#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hj8 s ALA 25 N 0.00 3.24 0.07 2.89 0.00 -1.26 -5.06 121.76 121.63 3hj8 s ALA 25 Ca 0.00 0.60 0.00 0.00 0.00 0.00 0.00 51.96 52.56 3hj8 s ALA 25 Cb 0.00 -3.31 -0.04 0.00 0.00 0.00 0.00 23.12 19.77 3hj8 s ALA 25 CO 0.00 -0.13 -0.04 0.95 0.00 0.00 0.00 175.76 176.54 3hj8 s THR 26 N 0.36 0.40 0.03 0.00 -4.23 -1.26 -5.17 115.64 105.76 3hj8 s THR 26 Ca 0.49 -1.84 -0.02 0.00 -1.18 0.00 0.00 61.69 59.14 3hj8 s THR 26 Cb -0.23 -1.56 -0.02 0.00 1.34 0.00 0.00 72.50 72.02 3hj8 s THR 26 CO 0.30 -0.94 0.01 0.00 -0.54 0.00 0.00 174.62 173.44 3hj8 s ALA 27 N -3.76 0.16 -1.15 3.99 0.00 -1.26 -5.08 121.76 114.65 3hj8 s ALA 27 Ca 0.08 -0.72 -0.08 0.00 0.00 0.00 0.00 51.96 51.25 3hj8 s ALA 27 Cb 0.07 0.20 0.25 0.00 0.00 0.00 0.00 23.12 23.64 3hj8 s ALA 27 CO -0.08 -0.25 1.48 -0.40 0.00 0.00 0.00 175.76 176.51 3hj8 n ASP 28 N 1.02 5.74 -4.54 0.00 5.68 -1.26 -4.97 116.55 118.21 3hj8 n ASP 28 Ca -0.20 -3.19 -0.36 0.00 -0.50 0.00 0.00 54.79 50.53 3hj8 n ASP 28 Cb 0.57 -1.39 -0.11 0.00 -1.14 0.00 0.00 41.12 39.05 3hj8 n ASP 28 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 3hj8 s THR 29 N -1.08 4.74 0.53 2.12 2.01 -1.26 -5.09 115.64 117.61 3hj8 s THR 29 Ca 0.35 -0.03 -0.20 0.00 0.31 0.00 0.00 61.69 62.11 3hj8 s THR 29 Cb 0.01 -3.21 -0.06 0.00 0.01 0.00 0.00 72.50 69.26 3hj8 s THR 29 CO 0.02 0.35 1.15 -0.94 -0.69 0.00 0.00 174.62 174.51 3hj8 s SER 30 N 1.27 5.77 0.39 3.53 1.04 -1.26 -4.86 113.70 119.58 3hj8 s SER 30 Ca 0.06 2.23 0.17 0.00 0.48 0.00 0.00 55.95 58.88 3hj8 s SER 30 Cb -0.14 -2.59 1.07 0.00 0.10 0.00 0.00 66.02 64.46 3hj8 s SER 30 CO 0.05 -1.19 1.77 1.55 0.98 0.00 0.00 173.24 176.40 3hj8 h PRO 31 N 1.35 0.41 -0.52 4.02 0.13 -1.99 -1.65 132.00 133.76 3hj8 h PRO 31 Ca -0.50 -0.02 0.03 0.00 -0.87 0.00 0.00 66.00 64.64 3hj8 h PRO 31 Cb 1.26 -0.09 -0.04 0.00 0.13 0.00 0.00 31.00 32.26 3hj8 h PRO 31 CO 0.57 0.27 0.29 1.49 -0.23 0.00 0.00 178.00 180.40 3hj8 h GLU 32 N 0.42 0.56 0.10 0.86 4.22 -1.99 -0.51 114.58 118.24 3hj8 h GLU 32 Ca 0.59 -0.03 -0.00 0.00 0.08 0.00 0.00 59.36 60.00 3hj8 h GLU 32 Cb 1.46 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.58 3hj8 h GLU 32 CO -0.31 0.37 -0.05 -0.09 -2.18 0.00 0.00 179.01 176.75 3hj8 h ARG 33 N 0.58 -0.13 -0.72 1.92 2.43 -1.68 -2.55 114.38 114.22 3hj8 h ARG 33 Ca 0.21 0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.44 3hj8 h ARG 33 Cb 0.06 0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.59 3hj8 h ARG 33 CO -0.12 0.17 0.43 1.25 -1.51 0.00 0.00 179.97 180.19 3hj8 h LEU 34 N -0.43 0.68 -0.96 3.80 5.85 -1.30 0.13 115.31 123.08 3hj8 h LEU 34 Ca -0.01 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.77 3hj8 h LEU 34 Cb 0.36 -0.13 -0.06 0.00 0.37 0.00 0.00 40.66 41.20 3hj8 h LEU 34 CO 0.02 0.46 0.62 0.00 -0.34 0.00 0.00 178.44 179.20 3hj8 h ALA 35 N 1.33 1.29 -0.25 1.25 0.00 -1.11 0.64 119.26 122.42 3hj8 h ALA 35 Ca 0.30 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 55.05 3hj8 h ALA 35 Cb 0.10 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 3hj8 h ALA 35 CO -0.14 0.46 -0.35 0.00 0.00 0.00 0.00 179.25 179.22 3hj8 h ALA 36 N 1.41 0.38 -0.25 0.00 0.00 -0.81 -0.80 119.26 119.19 3hj8 h ALA 36 Ca 0.39 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3hj8 h ALA 36 Cb 0.07 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3hj8 h ALA 36 CO -0.14 0.44 0.13 0.82 0.00 0.00 0.00 179.25 180.50 3hj8 h ILE 37 N 0.40 1.13 -0.10 0.00 2.04 -0.52 -1.67 117.51 118.79 3hj8 h ILE 37 Ca 0.03 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.54 3hj8 h ILE 37 Cb 0.93 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.91 3hj8 h ILE 37 CO 0.08 0.12 0.07 0.00 0.00 0.00 0.00 178.15 178.42 3hj8 h ALA 38 N 1.00 0.13 -0.43 1.87 0.00 0.31 0.17 119.26 122.31 3hj8 h ALA 38 Ca 0.09 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.07 3hj8 h ALA 38 Cb 0.08 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 17.76 3hj8 h ALA 38 CO -0.01 -0.37 -0.03 -0.22 0.00 0.00 0.00 179.25 178.61 3hj8 h LYS 39 N 0.13 0.07 -0.35 0.00 3.64 -1.07 0.35 116.57 119.35 3hj8 h LYS 39 Ca 0.04 -0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.32 3hj8 h LYS 39 Cb -0.01 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 3hj8 h LYS 39 CO -0.01 0.05 -0.14 -0.44 -2.27 0.00 0.00 179.45 176.64 3hj8 h ASP 40 N 0.08 0.73 -0.22 4.20 3.45 -0.91 -1.61 116.42 122.13 3hj8 h ASP 40 Ca 0.21 -0.39 -0.02 0.00 0.43 0.00 0.00 57.03 57.26 3hj8 h ASP 40 Cb 0.31 -0.20 -0.01 0.00 -0.56 0.00 0.00 39.33 38.87 3hj8 h ASP 40 CO -0.38 0.96 0.06 0.00 -1.57 0.00 0.00 179.24 178.32 3hj8 h ALA 41 N 0.80 0.30 -0.08 3.45 0.00 -0.43 -1.63 119.26 121.66 3hj8 h ALA 41 Ca 0.08 -0.15 -0.22 0.00 0.00 0.00 0.00 54.91 54.62 3hj8 h ALA 41 Cb 0.67 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.39 3hj8 h ALA 41 CO 0.05 -0.07 -0.81 -0.07 0.00 0.00 0.00 179.25 178.35 3hj8 h LEU 42 N 0.19 0.85 -0.74 0.00 3.38 -0.99 -2.49 115.31 115.51 3hj8 h LEU 42 Ca 0.07 -0.68 0.05 0.00 0.09 0.00 0.00 57.88 57.41 3hj8 h LEU 42 Cb 0.25 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.70 3hj8 h LEU 42 CO -0.00 1.41 0.45 1.23 0.09 0.00 0.00 178.44 181.62 3hj8 h GLY 43 N 0.37 1.09 0.89 0.83 0.00 -1.34 -0.05 103.07 104.85 3hj8 h GLY 43 Ca -0.08 -0.33 -0.03 0.00 0.00 0.00 0.00 47.33 46.89 3hj8 h GLY 43 CO 0.16 0.25 0.07 0.00 0.00 0.00 0.00 176.54 177.03 3hj8 h ALA 44 N 1.34 0.36 -0.11 3.60 0.00 -1.22 0.16 119.26 123.39 3hj8 h ALA 44 Ca 0.31 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 3hj8 h ALA 44 Cb 0.10 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3hj8 h ALA 44 CO -0.14 0.02 0.07 -0.07 0.00 0.00 0.00 179.25 179.12 3hj8 h LEU 45 N 0.28 0.13 -1.13 0.00 4.07 -1.30 -1.59 115.31 115.77 3hj8 h LEU 45 Ca 0.09 -0.05 0.00 0.00 0.08 0.00 0.00 57.88 58.00 3hj8 h LEU 45 Cb 0.28 -0.03 -0.04 0.00 1.08 0.00 0.00 40.66 41.94 3hj8 h LEU 45 CO 0.00 0.15 0.54 0.78 -1.08 0.00 0.00 178.44 178.83 3hj8 h ASN 46 N 0.11 0.99 -0.58 -0.43 4.21 -0.71 -1.60 115.58 117.56 3hj8 h ASN 46 Ca 0.04 -0.04 -0.01 0.00 1.21 0.00 0.00 56.30 57.50 3hj8 h ASN 46 Cb 0.04 -0.25 -0.03 0.00 -1.12 0.00 0.00 38.32 36.96 3hj8 h ASN 46 CO -0.01 0.74 0.31 0.44 -1.29 0.00 0.00 177.43 177.62 3hj8 h ASP 47 N 1.16 0.74 -0.46 5.81 3.32 -0.46 -1.72 116.42 124.80 3hj8 h ASP 47 Ca 0.31 -0.10 0.06 0.00 0.02 0.00 0.00 57.03 57.32 3hj8 h ASP 47 Cb -0.10 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.24 3hj8 h ASP 47 CO -0.06 0.63 0.31 0.58 -1.72 0.00 0.00 179.24 178.98 3hj8 h VAL 48 N 0.79 0.96 -0.05 -1.35 2.07 -0.49 0.35 116.25 118.53 3hj8 h VAL 48 Ca 0.20 -0.13 -0.03 0.00 0.82 0.00 0.00 66.70 67.56 3hj8 h VAL 48 Cb 0.06 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 3hj8 h VAL 48 CO -0.03 0.07 -0.10 0.40 0.02 0.00 0.00 177.57 177.93 3hj8 h ILE 49 N 0.37 1.42 -0.26 4.57 2.04 -0.75 -2.26 117.51 122.64 3hj8 h ILE 49 Ca 0.20 -1.40 -0.04 0.00 1.00 0.00 0.00 64.86 64.62 3hj8 h ILE 49 Cb 0.33 2.22 -0.01 0.00 -0.74 0.00 0.00 36.82 38.61 3hj8 h ILE 49 CO -0.05 0.38 -0.01 -0.07 0.00 0.00 0.00 178.15 178.41 3hj8 h LEU 50 N -0.34 0.36 0.05 1.44 3.38 -0.98 -1.40 115.31 117.83 3hj8 h LEU 50 Ca 0.00 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 3hj8 h LEU 50 Cb 0.67 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.33 3hj8 h LEU 50 CO 0.02 0.43 -0.02 0.50 0.09 0.00 0.00 178.44 179.46 3hj8 h LYS 51 N 0.38 -0.06 -0.16 1.13 3.64 -0.23 -3.31 116.57 117.97 3hj8 h LYS 51 Ca 0.09 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3hj8 h LYS 51 Cb 0.27 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 3hj8 h LYS 51 CO 0.01 0.27 0.00 0.72 -2.27 0.00 0.00 179.45 178.18 3hj8 n HIS 52 N -4.96 0.19 -3.32 1.91 8.25 -0.86 -4.95 115.22 111.48 3hj8 n HIS 52 Ca -0.08 -0.09 -0.16 0.00 -0.26 0.00 0.00 57.72 57.12 3hj8 n HIS 52 Cb 0.19 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.38 3hj8 n HIS 52 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hj8 n GLY 53 N 1.34 -0.93 3.65 -1.41 0.00 -0.62 -4.89 105.19 102.32 3hj8 n GLY 53 Ca 0.17 0.45 -0.42 0.00 0.00 0.00 0.00 46.02 46.21 3hj8 n GLY 53 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hj8 s VAL 54 N -3.39 3.46 0.79 1.61 1.01 -0.65 -4.98 120.40 118.25 3hj8 s VAL 54 Ca 0.33 0.54 -0.10 0.00 0.00 0.00 0.00 61.98 62.75 3hj8 s VAL 54 Cb -0.05 -3.40 0.09 0.00 0.00 0.00 0.00 36.38 33.03 3hj8 s VAL 54 CO 0.74 -0.10 1.13 0.42 0.00 0.00 0.00 175.10 177.29 3hj8 s THR 55 N 4.75 2.12 0.14 3.92 -4.23 -1.26 -4.89 115.64 116.18 3hj8 s THR 55 Ca 0.78 -0.14 -0.14 0.00 -1.18 0.00 0.00 61.69 61.01 3hj8 s THR 55 Cb -0.33 -2.98 -0.00 0.00 1.34 0.00 0.00 72.50 70.53 3hj8 s THR 55 CO 0.32 0.00 1.60 1.88 -0.54 0.00 0.00 174.62 177.88 3hj8 h TYR 56 N -0.94 0.83 -0.47 3.99 -1.99 -1.98 -1.18 116.97 115.22 3hj8 h TYR 56 Ca -0.45 -0.13 0.03 0.00 2.00 0.00 0.00 58.73 60.18 3hj8 h TYR 56 Cb 1.31 -0.22 -0.03 0.00 2.00 0.00 0.00 36.73 39.78 3hj8 h TYR 56 CO 0.07 0.80 0.27 -1.35 -0.00 0.00 0.00 178.16 177.95 3hj8 h PRO 57 N 0.62 0.52 -0.84 4.88 0.11 -2.00 -0.56 132.00 134.73 3hj8 h PRO 57 Ca 0.13 -0.03 0.05 0.00 0.11 0.00 0.00 66.00 66.26 3hj8 h PRO 57 Cb 0.45 -0.12 -0.05 0.00 0.11 0.00 0.00 31.00 31.39 3hj8 h PRO 57 CO 0.02 0.34 0.55 0.93 -0.21 0.00 0.00 178.00 179.63 3hj8 h GLU 58 N 0.54 0.96 -0.84 1.05 5.08 -1.94 -1.38 114.58 118.04 3hj8 h GLU 58 Ca 0.19 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.48 3hj8 h GLU 58 Cb 0.04 -0.22 -0.04 0.00 0.50 0.00 0.00 28.75 29.04 3hj8 h GLU 58 CO -0.10 0.63 0.46 -0.92 -1.00 0.00 0.00 179.01 178.08 3hj8 h TYR 59 N 0.99 1.16 -0.28 4.33 3.20 -0.67 -0.82 116.97 124.88 3hj8 h TYR 59 Ca 0.35 -0.03 -0.07 0.00 3.14 0.00 0.00 58.73 62.12 3hj8 h TYR 59 Cb 0.13 -0.37 -0.02 0.00 1.54 0.00 0.00 36.73 38.01 3hj8 h TYR 59 CO -0.00 0.80 -0.12 0.00 -1.64 0.00 0.00 178.16 177.20 3hj8 h ARG 60 N 1.17 0.46 -0.48 1.82 3.08 -0.15 -1.23 114.38 119.06 3hj8 h ARG 60 Ca 0.30 -0.13 -0.13 0.00 0.07 0.00 0.00 59.98 60.09 3hj8 h ARG 60 Cb 0.03 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 3hj8 h ARG 60 CO -0.05 0.58 -0.19 0.28 -1.07 0.00 0.00 179.97 179.53 3hj8 h VAL 61 N 0.43 1.27 -0.42 2.04 2.07 -0.96 -1.13 116.25 119.54 3hj8 h VAL 61 Ca 0.08 -1.35 -0.07 0.00 0.82 0.00 0.00 66.70 66.19 3hj8 h VAL 61 Cb 0.47 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 3hj8 h VAL 61 CO 0.03 0.47 0.00 0.15 0.02 0.00 0.00 177.57 178.24 3hj8 h PHE 62 N 0.84 0.81 -0.41 1.57 -0.00 -0.91 -1.54 116.94 117.31 3hj8 h PHE 62 Ca 0.11 -0.14 0.00 0.00 -0.00 0.00 0.00 57.97 57.94 3hj8 h PHE 62 Cb 0.76 -0.21 -0.02 0.00 -0.00 0.00 0.00 35.95 36.48 3hj8 h PHE 62 CO 0.05 0.81 0.25 -0.22 -0.00 0.00 0.00 178.31 179.20 3hj8 h LYS 63 N 0.59 0.55 -0.39 1.11 3.64 -1.18 -1.74 116.57 119.13 3hj8 h LYS 63 Ca 0.12 -0.04 -0.10 0.00 -1.27 0.00 0.00 60.65 59.36 3hj8 h LYS 63 Cb 0.48 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 3hj8 h LYS 63 CO 0.02 0.39 -0.17 0.37 -2.27 0.00 0.00 179.45 177.79 3hj8 h GLN 64 N 0.54 0.74 -0.36 1.90 5.75 -1.14 -2.65 115.11 119.88 3hj8 h GLN 64 Ca 0.15 -0.27 -0.10 0.00 -0.15 0.00 0.00 58.65 58.28 3hj8 h GLN 64 Cb -0.02 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.46 3hj8 h GLN 64 CO -0.03 0.86 -0.19 2.35 -2.65 0.00 0.00 178.83 179.17 3hj8 h TRP 65 N 0.66 0.76 -0.50 3.99 7.01 -1.19 -0.02 115.95 126.66 3hj8 h TRP 65 Ca 0.10 -0.16 -0.08 0.00 2.11 0.00 0.00 58.89 60.87 3hj8 h TRP 65 Cb 0.65 -0.19 -0.02 0.00 -2.10 0.00 0.00 29.16 27.50 3hj8 h TRP 65 CO 0.03 0.83 0.00 -0.07 -2.79 0.00 0.00 178.44 176.44 3hj8 h LEU 66 N 0.61 0.79 0.13 0.65 3.38 -1.21 0.04 115.31 119.69 3hj8 h LEU 66 Ca 0.09 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 3hj8 h LEU 66 Cb 0.66 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.20 3hj8 h LEU 66 CO 0.05 0.86 -0.06 0.40 0.09 0.00 0.00 178.44 179.78 3hj8 h ILE 67 N 0.77 0.95 -0.40 1.22 2.04 -1.23 -3.05 117.51 117.81 3hj8 h ILE 67 Ca 0.15 -0.27 0.08 0.00 1.00 0.00 0.00 64.86 65.82 3hj8 h ILE 67 Cb 0.46 1.12 -0.08 0.00 -0.74 0.00 0.00 36.82 37.58 3hj8 h ILE 67 CO 0.02 0.07 -0.11 0.44 0.00 0.00 0.00 178.15 178.56 3hj8 h ASP 68 N -0.29 -0.41 -0.54 1.72 3.32 -0.85 -0.26 116.42 119.09 3hj8 h ASP 68 Ca -0.02 0.12 0.11 0.00 0.02 0.00 0.00 57.03 57.26 3hj8 h ASP 68 Cb 0.24 0.26 -0.11 0.00 0.22 0.00 0.00 39.33 39.94 3hj8 h ASP 68 CO 0.03 -0.15 -0.23 0.58 -1.72 0.00 0.00 179.24 177.76 3hj8 h VAL 69 N -0.02 0.32 -0.12 -1.35 2.07 -1.01 0.12 116.25 116.26 3hj8 h VAL 69 Ca 0.19 0.00 -0.16 0.00 0.82 0.00 0.00 66.70 67.56 3hj8 h VAL 69 Cb 0.31 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 3hj8 h VAL 69 CO -0.42 0.00 -0.59 1.23 0.02 0.00 0.00 177.57 177.81 3hj8 h GLY 70 N -0.09 0.42 2.00 2.17 0.00 -1.35 -0.59 103.07 105.62 3hj8 h GLY 70 Ca 0.25 -0.51 -0.04 0.00 0.00 0.00 0.00 47.33 47.03 3hj8 h GLY 70 CO -0.61 0.46 -0.21 0.83 0.00 0.00 0.00 176.54 177.01 3hj8 h GLU 71 N 0.29 0.00 -0.12 4.80 5.08 -0.46 -2.64 114.58 121.52 3hj8 h GLU 71 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3hj8 h GLU 71 Cb 1.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.37 3hj8 h GLU 71 CO 0.10 0.21 0.00 0.41 -1.00 0.00 0.00 179.01 178.73 3hj8 n GLY 72 N -0.33 0.45 2.71 -3.84 0.00 0.36 -4.96 105.19 99.58 3hj8 n GLY 72 Ca -0.01 -0.50 -0.21 0.00 0.00 0.00 0.00 46.02 45.30 3hj8 n GLY 72 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hj8 n GLY 73 N 1.22 -0.48 1.33 -0.02 0.00 -0.99 -4.93 105.19 101.31 3hj8 n GLY 73 Ca 0.17 0.04 0.08 0.00 0.00 0.00 0.00 46.02 46.31 3hj8 n GLY 73 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hj8 n GLU 74 N -3.49 3.79 -0.07 1.61 1.02 -0.25 -4.52 120.64 118.74 3hj8 n GLU 74 Ca -0.17 -2.98 -0.11 0.00 -0.02 0.00 0.00 57.16 53.88 3hj8 n GLU 74 Cb 0.65 -2.03 -0.05 0.00 -0.02 0.00 0.00 31.44 29.99 3hj8 n GLU 74 CO 0.00 0.00 0.00 -1.49 1.18 0.00 0.00 177.13 176.82 3hj8 h TRP 75 N 2.77 0.37 -0.78 -0.32 -0.00 -1.92 0.40 115.95 116.48 3hj8 h TRP 75 Ca 0.00 -0.05 0.01 0.00 -0.00 0.00 0.00 58.89 58.85 3hj8 h TRP 75 Cb 1.68 -0.10 -0.04 0.00 -0.00 0.00 0.00 29.16 30.70 3hj8 h TRP 75 CO 0.76 0.48 0.51 -1.35 -0.00 0.00 0.00 178.44 178.84 3hj8 h PRO 76 N 0.16 1.02 0.11 0.49 0.11 -1.97 -1.09 132.00 130.84 3hj8 h PRO 76 Ca 0.07 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.11 3hj8 h PRO 76 Cb 0.31 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 31.19 3hj8 h PRO 76 CO 0.00 0.68 -0.05 1.25 -0.21 0.00 0.00 178.00 179.67 3hj8 h LEU 77 N 1.05 -0.12 -0.54 2.35 5.85 -1.82 -0.90 115.31 121.18 3hj8 h LEU 77 Ca 0.28 -0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.91 3hj8 h LEU 77 Cb -0.12 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 3hj8 h LEU 77 CO -0.06 -0.03 0.18 0.15 -0.34 0.00 0.00 178.44 178.34 3hj8 h PHE 78 N -0.21 0.86 -0.02 1.25 3.04 -0.82 -1.37 116.94 119.68 3hj8 h PHE 78 Ca -0.01 -0.08 -0.00 0.00 3.98 0.00 0.00 57.97 61.85 3hj8 h PHE 78 Cb 0.16 -0.25 -0.00 0.00 2.56 0.00 0.00 35.95 38.42 3hj8 h PHE 78 CO -0.05 0.73 0.00 -0.07 -2.02 0.00 0.00 178.31 176.90 3hj8 h LEU 79 N 0.75 0.03 -0.78 0.59 3.38 -1.17 -1.18 115.31 116.92 3hj8 h LEU 79 Ca 0.18 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 3hj8 h LEU 79 Cb 0.26 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 3hj8 h LEU 79 CO -0.01 0.30 0.46 0.44 0.09 0.00 0.00 178.44 179.72 3hj8 h ASP 80 N -0.24 0.95 -0.42 -0.43 3.32 -1.09 0.27 116.42 118.79 3hj8 h ASP 80 Ca 0.01 -0.08 -0.03 0.00 0.02 0.00 0.00 57.03 56.95 3hj8 h ASP 80 Cb 0.28 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 3hj8 h ASP 80 CO 0.00 0.75 0.14 0.58 -1.72 0.00 0.00 179.24 178.99 3hj8 h VAL 81 N 1.08 1.21 0.00 -1.35 2.07 -1.19 -3.31 116.25 114.75 3hj8 h VAL 81 Ca 0.28 -0.69 0.00 0.00 0.82 0.00 0.00 66.70 67.11 3hj8 h VAL 81 Cb -0.01 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 3hj8 h VAL 81 CO -0.05 0.25 -0.70 0.49 0.02 0.00 0.00 177.57 177.58 3hj8 n PHE 82 N -4.60 0.00 0.00 1.57 3.72 -0.45 -3.95 117.46 113.75 3hj8 n PHE 82 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 3hj8 n PHE 82 Cb 0.17 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 38.69 3hj8 n PHE 82 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 3hj8 n ILE 83 N -1.36 0.00 0.27 4.37 2.08 0.91 -4.84 119.36 120.79 3hj8 n ILE 83 Ca 0.02 0.00 0.13 0.00 0.56 0.00 0.00 62.75 63.46 3hj8 n ILE 83 Cb 0.22 -0.39 0.82 0.00 -0.75 0.00 0.00 39.64 39.54 3hj8 n ILE 83 CO 0.00 0.00 0.00 -0.08 0.56 0.00 0.00 176.55 177.03 3hj8 h GLU 84 N 0.00 0.00 -0.79 0.38 4.81 -1.50 -2.33 114.58 115.15 3hj8 h GLU 84 Ca 0.00 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.30 3hj8 h GLU 84 Cb 0.61 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.94 3hj8 h GLU 84 CO 0.00 0.00 0.51 1.12 -0.73 0.00 0.00 179.01 179.91 3hj8 h HIS 85 N 0.00 0.83 0.00 0.92 2.07 -1.80 -1.47 115.15 115.71 3hj8 h HIS 85 Ca 0.01 0.02 -0.10 0.00 -2.85 0.00 0.00 60.37 57.45 3hj8 h HIS 85 Cb 0.06 -0.27 -0.01 0.00 2.57 0.00 0.00 27.41 29.75 3hj8 h HIS 85 CO 0.00 0.43 -0.50 0.77 -3.07 0.00 0.00 177.93 175.56 3hj8 h SER 86 N 0.81 0.00 0.07 3.10 0.02 -1.78 -0.06 113.55 115.72 3hj8 h SER 86 Ca 0.35 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 61.11 3hj8 h SER 86 Cb 0.30 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.84 3hj8 h SER 86 CO -0.12 0.50 -0.69 0.58 -1.14 0.00 0.00 176.83 175.95 3hj8 h VAL 87 N 0.00 1.33 -0.04 2.27 2.07 -1.36 -2.34 116.25 118.18 3hj8 h VAL 87 Ca -0.00 -1.99 -0.25 0.00 0.82 0.00 0.00 66.70 65.27 3hj8 h VAL 87 Cb 1.01 1.97 0.02 0.00 -1.52 0.00 0.00 31.29 32.76 3hj8 