#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m70 s GLY 2 N 0.00 2.80 -0.43 0.00 0.00 -1.26 -4.79 107.32 103.63 1m70 s GLY 2 Ca 0.00 0.45 -0.11 0.00 0.00 0.00 0.00 44.72 45.06 1m70 s GLY 2 CO 0.00 0.89 0.30 -0.35 0.00 0.00 0.00 173.10 173.95 1m70 s ASP 3 N -1.57 5.80 0.34 1.64 -1.08 -1.26 -4.86 116.67 115.68 1m70 s ASP 3 Ca 0.47 -1.44 0.03 0.00 -0.52 0.00 0.00 52.55 51.09 1m70 s ASP 3 Cb -0.19 -2.05 0.61 0.00 -1.46 0.00 0.00 42.92 39.83 1m70 s ASP 3 CO 0.24 -0.57 1.96 0.00 0.52 0.00 0.00 175.17 177.32 1m70 h ALA 4 N 8.52 1.47 -0.41 3.66 0.00 -1.84 0.11 119.26 130.77 1m70 h ALA 4 Ca -0.25 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 1m70 h ALA 4 Cb 1.09 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1m70 h ALA 4 CO 0.79 0.43 0.13 1.49 0.00 0.00 0.00 179.25 182.09 1m70 h GLU 5 N 0.74 0.64 -0.64 0.00 4.81 -1.93 -1.02 114.58 117.18 1m70 h GLU 5 Ca 0.19 -0.14 -0.09 0.00 -0.13 0.00 0.00 59.36 59.19 1m70 h GLU 5 Cb 0.06 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 1m70 h GLU 5 CO -0.03 0.64 0.06 0.00 -0.73 0.00 0.00 179.01 178.95 1m70 h ALA 6 N 0.97 0.89 -0.72 2.92 0.00 -1.67 -2.94 119.26 118.72 1m70 h ALA 6 Ca 0.13 -0.29 0.10 0.00 0.00 0.00 0.00 54.91 54.85 1m70 h ALA 6 Cb 0.27 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 1m70 h ALA 6 CO -0.00 0.67 0.47 0.78 0.00 0.00 0.00 179.25 181.17 1m70 h GLY 7 N 1.02 0.83 1.10 0.00 0.00 -0.33 -2.26 103.07 103.45 1m70 h GLY 7 Ca 0.19 -0.24 0.12 0.00 0.00 0.00 0.00 47.33 47.40 1m70 h GLY 7 CO 0.02 0.14 0.33 -1.61 0.00 0.00 0.00 176.54 175.41 1m70 h GLN 8 N 0.58 0.00 -0.25 4.80 4.15 -1.01 -0.45 115.11 122.92 1m70 h GLN 8 Ca 0.33 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.75 1m70 h GLN 8 Cb 0.52 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.21 1m70 h GLN 8 CO -0.11 0.00 0.00 0.41 -1.93 0.00 0.00 178.83 177.20 1m70 n GLY 9 N -1.59 0.63 0.08 2.39 0.00 -0.85 -4.24 105.19 101.61 1m70 n GLY 9 Ca 0.07 -0.47 0.04 0.00 0.00 0.00 0.00 46.02 45.67 1m70 n GLY 9 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1m70 n LYS 10 N 0.57 2.33 -0.22 1.61 5.02 -0.18 -4.76 118.16 122.53 1m70 n LYS 10 Ca 0.16 -1.98 0.08 0.00 -2.02 0.00 0.00 58.31 54.55 1m70 n LYS 10 Cb 0.37 -1.23 0.14 0.00 -0.02 0.00 0.00 35.03 34.29 1m70 n LYS 10 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1m70 n VAL 11 N -0.83 1.73 -0.04 -0.18 0.24 -1.24 -4.81 118.33 113.20 1m70 n VAL 11 Ca 0.07 -2.19 -0.09 0.00 -2.04 0.00 0.00 64.34 60.09 1m70 n VAL 11 Cb 0.43 -0.15 -0.03 0.00 -1.47 0.00 0.00 33.84 32.62 1m70 n VAL 11 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1m70 h ALA 12 N 0.18 0.23 -0.32 2.33 0.00 -1.88 -0.76 119.26 119.04 1m70 h ALA 12 Ca -0.00 0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.79 1m70 h ALA 12 Cb 1.06 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1m70 h ALA 12 CO 0.00 -0.34 -0.35 -0.24 0.00 0.00 0.00 179.25 178.32 1m70 h VAL 13 N 0.18 1.28 -0.91 0.00 3.04 -2.00 -2.96 116.25 114.88 1m70 h VAL 13 Ca 0.09 -1.51 0.07 0.00 -1.01 0.00 0.00 66.70 64.34 1m70 h VAL 13 Cb 0.05 1.41 -0.07 0.00 -2.01 0.00 0.00 31.29 30.67 1m70 h VAL 13 CO -0.08 0.49 0.57 0.00 -1.01 0.00 0.00 177.57 177.54 1m70 h GLY 15 N 1.02 0.00 2.00 0.00 0.00 -0.98 0.97 103.07 106.08 1m70 h GLY 15 Ca 0.40 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.70 1m70 h GLY 15 CO -0.19 0.00 -0.15 0.00 0.00 0.00 0.00 176.54 176.20 1m70 h ALA 16 N 1.88 1.71 0.00 3.60 0.00 -1.30 -1.34 119.26 123.82 1m70 h ALA 16 Ca -0.00 -0.14 -0.26 0.00 0.00 0.00 0.00 54.91 54.51 1m70 h ALA 16 Cb 0.33 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 1m70 h ALA 16 CO 0.01 0.19 -1.97 0.00 0.00 0.00 0.00 179.25 177.49 1m70 n HIS 18 N -3.04 0.10 0.00 0.00 -0.00 0.30 -4.71 115.22 107.87 1m70 n HIS 18 Ca -0.30 -0.05 0.00 0.00 -0.00 0.00 0.00 57.72 57.36 1m70 n HIS 18 Cb 0.82 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.81 1m70 n HIS 18 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1m70 n GLY 19 N 1.29 -0.91 0.23 -1.41 0.00 -0.51 -1.19 105.19 102.69 1m70 n GLY 19 Ca 0.17 -1.41 0.07 0.00 0.00 0.00 0.00 46.02 44.85 1m70 n GLY 19 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1m70 h VAL 20 N 0.00 0.98 -0.32 1.61 -1.51 -1.86 -1.18 116.25 113.98 1m70 h VAL 20 Ca 0.00 -0.69 0.00 0.00 -1.23 0.00 0.00 66.70 64.78 1m70 h VAL 20 Cb 0.00 1.39 0.00 0.00 -2.13 0.00 0.00 31.29 30.55 1m70 h VAL 20 CO 0.00 0.19 0.00 -0.90 -1.23 0.00 0.00 177.57 175.63 1m70 n ASP 21 N -4.08 2.97 0.00 4.19 5.75 -1.26 -4.92 116.55 119.19 1m70 n ASP 21 Ca -0.02 -1.92 0.00 0.00 -0.01 0.00 0.00 54.79 52.83 1m70 n ASP 21 Cb 0.27 -0.20 0.00 0.00 -1.03 0.00 0.00 41.12 40.15 1m70 n ASP 21 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1m70 n GLY 22 N 1.40 0.47 3.17 6.12 0.00 -0.45 -4.40 105.19 111.51 1m70 n GLY 22 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 1m70 n GLY 22 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1m70 s ASN 23 N -2.13 5.86 -0.57 1.61 0.01 -1.10 -0.77 114.94 117.86 1m70 s ASN 23 Ca 0.00 -3.02 -0.35 0.00 -0.71 0.00 0.00 52.86 48.78 1m70 s ASN 23 Cb 0.00 -1.97 -0.15 0.00 0.41 0.00 0.00 41.25 39.54 1m70 s ASN 23 CO 0.00 -0.38 2.34 -1.54 -1.51 0.00 0.00 177.10 176.01 1m70 n SER 24 N 3.34 1.37 0.26 -1.22 3.41 -0.33 -4.51 113.62 115.93 1m70 n SER 24 Ca 0.13 0.29 0.12 0.00 -0.26 0.00 0.00 58.87 59.15 1m70 n SER 24 Cb 0.40 -1.13 0.68 0.00 -0.26 0.00 0.00 64.21 63.90 1m70 n SER 24 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1m70 h PRO 25 N 12.47 0.00 -5.50 4.33 0.13 -1.84 -3.40 132.00 138.18 1m70 h PRO 25 Ca -0.17 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.36 1m70 h PRO 25 Cb 1.33 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.35 1m70 h PRO 25 CO 1.15 0.14 -0.01 0.00 -0.23 0.00 0.00 178.00 179.05 1m70 s ALA 26 N -4.12 3.56 -1.39 -0.56 0.00 -1.26 -4.97 121.76 113.02 1m70 s ALA 26 Ca -0.02 -0.44 0.20 0.00 0.00 0.00 0.00 51.96 51.69 1m70 s ALA 26 Cb 0.13 -2.85 0.99 0.00 0.00 0.00 0.00 23.12 21.38 1m70 s ALA 26 CO 0.59 -0.54 1.62 -0.35 0.00 0.00 0.00 175.76 177.08 1m70 n PRO 27 N 5.04 0.26 0.09 0.00 -0.04 -1.26 -2.53 135.00 136.55 1m70 n PRO 27 Ca -0.04 0.10 0.12 0.00 -0.04 0.00 0.00 63.50 63.64 1m70 n PRO 27 Cb 0.50 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.65 