#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aor s ILE 10 N 0.00 4.63 0.29 3.17 1.01 -1.26 -3.99 121.20 125.04 2aor s ILE 10 Ca 0.00 1.68 -0.30 0.00 0.00 0.00 0.00 60.65 62.03 2aor s ILE 10 Cb 0.00 -4.32 -0.11 0.00 0.01 0.00 0.00 42.46 38.04 2aor s ILE 10 CO 0.00 -0.34 1.52 -2.16 0.00 0.00 0.00 174.94 173.96 2aor s PRO 11 N 3.36 4.17 0.00 2.79 0.04 -1.26 -4.88 135.00 139.22 2aor s PRO 11 Ca 0.42 2.48 0.22 0.00 0.04 0.00 0.00 61.00 64.15 2aor s PRO 11 Cb -0.13 -3.05 -0.13 0.00 0.04 0.00 0.00 34.50 31.23 2aor s PRO 11 CO 0.12 -0.54 0.96 1.04 0.04 0.00 0.00 177.00 178.63 2aor n GLN 12 N 1.98 0.02 -4.23 4.56 1.13 -1.26 -4.95 117.38 114.63 2aor n GLN 12 Ca 0.07 -0.00 -0.20 0.00 -1.94 0.00 0.00 57.00 54.92 2aor n GLN 12 Cb 0.39 -1.50 -0.12 0.00 0.11 0.00 0.00 30.24 29.12 2aor n GLN 12 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 2aor s THR 13 N -3.01 1.36 0.32 5.09 2.01 -1.26 -5.02 115.64 115.13 2aor s THR 13 Ca 0.08 -1.52 0.09 0.00 0.31 0.00 0.00 61.69 60.65 2aor s THR 13 Cb 0.16 -1.37 0.06 0.00 0.01 0.00 0.00 72.50 71.36 2aor s THR 13 CO 0.85 -0.25 1.74 0.25 -0.69 0.00 0.00 174.62 176.53 2aor h LEU 14 N 3.96 0.15 -0.67 4.42 5.85 -1.97 -1.95 115.31 125.09 2aor h LEU 14 Ca -0.42 -0.06 -0.11 0.00 0.84 0.00 0.00 57.88 58.13 2aor h LEU 14 Cb 1.19 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.16 2aor h LEU 14 CO 0.44 0.54 -0.17 -0.08 -0.34 0.00 0.00 178.44 178.82 2aor h GLU 15 N 0.12 0.86 -0.23 1.25 4.81 -1.99 -2.12 114.58 117.28 2aor h GLU 15 Ca 0.01 -0.33 -0.02 0.00 -0.13 0.00 0.00 59.36 58.89 2aor h GLU 15 Cb 0.77 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.09 2aor h GLU 15 CO 0.06 0.97 0.08 1.96 -0.73 0.00 0.00 179.01 181.34 2aor h GLN 16 N 0.76 0.36 -0.23 1.92 4.20 -1.84 -1.74 115.11 118.54 2aor h GLN 16 Ca 0.11 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.75 2aor h GLN 16 Cb 0.70 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.41 2aor h GLN 16 CO 0.05 0.43 0.14 1.25 -0.67 0.00 0.00 178.83 180.04 2aor h LEU 17 N 0.21 0.27 -0.76 1.46 5.85 -1.27 -0.45 115.31 120.63 2aor h LEU 17 Ca 0.08 -0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.67 2aor h LEU 17 Cb 0.22 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 2aor h LEU 17 CO -0.00 0.23 0.02 -0.07 -0.34 0.00 0.00 178.44 178.28 2aor h LEU 18 N 0.29 0.93 -0.48 2.25 3.38 -1.37 0.13 115.31 120.44 2aor h LEU 18 Ca 0.08 -0.24 -0.14 0.00 0.09 0.00 0.00 57.88 57.67 2aor h LEU 18 Cb 0.00 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 2aor h LEU 18 CO -0.02 0.98 -0.30 0.77 0.09 0.00 0.00 178.44 179.96 2aor h SER 19 N 0.89 0.96 -0.11 -0.43 4.64 -1.18 