h VAL 87 CO 0.06 0.61 -0.97 -0.08 0.02 0.00 0.00 177.57 177.22 3hj8 h GLU 88 N 0.40 0.70 -0.79 1.57 4.22 -1.22 -2.93 114.58 116.53 3hj8 h GLU 88 Ca -0.02 -0.70 0.12 0.00 0.08 0.00 0.00 59.36 58.84 3hj8 h GLU 88 Cb 1.27 0.19 -0.06 0.00 0.50 0.00 0.00 28.75 30.65 3hj8 h GLU 88 CO 0.13 1.29 0.52 1.49 -2.18 0.00 0.00 179.01 180.25 3hj8 h GLU 89 N 0.42 0.60 0.42 1.92 4.81 -0.97 0.61 114.58 122.39 3hj8 h GLU 89 Ca -0.11 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.07 3hj8 h GLU 89 Cb 1.61 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.86 3hj8 h GLU 89 CO 0.19 0.40 -0.20 0.28 -0.73 0.00 0.00 179.01 178.94 3hj8 h VAL 90 N 0.62 0.58 -0.27 0.32 2.07 -1.35 -3.07 116.25 115.15 3hj8 h VAL 90 Ca 0.38 -0.14 0.02 0.00 0.82 0.00 0.00 66.70 67.78 3hj8 h VAL 90 Cb 0.62 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 3hj8 h VAL 90 CO -0.15 0.03 0.18 0.25 0.02 0.00 0.00 177.57 177.90 3hj8 h LEU 91 N -0.65 0.26 -0.78 2.57 5.85 -0.97 -2.54 115.31 119.04 3hj8 h LEU 91 Ca -0.06 -0.01 0.13 0.00 0.84 0.00 0.00 57.88 58.79 3hj8 h LEU 91 Cb 0.48 -0.06 -0.09 0.00 0.37 0.00 0.00 40.66 41.36 3hj8 h LEU 91 CO 0.10 0.18 0.37 0.00 -0.34 0.00 0.00 178.44 178.75 3hj8 h ALA 92 N 1.84 1.12 -0.33 1.25 0.00 0.26 -2.70 119.26 120.69 3hj8 h ALA 92 Ca 0.11 0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.16 3hj8 h ALA 92 Cb 0.06 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.80 3hj8 h ALA 92 CO -0.02 -0.11 -0.02 0.00 0.00 0.00 0.00 179.25 179.09 3hj8 h ARG 93 N 0.56 0.06 -0.05 0.00 3.08 -1.43 -2.57 114.38 114.04 3hj8 h ARG 93 Ca 0.41 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.46 3hj8 h ARG 93 Cb 0.56 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.59 3hj8 h ARG 93 CO -0.35 0.04 0.00 -1.13 -1.07 0.00 0.00 179.97 177.46 3hj8 n SER 94 N -5.20 0.05 -4.16 7.04 3.41 -1.02 -4.84 113.62 108.90 3hj8 n SER 94 Ca 0.01 -1.59 -0.22 0.00 -0.26 0.00 0.00 58.87 56.81 3hj8 n SER 94 Cb 0.18 -0.03 -0.14 0.00 -0.26 0.00 0.00 64.21 63.96 3hj8 n SER 94 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3hj8 s ARG 95 N -1.93 1.10 -0.01 4.33 0.52 -0.97 -5.03 118.95 116.96 3hj8 s ARG 95 Ca 0.00 -0.75 0.06 0.00 -0.52 0.00 0.00 55.73 54.53 3hj8 s ARG 95 Cb 0.00 -1.12 -0.09 0.00 0.52 0.00 0.00 34.95 34.25 3hj8 s ARG 95 CO 0.00 0.29 0.15 1.63 0.02 0.00 0.00 175.30 177.39 3hj8 n LYS 96 N 2.08 0.82 0.00 3.54 5.02 -1.26 -4.97 118.16 123.38 3hj8 n LYS 96 Ca -0.17 -0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.07 3hj8 n LYS 96 Cb 0.54 -1.10 0.00 0.00 -0.02 0.00 0.00 35.03 34.46 3hj8 n LYS 96 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hj8 n GLY 97 N 2.02 -1.28 3.59 0.72 0.00 -1.26 -4.98 105.19 104.01 3hj8 n GLY 97 Ca -0.01 -1.56 -0.50 0.00 0.00 0.00 0.00 46.02 43.95 3hj8 n GLY 97 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3hj8 n THR 98 N -0.60 0.45 -1.63 2.61 -1.04 -0.24 -4.86 114.28 108.98 3hj8 n THR 98 Ca 0.00 -0.11 -0.45 0.00 -2.04 0.00 0.00 64.05 61.44 3hj8 n THR 98 Cb 0.00 -0.89 -0.03 0.00 -1.82 0.00 0.00 70.33 67.60 3hj8 n THR 98 CO 0.00 0.00 0.00 0.23 -0.64 0.00 0.00 175.07 174.66 3hj8 n MET 99 N 2.19 1.66 -2.54 -2.82 0.00 -1.26 -4.94 117.12 109.41 3hj8 n MET 99 Ca 0.16 0.59 -0.22 0.00 0.00 0.00 0.00 57.70 58.23 3hj8 n MET 99 Cb 0.23 -2.13 0.06 0.00 0.00 0.00 0.00 33.22 31.37 3hj8 n MET 99 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 3hj8 s GLY 100 N -0.05 1.79 0.29 3.03 0.00 -1.26 -4.77 107.32 106.34 3hj8 s GLY 100 Ca 0.66 -1.34 -0.07 0.00 0.00 0.00 0.00 44.72 43.96 3hj8 s GLY 100 CO 0.54 -0.97 0.45 -0.45 0.00 0.00 0.00 173.10 172.67 3hj8 s SER 101 N -4.51 0.35 0.65 1.64 0.15 -0.82 -4.79 113.70 106.36 3hj8 s SER 101 Ca 0.60 -1.22 -0.18 0.00 0.70 0.00 0.00 55.95 55.85 3hj8 s SER 101 Cb -0.09 0.60 -0.02 0.00 -1.71 0.00 0.00 66.02 64.80 3hj8 s SER 101 CO 0.41 -1.19 1.13 2.30 1.20 0.00 0.00 173.24 177.09 3hj8 n ILE 102 N -0.45 4.20 -0.11 6.45 -5.35 -1.26 -4.13 119.36 118.71 3hj8 n ILE 102 Ca -0.00 -0.48 -0.11 0.00 -0.27 0.00 0.00 62.75 61.89 3hj8 n ILE 102 Cb 0.62 -1.31 -0.03 0.00 -1.74 0.00 0.00 39.64 37.18 3hj8 n ILE 102 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 3hj8 h GLU 103 N 0.34 0.64 -0.09 6.28 4.81 -1.94 -3.44 114.58 121.19 3hj8 h GLU 103 Ca -0.50 -0.25 0.01 0.00 -0.13 0.00 0.00 59.36 58.50 3hj8 h GLU 103 Cb 1.35 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.69 3hj8 h GLU 103 CO 0.51 0.81 -0.02 0.41 -0.73 0.00 0.00 179.01 180.00 3hj8 n GLY 104 N -0.18 -1.58 0.47 1.92 0.00 -1.26 -4.63 105.19 99.93 3hj8 n GLY 104 Ca -0.02 -1.51 0.14 0.00 0.00 0.00 0.00 46.02 44.62 3hj8 n GLY 104 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3hj8 n PRO 105 N -1.74 1.54 -0.45 1.61 -0.05 -1.26 -4.47 135.00 130.17 3hj8 n PRO 105 Ca -0.00 -0.94 0.09 0.00 -0.05 0.00 0.00 63.50 62.60 3hj8 n PRO 105 Cb 0.02 -1.48 0.29 0.00 -0.05 0.00 0.00 33.50 32.28 3hj8 n PRO 105 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 175.50 176.11 3hj8 n TYR 106 N 0.09 1.10 -2.61 0.54 4.02 -1.26 -4.96 117.16 114.07 3hj8 n TYR 106 Ca 0.17 -0.60 -0.40 0.00 -0.01 0.00 0.00 57.90 57.06 3hj8 n TYR 106 Cb 0.37 -0.16 -0.05 0.00 -0.02 0.00 0.00 39.34 39.48 3hj8 n TYR 106 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 176.86 175.38 3hj8 s TYR 107 N -1.63 3.79 -0.03 -0.72 5.04 -1.26 -5.02 117.35 117.51 3hj8 s TYR 107 Ca 0.43 1.81 0.01 0.00 -2.44 0.00 0.00 57.07 56.88 3hj8 s TYR 107 Cb 0.27 -3.13 0.02 0.00 0.35 0.00 0.00 41.96 39.47 3hj8 s TYR 107 CO 0.22 -0.04 -0.03 0.42 -1.34 0.00 0.00 175.55 174.78 3hj8 s ILE 108 N -1.14 0.39 0.72 3.14 1.01 -1.26 -5.15 121.20 118.91 3hj8 s ILE 108 Ca 0.43 -0.08 -0.11 0.00 0.00 0.00 0.00 60.65 60.89 3hj8 s ILE 108 Cb -0.29 -0.42 0.03 0.00 0.01 0.00 0.00 42.46 41.79 3hj8 s ILE 108 CO 0.36 0.17 1.07 -1.61 0.00 0.00 0.00 174.94 174.94 3hj8 s GLU 109 N 0.69 2.69 -1.42 2.79 2.02 -1.26 -4.28 118.70 119.93 3hj8 s GLU 109 Ca -0.08 1.01 -0.08 0.00 0.02 0.00 0.00 54.97 55.84 3hj8 s GLU 109 Cb -0.11 -1.96 0.01 0.00 0.10 0.00 0.00 34.13 32.17 3hj8 s GLU 109 CO -0.00 -1.29 1.02 0.09 0.02 0.00 0.00 175.26 175.10 3hj8 n ASN 110 N -3.27 -6.25 -4.77 -0.19 3.02 -1.26 -4.99 115.26 97.56 3hj8 n ASN 110 Ca 0.08 -0.48 -0.40 0.00 -0.03 0.00 0.00 54.58 53.75 3hj8 n ASN 110 Cb 0.53 -4.95 -0.00 0.00 -0.61 0.00 0.00 39.78 34.75 3hj8 n ASN 110 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3hj8 s SER 111 N -3.15 6.28 0.29 6.41 1.04 -1.26 -4.89 113.70 118.41 3hj8 s SER 111 Ca 0.52 2.79 -0.30 0.00 0.48 0.00 0.00 55.95 59.44 3hj8 s SER 111 Cb -0.23 -2.65 -0.13 0.00 0.10 0.00 0.00 66.02 63.11 3hj8 s SER 111 CO 0.64 -0.89 1.37 -2.65 0.98 0.00 0.00 173.24 172.69 3hj8 n PRO 112 N 0.20 2.13 -2.00 4.02 -0.02 -1.26 -3.75 135.00 134.32 3hj8 n PRO 112 Ca 0.03 0.75 -0.35 0.00 -2.02 0.00 0.00 63.50 61.91 3hj8 n PRO 112 Cb 0.42 -2.38 0.03 0.00 -0.02 0.00 0.00 33.50 31.55 3hj8 n PRO 112 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3hj8 s GLU 113 N -1.09 3.01 0.06 -0.52 2.02 -1.26 -1.27 118.70 119.64 3hj8 s GLU 113 Ca 0.62 1.64 -0.07 0.00 0.02 0.00 0.00 54.97 57.17 3hj8 s GLU 113 Cb -0.60 -1.96 -0.01 0.00 0.10 0.00 0.00 34.13 31.67 3hj8 s GLU 113 CO 0.55 -1.13 0.14 -0.51 0.02 0.00 0.00 175.26 174.33 3hj8 s LEU 114 N -4.24 1.64 0.79 1.80 1.43 -0.26 -4.80 118.68 115.04 3hj8 s LEU 114 Ca 0.73 -0.61 -0.12 0.00 -1.03 0.00 0.00 54.13 53.10 3hj8 s LEU 114 Cb -0.25 0.81 0.07 0.00 0.03 0.00 0.00 46.19 46.84 3hj8 s LEU 114 CO 0.34 -0.62 1.12 -2.16 0.23 0.00 0.00 176.35 175.25 3hj8 s PRO 115 N -3.30 2.14 0.24 1.29 0.04 -1.26 -0.99 135.00 133.15 3hj8 s PRO 115 Ca 0.01 0.41 -0.10 0.00 0.04 0.00 0.00 61.00 61.35 3hj8 s PRO 115 Cb 0.03 -1.94 0.36 0.00 0.04 0.00 0.00 34.50 32.98 3hj8 s PRO 115 CO -0.08 -1.53 1.60 0.77 0.04 0.00 0.00 177.00 177.80 3hj8 h SER 116 N -1.02 -0.71 -3.74 6.66 0.02 -1.65 -3.30 113.55 109.81 3hj8 h SER 116 Ca -0.47 0.24 -0.65 0.00 -0.84 0.00 0.00 61.79 60.07 3hj8 h SER 116 Cb 1.29 0.49 -0.20 0.00 0.14 0.00 0.00 62.40 64.11 3hj8 h SER 116 CO 0.63 -0.26 -0.56 -0.75 -1.14 0.00 0.00 176.83 174.74 3hj8 s LYS 117 N -6.23 3.68 0.32 3.45 2.20 -1.26 0.07 119.74 121.98 3hj8 s LYS 117 Ca -0.14 -0.48 -0.15 0.00 -0.36 0.00 0.00 55.97 54.83 3hj8 s LYS 117 Cb 0.23 -3.52 0.03 0.00 -1.51 0.00 0.00 37.83 33.05 3hj8 s LYS 117 CO 0.76 -0.25 0.67 0.00 -0.36 0.00 0.00 175.35 176.17 3hj8 s THR 119 N -3.20 1.83 0.41 0.00 2.01 -1.26 -1.65 115.64 113.78 3hj8 s THR 119 Ca 0.17 -0.86 -0.25 0.00 0.31 0.00 0.00 61.69 61.06 3hj8 s THR 119 Cb -0.04 -1.62 -0.11 0.00 0.01 0.00 0.00 72.50 70.74 3hj8 s THR 119 CO 0.11 0.51 0.99 0.18 -0.69 0.00 0.00 174.62 175.72 3hj8 n LEU 120 N 3.89 2.42 -4.71 4.42 4.77 -0.28 -4.92 117.00 122.59 3hj8 n LEU 120 Ca -0.20 1.05 -0.42 0.00 -0.03 0.00 0.00 56.01 56.41 3hj8 n