1m70 n PRO 27 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 1m70 h ASN 28 N 0.00 0.00 -3.05 3.54 4.21 -1.94 -3.37 115.58 114.97 1m70 h ASN 28 Ca 0.00 -0.13 -0.61 0.00 1.21 0.00 0.00 56.30 56.77 1m70 h ASN 28 Cb 0.20 0.00 -0.06 0.00 -1.12 0.00 0.00 38.32 37.34 1m70 h ASN 28 CO 0.00 0.07 -0.21 -0.36 -1.29 0.00 0.00 177.43 175.64 1m70 s PHE 29 N -3.19 3.69 0.48 1.19 0.08 -1.05 -4.67 117.98 114.52 1m70 s PHE 29 Ca 0.06 0.96 -0.22 0.00 0.12 0.00 0.00 56.93 57.85 1m70 s PHE 29 Cb 0.12 -2.31 -0.07 0.00 -0.57 0.00 0.00 43.02 40.19 1m70 s PHE 29 CO 0.71 0.58 1.12 -1.25 -0.10 0.00 0.00 175.22 176.28 1m70 s PRO 30 N -0.85 3.68 0.27 0.24 0.04 -1.26 -4.80 135.00 132.32 1m70 s PRO 30 Ca 0.23 1.63 -0.29 0.00 0.04 0.00 0.00 61.00 62.61 1m70 s PRO 30 Cb -0.16 -2.25 -0.09 0.00 0.04 0.00 0.00 34.50 32.04 1m70 s PRO 30 CO 0.12 -0.58 1.25 0.15 0.04 0.00 0.00 177.00 177.98 1m70 s LYS 31 N -2.94 4.44 -0.01 4.56 1.02 -1.26 -4.67 119.74 120.88 1m70 s LYS 31 Ca 0.66 2.05 0.11 0.00 0.02 0.00 0.00 55.97 58.82 1m70 s LYS 31 Cb -0.25 -3.15 -0.16 0.00 -0.52 0.00 0.00 37.83 33.75 1m70 s LYS 31 CO 0.29 -0.11 0.31 1.28 -0.92 0.00 0.00 175.35 176.20 1m70 n LEU 32 N 1.59 0.13 -4.69 3.17 4.77 0.05 -4.95 117.00 117.07 1m70 n LEU 32 Ca 0.02 -0.13 -0.42 0.00 -0.03 0.00 0.00 56.01 55.45 1m70 n LEU 32 Cb 0.43 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.49 1m70 n LEU 32 CO 0.57 0.03 1.44 0.00 -1.33 0.00 0.00 177.39 178.10 1m70 s ALA 33 N -2.60 3.75 0.00 -1.18 0.00 -0.72 -1.87 121.76 119.14 1m70 s ALA 33 Ca -0.02 1.40 0.00 0.00 0.00 0.00 0.00 51.96 53.34 1m70 s ALA 33 Cb 0.08 -3.74 0.00 0.00 0.00 0.00 0.00 23.12 19.45 1m70 s ALA 33 CO 0.47 -1.18 0.00 0.41 0.00 0.00 0.00 175.76 175.45 1m70 n GLY 34 N 4.17 0.92 3.76 0.00 0.00 -0.27 -4.01 105.19 109.74 1m70 n GLY 34 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 1m70 n GLY 34 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1m70 s GLN 35 N -0.09 2.93 0.36 1.61 2.00 -0.78 -4.90 119.66 120.78 1m70 s GLN 35 Ca 0.00 1.66 -0.28 0.00 -2.00 0.00 0.00 55.36 54.74 1m70 s GLN 35 Cb 0.00 -1.94 -0.11 0.00 0.80 0.00 0.00 33.01 31.76 1m70 s GLN 35 CO 0.00 -1.20 1.48 0.20 -0.50 0.00 0.00 175.29 175.27 1m70 s GLY 36 N -1.91 2.82 0.18 2.59 0.00 -1.26 -4.11 107.32 105.63 1m70 s GLY 36 Ca 0.73 1.53 -0.12 0.00 0.00 0.00 0.00 44.72 46.87 1m70 s GLY 36 CO 0.35 2.26 1.74 -2.09 0.00 0.00 0.00 173.10 175.35 1m70 h GLU 37 N 3.35 0.91 -0.46 2.90 4.81 -1.92 -0.66 114.58 123.51 1m70 h GLU 37 Ca -0.50 -0.16 -0.09 0.00 -0.13 0.00 0.00 59.36 58.48 1m70 h GLU 37 Cb 1.23 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.45 1m70 h GLU 37 CO 0.67 0.77 -0.08 0.00 -0.73 0.00 0.00 179.01 179.64 1m70 h ARG 38 N 0.85 0.86 -0.08 1.92 3.08 -1.91 -1.00 114.38 118.10 1m70 h ARG 38 Ca 0.20 -0.31 -0.00 0.00 0.07 0.00 0.00 59.98 59.94 1m70 h ARG 38 Cb 0.19 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.18 1m70 h ARG 38 CO -0.02 0.95 0.04 -0.92 -1.07 0.00 0.00 179.97 178.95 1m70 h TYR 39 N 0.70 0.11 -0.47 3.04 3.20 -1.80 -1.12 116.97 120.63 1m70 h TYR 39 Ca 0.12 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.04 1m70 h TYR 39 Cb 0.61 -0.04 -0.05 0.00 1.54 0.00 0.00 36.73 38.79 1m70 h TYR 39 CO 0.05 0.18 0.19 -0.07 -1.64 0.00 0.00 178.16 176.86 1m70 h LEU 40 N 0.01 0.21 -0.61 2.82 3.38 -0.98 -0.32 115.31 119.83 1m70 h LEU 40 Ca 0.03 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 1m70 h LEU 40 Cb 0.11 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 1m70 h LEU 40 CO -0.00 0.15 0.25 0.25 0.09 0.00 0.00 178.44 179.18 1m70 h LEU 41 N 0.37 0.84 -0.48 1.67 5.85 -0.95 0.70 115.31 123.32 1m70 h LEU 41 Ca 0.22 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1m70 h LEU 41 Cb 0.21 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 1m70 h LEU 41 CO -0.21 0.78 0.31 0.50 -0.34 0.00 0.00 178.44 179.48 1m70 h LYS 42 N 0.85 0.64 -0.87 1.25 3.64 -0.75 -0.94 116.57 120.39 1m70 h LYS 42 Ca 0.21 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.52 1m70 h LYS 42 Cb 0.19 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 31.83 1m70 h LYS 42 CO -0.02 0.44 0.47 1.96 -2.27 0.00 0.00 179.45 180.03 1m70 h GLN 43 N 0.65 1.21 -0.73 1.90 1.08 -0.69 0.73 115.11 119.27 1m70 h GLN 43 Ca 0.18 -0.14 0.03 0.00 -1.45 0.00 0.00 58.65 57.26 1m70 h GLN 43 Cb -0.06 -0.24 -0.04 0.00 -0.05 0.00 0.00 27.48 27.09 1m70 h GLN 43 CO -0.04 0.89 0.46 -0.07 -0.95 0.00 0.00 178.83 179.13 1m70 h LEU 44 N 1.22 0.76 -0.31 1.46 3.38 -0.34 0.34 115.31 121.81 1m70 h LEU 44 Ca 0.31 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.24 1m70 h LEU 44 Cb 0.04 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1m70 h LEU 44 CO -0.05 0.53 0.06 1.56 0.09 0.00 0.00 178.44 180.63 1m70 h GLN 45 N 0.90 0.51 -0.62 1.13 4.20 -0.71 0.10 115.11 120.63 1m70 h GLN 45 Ca 0.29 -0.13 -0.08 0.00 0.06 0.00 0.00 58.65 58.78 1m70 h GLN 45 Cb 0.01 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.70 1m70 h GLN 45 CO -0.11 0.60 0.05 -0.44 -0.67 0.00 0.00 178.83 178.27 1m70 h ASP 46 N 0.34 1.02 -0.40 1.46 3.32 -0.53 -1.92 116.42 119.71 1m70 h ASP 46 Ca 0.10 -0.28 -0.15 0.00 0.02 0.00 0.00 57.03 56.72 1m70 h ASP 46 Cb 0.33 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 1m70 h ASP 46 CO 0.00 1.05 -0.32 0.40 -1.72 0.00 0.00 179.24 178.65 1m70 h ILE 47 N 0.96 1.27 -0.06 0.35 2.04 -0.21 -0.05 117.51 121.80 1m70 h ILE 47 Ca 0.18 -1.49 0.02 0.00 1.00 0.00 0.00 64.86 64.57 1m70 h ILE 47 Cb 0.49 1.33 -0.02 0.00 -0.74 0.00 0.00 36.82 37.88 1m70 h ILE 47 CO 0.02 0.50 -0.06 0.50 0.00 0.00 0.00 178.15 179.11 1m70 h LYS 48 N 0.75 -0.08 -0.56 2.37 3.64 -0.63 0.12 116.57 122.18 1m70 h LYS 48 Ca 0.07 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.44 1m70 h LYS 48 Cb 0.91 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.72 1m70 h LYS 48 CO 0.08 -0.05 0.27 0.00 -2.27 0.00 0.00 179.45 177.48 1m70 h ALA 49 N 0.97 0.72 0.00 5.00 0.00 -1.24 -2.74 119.26 121.96 1m70 h ALA 49 Ca 0.05 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 1m70 h ALA 49 Cb 0.15 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1m70 h ALA 49 CO -0.11 0.28 -0.33 0.78 0.00 0.00 0.00 179.25 179.87 1m70 h GLY 50 N 0.75 0.00 -1.27 0.00 0.00 -0.94 -3.34 103.07 98.28 1m70 h GLY 50 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 