0.41 113.55 118.73 2aor h SER 19 Ca 0.17 -0.40 -0.07 0.00 -0.47 0.00 0.00 61.79 61.01 2aor h SER 19 Cb 0.49 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 62.30 2aor h SER 19 CO 0.02 1.18 -0.15 -0.61 -0.87 0.00 0.00 176.83 176.41 2aor h GLN 20 N 0.77 0.48 -0.15 4.77 5.75 -0.79 -1.27 115.11 124.67 2aor h GLN 20 Ca 0.08 -0.14 -0.08 0.00 -0.15 0.00 0.00 58.65 58.36 2aor h GLN 20 Cb 0.88 -0.05 -0.00 0.00 1.07 0.00 0.00 27.48 29.38 2aor h GLN 20 CO 0.08 0.62 -0.23 0.00 -2.65 0.00 0.00 178.83 176.65 2aor h ALA 21 N 1.41 0.23 -0.83 3.38 0.00 -0.17 -3.03 119.26 120.24 2aor h ALA 21 Ca 0.08 -0.37 0.07 0.00 0.00 0.00 0.00 54.91 54.68 2aor h ALA 21 Cb 0.52 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.21 2aor h ALA 21 CO 0.03 0.19 0.54 1.96 0.00 0.00 0.00 179.25 181.97 2aor h GLN 22 N 0.03 0.88 0.00 0.00 4.20 0.08 -2.62 115.11 117.69 2aor h GLN 22 Ca 0.01 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.62 2aor h GLN 22 Cb 0.80 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.37 2aor h GLN 22 CO 0.05 0.58 -0.26 0.66 -0.67 0.00 0.00 178.83 179.20 2aor h SER 23 N 0.91 0.00 0.24 1.46 4.64 -1.16 -2.93 113.55 116.71 2aor h SER 23 Ca 0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 2aor h SER 23 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 2aor h SER 23 CO -0.13 0.26 -0.37 2.30 -0.87 0.00 0.00 176.83 178.02 2aor n ILE 24 N -3.46 0.00 -1.91 0.95 -5.35 -1.00 -4.88 119.36 103.72 2aor n ILE 24 Ca -0.00 -0.11 -0.42 0.00 -0.27 0.00 0.00 62.75 61.95 2aor n ILE 24 Cb 0.43 0.51 -0.03 0.00 -1.74 0.00 0.00 39.64 38.82 2aor n ILE 24 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2aor s ALA 25 N -2.62 3.77 0.00 -1.28 0.00 -1.11 -1.96 121.76 118.56 2aor s ALA 25 Ca 0.20 1.41 0.00 0.00 0.00 0.00 0.00 51.96 53.57 2aor s ALA 25 Cb 0.19 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.68 2aor s ALA 25 CO 0.58 -0.81 0.00 0.41 0.00 0.00 0.00 175.76 175.94 2aor n GLY 26 N 3.37 3.32 3.81 0.00 0.00 0.14 -5.00 105.19 110.83 2aor n GLY 26 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 2aor n GLY 26 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2aor s LEU 27 N 0.00 3.13 0.17 0.99 1.43 -0.83 -4.69 118.68 118.88 2aor s LEU 27 Ca 0.00 1.65 0.04 0.00 -1.03 0.00 0.00 54.13 54.79 2aor s LEU 27 Cb 0.00 -4.50 -0.04 0.00 0.03 0.00 0.00 46.19 41.68 2aor s LEU 27 CO 0.00 -1.52 0.23 0.42 0.23 0.00 0.00 176.35 175.72 2aor s THR 28 N -3.01 4.98 0.43 5.49 -4.23 -1.26 -0.98 115.64 117.06 2aor s THR 28 Ca 0.59 -0.88 0.17 0.00 -1.18 0.00 0.00 61.69 60.39 2aor s THR 28 Cb -0.14 -3.58 0.38 0.00 1.34 0.00 0.00 72.50 70.49 2aor s THR 28 CO 0.55 -0.13 