LEU 120 Cb 0.52 -1.34 -0.03 0.00 -2.33 0.00 0.00 43.42 40.24 3hj8 n LEU 120 CO 0.26 -1.52 1.37 -2.84 -1.33 0.00 0.00 177.39 173.33 3hj8 s PRO 121 N -1.94 4.14 0.06 3.23 0.02 -1.26 -4.88 135.00 134.37 3hj8 s PRO 121 Ca 0.63 2.55 -0.12 0.00 0.02 0.00 0.00 61.00 64.08 3hj8 s PRO 121 Cb -0.57 -3.22 0.01 0.00 0.02 0.00 0.00 34.50 30.74 3hj8 s PRO 121 CO 0.57 -0.75 0.26 0.00 -0.33 0.00 0.00 177.00 176.76 3hj8 s MET 122 N 1.57 0.82 1.01 5.54 0.23 -1.26 -0.87 119.30 126.35 3hj8 s MET 122 Ca 0.75 -0.67 -0.13 0.00 -1.03 0.00 0.00 55.69 54.61 3hj8 s MET 122 Cb -0.48 0.35 0.20 0.00 -1.53 0.00 0.00 34.83 33.37 3hj8 s MET 122 CO 0.33 -0.27 1.11 1.03 -2.03 0.00 0.00 175.02 175.19 3hj8 s ARG 123 N -3.02 0.30 0.44 3.16 0.52 -1.26 -4.94 118.95 114.15 3hj8 s ARG 123 Ca -0.02 0.34 0.14 0.00 -0.52 0.00 0.00 55.73 55.67 3hj8 s ARG 123 Cb 0.01 -1.74 0.97 0.00 0.52 0.00 0.00 34.95 34.71 3hj8 s ARG 123 CO -0.06 -2.78 1.98 1.05 0.02 0.00 0.00 175.30 175.51 3hj8 h GLU 124 N -1.92 0.04 -0.10 3.54 -0.00 -2.02 -2.82 114.58 111.30 3hj8 h GLU 124 Ca -0.52 -0.01 0.00 0.00 -0.00 0.00 0.00 59.36 58.83 3hj8 h GLU 124 Cb 1.33 -0.01 -0.01 0.00 -0.00 0.00 0.00 28.75 30.06 3hj8 h GLU 124 CO 0.55 0.21 0.06 0.93 -0.00 0.00 0.00 179.01 180.76 3hj8 h GLU 125 N 0.04 0.12 -0.35 1.06 3.07 -2.02 -3.17 114.58 113.32 3hj8 h GLU 125 Ca 0.01 -0.01 -0.02 0.00 -0.50 0.00 0.00 59.36 58.84 3hj8 h GLU 125 Cb 0.33 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 28.19 3hj8 h GLU 125 CO 0.02 0.08 0.14 -0.44 -1.40 0.00 0.00 179.01 177.41 3hj8 h ASP 126 N 0.12 0.44 0.00 1.42 3.32 -1.87 -1.84 116.42 118.01 3hj8 h ASP 126 Ca 0.04 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3hj8 h ASP 126 Cb -0.01 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.43 3hj8 h ASP 126 CO -0.02 0.40 0.08 -0.33 -1.72 0.00 0.00 179.24 177.66 3hj8 h GLU 127 N 0.49 0.00 -0.00 3.56 5.08 -1.50 -1.43 114.58 120.78 3hj8 h GLU 127 Ca 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 3hj8 h GLU 127 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 3hj8 h GLU 127 CO -0.01 0.00 -0.47 1.63 -1.00 0.00 0.00 179.01 179.15 3hj8 n LYS 128 N -2.24 0.33 -3.57 2.33 4.76 -0.69 -4.91 118.16 114.17 3hj8 n LYS 128 Ca -0.01 -0.21 -0.33 0.00 -2.87 0.00 0.00 58.31 54.89 3hj8 n LYS 128 Cb 0.12 -1.50 -0.05 0.00 -1.84 0.00 0.00 35.03 31.76 3hj8 n LYS 128 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3hj8 s ILE 129 N -2.81 5.08 0.05 -0.18 1.09 -0.54 -5.00 121.20 118.89 3hj8 s ILE 129 Ca 0.15 0.29 -0.35 0.00 -1.10 0.00 0.00 60.65 59.64 3hj8 s ILE 129 Cb 0.18 -3.63 -0.14 0.00 -1.06 0.00 0.00 42.46 37.81 3hj8 s ILE 129 CO 0.65 0.10 1.60 0.41 -0.10 0.00 0.00 174.94 177.60 3hj8 n THR 130 N 0.31 0.15 -2.54 2.92 -1.04 -1.26 -4.90 114.28 107.93 3hj8 n THR 130 Ca -0.04 -0.03 -0.35 0.00 -2.04 0.00 0.00 64.05 61.60 3hj8 n THR 130 Cb 0.52 -1.42 -0.04 0.00 -1.82 0.00 0.00 70.33 67.57 3hj8 n THR 130 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 3hj8 s PRO 131 N 1.73 3.94 -0.18 -2.82 0.02 -1.26 -3.49 135.00 132.93 3hj8 s PRO 131 Ca 0.85 1.43 0.01 0.00 0.02 0.00 0.00 61.00 63.31 3hj8 s PRO 131 Cb -0.78 -2.28 0.02 0.00 0.02 0.00 0.00 34.50 31.48 3hj8 s PRO 131 CO 0.45 -0.32 -0.20 -1.17 -0.33 0.00 0.00 177.00 175.44 3hj8 s LEU 132 N -3.14 2.15 -0.38 -5.54 2.96 0.12 -0.72 118.68 114.14 3hj8 s LEU 132 Ca 0.63 -0.64 -0.11 0.00 -0.22 0.00 0.00 54.13 53.79 3hj8 s LEU 132 Cb -0.19 -1.49 0.03 0.00 0.50 0.00 0.00 46.19 45.05 3hj8 s LEU 132 CO 0.23 -0.00 0.21 -0.69 -1.32 0.00 0.00 176.35 174.78 3hj8 s VAL 133 N 1.29 4.53 -0.25 1.68 1.01 0.98 0.37 120.40 130.02 3hj8 s VAL 133 Ca 0.05 -0.92 -0.07 0.00 0.00 0.00 0.00 61.98 61.04 3hj8 s VAL 133 Cb -0.13 -3.56 -0.02 0.00 0.00 0.00 0.00 36.38 32.67 3hj8 s VAL 133 CO -0.13 -0.26 0.07 0.12 0.00 0.00 0.00 175.10 174.89 3hj8 s PHE 134 N 1.54 3.08 0.13 5.22 2.19 0.34 -1.75 117.98 128.73 3hj8 s PHE 134 Ca 0.02 -0.51 0.07 0.00 0.33 0.00 0.00 56.93 56.84 3hj8 s PHE 134 Cb -0.20 -2.24 -0.04 0.00 -1.31 0.00 0.00 43.02 39.24 3hj8 s PHE 134 CO 0.06 -0.39 -0.16 -1.12 1.83 0.00 0.00 175.22 175.44 3hj8 s SER 135 N 1.60 2.24 0.00 6.13 0.01 -0.34 0.12 113.70 123.46 3hj8 s SER 135 Ca 0.06 -0.80 0.00 0.00 1.31 0.00 0.00 55.95 56.52 3hj8 s SER 135 Cb -0.15 -0.10 0.00 0.00 0.21 0.00 0.00 66.02 65.98 3hj8 s SER 135 CO 0.03 -0.08 0.00 0.61 0.41 0.00 0.00 173.24 174.21 3hj8 n GLY 136 N 0.59 -0.73 3.00 3.44 0.00 -1.10 -0.02 105.19 110.36 3hj8 n GLY 136 Ca -0.16 -1.03 -0.12 0.00 0.00 0.00 0.00 46.02 44.71 3hj8 n GLY 136 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3hj8 s GLN 137 N -1.53 0.14 -0.15 1.61 0.74 -1.25 -2.06 119.66 117.15 3hj8 s GLN 137 Ca 0.00 0.18 -0.21 0.00 0.05 0.00 0.00 55.36 55.38 3hj8 s GLN 137 Cb 0.00 0.06 -0.03 0.00 1.10 0.00 0.00 33.01 34.14 3hj8 s GLN 137 CO 0.00 -0.02 0.60 0.08 -0.55 0.00 0.00 175.29 175.40 3hj8 s VAL 138 N 0.12 5.07 0.22 1.34 1.01 0.29 -1.19 120.40 127.27 3hj8 s VAL 138 Ca -0.00 1.17 -0.00 0.00 0.00 0.00 0.00 61.98 63.15 3hj8 s VAL 138 Cb -0.01 -3.93 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 3hj8 s VAL 138 CO -0.00 0.19 0.12 0.42 0.00 0.00 0.00 175.10 175.83 3hj8 s THR 139 N 1.40 0.17 0.00 3.92 -4.23 0.52 -1.91 115.64 115.50 3hj8 s THR 139 Ca 0.30 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.81 3hj8 s THR 139 Cb -0.16 -2.54 0.00 0.00 1.34 0.00 0.00 72.50 71.14 3hj8 s THR 139 CO 0.12 0.00 0.00 -0.90 -0.54 0.00 0.00 174.62 173.30 3hj8 n ASP 140 N -0.38 0.00 0.23 3.99 5.68 -0.49 -1.18 116.55 124.40 3hj8 n ASP 140 Ca 0.02 -0.97 0.08 0.00 -0.50 0.00 0.00 54.79 53.42 3hj8 n ASP 140 Cb 0.66 0.00 0.53 0.00 -1.14 0.00 0.00 41.12 41.17 3hj8 n ASP 140 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 3hj8 h LEU 141 N 0.00 0.00 -0.01 -2.12 4.07 -1.90 -2.70 115.31 112.64 3hj8 h LEU 141 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3hj8 h LEU 141 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 3hj8 h LEU 141 CO 0.00 0.24 -0.65 0.47 -1.08 0.00 0.00 178.44 177.42 3hj8 n ASP 142 N -3.76 0.67 0.00 -0.43 8.00 -1.26 -4.96 116.55 114.81 3hj8 n ASP 142 Ca -0.01 -0.49 0.00 0.00 0.71 0.00 0.00 54.79 55.00 3hj8 n ASP 142 Cb 0.34 0.47 0.00 0.00 -0.02 0.00 0.00 41.12 41.91 3hj8 n ASP 142 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hj8 n GLY 143 N 1.50 1.06 3.72 0.44 0.00 -1.02 -5.08 105.19 105.81 3hj8 n GLY 143 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 3hj8 n GLY 143 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hj8 s ASN 144 N -2.00 7.10 0.51 1.61 -0.87 -1.26 -4.79 114.94 115.24 3hj8 s ASN 144 Ca 0.00 2.02 -0.21 0.00 -1.57 0.00 0.00 52.86 53.09 3hj8 s ASN 144 Cb 0.00 -2.58 -0.06 0.00 -0.02 0.00 0.00 41.25 38.59 3hj8 s ASN 144 CO 0.00 -0.44 1.21 -0.83 -2.57 0.00 0.00 177.10 174.47 3hj8 s GLY 145 N 0.92 2.78 -0.22 0.66 0.00 -1.26 -1.40 107.32 108.80 3hj8 s GLY 145 Ca 0.57 1.02 -0.02 0.00 0.00 0.00 0.00 44.72 46.30 3hj8 s GLY 145 CO 0.30 1.47 -0.09 1.08 0.00 0.00 0.00 173.10 175.86 3hj8 s LEU 146 N -3.42 2.83 0.40 0.66 1.43 -0.80 -4.88 118.68 114.90 3hj8 s LEU 146 Ca 0.69 -0.63 -0.24 0.00 -1.03 0.00 0.00 54.13 52.92 3hj8 s LEU 146 Cb -0.31 -1.65 -0.09 0.00 0.03 0.00 0.00 46.19 44.17 3hj8 s LEU 146 CO 0.36 -0.06 1.05 0.00 0.23 0.00 0.00 176.35 177.93 3hj8 s ALA 147 N 1.38 3.07 -1.07 4.21 0.00 -1.26 -3.39 121.76 124.70 3hj8 s ALA 147 Ca 0.03 0.69 -0.02 0.00 0.00 0.00 0.00 51.96 52.67 3hj8 s ALA 147 Cb -0.15 -3.27 0.00 0.00 0.00 0.00 0.00 23.12 19.70 3hj8 s ALA 147 CO -0.06 -0.21 0.20 0.41 0.00 0.00 0.00 175.76 176.10 3hj8 n GLY 148 N 0.29 -0.14 3.81 0.00 0.00 -1.26 -4.51 105.19 103.38 3hj8 n GLY 148 Ca 0.05 -0.26 -0.36 0.00 0.00 0.00 0.00 46.02 45.46 3hj8 n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hj8 s ALA 149 N -2.81 3.33 -0.05 4.61 0.00 -1.25 -4.12 121.76 121.47 3hj8 s ALA 149 Ca 0.10 0.24 0.06 0.00 0.00 0.00 0.00 51.96 52.36 3hj8 s ALA 149 Cb -0.04 -2.91 -0.01 0.00 0.00 0.00 0.00 23.12 20.15 3hj8 s ALA 149 CO 0.12 0.28 -0.24 0.15 0.00 0.00 0.00 175.76 176.07 3hj8 s LYS 150 N -2.22 2.42 -0.34 0.00 1.02 0.25 -1.74 119.74 119.13 3hj8 s LYS 150 Ca 0.47 -0.90 0.01 0.00 0.02 0.00 0.00 55.97 55.58 3hj8 s LYS 150 Cb -0.16 -2.14 0.09 0.00 -0.52 0.00 0.00 37.83 35.10 3hj8 s LYS 150 CO 0.20 0.45 0.06 0.08 -0.92 0.00 0.00 175.35 175.23 3hj8 s VAL 151 N -0.34 2.67 -0.29 3.17 1.01 -0.11 -1.33 120.40 125.18 3hj8 s VAL 151 Ca 0.02 -1.98 -0.22 0.00 0.00 0.00 0.00 61.98 59.80 3hj8 s VAL 151 Cb -0.12 -2.79 -0.01 0.00 0.00 0.00 0.00 36.38 33.46 3hj8 s VAL 151 CO 0.02 -0.45 0.70 -1.61 0.00 0.00 0.00 175.10 173.77 3hj8 s GLU 152 N 1.06 3.99 -0.13 2.72 2.02 0.13 -0.60 118.70 127.89 3hj8 s GLU 152 Ca 0.04 0.51 0.02 0.00 0.02 0.00 0.00 54.97 55.56 3hj8 s GLU 152 Cb -0.20 -3.71 -0.00 0.00 0.10 0.00 0.00 