1m70 h GLY 50 CO -0.02 0.00 0.00 1.44 0.00 0.00 0.00 176.54 177.96 1m70 n SER 51 N -3.24 2.73 -4.77 0.19 7.64 0.41 -4.24 113.62 112.33 1m70 n SER 51 Ca 0.02 -1.86 -0.38 0.00 1.01 0.00 0.00 58.87 57.65 1m70 n SER 51 Cb 0.61 -0.18 -0.03 0.00 -1.01 0.00 0.00 64.21 63.60 1m70 n SER 51 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1m70 s THR 52 N -1.00 3.34 0.09 0.44 -1.32 -1.04 -1.77 115.64 114.38 1m70 s THR 52 Ca 0.22 1.14 -0.34 0.00 -1.21 0.00 0.00 61.69 61.50 1m70 s THR 52 Cb 0.12 -3.64 -0.14 0.00 -1.51 0.00 0.00 72.50 67.33 1m70 s THR 52 CO 0.17 0.12 1.63 -2.65 -2.21 0.00 0.00 174.62 171.67 1m70 n PRO 53 N 0.24 2.07 -1.13 7.08 -0.02 -1.26 -1.43 135.00 140.56 1m70 n PRO 53 Ca 0.03 0.75 -0.04 0.00 -2.02 0.00 0.00 63.50 62.22 1m70 n PRO 53 Cb 0.47 -2.53 -0.02 0.00 -0.02 0.00 0.00 33.50 31.40 1m70 n PRO 53 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1m70 n GLY 54 N 3.59 0.70 3.66 -1.23 0.00 -1.26 -5.00 105.19 105.64 1m70 n GLY 54 Ca 0.18 -0.45 -0.41 0.00 0.00 0.00 0.00 46.02 45.34 1m70 n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m70 n ALA 55 N 1.08 0.74 -1.72 4.61 0.00 -0.51 -4.89 120.51 119.82 1m70 n ALA 55 Ca -0.04 0.25 -0.41 0.00 0.00 0.00 0.00 53.44 53.24 1m70 n ALA 55 Cb 0.21 -2.18 0.01 0.00 0.00 0.00 0.00 19.45 17.49 1m70 n ALA 55 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1m70 n PRO 56 N 0.09 2.11 -1.78 0.00 -0.02 -1.26 -4.93 135.00 129.20 1m70 n PRO 56 Ca 0.08 0.75 -0.40 0.00 -2.02 0.00 0.00 63.50 61.90 1m70 n PRO 56 Cb 0.39 -2.44 0.01 0.00 -0.02 0.00 0.00 33.50 31.45 1m70 n PRO 56 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1m70 s GLU 57 N -2.16 3.77 0.00 -0.52 2.12 -1.26 -2.58 118.70 118.07 1m70 s GLU 57 Ca 0.59 2.47 0.00 0.00 0.36 0.00 0.00 54.97 58.39 1m70 s GLU 57 Cb -0.51 -2.73 0.00 0.00 0.26 0.00 0.00 34.13 31.16 1m70 s GLU 57 CO 0.60 -0.77 0.00 0.41 -0.54 0.00 0.00 175.26 174.96 1m70 n GLY 58 N 0.54 1.84 3.72 -1.50 0.00 -1.26 -5.05 105.19 103.48 1m70 n GLY 58 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1m70 n GLY 58 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1m70 s VAL 59 N -2.34 4.22 0.00 1.61 1.01 -1.07 -4.91 120.40 118.92 1m70 s VAL 59 Ca 0.00 1.69 0.00 0.00 0.00 0.00 0.00 61.98 63.67 1m70 s VAL 59 Cb 0.00 -4.08 0.00 0.00 0.00 0.00 0.00 36.38 32.30 1m70 s VAL 59 CO 0.00 0.19 0.00 0.61 0.00 0.00 0.00 175.10 175.90 1m70 n GLY 60 N 2.72 2.76 2.86 4.51 0.00 -1.26 -3.91 105.19 112.87 1m70 n GLY 60 Ca 0.06 -0.41 -0.30 0.00 0.00 0.00 0.00 46.02 45.37 1m70 n GLY 60 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1m70 s ARG 61 N 0.00 1.23 -0.35 1.61 3.52 -0.18 -4.36 118.95 120.43 1m70 s ARG 61 Ca 0.00 -0.89 -0.26 0.00 -0.13 0.00 0.00 55.73 54.45 1m70 s ARG 61 Cb 0.00 -2.41 0.01 0.00 -1.56 0.00 0.00 34.95 30.99 1m70 s ARG 61 CO 0.00 -0.68 0.94 0.21 -0.81 0.00 0.00 175.30 174.96 1m70 s LYS 62 N 1.53 3.92 -0.33 5.12 2.20 -1.26 -3.96 119.74 126.95 1m70 s LYS 62 Ca -0.02 0.70 0.04 0.00 -0.36 0.00 0.00 55.97 56.33 1m70 s LYS 62 Cb -0.18 -3.77 0.10 0.00 -1.51 0.00 0.00 37.83 32.46 1m70 s LYS 62 CO -0.09 -0.89 0.04 0.08 -0.36 0.00 0.00 175.35 174.13 1m70 s VAL 63 N 3.42 2.18 0.35 4.02 1.01 -1.26 -4.97 120.40 125.15 1m70 s VAL 63 Ca 0.39 -2.24 0.07 0.00 0.00 0.00 0.00 61.98 60.20 1m70 s VAL 63 Cb -0.12 -2.59 0.31 0.00 0.00 0.00 0.00 36.38 33.97 1m70 s VAL 63 CO 0.17 -0.56 1.90 -0.07 0.00 0.00 0.00 175.10 176.54 1m70 h LEU 64 N 7.65 0.69 -0.46 3.92 3.38 -1.95 -0.34 115.31 128.20 1m70 h LEU 64 Ca -0.06 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1m70 h LEU 64 Cb 1.02 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.66 1m70 h LEU 64 CO 0.51 0.39 0.00 -0.62 0.09 0.00 0.00 178.44 178.81 1m70 n GLU 65 N -4.53 0.13 -0.26 1.13 -0.58 -1.26 -2.08 120.64 113.20 1m70 n GLU 65 Ca 0.15 0.36 0.06 0.00 -0.42 0.00 0.00 57.16 57.31 1m70 n GLU 65 Cb 0.37 -1.75 0.18 0.00 -0.57 0.00 0.00 31.44 29.67 1m70 n GLU 65 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 1m70 n MET 66 N -2.00 2.86 -1.71 3.49 2.81 -0.16 -5.02 117.12 117.39 1m70 n MET 66 Ca 0.03 -2.30 -0.59 0.00 -1.81 0.00 0.00 57.70 53.03 1m70 n MET 66 Cb 0.22 -1.46 -0.08 0.00 -0.71 0.00 0.00 33.22 31.19 1m70 n MET 66 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1m70 n THR 67 N 0.05 0.26 0.00 2.03 -1.04 -0.88 -1.48 114.28 113.21 1m70 n THR 67 Ca 0.14 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 62.11 1m70 n THR 67 Cb 0.58 -1.11 0.00 0.00 -1.82 0.00 0.00 70.33 67.98 1m70 n THR 67 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1m70 n GLY 68 N 4.09 2.41 0.26 3.41 0.00 -0.73 -4.86 105.19 109.78 1m70 n GLY 68 Ca 0.27 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.27 1m70 n GLY 68 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1m70 h MET 69 N 1.57 0.51 -0.00 1.61 2.07 -1.57 -2.17 114.93 116.94 1m70 h MET 69 Ca 0.00 -0.14 0.00 0.00 -2.07 0.00 0.00 59.70 57.49 1m70 h MET 69 Cb 0.00 -0.06 0.00 0.00 -1.87 0.00 0.00 31.60 29.67 1m70 h MET 69 CO 0.00 0.62 -0.38 1.28 1.07 0.00 0.00 176.91 179.50 1m70 n LEU 70 N -4.21 0.41 -0.12 1.22 4.77 -1.26 -4.39 117.00 113.42 1m70 n LEU 70 Ca 0.01 0.10 -0.06 0.00 -0.03 0.00 0.00 56.01 56.03 1m70 n LEU 70 Cb 0.32 -0.30 0.02 0.00 -2.33 0.00 0.00 43.42 41.13 1m70 n LEU 70 CO 0.40 0.10 0.95 0.44 -1.33 0.00 0.00 177.39 177.95 1m70 h ASP 71 N 0.03 0.15 0.02 -1.43 3.32 -1.74 -2.43 116.42 114.35 1m70 h ASP 71 Ca 0.00 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1m70 h ASP 71 Cb 0.50 0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.07 1m70 h ASP 71 CO 0.00 0.12 -0.00 -0.81 -1.72 0.00 0.00 179.24 176.83 1m70 n PRO 72 N -5.01 1.05 -3.06 3.56 -0.04 -1.26 -4.82 135.00 125.41 1m70 n PRO 72 Ca 0.02 -0.10 -0.39 0.00 -0.04 0.00 0.00 63.50 62.98 1m70 n PRO 72 Cb 0.14 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.05 1m70 n PRO 72 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1m70 s LEU 73 N -2.02 4.48 0.83 1.53 1.43 -0.92 -5.05 118.68 118.96 1m70 s LEU 73 Ca 0.46 1.40 -0.12 0.00 -1.03 0.00 0.00 54.13 54.85 1m70 s LEU 73 Cb 0.22 -3.14 0.09 0.00 0.03 0.00 0.00 46.19 43.39 1m70 s LEU 73 CO 0.37 0.10 1.10 -0.94 0.23 0.00 0.00 176.35 177.21 1m70 s SER 74 N -0.40 4.19 0.31 2.29 1.04 -1.26 -4.85 113.70 115.03 1m70 s SER 74 