1.88 -0.26 -0.54 0.00 0.00 174.62 176.12 2aor h PHE 29 N 2.13 0.50 -0.20 3.99 0.04 -1.10 -1.41 116.94 120.89 2aor h PHE 29 Ca -0.48 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.29 2aor h PHE 29 Cb 1.20 -0.15 -0.01 0.00 2.20 0.00 0.00 35.95 39.19 2aor h PHE 29 CO 0.54 0.15 0.07 0.78 -0.60 0.00 0.00 178.31 179.25 2aor h GLY 30 N 0.39 0.33 0.98 -1.45 0.00 -1.13 0.15 103.07 102.34 2aor h GLY 30 Ca 0.43 -0.19 -0.00 0.00 0.00 0.00 0.00 47.33 47.57 2aor h GLY 30 CO -0.15 0.18 0.10 0.83 0.00 0.00 0.00 176.54 177.50 2aor h GLU 31 N 0.15 0.22 -0.39 4.80 5.08 -1.52 -0.11 114.58 122.81 2aor h GLU 31 Ca 0.06 -0.02 -0.12 0.00 -1.00 0.00 0.00 59.36 58.29 2aor h GLU 31 Cb 0.22 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 2aor h GLU 31 CO -0.00 0.18 -0.22 1.25 -1.00 0.00 0.00 179.01 179.22 2aor h LEU 32 N 0.20 0.86 -1.07 1.33 5.85 -1.35 -1.84 115.31 119.30 2aor h LEU 32 Ca 0.06 -0.42 -0.04 0.00 0.84 0.00 0.00 57.88 58.33 2aor h LEU 32 Cb 0.01 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.78 2aor h LEU 32 CO -0.01 1.09 0.22 0.00 -0.34 0.00 0.00 178.44 179.39 2aor h ALA 33 N 0.80 1.26 0.18 1.25 0.00 -0.62 -2.07 119.26 120.06 2aor h ALA 33 Ca 0.08 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2aor h ALA 33 Cb 0.78 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 2aor h ALA 33 CO 0.06 0.54 -0.12 -0.44 0.00 0.00 0.00 179.25 179.29 2aor h ASP 34 N 0.86 -0.29 -0.70 0.00 3.45 -0.70 0.56 116.42 119.59 2aor h ASP 34 Ca 0.20 0.02 0.04 0.00 0.43 0.00 0.00 57.03 57.72 2aor h ASP 34 Cb 0.20 0.09 -0.04 0.00 -0.56 0.00 0.00 39.33 39.02 2aor h ASP 34 CO -0.01 -0.19 0.46 -0.33 -1.57 0.00 0.00 179.24 177.60 2aor h GLU 35 N -0.29 0.80 -0.25 3.56 5.08 -1.07 -1.19 114.58 121.23 2aor h GLU 35 Ca -0.01 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2aor h GLU 35 Cb 0.25 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.32 2aor h GLU 35 CO 0.01 0.53 0.00 1.28 -1.00 0.00 0.00 179.01 179.83 2aor n LEU 36 N -4.46 1.95 -3.81 1.33 4.77 -0.80 -4.91 117.00 111.07 2aor n LEU 36 Ca 0.09 -0.86 -0.28 0.00 -0.03 0.00 0.00 56.01 54.93 2aor n LEU 36 Cb 0.14 -0.16 0.04 0.00 -2.33 0.00 0.00 43.42 41.12 2aor n LEU 36 CO 0.35 0.43 0.13 1.41 -1.33 0.00 0.00 177.39 178.38 2aor n HIS 37 N 0.52 -2.42 -3.75 -1.77 8.25 -0.13 -4.95 115.22 110.97 2aor n HIS 37 Ca 0.16 0.93 -0.37 0.00 -0.26 0.00 0.00 57.72 58.18 2aor n HIS 37 Cb 0.36 -4.30 -0.13 0.00 1.12 0.00 0.00 29.99 27.04 2aor n HIS 37 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2aor s ILE 38 N -3.34 4.22 0.50 1.59 1.01 0.18 -5.02 121.20 120.35 2aor s ILE 38 Ca 0.58 -0.31 -0.22 0.00 0.00 0.00 0.00 60.65 