34.13 30.32 3hj8 s GLU 152 CO -0.05 -0.57 -0.19 -1.17 0.02 0.00 0.00 175.26 173.29 3hj8 s LEU 153 N 2.74 2.32 0.01 1.80 2.96 -0.84 -0.89 118.68 126.77 3hj8 s LEU 153 Ca 0.29 -0.50 0.01 0.00 -0.22 0.00 0.00 54.13 53.70 3hj8 s LEU 153 Cb -0.15 -1.50 -0.01 0.00 0.50 0.00 0.00 46.19 45.03 3hj8 s LEU 153 CO 0.11 0.12 -0.03 -1.66 -1.32 0.00 0.00 176.35 173.57 3hj8 s TRP 154 N 0.61 0.26 0.39 5.38 -2.14 -0.52 -1.78 118.94 121.14 3hj8 s TRP 154 Ca -0.11 -0.21 -0.14 0.00 2.66 0.00 0.00 56.10 58.30 3hj8 s TRP 154 Cb -0.16 -0.17 0.05 0.00 -3.10 0.00 0.00 33.47 30.09 3hj8 s TRP 154 CO 0.03 -0.06 0.76 -3.38 -2.66 0.00 0.00 176.95 171.65 3hj8 s HIS 155 N -0.55 0.23 0.28 1.66 -3.43 -1.00 -0.61 115.29 111.87 3hj8 s HIS 155 Ca -0.05 -0.88 -0.01 0.00 -0.80 0.00 0.00 55.06 53.33 3hj8 s HIS 155 Cb -0.04 0.76 -0.04 0.00 -1.43 0.00 0.00 32.58 31.83 3hj8 s HIS 155 CO -0.00 -1.55 0.48 0.00 -2.00 0.00 0.00 174.74 171.66 3hj8 s ALA 156 N -2.29 3.75 1.03 -1.38 0.00 -1.26 -4.72 121.76 116.89 3hj8 s ALA 156 Ca 0.17 -0.84 -0.12 0.00 0.00 0.00 0.00 51.96 51.18 3hj8 s ALA 156 Cb -0.05 -2.08 0.16 0.00 0.00 0.00 0.00 23.12 21.16 3hj8 s ALA 156 CO 0.13 0.21 0.88 -0.40 0.00 0.00 0.00 175.76 176.58 3hj8 n ASP 157 N -1.19 -0.26 0.01 0.00 5.68 -0.81 -4.25 116.55 115.73 3hj8 n ASP 157 Ca -0.04 -1.26 0.06 0.00 -0.50 0.00 0.00 54.79 53.04 3hj8 n ASP 157 Cb 0.55 -0.69 0.26 0.00 -1.14 0.00 0.00 41.12 40.10 3hj8 n ASP 157 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 3hj8 n ASN 158 N -3.71 0.06 -0.95 -1.12 5.15 -1.26 -0.58 115.26 112.85 3hj8 n ASN 158 Ca 0.11 0.52 0.12 0.00 -0.60 0.00 0.00 54.58 54.73 3hj8 n ASN 158 Cb 0.39 -0.53 0.23 0.00 -0.53 0.00 0.00 39.78 39.35 3hj8 n ASN 158 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 3hj8 n ASP 159 N -1.57 2.88 -1.88 1.20 10.43 -1.26 -4.75 116.55 121.60 3hj8 n ASP 159 Ca 0.03 -1.91 -0.15 0.00 2.57 0.00 0.00 54.79 55.33 3hj8 n ASP 159 Cb 0.13 -0.13 0.01 0.00 1.84 0.00 0.00 41.12 42.97 3hj8 n ASP 159 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3hj8 n GLY 160 N 1.38 -0.16 3.52 0.44 0.00 0.25 -5.04 105.19 105.57 3hj8 n GLY 160 Ca 0.17 -0.23 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 3hj8 n GLY 160 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hj8 s TYR 161 N -2.85 2.62 -0.08 1.61 4.12 -1.26 -4.77 117.35 116.74 3hj8 s TYR 161 Ca 0.11 -0.22 -0.05 0.00 0.02 0.00 0.00 57.07 56.94 3hj8 s TYR 161 Cb -0.05 -1.40 -0.04 0.00 -1.52 0.00 0.00 41.96 38.95 3hj8 s TYR 161 CO 0.14 0.39 0.13 0.71 0.02 0.00 0.00 175.55 176.94 3hj8 s TYR 162 N -1.14 3.52 0.50 2.71 1.51 -1.26 -1.93 117.35 121.25 3hj8 s TYR 162 Ca 0.19 0.42 -0.23 0.00 -1.01 0.00 0.00 57.07 56.44 3hj8 s TYR 162 Cb -0.11 -1.88 -0.06 0.00 -0.11 0.00 0.00 41.96 39.80 3hj8 s TYR 162 CO 0.11 0.67 1.30 -1.54 -1.11 0.00 0.00 175.55 174.99 3hj8 s SER 163 N -1.33 5.68 0.00 2.29 1.04 -1.26 -1.90 113.70 118.22 3hj8 s SER 163 Ca 0.19 2.64 0.00 0.00 0.48 0.00 0.00 55.95 59.26 3hj8 s SER 163 Cb -0.12 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.37 3hj8 s SER 163 CO 0.09 -1.28 0.00 0.00 0.98 0.00 0.00 173.24 173.03 3hj8 n GLN 164 N -0.68 -0.72 -0.56 4.02 6.02 -1.26 -4.72 117.38 119.48 3hj8 n GLN 164 Ca 0.08 0.18 0.02 0.00 -0.01 0.00 0.00 57.00 57.27 3hj8 n GLN 164 Cb 0.45 -3.85 0.02 0.00 1.02 0.00 0.00 30.24 27.88 3hj8 n GLN 164 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 3hj8 n PHE 165 N -2.37 0.00 -3.21 1.08 3.01 -0.80 -4.98 117.46 110.20 3hj8 n PHE 165 Ca 0.00 -0.20 0.02 0.00 1.01 0.00 0.00 57.45 58.28 3hj8 n PHE 165 Cb 0.18 -0.08 -0.02 0.00 -0.01 0.00 0.00 39.48 39.55 3hj8 n PHE 165 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3hj8 s ALA 166 N -0.40 -2.05 0.31 4.37 0.00 -1.11 -4.67 121.76 118.21 3hj8 s ALA 166 Ca 0.08 1.72 0.08 0.00 0.00 0.00 0.00 51.96 53.84 3hj8 s ALA 166 Cb 0.08 -2.06 0.84 0.00 0.00 0.00 0.00 23.12 21.98 3hj8 s ALA 166 CO -0.02 -1.29 1.72 -1.00 0.00 0.00 0.00 175.76 175.17 3hj8 h PRO 167 N 8.03 0.49 0.00 0.00 0.13 -1.93 -2.88 132.00 135.84 3hj8 h PRO 167 Ca -0.22 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 3hj8 h PRO 167 Cb 1.16 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.17 3hj8 h PRO 167 CO 0.25 0.33 0.00 -2.39 -0.23 0.00 0.00 178.00 175.96 3hj8 n HIS 168 N -4.95 0.00 -3.83 1.56 1.44 -1.26 -4.82 115.22 103.36 3hj8 n HIS 168 Ca 0.25 0.00 -0.34 0.00 -2.01 0.00 0.00 57.72 55.62 3hj8 n HIS 168 Cb 0.72 -0.50 -0.05 0.00 0.12 0.00 0.00 29.99 30.28 3hj8 n HIS 168 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 3hj8 s LEU 169 N -2.99 4.37 0.36 2.39 1.43 -1.09 -5.07 118.68 118.08 3hj8 s LEU 169 Ca 0.09 0.46 -0.28 0.00 -1.03 0.00 0.00 54.13 53.38 3hj8 s LEU 169 Cb 0.13 -2.56 -0.12 0.00 0.03 0.00 0.00 46.19 43.67 3hj8 s LEU 169 CO 0.35 0.28 1.42 -2.65 0.23 0.00 0.00 176.35 175.98 3hj8 n PRO 170 N 1.19 2.47 0.19 1.29 -0.02 -1.26 -4.68 135.00 134.17 3hj8 n PRO 170 Ca -0.12 0.87 0.14 0.00 -2.02 0.00 0.00 63.50 62.36 3hj8 n PRO 170 Cb 0.53 -2.54 0.62 0.00 -0.02 0.00 0.00 33.50 32.08 3hj8 n PRO 170 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 3hj8 h GLU 171 N 2.87 0.00 -0.04 -0.52 4.11 -1.95 -0.66 114.58 118.39 3hj8 h GLU 171 Ca -0.49 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 58.93 3hj8 h GLU 171 Cb 1.26 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 3hj8 h GLU 171 CO 0.64 0.00 -0.20 0.91 0.07 0.00 0.00 179.01 180.43 3hj8 n TRP 172 N -2.50 0.15 -1.68 2.06 7.02 -1.26 -4.14 117.44 117.08 3hj8 n TRP 172 Ca 0.01 -1.24 -0.48 0.00 -1.02 0.00 0.00 57.50 54.77 3hj8 n TRP 172 Cb 0.19 -0.23 -0.05 0.00 -2.42 0.00 0.00 31.31 28.81 3hj8 n TRP 172 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 3hj8 n ASN 173 N -1.23 3.43 -3.38 -0.99 4.05 -0.25 -2.11 115.26 114.78 3hj8 n ASN 173 Ca 0.19 0.98 -0.24 0.00 0.45 0.00 0.00 54.58 55.96 3hj8 n ASN 173 Cb 0.71 -1.38 0.05 0.00 1.23 0.00 0.00 39.78 40.39 3hj8 n ASN 173 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 3hj8 n LEU 174 N 6.30 -2.90 -3.91 1.20 4.77 -0.05 -4.31 117.00 118.11 3hj8 n LEU 174 Ca 0.22 -0.45 -0.17 0.00 -0.03 0.00 0.00 56.01 55.58 3hj8 n LEU 174 Cb 0.30 -2.91 -0.15 0.00 -2.33 0.00 0.00 43.42 38.33 3hj8 n LEU 174 CO 0.72 0.43 -0.39 -0.13 -1.33 0.00 0.00 177.39 176.69 3hj8 s ARG 175 N -6.08 0.44 0.13 3.23 0.52 -0.90 -2.37 118.95 113.92 3hj8 s ARG 175 Ca 0.47 -0.10 -0.24 0.00 -0.52 0.00 0.00 55.73 55.34 3hj8 s ARG 175 Cb -0.21 -0.48 0.07 0.00 0.52 0.00 0.00 34.95 34.85 3hj8 s ARG 175 CO 0.58 0.01 0.69 0.20 0.02 0.00 0.00 175.30 176.81 3hj8 s GLY 176 N 0.35 -0.53 -0.56 -3.53 0.00 -0.73 -4.62 107.32 97.71 3hj8 s GLY 176 Ca -0.04 0.55 -0.00 0.00 0.00 0.00 0.00 44.72 45.23 3hj8 s GLY 176 CO -0.00 0.18 0.35 -1.59 0.00 0.00 0.00 173.10 172.03 3hj8 s THR 177 N -3.59 3.27 -0.11 0.90 2.01 -0.40 -1.98 115.64 115.74 3hj8 s THR 177 Ca 0.03 -2.97 -0.30 0.00 0.31 0.00 0.00 61.69 58.76 3hj8 s THR 177 Cb -0.01 -3.19 -0.02 0.00 0.01 0.00 0.00 72.50 69.29 3hj8 s THR 177 CO -0.10 -0.83 1.19 -0.63 -0.69 0.00 0.00 174.62 173.57 3hj8 s ILE 178 N 0.01 4.34 -0.74 1.82 1.09 0.23 -1.10 121.20 126.86 3hj8 s ILE 178 Ca 0.16 1.65 -0.21 0.00 -1.10 0.00 0.00 60.65 61.15 3hj8 s ILE 178 Cb -0.22 -4.06 0.10 0.00 -1.06 0.00 0.00 42.46 37.22 3hj8 s ILE 178 CO -0.03 -0.06 0.98 -0.63 -0.10 0.00 0.00 174.94 175.10 3hj8 s ILE 179 N 2.69 4.54 0.21 2.92 -1.09 -0.16 -0.93 121.20 129.36 3hj8 s ILE 179 Ca 0.54 -0.87 -0.31 0.00 -2.23 0.00 0.00 60.65 57.78 3hj8 s ILE 179 Cb -0.22 -4.69 -0.10 0.00 -1.58 0.00 0.00 42.46 35.87 3hj8 s ILE 179 CO 0.18 -1.42 1.48 0.00 -1.23 0.00 0.00 174.94 173.95 3hj8 s ALA 180 N 3.38 3.68 1.31 9.38 0.00 -0.71 -1.78 121.76 137.02 3hj8 s ALA 180 Ca 0.24 1.32 -0.20 0.00 0.00 0.00 0.00 51.96 53.33 3hj8 s ALA 180 Cb -0.14 -3.58 0.33 0.00 0.00 0.00 0.00 23.12 19.73 3hj8 s ALA 180 CO 0.03 -0.74 1.00 0.16 0.00 0.00 0.00 175.76 176.20 3hj8 s ASP 181 N 0.70 -0.10 0.42 0.00 1.47 -0.79 -4.07 116.67 114.31 3hj8 s ASP 181 Ca 0.64 0.92 0.08 0.00 1.18 0.00 0.00 52.55 55.37 3hj8 s ASP 181 Cb -0.42 -1.34 0.43 0.00 -0.34 0.00 0.00 42.92 41.24 3hj8 s ASP 181 CO 0.38 -4.78 1.11 1.05 0.68 0.00 0.00 175.17 173.61 3hj8 h GLU 182 N -3.03 0.00 -0.04 2.11 -0.00 -1.92 0.43 114.58 112.14 3hj8 h GLU 182 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 58.88 3hj8 h GLU 182 Cb 1.33 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.08 3hj8 h GLU 182 CO 0.35 0.00 0.00 -0.85 -0.00 0.00 0.00 179.01 178.51 3hj8 n GLU 183 N -2.11 0.53 -0.60 1.06 -0.00 -1.26 -4.05 120.64 114.21 3hj8 n GLU 183 Ca -0.01 -1.13 0.00 0.00 -0.00 0.00 0.00 57.16 56.02 3hj8 n GLU 183 Cb 0.61 -1.17 0.00 0.00 -0.00 0.00 0.00 31.44 30.87 3hj8 n GLU 183 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3hj8 n GLY 184 N 0.47 0.68 3.92 -1.84 0.00 0.15 -4.22 105.19 104.36 3hj8 n GLY 184 Ca 0.06 -0.15 -0.31 0.00 0.00 0.00 0.00 46.02 45.61 3hj8 n GLY 184 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hj8 s ARG 185 N -0.58 3.44 -0.02 1.61 0.52 -1.26 0.11 118.95 122.76 3hj8 s ARG 185 Ca 0.00 -0.42 -0.06 0.00 -0.52 0.00 0.00 55.73 54.73 3hj8 s ARG 185 Cb 0.00 -3.05 0.00 0.00 0.52 0.00 0.00 34.95 32.43 3hj8 s ARG 185 CO 0.00 0.62 0.12 1.52 0.02 0.00 0.00 175.30 177.58 3hj8 s TYR 186 N -1.48 -0.02 -0.38 -0.53 1.13 -0.88 -1.88 117.35 113.31 3hj8 s TYR 186 Ca 0.34 0.05 0.01 0.00 -1.41 0.00 0.00 57.07 56.06 3hj8 s TYR 186 Cb -0.13 -0.02 0.12 0.00 -1.10 0.00 0.00 41.96 40.83 3hj8 s TYR 186 CO 0.27 -0.18 0.16 -2.00 -2.51 0.00 0.00 175.55 171.29 3hj8 s GLU 187 N -0.75 1.08 -0.28 -3.49 2.12 0.11 -2.70 118.70 114.80 3hj8 s GLU 187 Ca -0.08 -1.63 -0.08 0.00 0.36 0.00 0.00 54.97 53.53 3hj8 s GLU 187 Cb -0.05 -2.29 -0.02 0.00 0.26 0.00 0.00 34.13 32.03 3hj8 s GLU 187 CO 0.01 -1.07 0.10 0.42 -0.54 0.00 0.00 175.26 174.18 3hj8 s ILE 188 N 0.90 4.42 -0.25 -3.70 1.01 0.33 -2.10 121.20 121.81 3hj8 s ILE 188 Ca 0.14 -0.29 -0.12 0.00 0.00 0.00 0.00 60.65 60.38 3hj8 s ILE 188 Cb -0.21 -3.15 -0.05 0.00 0.01 0.00 0.00 42.46 39.06 3hj8 s ILE 188 CO -0.10 0.22 0.22 -0.89 0.00 0.00 0.00 174.94 174.38 3hj8 s THR 189 N 1.61 5.31 0.00 2.92 2.01 -0.66 0.13 115.64 126.96 3hj8 s THR 189 Ca 0.05 0.28 0.00 0.00 0.31 0.00 0.00 61.69 62.33 3hj8 s THR 189 Cb -0.16 -3.55 0.00 0.00 0.01 0.00 0.00 72.50 68.80 3hj8 s THR 189 CO 0.05 0.29 0.00 1.07 -0.69 0.00 0.00 174.62 175.34 3hj8 n THR 190 N 4.58 0.00 -3.59 -0.82 5.66 0.16 -1.13 114.28 119.13 3hj8 n THR 190 Ca -0.13 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.66 3hj8 n THR 190 Cb 0.52 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.27 3hj8 n THR 190 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 3hj8 s ILE 191 N -1.44 2.71 -0.19 1.09 -4.36 -1.26 0.12 121.20 117.86 3hj8 s ILE 191 Ca 0.00 -1.35 -0.25 0.00 -0.26 0.00 0.00 60.65 58.79 3hj8 s ILE 191 Cb 0.00 -3.01 -0.01 0.00 1.25 0.00 0.00 42.46 40.69 3hj8 s ILE 191 CO 0.00 -0.01 0.81 -1.58 0.24 0.00 0.00 174.94 174.40 3hj8 s GLN 192 N -4.12 4.26 0.68 0.37 0.74 -1.23 -4.59 119.66 115.78 3hj8 s GLN 192 Ca 0.47 0.96 -0.17 0.00 0.05 0.00 0.00 55.36 56.68 3hj8 s GLN 192 Cb -0.03 -3.59 0.01 0.00 1.10 0.00 0.00 33.01 30.49 3hj8 s GLN 192 CO 0.28 -0.37 1.24 -2.14 -0.55 0.00 0.00 175.29 173.75 3hj8 s PRO 193 N 2.31 2.41 0.32 1.67 0.02 -1.26 -4.74 135.00 135.72 3hj8 s PRO 193 Ca 0.36 1.88 -0.08 0.00 0.02 0.00 0.00 61.00 63.19 3hj8 s PRO 193 Cb -0.16 -1.85 -0.06 0.00 0.02 0.00 0.00 34.50 32.45 3hj8 s PRO 193 CO 0.11 -1.66 0.63 0.00 -0.33 0.00 0.00 177.00 175.75 3hj8 s ALA 194 N -1.71 3.52 0.61 -1.55 0.00 -1.23 -4.67 121.76 116.73 3hj8 s ALA 194 Ca 0.78 -0.39 -0.18 0.00 0.00 0.00 0.00 51.96 52.17 3hj8 s ALA 194 Cb -0.32 -2.46 -0.05 0.00 0.00 0.00 0.00 23.12 20.29 3hj8 s ALA 194 CO 0.41 0.20 0.87 -2.30 0.00 0.00 0.00 175.76 174.95 3hj8 n PRO 195 N -0.92 0.77 -3.80 0.00 -0.02 -1.26 -4.45 135.00 125.33 3hj8 n PRO 195 Ca 0.00 0.31 -0.36 0.00 -2.02 0.00 0.00 63.50 61.43 3hj8 n PRO 195 Cb 0.54 -2.08 -0.07 0.00 -0.02 0.00 0.00 33.50 31.86 3hj8 n PRO 195 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3hj8 s TYR 196 N -1.57 3.48 -0.17 6.00 6.14 -0.61 -4.67 117.35 125.95 3hj8 s TYR 196 Ca 0.75 0.40 -0.02 0.00 0.64 0.00 0.00 57.07 58.85 3hj8 s TYR 196 Cb -0.41 -2.07 -0.01 0.00 0.42 0.00 0.00 41.96 39.88 3hj8 s TYR 196 CO 0.48 0.47 -0.09 -1.14 0.64 0.00 0.00 175.55 175.90 3hj8 s GLN 197 N -0.19 3.40 -0.09 4.97 0.74 -1.26 0.15 119.66 127.37 3hj8 s GLN 197 Ca 0.11 -0.65 -0.30 0.00 0.05 0.00 0.00 55.36 54.57 3hj8 s GLN 197 Cb -0.11 -2.79 -0.02 0.00 1.10 0.00 0.00 33.01 31.18 3hj8 s GLN 197 CO 0.00 0.06 1.14 0.96 -0.55 0.00 0.00 175.29 176.90 3hj8 s ILE 198 N 0.78 4.44 -0.36 -2.34 -4.36 0.15 -4.89 121.20 114.63 3hj8 s ILE 198 Ca -0.04 1.75 -0.33 0.00 -0.26 0.00 0.00 60.65 61.77 3hj8 s ILE 198 Cb -0.15 -4.12 -0.14 0.00 1.25 0.00 0.00 42.46 39.30 3hj8 s ILE 198 CO 0.01 -0.03 1.34 -2.65 0.24 0.00 0.00 174.94 173.85 3hj8 n PRO 199 N 5.38 0.00 0.25 0.37 -0.02 -1.26 -4.75 135.00 134.97 3hj8 n PRO 199 Ca 0.11 0.00 0.15 0.00 -2.02 0.00 0.00 63.50 61.73 3hj8 n PRO 199 Cb 0.47 -1.08 0.46 0.00 -0.02 0.00 0.00 33.50 33.32 3hj8 n PRO 199 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 3hj8 h THR 200 N 4.28 0.04 0.00 3.45 1.35 -1.92 -3.27 112.91 116.83 3hj8 h THR 200 Ca -0.21 -0.76 -0.01 0.00 -0.55 0.00 0.00 66.41 64.88 3hj8 h THR 200 Cb 1.01 1.73 -0.00 0.00 -1.73 0.00 0.00 68.15 69.16 3hj8 h THR 200 CO 0.74 0.02 -0.37 -0.78 -0.25 0.00 0.00 175.52 174.88 3hj8 h ASP 201 N 0.00 0.00 -3.31 5.36 -0.00 -1.92 -3.34 116.42 113.22 3hj8 h ASP 201 Ca -0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 57.03 56.84 3hj8 h ASP 201 Cb 0.73 0.00 0.06 0.00 -0.00 0.00 0.00 39.33 40.13 3hj8 h ASP 201 CO 0.00 0.03 0.14 0.61 -0.00 0.00 0.00 179.24 180.02 3hj8 n GLY 202 N 1.14 -0.59 0.20 -0.78 0.00 -1.24 -4.82 105.19 99.09 3hj8 n GLY 202 Ca 0.02 -1.79 0.01 0.00 0.00 0.00 0.00 46.02 44.27 3hj8 n GLY 202 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3hj8 h PRO 203 N 0.00 0.08 0.04 1.61 0.11 -1.89 0.57 132.00 132.52 3hj8 h PRO 203 Ca -0.17 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.91 3hj8 h PRO 203 Cb 0.52 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.62 3hj8 h PRO 203 CO 0.14 0.42 -0.02 1.15 -0.21 0.00 0.00 178.00 179.49 3hj8 h THR 204 N 0.07 1.15 -0.04 -1.15 2.02 -1.93 -0.85 112.91 112.18 3hj8 h THR 204 Ca 0.01 -0.60 -0.04 0.00 0.77 0.00 0.00 66.41 66.54 3hj8 h THR 204 Cb 0.65 1.56 -0.01 0.00 -1.74 0.00 0.00 68.15 68.61 3hj8 h THR 204 CO 0.05 0.15 -0.19 1.23 0.37 0.00 0.00 175.52 177.14 3hj8 h GLY 205 N -0.31 0.06 1.07 2.16 0.00 -1.59 -2.61 103.07 101.86 3hj8 h GLY 205 Ca -0.00 -0.04 -0.09 0.00 0.00 0.00 0.00 47.33 47.20 3hj8 h GLY 205 CO 0.01 0.04 0.06 1.46 0.00 0.00 0.00 176.54 178.11 3hj8 h GLN 206 N 0.06 1.08 0.00 4.80 4.20 -0.74 0.86 115.11 125.37 3hj8 h GLN 206 Ca 0.01 -0.31 -0.04 0.00 0.06 0.00 0.00 58.65 58.37 3hj8 h GLN 206 Cb 0.37 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 3hj8 h GLN 206 CO 0.03 1.02 -0.18 0.35 -0.67 0.00 0.00 178.83 179.37 3hj8 h PHE 207 N 0.99 0.00 0.00 2.96 3.57 -0.79 -2.28 116.94 121.39 3hj8 h PHE 207 Ca 0.19 0.00 -0.20 0.00 3.53 0.00 0.00 57.97 61.49 3hj8 h PHE 207 Cb 0.49 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.20 3hj8 h PHE 207 CO 0.04 0.18 -1.10 0.82 -2.23 0.00 0.00 178.31 176.01 3hj8 h ILE 208 N 0.00 0.98 -0.96 1.41 2.04 -1.19 -3.30 117.51 116.49 3hj8 h ILE 208 Ca -0.00 -2.16 0.12 0.00 1.00 0.00 0.00 64.86 63.82 3hj8 h ILE 208 Cb 0.33 2.28 -0.09 0.00 -0.74 0.00 0.00 36.82 38.61 3hj8 h ILE 208 CO 0.02 0.33 0.59 -0.08 0.00 0.00 0.00 178.15 179.01 3hj8 h GLU 209 N -1.00 0.89 0.00 2.37 4.57 -0.86 -1.27 114.58 119.27 3hj8 h GLU 209 Ca -0.30 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 57.82 3hj8 h GLU 209 Cb 1.25 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 29.64 3hj8 h GLU 209 CO -0.18 0.59 0.00 0.00 -1.18 0.00 0.00 179.01 178.23 3hj8 h ALA 210 N 1.54 1.00 -0.30 2.92 0.00 -1.56 -2.47 119.26 120.40 3hj8 h ALA 210 Ca 0.49 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.40 3hj8 h ALA 210 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3hj8 h ALA 210 CO -0.28 0.00 0.00 0.00 0.00 0.00 0.00 179.25 178.97 3hj8 n GLN 211 N -2.43 2.54 -1.98 0.00 10.64 -0.57 -4.99 117.38 120.59 3hj8 n GLN 211 Ca 0.01 -1.92 -0.18 0.00 -1.83 0.00 0.00 57.00 53.09 3hj8 n GLN 211 Cb 0.22 -1.26 -0.04 0.00 -0.86 0.00 0.00 30.24 28.30 3hj8 n GLN 211 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 3hj8 n ASN 212 N 0.51 -5.19 -2.86 2.61 3.02 -0.89 -5.02 115.26 107.44 3hj8 n ASN 212 Ca 0.11 0.18 -0.13 0.00 -0.03 0.00 0.00 54.58 54.71 3hj8 n ASN 212 Cb 0.40 -4.26 0.10 0.00 -0.61 0.00 0.00 39.78 35.41 3hj8 n ASN 212 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hj8 n GLY 213 N -0.91 -1.70 3.12 7.41 0.00 -0.65 -5.02 105.19 107.43 3hj8 n GLY 213 Ca -0.20 -1.62 -0.24 0.00 0.00 0.00 0.00 46.02 43.97 3hj8 n GLY 213 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3hj8 s HIS 214 N -2.13 1.44 -0.29 1.61 -3.43 -1.26 -4.66 115.29 106.56 3hj8 s HIS 214 Ca 0.32 -0.33 -0.01 0.00 -0.80 0.00 0.00 55.06 54.24 3hj8 s HIS 214 Cb -0.02 -0.95 0.22 0.00 -1.43 0.00 0.00 32.58 30.40 3hj8 s HIS 214 CO 0.23 -0.08 1.94 -0.35 -2.00 0.00 0.00 174.74 174.49 3hj8 n PRO 215 N 2.91 1.75 -4.90 -0.38 -0.04 -1.26 -4.78 135.00 128.29 3hj8 n PRO 215 Ca -0.16 -1.49 -0.29 0.00 -0.04 0.00 0.00 63.50 61.53 3hj8 n PRO 215 Cb 0.54 -1.58 -0.15 0.00 -0.04 0.00 0.00 33.50 32.27 3hj8 n PRO 215 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 3hj8 s TRP 