Ca 0.35 1.33 0.01 0.00 0.48 0.00 0.00 55.95 58.12 1m70 s SER 74 Cb -0.20 -2.04 0.54 0.00 0.10 0.00 0.00 66.02 64.41 1m70 s SER 74 CO 0.22 -2.16 1.94 0.44 0.98 0.00 0.00 173.24 174.66 1m70 h ASP 75 N -1.22 0.88 -0.69 7.02 3.32 -1.97 -1.38 116.42 122.37 1m70 h ASP 75 Ca -0.48 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 56.56 1m70 h ASP 75 Cb 1.28 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 40.60 1m70 h ASP 75 CO 0.58 0.59 0.39 -0.61 -1.72 0.00 0.00 179.24 178.48 1m70 h GLN 76 N 1.01 0.96 -0.59 3.56 5.75 -1.99 -1.49 115.11 122.31 1m70 h GLN 76 Ca 0.34 -0.10 0.05 0.00 -0.15 0.00 0.00 58.65 58.78 1m70 h GLN 76 Cb 0.08 -0.19 -0.05 0.00 1.07 0.00 0.00 27.48 28.39 1m70 h GLN 76 CO -0.11 0.71 0.33 -0.44 -2.65 0.00 0.00 178.83 176.66 1m70 h ASP 77 N 0.95 0.49 -0.61 -0.69 3.32 -1.69 0.39 116.42 118.58 1m70 h ASP 77 Ca 0.25 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.31 1m70 h ASP 77 Cb 0.02 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.46 1m70 h ASP 77 CO -0.04 0.33 0.34 -0.07 -1.72 0.00 0.00 179.24 178.08 1m70 h LEU 78 N 0.62 0.75 -0.67 1.55 3.38 -0.83 0.47 115.31 120.58 1m70 h LEU 78 Ca 0.26 -0.09 0.02 0.00 0.09 0.00 0.00 57.88 58.16 1m70 h LEU 78 Cb 0.13 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 1m70 h LEU 78 CO -0.16 0.62 0.43 -0.33 0.09 0.00 0.00 178.44 179.09 1m70 h GLU 79 N 0.82 0.82 -0.60 1.13 5.08 -0.68 -0.91 114.58 120.25 1m70 h GLU 79 Ca 0.21 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.46 1m70 h GLU 79 Cb 0.03 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.07 1m70 h GLU 79 CO -0.04 0.54 0.13 -0.44 -1.00 0.00 0.00 179.01 178.21 1m70 h ASP 80 N 0.84 0.92 -0.34 1.42 3.32 -0.39 -0.26 116.42 121.93 1m70 h ASP 80 Ca 0.26 -0.24 -0.04 0.00 0.02 0.00 0.00 57.03 57.03 1m70 h ASP 80 Cb -0.02 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.28 1m70 h ASP 80 CO -0.09 0.92 0.06 0.40 -1.72 0.00 0.00 179.24 178.81 1m70 h ILE 81 N 0.88 1.23 -0.56 0.35 2.04 -0.71 0.12 117.51 120.86 1m70 h ILE 81 Ca 0.19 -0.81 0.06 0.00 1.00 0.00 0.00 64.86 65.29 1m70 h ILE 81 Cb 0.37 1.11 -0.05 0.00 -0.74 0.00 0.00 36.82 37.51 1m70 h ILE 81 CO 0.00 0.27 0.27 0.00 0.00 0.00 0.00 178.15 178.70 1m70 h ALA 82 N 0.90 0.73 -0.68 1.87 0.00 -0.92 -1.35 119.26 119.81 1m70 h ALA 82 Ca 0.10 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1m70 h ALA 82 Cb 0.34 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1m70 h ALA 82 CO 0.01 -0.09 0.30 0.00 0.00 0.00 0.00 179.25 179.47 1m70 h ALA 83 N 1.32 0.87 0.46 0.00 0.00 -0.79 -1.24 119.26 119.89 1m70 h ALA 83 Ca 0.26 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1m70 h ALA 83 Cb 0.20 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1m70 h ALA 83 CO -0.20 0.46 -0.25 -0.92 0.00 0.00 0.00 179.25 178.34 1m70 h TYR 84 N 0.95 -0.66 -0.75 0.00 3.20 -0.44 -1.79 116.97 117.48 1m70 h TYR 84 Ca 0.23 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.05 1m70 h TYR 84 Cb 0.16 0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.62 1m70 h TYR 84 CO 0.01 -0.40 0.31 0.74 -1.64 0.00 0.00 178.16 177.18 1m70 h PHE 85 N -0.67 1.13 -0.48 -3.82 0.04 -1.19 -2.03 116.94 109.92 1m70 h PHE 85 Ca -0.06 -0.08 0.10 0.00 2.80 0.00 0.00 57.97 60.73 1m70 h PHE 85 Cb 0.53 -0.34 -0.03 0.00 2.20 0.00 0.00 35.95 38.32 1m70 h PHE 85 CO -0.07 0.86 0.33 1.03 -0.60 0.00 0.00 178.31 179.86 1m70 h SER 86 N 1.07 0.19 1.13 2.17 0.87 -1.11 -0.49 113.55 117.39 1m70 h SER 86 Ca 0.25 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.81 1m70 h SER 86 Cb 0.20 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.12 1m70 h SER 86 CO -0.02 0.12 -0.00 -1.54 -0.53 0.00 0.00 176.83 174.85 1m70 n SER 87 N -4.45 0.23 -4.86 6.23 3.41 -0.68 -3.71 113.62 109.79 1m70 n SER 87 Ca 0.08 0.52 -0.31 0.00 -0.26 0.00 0.00 58.87 58.89 1m70 n SER 87 Cb 0.39 -0.58 0.00 0.00 -0.26 0.00 0.00 64.21 63.77 1m70 n SER 87 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1m70 s GLN 88 N -3.03 3.62 -0.22 4.33 -1.52 -0.70 -4.90 119.66 117.24 1m70 s GLN 88 Ca 0.13 0.83 -0.27 0.00 -1.95 0.00 0.00 55.36 54.10 1m70 s GLN 88 Cb 0.17 -2.08 -0.00 0.00 -0.22 0.00 0.00 33.01 30.88 1m70 s GLN 88 CO 0.55 -0.55 0.93 0.21 -0.25 0.00 0.00 175.29 176.18 1m70 s LYS 89 N -4.86 4.24 0.89 2.91 2.20 -1.26 -2.29 119.74 121.56 1m70 s LYS 89 Ca 0.56 1.16 -0.10 0.00 -0.36 0.00 0.00 55.97 57.23 1m70 s LYS 89 Cb -0.11 -3.63 0.13 0.00 -1.51 0.00 0.00 37.83 32.71 1m70 s LYS 89 CO 0.48 -0.53 1.14 0.20 -0.36 0.00 0.00 175.35 176.27 1m70 s GLY 90 N 1.24 1.69 0.23 5.54 0.00 -1.26 -4.74 107.32 110.03 1m70 s GLY 90 Ca 0.40 0.52 0.08 0.00 0.00 0.00 0.00 44.72 45.72 1m70 s GLY 90 CO 0.08 0.93 -0.12 -1.35 0.00 0.00 0.00 173.10 172.64 1m70 s SER 91 N -2.81 2.69 -0.04 1.64 1.04 -1.26 -5.04 113.70 109.92 1m70 s SER 91 Ca 0.66 -1.08 0.07 0.00 0.48 0.00 0.00 55.95 56.08 1m70 s SER 91 Cb -0.22 -0.16 -0.01 0.00 0.10 0.00 0.00 66.02 65.73 1m70 s SER 91 CO 0.58 -0.21 -0.24 -0.69 0.98 0.00 0.00 173.24 173.66 1m70 s VAL 92 N -2.96 1.91 0.00 5.02 1.01 -1.26 -4.28 120.40 119.84 1m70 s VAL 92 Ca 0.25 -1.01 0.00 0.00 0.00 0.00 0.00 61.98 61.22 1m70 s VAL 92 Cb 0.00 -1.60 0.00 0.00 0.00 0.00 0.00 36.38 34.78 1m70 s VAL 92 CO 0.09 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.34 1m70 n GLY 93 N 2.74 5.20 3.72 4.51 0.00 -0.27 -5.02 105.19 116.07 1m70 n GLY 93 Ca -0.17 -2.02 -0.39 0.00 0.00 0.00 0.00 46.02 43.45 1m70 n GLY 93 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1m70 s TYR 94 N 1.51 3.56 -0.39 1.61 5.04 -1.26 -3.94 117.35 123.48 1m70 s TYR 94 Ca 0.00 1.11 -0.05 0.00 -2.44 0.00 0.00 57.07 55.68 1m70 s TYR 94 Cb 0.00 -2.69 0.08 0.00 0.35 0.00 0.00 41.96 39.70 1m70 s TYR 94 CO 0.00 0.14 0.18 0.00 -1.34 0.00 0.00 175.55 174.53 1m70 s ALA 95 N 0.66 3.14 -0.14 3.97 0.00 -1.26 -4.30 121.76 123.83 1m70 s ALA 95 Ca 0.33 -2.19 -0.31 0.00 0.00 0.00 0.00 51.96 49.78 1m70 s ALA 95 Cb -0.17 -2.42 -0.09 0.00 0.00 0.00 0.00 23.12 20.44 1m70 s ALA 95 CO 0.15 -1.62 2.06 -3.47 0.00 0.00 0.00 175.76 172.88 1m70 n ASP 96 N 4.75 3.38 -0.23 0.00 2.03 -1.26 -4.85 116.55 120.37 1m70 n ASP 96 Ca -0.08 0.64 0.02 0.00 0.52 0.00 0.00 54.79 55.88 1m70 n ASP 96 Cb 0.42 -1.45 0.14 0.00 -0.72 0.00 0.00 41.12 39.51 1m70 n ASP 96 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1m70 