60.70 2aor s ILE 38 Cb -0.28 -3.02 -0.06 0.00 0.01 0.00 0.00 42.46 39.11 2aor s ILE 38 CO 0.80 0.27 1.26 -2.16 0.00 0.00 0.00 174.94 175.12 2aor s PRO 39 N 1.59 3.45 -0.20 2.79 0.04 -1.26 -4.37 135.00 137.04 2aor s PRO 39 Ca 0.06 2.00 -0.07 0.00 0.04 0.00 0.00 61.00 63.03 2aor s PRO 39 Cb -0.16 -2.33 -0.04 0.00 0.04 0.00 0.00 34.50 32.02 2aor s PRO 39 CO 0.03 -0.87 0.05 0.08 0.04 0.00 0.00 177.00 176.33 2aor s VAL 40 N -1.43 4.51 0.99 -0.36 1.01 -1.26 -5.09 120.40 118.78 2aor s VAL 40 Ca 0.68 -0.13 -0.13 0.00 0.00 0.00 0.00 61.98 62.40 2aor s VAL 40 Cb -0.34 -3.05 0.19 0.00 0.00 0.00 0.00 36.38 33.18 2aor s VAL 40 CO 0.41 0.43 1.12 -2.16 0.00 0.00 0.00 175.10 174.89 2aor s PRO 41 N 0.74 0.46 0.21 2.72 0.04 -1.26 -4.95 135.00 132.96 2aor s PRO 41 Ca 0.03 0.33 -0.01 0.00 0.04 0.00 0.00 61.00 61.39 2aor s PRO 41 Cb -0.14 -1.76 0.18 0.00 0.04 0.00 0.00 34.50 32.83 2aor s PRO 41 CO 0.02 -2.67 1.54 0.82 0.04 0.00 0.00 177.00 176.75 2aor h ILE 42 N -1.84 1.33 -2.95 0.56 5.03 -2.02 -3.45 117.51 114.18 2aor h ILE 42 Ca -0.52 -1.78 -0.06 0.00 -0.12 0.00 0.00 64.86 62.38 2aor h ILE 42 Cb 1.33 1.78 -0.00 0.00 -3.03 0.00 0.00 36.82 36.89 2aor h ILE 42 CO 0.56 0.55 0.18 -0.90 -0.68 0.00 0.00 178.15 177.86 2aor n ASP 43 N -3.96 -1.78 -0.66 1.72 5.68 -1.26 -4.33 116.55 111.96 2aor n ASP 43 Ca -0.03 -2.35 0.12 0.00 -0.50 0.00 0.00 54.79 52.03 2aor n ASP 43 Cb 0.58 3.00 0.37 0.00 -1.14 0.00 0.00 41.12 43.94 2aor n ASP 43 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 2aor n LEU 44 N 0.00 2.01 -0.28 -2.12 4.77 -1.26 -4.48 117.00 115.64 2aor n LEU 44 Ca -0.06 -0.76 0.10 0.00 -0.03 0.00 0.00 56.01 55.25 2aor n LEU 44 Cb 0.49 -0.07 0.25 0.00 -2.33 0.00 0.00 43.42 41.76 2aor n LEU 44 CO 0.23 0.38 1.01 0.11 -1.33 0.00 0.00 177.39 177.79 2aor h LYS 45 N 2.89 0.37 -0.70 3.23 1.57 -1.97 -2.16 116.57 119.79 2aor h LYS 45 Ca 0.00 -0.02 -0.51 0.00 -1.87 0.00 0.00 60.65 58.25 2aor h LYS 45 Cb 0.62 -0.08 -0.41 0.00 0.08 0.00 0.00 32.23 32.44 2aor h LYS 45 CO 0.00 0.25 -0.83 0.54 -0.57 0.00 0.00 179.45 178.83 2aor n ARG 46 N -5.06 3.41 -2.63 3.15 1.74 -1.26 -4.56 116.66 111.44 2aor n ARG 46 Ca 0.18 -4.09 -0.05 0.00 -0.77 0.00 0.00 57.85 53.12 2aor n ARG 46 Cb 0.55 -2.20 0.09 0.00 -1.02 0.00 0.00 32.46 29.88 2aor n ARG 46 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2aor n ASP 47 N -0.71 -1.60 -0.11 0.55 9.92 -0.87 -5.02 116.55 118.72 2aor n ASP 47 Ca 0.40 -2.19 0.23 0.00 -0.53 0.00 0.00 54.79 52.71 2aor n ASP 47 Cb 0.95 0.92 0.68 0.00 -0.64 0.00 0.00 41.12 43.03 2aor n ASP 47 CO 0.00 0.00 0.00 0.11 0.13 0.00 0.00 177.20 177.44 2aor h LYS 48 N 1.58 0.06 -0.52 -1.24 1.57 -1.66 -1.46 116.57 114.91 2aor h LYS 48 Ca -0.36 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.42 2aor h LYS 48 Cb 1.27 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.57 2aor h LYS 48 CO -0.12 0.04 0.00 0.41 -0.57 0.00 0.00 179.45 179.21 2aor n GLY 49 N -1.66 2.12 0.28 3.86 0.00 -1.26 -4.64 105.19 103.90 2aor n GLY 49 Ca 0.15 -0.70 0.03 0.00 0.00 0.00 0.00 46.02 45.50 2aor n GLY 49 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2aor h TRP 50 N 3.98 0.68 -0.37 1.61 7.01 -1.65 0.18 115.95 127.39 2aor h TRP 50 Ca 0.00 0.03 -0.11 0.00 2.11 0.00 0.00 58.89 60.92 2aor h TRP 50 Cb 0.93 -0.19 -0.01 0.00 -2.10 0.00 0.00 29.16 27.79 2aor h TRP 50 CO 0.34 0.22 -0.21 0.28 -2.79 0.00 0.00 178.44 176.28 2aor h VAL 51 N 0.62 1.28 -0.87 2.65 2.07 -1.82 0.75 116.25 120.93 2aor h VAL 51 Ca 0.39 -1.35 -0.02 0.00 0.82 0.00 0.00 66.70 66.54 2aor h VAL 51 Cb 0.45 1.36 -0.04 0.00 -1.52 0.00 0.00 31.29 31.55 2aor h VAL 51 CO -0.30 0.45 0.45 1.23 0.02 0.00 0.00 177.57 179.42 2aor h GLY 52 N 0.58 1.32 2.00 2.17 0.00 -1.74 -1.59 103.07 105.81 2aor h GLY 52 Ca 0.08 -0.62 -0.10 0.00 0.00 0.00 0.00 47.33 46.69 2aor h GLY 52 CO 0.06 0.60 -0.46 -0.33 0.00 0.00 0.00 176.54 176.41 2aor h MET 53 N 1.23 0.00 -0.21 4.80 2.07 -0.84 -2.12 114.93 119.85 2aor h MET 53 Ca 0.30 0.00 -0.04 0.00 -2.07 0.00 0.00 59.70 57.89 2aor h MET 53 Cb 0.07 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 29.79 2aor h MET 53 CO -0.04 0.46 -0.04 1.25 1.07 0.00 0.00 176.91 179.61 2aor h LEU 54 N 0.00 0.40 -0.80 1.22 5.85 -0.17 -2.57 115.31 119.25 2aor h LEU 54 Ca -0.00 -0.35 -0.10 0.00 0.84 0.00 0.00 57.88 58.26 2aor h LEU 54 Cb 1.00 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.91 2aor h LEU 54 CO 0.06 0.66 -0.19 -0.07 -0.34 0.00 0.00 178.44 178.56 2aor h LEU 55 N 0.14 0.70 -0.49 2.25 -0.00 -1.20 -2.31 115.31 114.41 2aor h LEU 55 Ca 0.06 -0.23 0.02 0.00 -0.00 0.00 0.00 57.88 57.72 2aor h LEU 55 Cb 0.48 -0.19 -0.03 0.00 -0.00 0.00 0.00 40.66 40.92 2aor h LEU 55 CO 0.02 0.89 0.29 -0.33 -0.00 0.00 0.00 178.44 179.31 2aor h GLU 56 N 0.62 0.57 -0.37 1.13 5.08 -1.29 0.13 114.58 120.45 2aor h GLU 56 Ca 0.09 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.40 2aor h GLU 56 Cb 0.66 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.77 2aor h GLU 56 CO 0.05 0.38 0.16 0.00 -1.00 0.00 0.00 179.01 178.59 2aor h ARG 57 N 0.59 0.54 0.00 2.33 3.08 -1.29 -0.10 114.38 119.53 2aor h ARG 57 Ca 0.19 -0.09 -0.04 0.00 0.07 0.00 0.00 59.98 60.11 2aor h ARG 57 Cb 0.01 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 2aor h ARG 57 CO -0.08 0.51 -0.20 0.00 -1.07 0.00 0.00 179.97 179.13 