0.25 -0.70 -0.25 0.00 0.00 0.00 0.00 61.98 61.28 3hq6 s VAL 328 Cb -0.15 -2.23 -0.03 0.00 0.00 0.00 0.00 36.38 33.97 3hq6 s VAL 328 CO 0.15 0.52 0.79 -0.69 0.00 0.00 0.00 175.10 175.87 3hq6 s VAL 329 N 0.55 4.96 0.15 2.92 1.01 -1.26 -5.00 120.40 123.73 3hq6 s VAL 329 Ca -0.09 1.61 -0.33 0.00 0.00 0.00 0.00 61.98 63.17 3hq6 s VAL 329 Cb -0.16 -4.12 -0.13 0.00 0.00 0.00 0.00 36.38 31.97 3hq6 s VAL 329 CO 0.04 0.16 1.68 0.00 0.00 0.00 0.00 175.10 176.97 3hq6 n TYR 330 N 4.32 2.46 -1.89 5.22 9.36 -1.26 -4.89 117.16 130.49 3hq6 n TYR 330 Ca 0.02 0.12 -0.38 0.00 3.32 0.00 0.00 57.90 60.98 3hq6 n TYR 330 Cb 0.50 -2.62 0.03 0.00 -0.63 0.00 0.00 39.34 36.63 3hq6 n TYR 330 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 3hq6 s PRO 331 N 1.53 3.20 -0.43 2.98 0.04 -1.26 -4.98 135.00 136.08 3hq6 s PRO 331 Ca 0.79 2.11 -0.17 0.00 0.04 0.00 0.00 61.00 63.77 3hq6 s PRO 331 Cb -0.60 -2.23 0.03 0.00 0.04 0.00 0.00 34.50 31.73 3hq6 s PRO 331 CO 0.37 -1.10 0.43 0.42 0.04 0.00 0.00 177.00 177.17 3hq6 s ILE 332 N -1.37 5.10 0.01 0.56 1.01 -1.26 -5.04 121.20 120.21 3hq6 s ILE 332 Ca 0.71 -0.44 -0.03 0.00 0.00 0.00 0.00 60.65 60.89 3hq6 s ILE 332 Cb -0.37 -4.05 -0.04 0.00 0.01 0.00 0.00 42.46 38.00 3hq6 s ILE 332 CO 0.44 -0.45 0.22 -0.04 0.00 0.00 0.00 174.94 175.11 3hq6 s MET 333 N 2.09 3.48 0.13 2.79 -1.94 -1.26 -5.03 119.30 119.56 3hq6 s MET 333 Ca 0.11 -0.27 -0.17 0.00 -1.71 0.00 0.00 55.69 53.65 3hq6 s MET 333 Cb -0.18 -3.07 -0.07 0.00 2.01 0.00 0.00 34.83 33.52 3hq6 s MET 333 CO 0.13 0.65 0.59 -1.25 -0.01 0.00 0.00 175.02 175.12 3hq6 s PRO 334 N -2.03 4.12 0.43 2.03 0.04 -1.26 -4.99 135.00 133.33 3hq6 s PRO 334 Ca 0.29 0.66 -0.26 0.00 0.04 0.00 0.00 61.00 61.73 3hq6 s PRO 334 Cb -0.13 -3.04 -0.09 0.00 0.04 0.00 0.00 34.50 31.28 3hq6 s PRO 334 CO 0.20 0.52 1.46 0.00 0.04 0.00 0.00 177.00 179.22 3hq6 n ALA 335 N 1.13 2.18 -0.32 8.56 0.00 -1.26 -5.02 120.51 125.78 3hq6 n ALA 335 Ca -0.07 0.27 -0.30 0.00 0.00 0.00 0.00 53.44 53.35 3hq6 n ALA 335 Cb 0.51 -2.41 0.29 0.00 0.00 0.00 0.00 19.45 17.84 3hq6 n ALA 335 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3hq6 n SER 336 N -0.02 -3.23 -3.82 0.00 7.64 -1.26 -4.89 113.62 108.04 3hq6 n SER 336 Ca 0.04 -0.59 -0.22 0.00 1.01 0.00 0.00 58.87 59.11 3hq6 n SER 336 Cb 0.41 -1.11 -0.08 0.00 -1.01 0.00 0.00 64.21 62.42 3hq6 n SER 