h PRO 97 N 11.84 0.42 -0.19 -0.67 0.11 -1.98 0.82 132.00 142.35 1m70 h PRO 97 Ca -0.44 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.54 1m70 h PRO 97 Cb 1.26 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 1m70 h PRO 97 CO 0.96 0.28 -0.31 0.00 -0.21 0.00 0.00 178.00 178.72 1m70 h ALA 98 N 1.47 0.29 -0.34 -0.75 0.00 -2.00 -1.83 119.26 116.10 1m70 h ALA 98 Ca 0.35 -0.41 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 1m70 h ALA 98 Cb 0.46 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1m70 h ALA 98 CO -0.34 0.32 -0.02 1.25 0.00 0.00 0.00 179.25 180.46 1m70 h LEU 99 N 0.21 0.62 -1.41 0.00 5.85 -1.85 -2.28 115.31 116.44 1m70 h LEU 99 Ca 0.01 -0.33 -0.05 0.00 0.84 0.00 0.00 57.88 58.36 1m70 h LEU 99 Cb 0.90 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 1m70 h LEU 99 CO 0.07 0.79 -0.17 0.00 -0.34 0.00 0.00 178.44 178.79 1m70 h ALA 100 N 0.84 1.51 -0.62 1.25 0.00 -0.84 -1.36 119.26 120.05 1m70 h ALA 100 Ca 0.09 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 1m70 h ALA 100 Cb 0.49 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1m70 h ALA 100 CO 0.02 0.35 0.09 -0.22 0.00 0.00 0.00 179.25 179.49 1m70 h LYS 101 N 0.16 1.03 -0.78 0.00 1.63 -0.88 0.31 116.57 118.05 1m70 h LYS 101 Ca 0.03 -0.28 -0.03 0.00 -0.85 0.00 0.00 60.65 59.51 1m70 h LYS 101 Cb 0.41 -0.12 -0.04 0.00 -0.60 0.00 0.00 32.23 31.89 1m70 h LYS 101 CO 0.03 0.97 0.35 0.37 -3.45 0.00 0.00 179.45 177.72 1m70 h GLN 102 N 0.94 1.13 -0.80 1.90 5.75 -0.92 -2.17 115.11 120.95 1m70 h GLN 102 Ca 0.19 -0.17 -0.03 0.00 -0.15 0.00 0.00 58.65 58.48 1m70 h GLN 102 Cb 0.45 -0.20 -0.04 0.00 1.07 0.00 0.00 27.48 28.76 1m70 h GLN 102 CO 0.01 0.89 0.39 0.78 -2.65 0.00 0.00 178.83 178.25 1m70 h GLY 103 N 1.15 1.24 0.95 2.39 0.00 -0.49 -2.68 103.07 105.64 1m70 h GLY 103 Ca 0.27 -0.61 0.01 0.00 0.00 0.00 0.00 47.33 46.99 1m70 h GLY 103 CO -0.03 0.58 0.29 -2.09 0.00 0.00 0.00 176.54 175.29 1m70 h GLU 104 N 1.14 0.57 -0.49 4.80 4.81 -0.10 0.17 114.58 125.47 1m70 h GLU 104 Ca 0.28 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.50 1m70 h GLU 104 Cb 0.12 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.33 1m70 h GLU 104 CO -0.03 0.38 0.28 -0.22 -0.73 0.00 0.00 179.01 178.68 1m70 h LYS 105 N 0.59 0.53 -0.34 1.92 3.64 -1.17 -1.17 116.57 120.56 1m70 h LYS 105 Ca 0.17 -0.03 -0.13 0.00 -1.27 0.00 0.00 60.65 59.39 1m70 h LYS 105 Cb -0.03 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 1m70 h LYS 105 CO -0.06 0.35 -0.30 -0.07 -2.27 0.00 0.00 179.45 177.10 1m70 h LEU 106 N 0.55 0.86 -0.72 5.20 3.38 -1.13 -0.39 115.31 123.06 1m70 h LEU 106 Ca 0.20 -0.46 0.01 0.00 0.09 0.00 0.00 57.88 57.73 1m70 h LEU 106 Cb 0.06 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.53 1m70 h LEU 106 CO -0.11 1.14 0.47 0.15 0.09 0.00 0.00 178.44 180.17 1m70 h PHE 107 N 0.59 0.88 0.00 1.13 3.57 -0.39 0.10 116.94 122.83 1m70 h PHE 107 Ca 0.06 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.50 1m70 h PHE 107 Cb 0.88 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 39.31 1m70 h PHE 107 CO 0.07 0.54 -0.85 0.00 -2.23 0.00 0.00 178.31 175.84 1m70 h ARG 108 N 0.94 0.00 0.00 1.11 3.08 -1.20 -0.84 114.38 117.48 1m70 h ARG 108 Ca 0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.32 1m70 h ARG 108 Cb -0.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.98 1m70 h ARG 108 CO -0.07 0.24 -0.77 0.41 -1.07 0.00 0.00 179.97 178.70 1m70 n GLY 109 N 1.25 0.19 7.00 0.04 0.00 -0.16 -4.79 105.19 108.73 1m70 n GLY 109 Ca -0.02 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1m70 n GLY 109 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1m70 n GLY 110 N 1.91 0.95 2.51 -0.02 0.00 0.35 -4.27 105.19 106.62 1m70 n GLY 110 Ca -0.00 -0.67 -0.27 0.00 0.00 0.00 0.00 46.02 45.08 1m70 n GLY 110 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1m70 s LYS 111 N 0.00 1.26 0.24 1.61 1.02 -0.09 -4.81 119.74 118.97 1m70 s LYS 111 Ca 0.00 -2.39 -0.06 0.00 0.02 0.00 0.00 55.97 53.54 1m70 s LYS 111 Cb 0.00 -1.88 0.33 0.00 -0.52 0.00 0.00 37.83 35.76 1m70 s LYS 111 CO 0.00 -1.36 1.83 1.25 -0.92 0.00 0.00 175.35 176.14 1m70 h LEU 112 N 5.59 0.72 0.00 3.17 5.85 -1.75 0.33 115.31 129.21 1m70 h LEU 112 Ca 0.24 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.99 1m70 h LEU 112 Cb 0.87 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.79 1m70 h LEU 112 CO 0.45 0.44 0.00 -0.90 -0.34 0.00 0.00 178.44 178.09 1m70 n ASP 113 N -4.70 0.00 -0.52 1.25 5.68 -1.26 -1.59 116.55 115.41 1m70 n ASP 113 Ca 0.12 -0.80 0.05 0.00 -0.50 0.00 0.00 54.79 53.66 1m70 n ASP 113 Cb 0.21 -0.01 0.10 0.00 -1.14 0.00 0.00 41.12 40.28 1m70 n ASP 113 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1m70 n GLN 114 N -1.01 1.86 -0.95 0.11 6.02 0.04 -4.99 117.38 118.46 1m70 n GLN 114 Ca 0.19 -1.64 0.00 0.00 -0.01 0.00 0.00 57.00 55.54 1m70 n GLN 114 Cb 0.09 -1.23 0.00 0.00 1.02 0.00 0.00 30.24 30.12 1m70 n GLN 114 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1m70 n GLY 115 N 0.51 0.49 3.47 1.08 0.00 -0.62 -5.03 105.19 105.08 1m70 n GLY 115 Ca 0.09 -0.34 -0.37 0.00 0.00 0.00 0.00 46.02 45.41 1m70 n GLY 115 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1m70 s MET 116 N -0.64 3.70 0.83 1.61 0.00 -0.82 -5.01 119.30 118.97 1m70 s MET 116 Ca 0.00 -0.45 -0.11 0.00 0.00 0.00 0.00 55.69 55.13 1m70 s MET 116 Cb 0.00 -3.38 0.09 0.00 0.00 0.00 0.00 34.83 31.54 1m70 s MET 116 CO 0.00 -0.18 1.09 -1.25 0.00 0.00 0.00 175.02 174.68 1m70 s PRO 117 N 1.63 1.81 1.02 4.11 0.04 -1.26 -0.91 135.00 141.43 1m70 s PRO 117 Ca 0.06 0.90 -0.11 0.00 0.04 0.00 0.00 61.00 61.89 1m70 s PRO 117 Cb -0.15 -1.87 0.21 0.00 0.04 0.00 0.00 34.50 32.73 1m70 s PRO 117 CO 0.05 -1.88 1.09 0.00 0.04 0.00 0.00 177.00 176.29 1m70 s ALA 118 N -2.97 0.60 -0.33 8.56 0.00 -1.26 -4.39 121.76 121.97 1m70 s ALA 118 Ca 0.62 0.20 0.23 0.00 0.00 0.00 0.00 51.96 53.01 1m70 s ALA 118 Cb -0.17 -3.33 0.13 0.00 0.00 0.00 0.00 23.12 19.75 1m70 s ALA 118 CO 0.56 -3.21 1.22 0.00 0.00 0.00 0.00 175.76 174.33 1m70 h THR 120 N 0.00 0.89 0.00 0.00 1.35 -1.81 -0.80 112.91 112.54 1m70 h THR 120 Ca 0.00 -1.37 -0.02 0.00 -0.55 0.00 0.00 66.41 64.47 1m70 h THR 120 Cb 0.97 1.83 -0.00 0.00 -1.73 0.00 0.00 68.15 69.21 1m70 h THR 120 CO 0.00 0.34 -0.11 1.23 -0.25 0.00 0.00 175.52 176.73 1m70 h GLY 121 N 1.79 0.00 0.00 5.82 0.00 -1.90 -0.13 103.07 108.66 1m70 h GLY 121 Ca -0.00 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.04 1m70 h GLY 121 CO 0.04 0.00 -2.02 0.00 0.00 0.00 0.00 176.54 174.57 1m70 n HIS 123 N -3.45 0.00 0.00 0.00 8.25 -0.32 -3.95 115.22 115.75 1m70 n HIS 123 Ca -0.34 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.12 1m70 n HIS 123 Cb 0.79 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.88 1m70 n HIS 123 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1m70 n ALA 124 N 0.29 -0.60 0.18 -1.41 0.00 -0.06 -0.91 120.51 117.99 1m70 n ALA 124 Ca 0.12 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.72 1m70 n ALA 124 Cb 0.48 -0.38 0.78 0.00 0.00 0.00 0.00 19.45 20.33 1m70 n ALA 124 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1m70 h PRO 125 N 0.00 0.00 -0.43 0.00 0.11 -1.92 -0.53 132.00 129.23 1m70 h PRO 125 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1m70 h PRO 125 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1m70 h PRO 125 CO 0.00 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.06 1m70 n ASN 126 N -3.98 4.00 0.00 -2.05 0.23 -1.26 -4.96 115.26 107.24 1m70 n ASN 126 Ca 0.02 -2.54 0.00 0.00 -0.53 0.00 0.00 54.58 51.53 1m70 n ASN 126 Cb 0.35 -0.47 0.00 0.00 -2.08 0.00 0.00 39.78 37.57 1m70 n ASN 126 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1m70 n GLY 127 N 0.37 0.73 0.00 4.83 0.00 -0.21 -3.98 105.19 106.93 1m70 n GLY 127 Ca 0.20 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.34 1m70 n GLY 127 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1m70 n VAL 128 N -2.52 0.34 -4.07 1.61 0.24 -1.06 -0.83 118.33 112.05 1m70 n VAL 128 Ca 0.00 0.08 0.00 0.00 -2.04 0.00 0.00 64.34 62.38 1m70 n VAL 128 Cb 0.00 -0.68 0.00 0.00 -1.47 0.00 0.00 33.84 31.70 1m70 n VAL 128 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1m70 n GLY 129 N 0.92 -1.73 2.96 7.63 0.00 -0.09 -3.97 105.19 110.91 1m70 n GLY 129 Ca 0.07 -1.35 -0.09 0.00 0.00 0.00 0.00 46.02 44.66 1m70 n GLY 129 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1m70 s ASN 130 N -4.00 -0.00 0.33 1.61 3.04 -0.22 -4.60 114.94 111.09 1m70 s ASN 130 Ca 0.00 -1.04 0.15 0.00 0.04 0.00 0.00 52.86 52.01 1m70 s ASN 130 Cb 0.00 1.19 0.52 0.00 -1.54 0.00 0.00 41.25 41.42 1m70 s ASN 130 CO 0.00 -0.25 1.67 -0.78 -3.04 0.00 0.00 177.10 174.71 1m70 h ASP 131 N 7.26 0.00 0.50 -4.21 3.58 -1.88 -1.47 116.42 120.20 1m70 h ASP 131 Ca 0.03 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.45 1m70 h ASP 131 Cb 1.11 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.16 1m70 h ASP 131 CO 0.17 0.48 -0.10 -0.07 -2.88 0.00 0.00 179.24 176.85 1m70 h LEU 132 N 0.00 0.00 -0.23 2.28 3.38 -1.96 -1.63 115.31 117.15 1m70 h LEU 132 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1m70 h LEU 132 Cb 1.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.75 1m70 h LEU 132 CO 0.06 0.10 -0.45 0.00 0.09 0.00 0.00 178.44 178.24 1m70 n ALA 133 N -2.22 3.48 -0.84 1.53 0.00 -0.79 -4.95 120.51 116.71 1m70 n ALA 133 Ca -0.01 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.02 1m70 n ALA 133 Cb 0.26 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.63 1m70 n ALA 133 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1m70 n GLY 134 N 1.44 0.50 3.60 0.00 0.00 -0.61 -5.02 105.19 105.10 1m70 n GLY 134 Ca 0.08 -0.68 -0.41 0.00 0.00 0.00 0.00 46.02 45.01 1m70 n GLY 134 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1m70 s PHE 135 N -2.00 3.23 0.59 1.61 0.08 -0.62 -4.84 117.98 116.03 1m70 s PHE 135 Ca 0.00 0.57 -0.18 0.00 0.12 0.00 0.00 56.93 57.44 1m70 s PHE 135 Cb 0.00 -2.89 -0.03 0.00 -0.57 0.00 0.00 43.02 39.52 1m70 s PHE 135 CO 0.00 -0.42 1.13 -1.25 -0.10 0.00 0.00 175.22 174.59 1m70 s PRO 136 N 2.49 3.09 0.26 0.24 0.04 -1.26 -1.06 135.00 138.80 1m70 s PRO 136 Ca 0.23 1.56 -0.30 0.00 0.04 0.00 0.00 61.00 62.54 1m70 s PRO 136 Cb -0.15 -1.97 -0.11 0.00 0.04 0.00 0.00 34.50 32.31 1m70 s PRO 136 CO 0.11 -1.05 1.55 0.21 0.04 0.00 0.00 177.00 177.86 1m70 s LYS 137 N -3.58 4.18 -0.08 4.56 2.20 -1.25 -4.05 119.74 121.71 1m70 s LYS 137 Ca 0.71 2.47 0.07 0.00 -0.36 0.00 0.00 55.97 58.87 1m70 s LYS 137 Cb -0.24 -3.06 -0.10 0.00 -1.51 0.00 0.00 37.83 32.92 1m70 s LYS 137 CO 0.33 -0.57 0.02 1.28 -0.36 0.00 0.00 175.35 176.06 1m70 n LEU 138 N 2.49 0.08 -4.69 5.43 4.77 -0.01 -4.91 117.00 120.17 1m70 n LEU 138 Ca 0.09 -0.00 -0.44 0.00 -0.03 0.00 0.00 56.01 55.62 1m70 n LEU 138 Cb 0.38 0.18 -0.03 0.00 -2.33 0.00 0.00 43.42 41.62 1m70 n LEU 138 CO 0.62 0.21 1.16 0.61 -1.33 0.00 0.00 177.39 178.67 1m70 n GLY 139 N 2.52 1.09 2.32 -0.72 0.00 -0.81 -1.79 105.19 107.80 1m70 n GLY 139 Ca -0.13 0.57 0.00 0.00 0.00 0.00 0.00 46.02 46.45 1m70 n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1m70 n GLY 140 N 2.85 1.17 3.76 -0.02 0.00 -0.29 -4.88 105.19 107.78 1m70 n GLY 140 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 1m70 n GLY 140 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1m70 s GLN 141 N -0.23 3.28 0.19 1.61 2.00 -0.74 -4.31 119.66 121.47 1m70 s GLN 141 Ca 0.00 1.94 -0.33 0.00 -2.00 0.00 0.00 55.36 54.97 1m70 s GLN 141 Cb 0.00 -2.19 -0.13 0.00 0.80 0.00 0.00 33.01 31.50 1m70 s GLN 141 CO 0.00 -0.99 1.66 0.72 -0.50 0.00 0.00 175.29 176.18 1m70 n HIS 142 N -1.06 2.54 -0.24 1.67 8.25 -1.26 -3.89 115.22 121.23 1m70 n HIS 142 Ca 0.11 0.15 0.02 0.00 -0.26 0.00 0.00 57.72 57.73 1m70 n HIS 142 Cb 0.48 -2.61 0.25 0.00 1.12 0.00 0.00 29.99 29.22 1m70 n HIS 142 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1m70 h ALA 143 N 6.35 1.49 -0.93 -1.41 0.00 -1.88 -1.48 119.26 121.42 1m70 h ALA 143 Ca -0.44 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 1m70 h ALA 143 Cb 1.23 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 18.68 1m70 h ALA 143 CO 0.92 0.44 0.56 0.00 0.00 0.00 0.00 179.25 181.18 1m70 h ALA 144 N 1.52 1.18 0.05 0.00 0.00 -1.90 -0.13 119.26 119.98 1m70 h ALA 144 Ca 0.31 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 1m70 h ALA 144 Cb -0.01 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.41 1m70 h ALA 144 CO -0.08 0.63 -0.03 -0.92 0.00 0.00 0.00 179.25 178.85 1m70 h TYR 145 N 1.28 -0.07 -0.78 0.00 3.20 -1.51 -1.80 116.97 117.29 1m70 h TYR 145 Ca 