216 N -1.72 2.12 0.04 0.54 0.52 -1.26 0.32 118.94 119.50 3hj8 s TRP 216 Ca 0.29 -0.40 0.06 0.00 0.02 0.00 0.00 56.10 56.08 3hj8 s TRP 216 Cb 0.23 -1.29 -0.03 0.00 -1.15 0.00 0.00 33.47 31.23 3hj8 s TRP 216 CO 0.00 0.07 -0.14 1.03 0.02 0.00 0.00 176.95 177.94 3hj8 s ARG 217 N -1.03 2.21 0.85 4.98 0.52 0.39 -2.88 118.95 123.99 3hj8 s ARG 217 Ca 0.10 -0.92 -0.11 0.00 -0.52 0.00 0.00 55.73 54.28 3hj8 s ARG 217 Cb -0.09 -2.29 0.11 0.00 0.52 0.00 0.00 34.95 33.19 3hj8 s ARG 217 CO 0.01 0.55 1.15 -1.25 0.02 0.00 0.00 175.30 175.78 3hj8 s PRO 218 N -1.55 1.45 0.29 3.54 0.04 -1.25 -1.58 135.00 135.94 3hj8 s PRO 218 Ca 0.16 1.53 -0.30 0.00 0.04 0.00 0.00 61.00 62.44 3hj8 s PRO 218 Cb -0.11 -1.78 -0.12 0.00 0.04 0.00 0.00 34.50 32.54 3hj8 s PRO 218 CO 0.07 -2.31 1.54 0.00 0.04 0.00 0.00 177.00 176.34 3hj8 n ALA 219 N -3.81 2.22 -3.38 8.56 0.00 -1.26 -4.21 120.51 118.63 3hj8 n ALA 219 Ca 0.12 0.38 -0.14 0.00 0.00 0.00 0.00 53.44 53.79 3hj8 n ALA 219 Cb 0.52 -2.42 -0.08 0.00 0.00 0.00 0.00 19.45 17.47 3hj8 n ALA 219 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 3hj8 s HIS 220 N -0.14 -0.48 -0.03 0.00 -3.43 -1.26 -4.21 115.29 105.74 3hj8 s HIS 220 Ca 0.64 1.04 -0.11 0.00 -0.80 0.00 0.00 55.06 55.82 3hj8 s HIS 220 Cb -0.53 0.20 -0.05 0.00 -1.43 0.00 0.00 32.58 30.78 3hj8 s HIS 220 CO 0.50 -0.35 0.32 -0.51 -2.00 0.00 0.00 174.74 172.70 3hj8 s LEU 221 N -0.37 4.43 -0.17 5.38 1.43 -0.20 -4.61 118.68 124.57 3hj8 s LEU 221 Ca -0.05 0.77 -0.08 0.00 -1.03 0.00 0.00 54.13 53.73 3hj8 s LEU 221 Cb -0.03 -2.47 -0.04 0.00 0.03 0.00 0.00 46.19 43.67 3hj8 s LEU 221 CO 0.03 0.33 0.11 -1.00 0.23 0.00 0.00 176.35 176.05 3hj8 s HIS 222 N -1.11 3.40 -0.04 0.29 3.76 0.22 -1.19 115.29 120.62 3hj8 s HIS 222 Ca 0.22 0.30 -0.01 0.00 -0.15 0.00 0.00 55.06 55.42 3hj8 s HIS 222 Cb -0.15 -2.08 0.03 0.00 1.11 0.00 0.00 32.58 31.50 3hj8 s HIS 222 CO 0.11 0.36 0.03 -0.51 -0.85 0.00 0.00 174.74 173.88 3hj8 s LEU 223 N 0.02 0.54 -0.24 0.89 1.02 -0.20 -1.44 118.68 119.27 3hj8 s LEU 223 Ca 0.08 0.02 -0.09 0.00 0.02 0.00 0.00 54.13 54.17 3hj8 s LEU 223 Cb -0.12 -0.20 -0.04 0.00 0.02 0.00 0.00 46.19 45.85 3hj8 s LEU 223 CO -0.00 -0.20 0.11 -0.63 0.02 0.00 0.00 176.35 175.65 3hj8 s ILE 224 N 1.77 4.77 -0.16 -0.59 1.01 -0.07 -0.63 121.20 127.31 3hj8 s ILE 224 Ca 0.00 -0.02 0.01 0.00 0.00 0.00 0.00 60.65 60.64 3hj8 s ILE 224 Cb -0.12 -3.23 0.01 0.00 0.01 0.00 0.00 42.46 39.13 3hj8 s ILE 224 CO -0.03 0.34 -0.18 -0.69 0.00 0.00 0.00 174.94 174.38 3hj8 s VAL 225 N 1.34 2.37 0.20 2.92 1.01 0.87 -0.69 120.40 128.41 3hj8 s VAL 225 Ca 0.06 -0.86 0.07 0.00 0.00 0.00 0.00 61.98 61.24 3hj8 s VAL 225 Cb -0.15 -1.98 -0.05 0.00 0.00 0.00 0.00 36.38 34.20 3hj8 s VAL 225 CO 0.05 0.53 -0.13 -0.94 0.00 0.00 0.00 175.10 174.61 3hj8 s SER 226 N 0.94 2.44 0.03 3.32 1.04 -0.44 -0.76 113.70 120.26 3hj8 s SER 226 Ca -0.03 -1.03 -0.15 0.00 0.48 0.00 0.00 55.95 55.22 3hj8 s SER 226 Cb -0.15 -0.11 0.02 0.00 0.10 0.00 0.00 66.02 65.88 3hj8 s SER 226 CO -0.03 -0.21 0.32 0.00 0.98 0.00 0.00 173.24 174.30 3hj8 s ALA 227 N -3.04 -0.76 -0.07 5.32 0.00 -1.26 -0.58 121.76 121.36 3hj8 s ALA 227 Ca 0.22 0.14 -0.29 0.00 0.00 0.00 0.00 51.96 52.03 3hj8 s ALA 227 Cb 0.00 0.26 -0.07 0.00 0.00 0.00 0.00 23.12 23.31 3hj8 s ALA 227 CO 0.06 -0.38 1.96 -2.14 0.00 0.00 0.00 175.76 175.26 3hj8 s PRO 228 N -2.21 3.83 0.00 0.00 0.02 -1.26 -1.02 135.00 134.36 3hj8 s PRO 228 Ca -0.07 2.29 0.00 0.00 0.02 0.00 0.00 61.00 63.24 3hj8 s PRO 228 Cb -0.02 -4.18 0.00 0.00 0.02 0.00 0.00 34.50 30.32 3hj8 s PRO 228 CO -0.01 -1.30 0.00 0.41 -0.33 0.00 0.00 177.00 175.77 3hj8 n GLY 229 N 4.84 0.66 3.38 0.52 0.00 -1.26 -5.06 105.19 108.27 3hj8 n GLY 229 Ca 0.22 -0.33 -0.29 0.00 0.00 0.00 0.00 46.02 45.62 3hj8 n GLY 229 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hj8 s LYS 230 N -0.79 1.54 -0.29 1.61 -0.14 -0.19 -1.82 119.74 119.66 3hj8 s LYS 230 Ca 0.00 -1.27 -0.29 0.00 -1.36 0.00 0.00 55.97 53.05 3hj8 s LYS 230 Cb 0.00 -1.93 0.00 0.00 -1.68 0.00 0.00 37.83 34.22 3hj8 s LYS 230 CO 0.00 0.47 1.28 -2.00 -0.76 0.00 0.00 175.35 174.34 3hj8 s GLU 231 N -1.82 3.97 1.05 1.68 2.12 0.06 -4.51 118.70 121.24 3hj8 s GLU 231 Ca 0.13 1.28 -0.13 0.00 0.36 0.00 0.00 54.97 56.61 3hj8 s GLU 231 Cb -0.10 -3.85 0.15 0.00 0.26 0.00 0.00 34.13 30.59 3hj8 s GLU 231 CO 0.05 -1.05 0.68 0.43 -0.54 0.00 0.00 175.26 174.83 3hj8 n SER 232 N 7.44 -1.44 -3.92 -1.70 7.64 -1.26 -3.96 113.62 116.41 3hj8 n SER 232 Ca 0.14 0.11 -0.23 0.00 1.01 0.00 0.00 58.87 59.91 3hj8 n SER 232 Cb 0.46 -1.24 -0.17 0.00 -1.01 0.00 0.00 64.21 62.26 3hj8 n SER 232 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3hj8 s VAL 233 N -2.42 0.76 -0.24 0.44 0.11 0.06 -4.93 120.40 114.18 3hj8 s VAL 233 Ca 0.63 -0.22 -0.10 0.00 -2.93 0.00 0.00 61.98 59.35 3hj8 s VAL 233 Cb -0.21 -0.77 -0.05 0.00 -1.53 0.00 0.00 36.38 33.83 3hj8 s VAL 233 CO 0.64 0.29 0.15 -0.89 -3.33 0.00 0.00 175.10 171.96 3hj8 s THR 234 N 1.06 5.29 0.19 5.04 2.01 -1.26 -0.09 115.64 127.88 3hj8 s THR 234 Ca -0.08 0.16 -0.13 0.00 0.31 0.00 0.00 61.69 61.94 3hj8 s THR 234 Cb -0.14 -3.46 0.01 0.00 0.01 0.00 0.00 72.50 68.91 3hj8 s THR 234 CO -0.01 0.35 0.42 0.28 -0.69 0.00 0.00 174.62 174.98 3hj8 s THR 235 N 1.03 0.04 0.08 -0.82 -1.32 0.20 -1.95 115.64 112.90 3hj8 s THR 235 Ca 0.07 -1.12 0.05 0.00 -1.21 0.00 0.00 61.69 59.48 3hj8 s THR 235 Cb -0.13 -1.78 -0.03 0.00 -1.51 0.00 0.00 72.50 69.04 3hj8 s THR 235 CO 0.04 -0.17 -0.15 -1.10 -2.21 0.00 0.00 174.62 171.03 3hj8 s GLN 236 N -3.93 0.85 -0.09 7.08 -0.21 -1.26 -1.03 119.66 121.06 3hj8 s GLN 236 Ca 0.14 -0.98 0.03 0.00 0.02 0.00 0.00 55.36 54.57 3hj8 s GLN 236 Cb 0.01 -0.87 0.01 0.00 1.00 0.00 0.00 33.01 33.16 3hj8 s GLN 236 CO 0.00 0.19 -0.19 -0.51 -2.12 0.00 0.00 175.29 172.66 3hj8 s LEU 237 N -1.79 1.91 0.00 2.90 1.43 -0.34 -4.81 118.68 117.99 3hj8 s LEU 237 Ca -0.01 -0.46 0.02 0.00 -1.03 0.00 0.00 54.13 52.65 3hj8 s LEU 237 Cb -0.10 -1.19 0.02 0.00 0.03 0.00 0.00 46.19 44.96 3hj8 s LEU 237 CO 0.02 0.10 0.21 -1.22 0.23 0.00 0.00 176.35 175.69 3hj8 n TYR 238 N 3.70 -0.53 -4.12 0.29 4.01 0.11 -1.04 117.16 119.58 3hj8 n TYR 238 Ca -0.20 -1.54 -0.22 0.00 -0.16 0.00 0.00 57.90 55.78 3hj8 n TYR 238 Cb 0.52 -0.27 -0.17 0.00 -0.31 0.00 0.00 39.34 39.11 3hj8 n TYR 238 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 3hj8 s PHE 239 N -1.86 0.95 0.13 -0.72 0.40 -1.26 0.25 117.98 115.87 3hj8 s PHE 239 Ca 0.16 -0.33 -0.32 0.00 -0.60 0.00 0.00 56.93 55.84 3hj8 s PHE 239 Cb -0.01 -0.83 -0.09 0.00 0.51 0.00 0.00 43.02 42.59 3hj8 s PHE 239 CO 0.10 -0.27 1.55 -0.22 0.70 0.00 0.00 175.22 177.08 3hj8 h LYS 240 N 7.50 -0.40 -0.79 0.44 3.64 -1.32 0.98 116.57 126.62 3hj8 h LYS 240 Ca -0.32 0.03 0.09 0.00 -1.27 0.00 0.00 60.65 59.18 3hj8 h LYS 240 Cb 1.15 0.09 -0.07 0.00 -0.41 0.00 0.00 32.23 32.99 3hj8 h LYS 240 CO 0.42 -0.27 0.44 0.78 -2.27 0.00 0.00 179.45 178.55 3hj8 h GLY 241 N -0.42 1.21 -0.98 5.01 0.00 -1.98 -3.47 103.07 102.44 3hj8 h GLY 241 Ca 0.08 -0.29 -0.13 0.00 0.00 0.00 0.00 47.33 46.99 3hj8 h GLY 241 CO -0.57 0.11 -0.06 0.61 0.00 0.00 0.00 176.54 176.63 3hj8 n GLY 242 N -1.31 -0.23 3.89 4.60 0.00 0.34 -4.96 105.19 107.51 3hj8 n GLY 242 Ca 0.13 0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.94 3hj8 n GLY 242 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3hj8 s GLU 243 N -0.12 2.17 -0.80 1.61 2.56 -1.26 -3.53 118.70 119.32 3hj8 s GLU 243 Ca 0.13 0.23 0.00 0.00 0.00 0.00 0.00 54.97 55.34 3hj8 s GLU 243 Cb -0.19 -1.96 0.00 0.00 2.00 0.00 0.00 34.13 33.98 3hj8 s GLU 243 CO 0.10 -1.48 0.00 0.91 -0.56 0.00 0.00 175.26 174.23 3hj8 n TRP 244 N -3.26 -0.17 0.08 5.30 7.02 -1.26 -4.28 117.44 120.86 3hj8 n TRP 244 Ca 0.08 0.00 -0.01 0.00 -1.02 0.00 0.00 57.50 56.54 3hj8 n TRP 244 Cb 0.60 -2.14 0.25 0.00 -2.42 0.00 0.00 31.31 27.60 3hj8 n TRP 244 CO 0.00 0.00 0.00 0.97 -2.02 0.00 0.00 177.69 176.64 3hj8 h ILE 245 N 0.00 1.27 -0.42 -0.99 6.09 -1.93 -2.84 117.51 118.69 3hj8 h ILE 245 Ca -0.15 -1.30 0.00 0.00 -1.37 0.00 0.00 64.86 62.03 3hj8 h ILE 245 Cb 0.81 1.50 0.00 0.00 0.47 0.00 0.00 36.82 39.60 3hj8 h ILE 245 CO 0.23 0.40 0.00 0.47 -3.07 0.00 0.00 178.15 176.17 3hj8 n ASP 246 N -4.10 3.20 -2.75 2.19 8.00 -1.26 -4.51 116.55 117.31 3hj8 n ASP 246 Ca -0.01 -2.06 -0.10 0.00 0.71 0.00 0.00 54.79 53.33 3hj8 n ASP 246 Cb 0.42 -0.30 0.04 0.00 -0.02 0.00 0.00 41.12 41.26 3hj8 n ASP 246 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3hj8 n SER 247 N 0.67 0.56 -4.66 -2.24 3.41 -1.08 -5.11 113.62 105.16 3hj8 n SER 247 Ca 0.15 -2.75 -0.42 0.00 -0.26 0.00 0.00 58.87 55.58 3hj8 n SER 247 Cb 0.50 -0.15 -0.03 0.00 -0.26 0.00 0.00 64.21 64.27 3hj8 n SER 247 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3hj8 s ASP 248 N -2.58 6.70 0.55 