336 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3hq6 s THR 337 N -2.23 0.31 0.58 0.44 -4.23 -1.26 -4.99 115.64 104.26 3hq6 s THR 337 Ca 0.68 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 59.47 3hq6 s THR 337 Cb -0.18 -2.44 0.35 0.00 1.34 0.00 0.00 72.50 71.57 3hq6 s THR 337 CO 0.61 0.00 2.19 0.44 -0.54 0.00 0.00 174.62 177.32 3hq6 h ASP 338 N 2.03 0.00 1.59 3.99 3.32 -1.98 0.15 116.42 125.52 3hq6 h ASP 338 Ca -0.31 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.74 3hq6 h ASP 338 Cb 1.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.80 3hq6 h ASP 338 CO 0.48 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 178.00 3hq6 h ALA 339 N 1.92 1.00 -2.49 3.45 0.00 -1.96 -3.46 119.26 117.72 3hq6 h ALA 339 Ca 0.03 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.41 3hq6 h ALA 339 Cb 0.18 0.00 0.02 0.00 0.00 0.00 0.00 17.79 17.99 3hq6 h ALA 339 CO -0.00 0.00 0.80 0.99 0.00 0.00 0.00 179.25 181.04 3hq6 s THR 340 N -3.14 3.36 0.56 0.00 2.01 0.04 -4.90 115.64 113.56 3hq6 s THR 340 Ca 0.09 0.91 -0.20 0.00 0.31 0.00 0.00 61.69 62.80 3hq6 s THR 340 Cb 0.10 -3.58 -0.07 0.00 0.01 0.00 0.00 72.50 68.96 3hq6 s THR 340 CO 0.61 0.04 0.91 -2.65 -0.69 0.00 0.00 174.62 172.85 3hq6 n PRO 341 N 4.56 0.95 -2.23 4.92 -0.02 -1.26 -4.85 135.00 137.07 3hq6 n PRO 341 Ca 0.13 0.36 -0.29 0.00 -2.02 0.00 0.00 63.50 61.68 3hq6 n PRO 341 Cb 0.42 -2.08 0.02 0.00 -0.02 0.00 0.00 33.50 31.85 3hq6 n PRO 341 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3hq6 s ARG 342 N -2.50 3.21 0.07 -0.52 1.81 -1.26 -5.01 118.95 114.76 3hq6 s ARG 342 Ca 0.72 0.31 -0.37 0.00 -1.72 0.00 0.00 55.73 54.67 3hq6 s ARG 342 Cb -0.45 -2.20 -0.18 0.00 -0.45 0.00 0.00 34.95 31.67 3hq6 s ARG 342 CO 0.50 -0.62 1.23 -2.30 -0.68 0.00 0.00 175.30 173.43 3hq6 n PRO 343 N -2.63 0.80 -2.33 3.54 -0.02 -1.26 -4.88 135.00 128.22 3hq6 n PRO 343 Ca 0.04 0.29 -0.43 0.00 -2.02 0.00 0.00 63.50 61.38 3hq6 n PRO 343 Cb 0.56 -1.86 -0.02 0.00 -0.02 0.00 0.00 33.50 32.15 3hq6 n PRO 343 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 3hq6 s ARG 344 N 0.22 3.95 0.00 -0.52 3.52 0.54 -4.95 118.95 121.71 3hq6 s ARG 344 Ca 0.85 1.45 0.27 0.00 -0.13 0.00 0.00 55.73 58.16 3hq6 s ARG 344 Cb -1.03 -3.90 0.76 0.00 -1.56 0.00 0.00 34.95 29.22 3hq6 s ARG 344 CO 0.50 -1.08 1.58 1.28 -0.81 0.00 0.00 175.30 176.77