0.33 -0.00 0.05 0.00 3.14 0.00 0.00 58.73 62.25 1m70 h TYR 145 Cb -0.06 0.02 -0.05 0.00 1.54 0.00 0.00 36.73 38.18 1m70 h TYR 145 CO 0.00 0.34 0.48 1.15 -1.64 0.00 0.00 178.16 178.49 1m70 h THR 146 N -0.49 1.06 -0.65 1.81 2.02 -1.10 -0.71 112.91 114.84 1m70 h THR 146 Ca -0.01 -0.31 -0.03 0.00 0.77 0.00 0.00 66.41 66.84 1m70 h THR 146 Cb 0.44 0.08 -0.03 0.00 -1.74 0.00 0.00 68.15 66.90 1m70 h THR 146 CO 0.01 0.16 0.31 0.00 0.37 0.00 0.00 175.52 176.38 1m70 h ALA 147 N 1.35 0.84 -0.75 6.16 0.00 -1.00 -0.65 119.26 125.22 1m70 h ALA 147 Ca 0.33 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1m70 h ALA 147 Cb 0.10 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1m70 h ALA 147 CO -0.15 0.41 0.40 -0.22 0.00 0.00 0.00 179.25 179.70 1m70 h LYS 148 N 0.91 1.05 -0.43 0.00 3.64 -0.72 -0.74 116.57 120.27 1m70 h LYS 148 Ca 0.22 -0.13 -0.06 0.00 -1.27 0.00 0.00 60.65 59.41 1m70 h LYS 148 Cb 0.13 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 1m70 h LYS 148 CO -0.03 0.79 0.02 1.96 -2.27 0.00 0.00 179.45 179.92 1m70 h GLN 149 N 1.03 0.75 -0.69 1.90 1.08 -0.54 0.22 115.11 118.86 1m70 h GLN 149 Ca 0.26 -0.23 -0.07 0.00 -1.45 0.00 0.00 58.65 57.16 1m70 h GLN 149 Cb 0.05 -0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 27.38 1m70 h GLN 149 CO -0.04 0.81 0.15 -0.07 -0.95 0.00 0.00 178.83 178.72 1m70 h LEU 150 N 0.59 1.07 -0.37 1.46 3.38 -0.97 1.00 115.31 121.47 1m70 h LEU 150 Ca 0.13 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 1m70 h LEU 150 Cb 0.45 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1m70 h LEU 150 CO 0.02 1.04 0.07 0.74 0.09 0.00 0.00 178.44 180.39 1m70 h THR 151 N 1.05 1.24 -0.44 0.22 2.02 -0.93 -0.23 112.91 115.84 1m70 h THR 151 Ca 0.21 -0.83 -0.07 0.00 0.77 0.00 0.00 66.41 66.49 1m70 h THR 151 Cb 0.40 1.07 -0.02 0.00 -1.74 0.00 0.00 68.15 67.86 1m70 h THR 151 CO 0.01 0.28 -0.02 0.44 0.37 0.00 0.00 175.52 176.59 1m70 h ASP 152 N 0.45 0.71 -0.24 4.18 3.32 -0.24 -0.49 116.42 124.11 1m70 h ASP 152 Ca 0.11 -0.17 -0.03 0.00 0.02 0.00 0.00 57.03 56.96 1m70 h ASP 152 Cb 0.35 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 1m70 h ASP 152 CO 0.01 0.79 0.05 -0.26 -1.72 0.00 0.00 179.24 178.11 1m70 h PHE 153 N 0.69 0.41 -0.96 4.55 0.04 -0.63 0.27 116.94 121.31 1m70 h PHE 153 Ca 0.13 -0.05 0.06 0.00 2.80 0.00 0.00 57.97 60.91 1m70 h PHE 153 Cb 0.46 -0.11 -0.06 0.00 2.20 0.00 0.00 35.95 38.43 1m70 h PHE 153 CO 0.02 0.50 0.62 -0.09 -0.60 0.00 0.00 178.31 178.77 1m70 h ARG 154 N 0.21 1.08 -0.02 1.51 2.43 -0.56 -2.36 114.38 116.67 1m70 h ARG 154 Ca 0.07 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1m70 h ARG 154 Cb 0.30 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 29.61 1m70 h ARG 154 CO 0.00 0.72 -0.01 0.39 -1.51 0.00 0.00 179.97 179.55 1m70 n GLU 155 N -4.49 1.68 -1.55 0.20 -0.58 -0.23 -4.72 120.64 110.94 1m70 n GLU 155 Ca 0.15 -1.03 -0.09 0.00 -0.42 0.00 0.00 57.16 55.78 1m70 n GLU 155 Cb 0.19 -1.48 -0.03 0.00 -0.57 0.00 0.00 31.44 29.55 1m70 n GLU 155 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1m70 n GLY 156 N 1.20 0.70 0.01 0.62 0.00 -0.69 -4.92 105.19 102.12 1m70 n GLY 156 Ca 0.18 -0.61 0.12 0.00 0.00 0.00 0.00 46.02 45.71 1m70 n GLY 156 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1m70 n ASN 157 N 0.53 0.57 -4.15 1.61 3.02 0.88 -4.66 115.26 113.05 1m70 n ASN 157 Ca -0.09 -0.23 -0.33 0.00 -0.03 0.00 0.00 54.58 53.90 1m70 n ASN 157 Cb 0.38 0.34 -0.16 0.00 -0.61 0.00 0.00 39.78 39.73 1m70 n ASN 157 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1m70 s ARG 158 N -3.05 3.03 0.00 3.52 3.52 -0.97 -4.96 118.95 120.05 1m70 s ARG 158 Ca 0.09 -0.82 0.00 0.00 -0.13 0.00 0.00 55.73 54.87 1m70 s ARG 158 Cb 0.16 -2.55 0.00 0.00 -1.56 0.00 0.00 34.95 31.01 1m70 s ARG 158 CO 0.73 -0.13 0.76 0.25 -0.81 0.00 0.00 175.30 176.09 1m70 n THR 159 N 4.41 0.54 1.18 4.11 -2.24 -1.26 -4.53 114.28 116.49 1m70 n THR 159 Ca -0.20 -0.56 0.02 0.00 -2.27 0.00 0.00 64.05 61.04 1m70 n THR 159 Cb 0.51 0.76 0.08 0.00 -2.10 0.00 0.00 70.33 69.58 1m70 n THR 159 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1m70 n ASN 160 N -0.27 1.28 0.00 3.42 6.94 -1.26 -1.25 115.26 124.12 1m70 n ASN 160 Ca 0.00 -2.07 0.12 0.00 -0.02 0.00 0.00 54.58 52.61 1m70 n ASN 160 Cb 0.34 -0.25 0.57 0.00 -2.36 0.00 0.00 39.78 38.08 1m70 n ASN 160 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 1m70 n ASP 161 N 0.04 0.00 -0.26 0.53 5.75 -1.26 -5.03 116.55 116.32 1m70 n ASP 161 Ca 0.06 0.18 0.03 0.00 -0.01 0.00 0.00 54.79 55.05 1m70 n ASP 161 Cb 0.25 -0.38 -0.01 0.00 -1.03 0.00 0.00 41.12 39.95 1m70 n ASP 161 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1m70 n GLY 162 N 0.88 -2.14 0.24 6.12 0.00 -0.38 -4.23 105.19 105.69 1m70 n GLY 162 Ca 0.09 -1.44 0.16 0.00 0.00 0.00 0.00 46.02 44.83 1m70 n GLY 162 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1m70 h ASP 163 N -0.21 0.00 1.06 1.61 5.19 -1.96 -0.40 116.42 121.72 1m70 h ASP 163 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1m70 h ASP 163 Cb 0.20 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.71 1m70 h ASP 163 CO 0.00 0.00 0.00 0.35 -3.12 0.00 0.00 179.24 176.47 1m70 n THR 164 N -2.82 0.48 -3.75 0.35 -2.24 -1.26 -4.92 114.28 100.12 1m70 n THR 164 Ca 0.00 -0.03 -0.26 0.00 -2.27 0.00 0.00 64.05 61.49 1m70 n THR 164 Cb 0.24 -0.70 0.05 0.00 -2.10 0.00 0.00 70.33 67.81 1m70 n THR 164 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1m70 n MET 165 N -1.89 -6.19 0.02 -0.78 2.81 -0.16 -4.89 117.12 106.05 1m70 n MET 165 Ca 0.05 0.69 -0.12 0.00 -1.81 0.00 0.00 57.70 56.51 1m70 n MET 165 Cb 0.33 -5.57 -0.06 0.00 -0.71 0.00 0.00 33.22 27.21 1m70 n MET 165 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 1m70 h ILE 166 N -2.20 1.03 0.04 2.02 2.04 -1.82 0.11 117.51 118.72 1m70 h ILE 166 Ca -0.58 -0.07 -0.25 0.00 1.00 0.00 0.00 64.86 64.96 1m70 h ILE 166 Cb 1.37 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 38.43 1m70 h ILE 166 CO 0.61 0.02 -1.22 0.24 0.00 0.00 0.00 178.15 177.80 1m70 h MET 167 N 0.04 0.09 -0.63 2.37 2.86 -1.92 -1.65 114.93 116.09 1m70 h MET 167 Ca 0.01 -0.16 -0.02 0.00 -2.06 0.00 0.00 59.70 57.48 1m70 h MET 167 Cb 0.02 0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.70 1m70 h MET 167 CO -0.00 0.99 0.30 0.00 1.06 