4.04 2.15 -1.15 -4.88 116.67 121.51 3hj8 s ASP 248 Ca 0.28 2.19 0.30 0.00 0.43 0.00 0.00 52.55 55.75 3hj8 s ASP 248 Cb 0.43 -2.54 1.62 0.00 -0.30 0.00 0.00 42.92 42.13 3hj8 s ASP 248 CO -0.01 -0.89 2.13 1.62 -0.17 0.00 0.00 175.17 177.86 3hj8 h VAL 249 N 5.45 0.47 -0.02 1.11 3.04 -1.83 -0.84 116.25 123.63 3hj8 h VAL 249 Ca -0.38 -0.37 0.00 0.00 -1.01 0.00 0.00 66.70 64.94 3hj8 h VAL 249 Cb 1.17 1.25 0.00 0.00 -2.01 0.00 0.00 31.29 31.70 3hj8 h VAL 249 CO 0.95 0.08 -0.04 0.00 -1.01 0.00 0.00 177.57 177.54 3hj8 n ALA 250 N -2.26 2.65 -3.52 3.17 0.00 -1.25 -4.71 120.51 114.59 3hj8 n ALA 250 Ca -0.02 -0.46 -0.26 0.00 0.00 0.00 0.00 53.44 52.70 3hj8 n ALA 250 Cb 0.19 -1.12 0.01 0.00 0.00 0.00 0.00 19.45 18.53 3hj8 n ALA 250 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3hj8 n SER 251 N 0.17 -4.52 -0.81 0.00 7.64 -0.32 -4.54 113.62 111.23 3hj8 n SER 251 Ca 0.17 -0.52 0.08 0.00 1.01 0.00 0.00 58.87 59.62 3hj8 n SER 251 Cb 0.38 -3.67 0.15 0.00 -1.01 0.00 0.00 64.21 60.06 3hj8 n SER 251 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3hj8 n ALA 252 N -3.95 2.36 -2.47 -0.43 0.00 -1.26 -4.87 120.51 109.89 3hj8 n ALA 252 Ca -0.01 -0.95 -0.39 0.00 0.00 0.00 0.00 53.44 52.10 3hj8 n ALA 252 Cb 0.55 -0.60 -0.06 0.00 0.00 0.00 0.00 19.45 19.34 3hj8 n ALA 252 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3hj8 s THR 253 N -1.17 4.91 0.01 0.00 -4.23 -1.26 -4.70 115.64 109.20 3hj8 s THR 253 Ca 0.27 1.19 0.04 0.00 -1.18 0.00 0.00 61.69 62.01 3hj8 s THR 253 Cb 0.16 -3.90 -0.01 0.00 1.34 0.00 0.00 72.50 70.08 3hj8 s THR 253 CO 0.22 0.44 -0.12 -0.54 -0.54 0.00 0.00 174.62 174.08 3hj8 s LYS 254 N -0.32 0.89 0.52 3.99 1.02 -1.26 -5.04 119.74 119.55 3hj8 s LYS 254 Ca 0.30 -0.50 0.27 0.00 0.02 0.00 0.00 55.97 56.05 3hj8 s LYS 254 Cb -0.18 -0.86 1.43 0.00 -0.52 0.00 0.00 37.83 37.70 3hj8 s LYS 254 CO 0.17 0.23 2.07 -1.35 -0.92 0.00 0.00 175.35 175.54 3hj8 h PRO 255 N 5.57 0.00 0.00 -1.68 0.11 -1.99 -0.18 132.00 133.84 3hj8 h PRO 255 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 3hj8 h PRO 255 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3hj8 h PRO 255 CO 0.48 0.12 0.00 0.39 -0.21 0.00 0.00 178.00 178.77 3hj8 n GLU 256 N -3.65 0.11 -0.37 1.05 4.71 -1.26 -2.73 120.64 118.49 3hj8 n GLU 256 Ca -0.02 0.43 0.09 0.00 -0.01 0.00 0.00 57.16 57.64 3hj8 n GLU 256 Cb 0.24 -1.75 0.23 0.00 -1.01 0.00 0.00 31.44 29.16 3hj8 n GLU 256 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 3hj8 n LEU 257 N -1.96 3.60 -4.57 -4.62 4.77 -0.08 -4.96 117.00 109.18 3hj8 n LEU 257 Ca 0.02 -2.95 -0.39 0.00 -0.03 0.00 0.00 56.01 52.65 3hj8 n LEU 257 Cb 0.15 -0.50 -0.10 0.00 -2.33 0.00 0.00 43.42 40.64 3hj8 n LEU 257 CO 0.14 0.68 -0.02 -0.63 -1.33 0.00 0.00 177.39 176.23 3hj8 s ILE 258 N -2.70 5.21 0.17 -0.08 1.01 -1.11 0.06 121.20 123.76 3hj8 s ILE 258 Ca 0.39 0.24 -0.23 0.00 0.00 0.00 0.00 60.65 61.05 3hj8 s ILE 258 Cb 0.32 -3.70 -0.08 0.00 0.01 0.00 0.00 42.46 39.00 3hj8 s ILE 258 CO 0.08 0.08 0.72 -0.76 0.00 0.00 0.00 174.94 175.07 3hj8 s LEU 259 N 1.95 4.51 -0.76 2.97 1.43 0.14 -4.85 118.68 124.07 3hj8 s LEU 259 Ca 0.11 1.51 0.03 0.00 -1.03 0.00 0.00 54.13 54.76 3hj8 s LEU 259 Cb -0.16 -3.31 0.18 0.00 0.03 0.00 0.00 46.19 42.93 3hj8 s LEU 259 CO 0.11 0.17 0.57 -0.67 0.23 0.00 0.00 176.35 176.76 3hj8 n ASP 260 N 1.36 3.34 -4.77 2.29 2.03 -1.26 -0.84 116.55 118.71 3hj8 n ASP 260 Ca -0.06 -3.20 -0.40 0.00 0.52 0.00 0.00 54.79 51.65 3hj8 n ASP 260 Cb 0.50 -0.83 -0.02 0.00 -0.72 0.00 0.00 41.12 40.05 3hj8 n ASP 260 CO 0.00 0.00 0.00 -2.84 -1.92 0.00 0.00 177.20 172.44 3hj8 s PRO 261 N -1.48 4.20 0.01 -0.67 0.02 -1.26 -4.91 135.00 130.91 3hj8 s PRO 261 Ca 0.26 2.07 0.04 0.00 0.02 0.00 0.00 61.00 63.39 3hj8 s PRO 261 Cb -0.04 -2.90 -0.03 0.00 0.02 0.00 0.00 34.50 31.54 3hj8 s PRO 261 CO -0.16 -0.26 -0.08 0.15 -0.33 0.00 0.00 177.00 176.32 3hj8 s LYS 262 N -2.00 2.48 -0.15 5.54 -0.14 -0.10 -4.83 119.74 120.54 3hj8 s LYS 262 Ca 0.53 -0.76 -0.07 0.00 -1.36 0.00 0.00 55.97 54.30 3hj8 s LYS 262 Cb -0.36 -2.46 -0.04 0.00 -1.68 0.00 0.00 37.83 33.29 3hj8 s LYS 262 CO 0.47 0.59 0.11 -0.08 -0.76 0.00 0.00 175.35 175.68 3hj8 s THR 263 N -0.99 5.22 0.74 2.17 -1.32 -1.26 0.69 115.64 120.89 3hj8 s THR 263 Ca 0.17 0.11 -0.06 0.00 -1.21 0.00 0.00 61.69 60.70 3hj8 s THR 263 Cb -0.11 -3.32 0.10 0.00 -1.51 0.00 0.00 72.50 67.66 3hj8 s THR 263 CO 0.07 0.53 1.05 -0.83 -2.21 0.00 0.00 174.62 173.23 3hj8 s GLY 264 N -0.32 1.73 0.06 6.08 0.00 0.12 -4.92 107.32 110.07 3hj8 s GLY 264 Ca 0.10 -1.19 0.28 0.00 0.00 0.00 0.00 44.72 43.91 3hj8 s GLY 264 CO 0.01 -0.69 1.81 1.22 0.00 0.00 0.00 173.10 175.45 3hj8 n ASP 265 N -3.01 0.30 0.00 1.64 8.00 -1.26 -0.02 116.55 122.20 3hj8 n ASP 265 Ca 0.11 0.44 0.12 0.00 0.71 0.00 0.00 54.79 56.16 3hj8 n ASP 265 Cb 0.60 -0.48 0.56 0.00 -0.02 0.00 0.00 41.12 41.78 3hj8 n ASP 265 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3hj8 n ASP 266 N -1.73 0.00 -0.07 -2.24 5.68 -1.26 -4.92 116.55 112.00 3hj8 n ASP 266 Ca 0.06 0.26 -0.01 0.00 -0.50 0.00 0.00 54.79 54.61 3hj8 n ASP 266 Cb 0.37 -0.41 -0.00 0.00 -1.14 0.00 0.00 41.12 39.93 3hj8 n ASP 266 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3hj8 n GLY 267 N 0.93 0.49 3.88 6.12 0.00 0.98 -5.05 105.19 112.54 3hj8 n GLY 267 Ca 0.08 -0.39 -0.31 0.00 0.00 0.00 0.00 46.02 45.40 3hj8 n GLY 267 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hj8 s LYS 268 N -1.02 3.77 -0.15 1.61 1.02 -1.25 -4.72 119.74 119.01 3hj8 s LYS 268 Ca 0.00 0.30 -0.17 0.00 0.02 0.00 0.00 55.97 56.11 3hj8 s LYS 268 Cb 0.00 -2.55 -0.04 0.00 -0.52 0.00 0.00 37.83 34.71 3hj8 s LYS 268 CO 0.00 0.18 0.44 -0.80 -0.92 0.00 0.00 175.35 174.25 3hj8 s ASN 269 N -2.78 6.60 -0.12 2.83 0.01 0.11 0.14 114.94 121.72 3hj8 s ASN 269 Ca 0.48 0.71 0.02 0.00 -0.71 0.00 0.00 52.86 53.36 3hj8 s ASN 269 Cb -0.11 -2.26 -0.00 0.00 0.41 0.00 0.00 41.25 39.29 3hj8 s ASN 269 CO 0.26 -0.02 -0.20 -0.31 -1.51 0.00 0.00 177.10 175.32 3hj8 s TYR 270 N 0.81 2.66 -0.02 2.20 1.51 0.22 -0.01 117.35 124.72 3hj8 s TYR 270 Ca 0.23 -1.00 -0.05 0.00 -1.01 0.00 0.00 57.07 55.24 3hj8 s TYR 270 Cb -0.15 -1.78 0.00 0.00 -0.11 0.00 0.00 41.96 39.93 3hj8 s TYR 270 CO 0.09 -0.41 0.10 0.54 -1.11 0.00 0.00 175.55 174.76 3hj8 s VAL 271 N 0.47 0.05 -0.07 0.71 0.11 -0.72 -0.92 120.40 120.03 3hj8 s VAL 271 Ca -0.14 -0.39 0.05 0.00 -2.93 0.00 0.00 61.98 58.57 3hj8 s VAL 271 Cb -0.17 -0.28 -0.01 0.00 -1.53 0.00 0.00 36.38 34.39 3hj8 s VAL 271 CO 0.06 -0.21 -0.22 -0.89 -3.33 0.00 0.00 175.10 170.50 3hj8 s THR 272 N -0.70 2.28 -0.16 5.04 2.01 -1.25 -1.20 115.64 121.66 3hj8 s THR 272 Ca -0.08 -0.98 -0.08 0.00 0.31 0.00 0.00 61.69 60.86 3hj8 s THR 272 Cb -0.05 -1.85 0.06 0.00 0.01 0.00 0.00 72.50 70.67 3hj8 s THR 272 CO 0.01 0.57 0.38 -0.47 -0.69 0.00 0.00 174.62 174.42 3hj8 s TYR 273 N -0.15 -0.58 0.02 4.92 6.14 0.97 -4.97 117.35 123.70 3hj8 s TYR 273 Ca -0.03 1.23 -0.01 0.00 0.64 0.00 0.00 57.07 58.90 3hj8 s TYR 273 Cb -0.14 0.23 -0.04 0.00 0.42 0.00 0.00 41.96 42.43 3hj8 s TYR 273 CO 0.04 -0.34 0.14 -0.80 0.64 0.00 0.00 175.55 175.23 3hj8 s ASN 274 N 1.52 6.03 -0.19 4.32 0.02 -1.26 -3.91 114.94 121.47 3hj8 s ASN 274 Ca -0.09 0.22 -0.07 0.00 -1.02 0.00 0.00 52.86 51.90 3hj8 s ASN 274 Cb -0.09 -1.80 -0.04 0.00 0.02 0.00 0.00 41.25 39.34 3hj8 s ASN 274 CO -0.12 0.24 0.05 -0.36 0.02 0.00 0.00 177.10 176.93 3hj8 s PHE 275 N -1.33 3.19 -0.44 2.20 0.40 -0.33 -4.95 117.98 116.72 3hj8 s PHE 275 Ca 0.28 -0.06 -0.10 0.00 -0.60 0.00 0.00 56.93 56.45 3hj8 s PHE 275 Cb -0.12 -2.09 0.09 0.00 0.51 0.00 0.00 43.02 41.40 3hj8 s PHE 275 CO 0.19 0.04 0.30 0.08 0.70 0.00 0.00 175.22 176.53 3hj8 s VAL 276 N 0.59 4.37 0.11 -0.44 1.01 -1.26 -0.36 120.40 124.43 3hj8 s VAL 276 Ca 0.02 -1.43 -0.22 0.00 0.00 0.00 0.00 61.98 60.36 3hj8 s VAL 276 Cb -0.13 -3.70 -0.07 0.00 0.00 0.00 0.00 36.38 32.47 3hj8 s VAL 276 CO 0.01 -0.57 0.65 -0.76 0.00 0.00 0.00 175.10 174.44 3hj8 s LEU 277 N 1.44 4.55 0.62 3.92 1.43 -0.33 -1.08 118.68 129.24 3hj8 s LEU 277 Ca 0.04 1.42 -0.11 0.00 -1.03 0.00 0.00 54.13 54.44 3hj8 s LEU 277 Cb -0.24 -3.06 -0.04 0.00 0.03 0.00 0.00 46.19 42.88 3hj8 s LEU 277 CO 0.02 0.25 1.03 -1.81 0.23 0.00 0.00 176.35 176.07 3hj8 s ASP 278 N -1.13 6.23 0.43 2.29 1.01 -1.25 -3.75 116.67 120.50 3hj8 s ASP 278 Ca 0.32 1.43 -0.22 0.00 0.71 0.00 0.00 52.55 54.78 3hj8 s ASP 278 Cb -0.21 -2.47 -0.09 0.00 1.01 0.00 0.00 42.92 41.16 3hj8 s ASP 278 CO 0.22 -0.87 1.01 -2.16 0.21 0.00 0.00 175.17 173.58 3hj8 s PRO 279 N -5.15 4.07 0.00 8.23 0.04 -1.26 -0.76 135.00 140.17 3hj8 s PRO 279 Ca 0.55 1.34 0.28 0.00 0.04 0.00 0.00 61.00 63.21 3hj8 s PRO 279 Cb -0.11 -2.30 1.66 0.00 0.04 0.00 0.00 34.50 33.80 3hj8 s PRO 279 CO 0.53 -0.19 2.01 0.00 0.04 0.00 0.00 177.00 179.39