0.00 0.00 176.91 179.26 1m70 h ARG 168 N 0.02 0.89 -0.25 1.72 3.08 -1.78 0.36 114.38 118.43 1m70 h ARG 168 Ca -0.11 -0.12 -0.13 0.00 0.07 0.00 0.00 59.98 59.69 1m70 h ARG 168 Cb 1.88 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 31.76 1m70 h ARG 168 CO 0.14 0.69 -0.37 0.78 -1.07 0.00 0.00 179.97 180.15 1m70 h GLY 169 N 0.97 0.75 0.94 0.04 0.00 -0.67 -2.27 103.07 102.83 1m70 h GLY 169 Ca 0.22 -0.84 -0.00 0.00 0.00 0.00 0.00 47.33 46.71 1m70 h GLY 169 CO -0.03 0.75 0.04 -2.08 0.00 0.00 0.00 176.54 175.23 1m70 h VAL 170 N 0.41 1.07 0.00 4.60 2.07 -1.10 -3.19 116.25 120.11 1m70 h VAL 170 Ca 0.02 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1m70 h VAL 170 Cb 0.96 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 31.81 1m70 h VAL 170 CO 0.09 0.06 0.00 0.00 0.02 0.00 0.00 177.57 177.74 1m70 h ALA 171 N 0.96 1.00 -0.59 1.67 0.00 -0.94 -3.10 119.26 118.25 1m70 h ALA 171 Ca 0.02 0.00 0.15 0.00 0.00 0.00 0.00 54.91 55.09 1m70 h ALA 171 Cb 0.07 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1m70 h ALA 171 CO -0.00 0.00 0.41 0.00 0.00 0.00 0.00 179.25 179.66 1m70 h ALA 172 N 2.11 2.39 -0.55 0.00 0.00 -1.39 -1.85 119.26 119.97 1m70 h ALA 172 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1m70 h ALA 172 Cb 0.67 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1m70 h ALA 172 CO 0.00 -0.55 0.00 1.63 0.00 0.00 0.00 179.25 180.33 1m70 n LYS 173 N -4.40 2.92 -3.88 0.00 4.01 -1.17 -4.92 118.16 110.72 1m70 n LYS 173 Ca 0.11 -2.26 -0.35 0.00 -0.51 0.00 0.00 58.31 55.30 1m70 n LYS 173 Cb 0.58 -1.66 -0.10 0.00 -0.51 0.00 0.00 35.03 33.34 1m70 n LYS 173 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 1m70 s LEU 174 N -1.37 3.89 0.79 -0.35 1.43 -0.69 -5.10 118.68 117.28 1m70 s LEU 174 Ca 0.41 0.08 -0.12 0.00 -1.03 0.00 0.00 54.13 53.47 1m70 s LEU 174 Cb 0.25 -2.01 0.07 0.00 0.03 0.00 0.00 46.19 44.53 1m70 s LEU 174 CO 0.23 0.13 1.13 -0.94 0.23 0.00 0.00 176.35 177.12 1m70 s SER 175 N 0.63 4.64 0.22 2.29 1.04 -1.26 -4.88 113.70 116.38 1m70 s SER 175 Ca 0.05 1.05 -0.08 0.00 0.48 0.00 0.00 55.95 57.45 1m70 s SER 175 Cb -0.13 -1.72 0.26 0.00 0.10 0.00 0.00 66.02 64.53 1m70 s SER 175 CO 0.01 -1.85 1.83 0.78 0.98 0.00 0.00 173.24 174.99 1m70 h ASN 176 N -1.01 0.66 -0.47 7.02 2.35 -1.99 -1.18 115.58 120.96 1m70 h ASN 176 Ca -0.47 0.02 -0.11 0.00 -0.55 0.00 0.00 56.30 55.19 1m70 h ASN 176 Cb 1.29 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 39.53 1m70 h ASN 176 CO 0.63 0.43 -0.12 0.50 -1.65 0.00 0.00 177.43 177.21 1m70 h LYS 177 N 0.79 0.95 -0.79 0.81 1.63 -1.99 -0.76 116.57 117.21 1m70 h LYS 177 Ca 0.32 -0.35 0.07 0.00 -0.85 0.00 0.00 60.65 59.84 1m70 h LYS 177 Cb 0.15 -0.06 -0.06 0.00 -0.60 0.00 0.00 32.23 31.66 1m70 h LYS 177 CO -0.17 1.01 0.47 -0.44 -3.45 0.00 0.00 179.45 176.87 1m70 h ASP 178 N 0.84 0.71 -0.44 4.20 3.32 -1.81 -0.23 116.42 123.01 1m70 h ASP 178 Ca 0.13 0.03 -0.08 0.00 0.02 0.00 0.00 57.03 57.13 1m70 h ASP 178 Cb 0.67 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.08 1m70 h ASP 178 CO 0.05 0.45 -0.02 0.40 -1.72 0.00 0.00 179.24 178.39 1m70 h ILE 179 N 0.84 1.26 -0.49 0.35 2.04 -0.82 -0.39 117.51 120.31 1m70 h ILE 179 Ca 0.35 -1.08 0.00 0.00 1.00 0.00 0.00 64.86 65.13 1m70 h ILE 179 Cb 0.21 1.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 1m70 h ILE 179 CO -0.19 0.37 0.30 -0.08 0.00 0.00 0.00 178.15 178.56 1m70 h GLU 180 N 0.63 0.65 0.05 2.37 4.81 -0.82 -0.55 114.58 121.73 1m70 h GLU 180 Ca 0.12 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 1m70 h GLU 180 Cb 0.53 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.77 1m70 h GLU 180 CO 0.03 0.46 -0.02 0.00 -0.73 0.00 0.00 179.01 178.74 1m70 h ALA 181 N 1.15 -0.07 -0.55 2.92 0.00 -0.86 -1.91 119.26 119.94 1m70 h ALA 181 Ca 0.18 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 55.04 1m70 h ALA 181 Cb -0.04 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.72 1m70 h ALA 181 CO -0.04 -0.44 0.24 -0.07 0.00 0.00 0.00 179.25 178.95 1m70 h LEU 182 N -0.28 0.29 -0.86 0.00 3.38 -1.03 -1.29 115.31 115.52 1m70 h LEU 182 Ca -0.01 0.05 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 1m70 h LEU 182 Cb 0.25 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 1m70 h LEU 182 CO 0.01 0.19 -0.14 0.28 0.09 0.00 0.00 178.44 178.88 1m70 h SER 183 N 0.45 0.68 0.04 -0.43 0.02 -0.94 -0.41 113.55 112.96 1m70 h SER 183 Ca 0.26 -0.21 -0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1m70 h SER 183 Cb 0.25 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.61 1m70 h SER 183 CO -0.23 0.84 -0.02 -1.28 -1.14 0.00 0.00 176.83 175.00 1m70 h SER 184 N 0.63 -0.05 -0.45 3.07 0.87 -1.01 -1.84 113.55 114.76 1m70 h SER 184 Ca 0.10 -0.24 0.05 0.00 -1.23 0.00 0.00 61.79 60.47 1m70 h SER 184 Cb 0.59 0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 62.52 1m70 h SER 184 CO 0.04 0.21 0.20 0.22 -0.53 0.00 0.00 176.83 176.97 1m70 h TYR 185 N -0.31 0.37 -0.70 2.24 3.20 -1.00 -2.63 116.97 118.14 1m70 h TYR 185 Ca -0.01 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.86 1m70 h TYR 185 Cb 0.28 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.42 1m70 h TYR 185 CO 0.01 0.17 0.32 0.82 -1.64 0.00 0.00 178.16 177.84 1m70 h ILE 186 N 0.41 1.23 -0.72 1.81 2.04 -1.02 -1.90 117.51 119.34 1m70 h ILE 186 Ca 0.20 -0.66 0.07 0.00 1.00 0.00 0.00 64.86 65.48 1m70 h ILE 186 Cb 0.15 0.35 -0.05 0.00 -0.74 0.00 0.00 36.82 36.53 1m70 h ILE 186 CO -0.17 0.27 0.48 -0.61 0.00 0.00 0.00 178.15 178.12 1m70 h GLN 187 N 0.99 0.71 -0.02 2.37 4.15 -0.95 -0.50 115.11 121.86 1m70 h GLN 187 Ca 0.24 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.62 1m70 h GLN 187 Cb 0.12 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 27.65 1m70 h GLN 187 CO -0.03 0.47 -0.06 0.41 -1.93 0.00 0.00 178.83 177.69 1m70 n GLY 188 N -1.45 0.28 3.73 2.39 0.00 -0.85 -1.11 105.19 108.18 1m70 n GLY 188 Ca 0.11 -0.54 -0.41 0.00 0.00 0.00 0.00 46.02 45.18 1m70 n GLY 188 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1m70 s LEU 189 N -2.09 4.47 0.00 0.99 2.96 -0.63 -4.84 118.68 119.55 1m70 s LEU 189 Ca 0.32 1.87 0.00 0.00 -0.22 0.00 0.00 54.13 56.10 1m70 s LEU 189 Cb 0.20 -3.59 0.00 0.00 0.50 0.00 0.00 46.19 43.30 1m70 s LEU 189 CO 0.36 -0.16 0.00 0.00 -1.32 0.00 0.00 176.35 175.23