2aor h ALA 58 N 1.01 1.37 -0.20 0.04 0.00 -1.10 -3.10 119.26 117.28 2aor h ALA 58 Ca 0.12 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2aor h ALA 58 Cb 0.16 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2aor h ALA 58 CO -0.01 0.25 0.00 1.28 0.00 0.00 0.00 179.25 180.76 2aor n LEU 59 N -3.87 3.13 0.00 0.00 4.77 0.00 -4.98 117.00 116.06 2aor n LEU 59 Ca -0.02 -1.26 0.00 0.00 -0.03 0.00 0.00 56.01 54.70 2aor n LEU 59 Cb 0.29 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 2aor n LEU 59 CO 0.34 0.61 0.00 0.61 -1.33 0.00 0.00 177.39 177.62 2aor n GLY 60 N 1.33 0.68 3.84 -0.72 0.00 -0.62 -4.44 105.19 105.26 2aor n GLY 60 Ca 0.16 -0.16 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 2aor n GLY 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aor s ALA 61 N -2.00 3.12 -0.17 4.61 0.00 -0.15 -4.49 121.76 122.68 2aor s ALA 61 Ca 0.00 0.22 -0.24 0.00 0.00 0.00 0.00 51.96 51.94 2aor s ALA 61 Cb 0.00 -3.04 -0.02 0.00 0.00 0.00 0.00 23.12 20.06 2aor s ALA 61 CO 0.00 0.03 0.77 0.99 0.00 0.00 0.00 175.76 177.55 2aor s THR 62 N -2.31 4.93 0.18 0.00 2.01 -1.26 -4.47 115.64 114.71 2aor s THR 62 Ca 0.59 1.51 -0.32 0.00 0.31 0.00 0.00 61.69 63.78 2aor s THR 62 Cb -0.10 -4.08 -0.11 0.00 0.01 0.00 0.00 72.50 68.23 2aor s THR 62 CO 0.21 0.06 1.60 0.00 -0.69 0.00 0.00 174.62 175.81 2aor s ALA 63 N 2.01 3.82 0.00 7.40 0.00 -1.26 -2.33 121.76 131.39 2aor s ALA 63 Ca 0.36 1.42 0.00 0.00 0.00 0.00 0.00 51.96 53.74 2aor s ALA 63 Cb -0.16 -3.64 0.00 0.00 0.00 0.00 0.00 23.12 19.32 2aor s ALA 63 CO 0.12 -0.81 0.00 0.41 0.00 0.00 0.00 175.76 175.48 2aor n GLY 64 N 3.77 0.85 3.73 0.00 0.00 -1.26 -5.00 105.19 107.28 2aor n GLY 64 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 2aor n GLY 64 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2aor n SER 65 N -0.00 2.87 -0.94 1.61 2.88 -0.98 -4.92 113.62 114.13 2aor n SER 65 Ca 0.00 1.10 0.08 0.00 -1.33 0.00 0.00 58.87 58.72 2aor n SER 65 Cb 0.00 -1.55 0.23 0.00 -0.75 0.00 0.00 64.21 62.14 2aor n SER 65 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2aor n LYS 66 N -0.15 2.89 -1.15 -1.46 4.76 -1.26 -5.03 118.16 116.76 2aor n LYS 66 Ca 0.06 -2.34 -0.34 0.00 -2.87 0.00 0.00 58.31 52.82 2aor n LYS 66 Cb 0.41 -1.43 0.11 0.00 -1.84 0.00 0.00 35.03 32.27 2aor n LYS 66 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2aor n ALA 67 N 0.87 -0.63 -0.03 7.82 0.00 -1.26 -4.87 120.51 122.41 2aor n ALA 67 Ca 0.17 -0.32 0.12 0.00 0.00 0.00 0.00 53.44 53.41 2aor n ALA 67 Cb 0.54 -2.10 0.53 0.00 0.00 0.00 0.00 19.45 18.42 2aor n ALA 67 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2aor h GLU 68 N -0.75 0.33 -4.03 0.00 4.57 -2.01 -3.42 114.58 109.27 2aor h GLU 68 Ca -0.46 -0.02 -0.15 0.00 -1.18 0.00 0.00 59.36 57.55 2aor h GLU 68 Cb 1.31 -0.07 -0.19 0.00 -0.16 0.00 0.00 28.75 29.64 2aor h GLU 68 CO 0.44 0.22 -0.68 -0.65 -1.18 0.00 0.00 179.01 177.16 2aor s GLN 69 N -5.33 0.41 0.30 1.92 -0.21 -1.26 -4.61 119.66 110.88 2aor s GLN 69 Ca -0.07 -0.78 0.02 0.00 0.02 0.00 0.00 55.36 54.55 2aor s GLN 69 Cb 0.19 0.15 0.58 0.00 1.00 0.00 0.00 33.01 34.93 2aor s GLN 69 CO 0.74 -0.07 1.87 -0.44 -2.12 0.00 0.00 175.29 175.26 2aor h ASP 70 N 4.17 0.88 -3.22 5.90 3.32 -1.81 -3.25 116.42 122.41 2aor h ASP 70 Ca -0.33 0.03 -0.62 0.00 0.02 0.00 0.00 57.03 56.14 2aor h ASP 70 Cb 1.19 -0.15 -0.41 0.00 0.22 0.00 0.00 39.33 40.18 2aor h ASP 70 CO 0.48 0.51 -0.67 -0.36 -1.72 0.00 0.00 179.24 177.48 2aor s PHE 71 N -5.90 2.92 0.47 4.55 0.40 -0.35 -4.58 117.98 115.49 2aor s PHE 71 Ca -0.11 -3.04 0.17 0.00 -0.60 0.00 0.00 56.93 53.34 2aor s PHE 71 Cb 0.21 -2.33 1.15 0.00 0.51 0.00 0.00 43.02 42.56 2aor s PHE 71 CO 0.80 -0.65 2.05 0.77 0.70 0.00 0.00 175.22 178.89 2aor h SER 72 N 5.76 0.00 0.68 1.36 0.02 -1.81 0.20 113.55 119.76 2aor h SER 72 Ca 0.11 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 2aor h SER 72 Cb 0.82 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.36 2aor h SER 72 CO 0.63 0.13 0.00 0.00 -1.14 0.00 0.00 176.83 176.44 2aor n HIS 73 N -4.29 0.00 0.00 3.45 1.44 -1.26 -3.33 115.22 111.24 2aor n HIS 73 Ca -0.03 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.69 2aor n HIS 73 Cb 0.20 -0.37 -0.00 0.00 0.12 0.00 0.00 29.99 29.94 2aor n HIS 73 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2aor n LEU 74 N -1.37 0.00 -1.45 2.39 4.77 -0.65 -5.01 117.00 115.68 2aor n LEU 74 Ca 0.10 -0.25 -0.10 0.00 -0.03 0.00 0.00 56.01 55.74 2aor n LEU 74 Cb 0.26 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.36 2aor n LEU 74 CO 0.23 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.90 2aor n GLY 75 N 1.74 0.16 3.26 -0.72 0.00 0.61 -5.03 105.19 105.21 2aor n GLY 75 Ca 0.00 -0.39 -0.31 0.00 0.00 0.00 0.00 46.02 45.32 2aor n GLY 75 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2aor s VAL 76 N -2.81 2.04 -0.13 1.61 1.01 -0.83 -4.51 120.40 116.78 2aor s VAL 76 Ca 0.13 -1.05 -0.03 0.00 0.00 0.00 0.00 61.98 61.03 2aor s VAL 76 Cb -0.06 -1.73 -0.03 0.00 0.00 0.00 0.00 36.38 34.56 2aor s VAL 76 CO 0.16 0.57 -0.02 -0.70 0.00 0.00 0.00 175.10 175.11 2aor s GLU 77 N -0.10 3.43 -0.17 2.72 2.56 -0.42 -1.21 118.70 125.50 2aor s GLU 77 Ca -0.05 -0.48 -0.07 0.00 0.00 0.00 0.00 54.97 54.36 2aor s GLU 77 Cb -0.14 -2.87 -0.04 0.00 2.00 0.00 0.00 34.13 33.07 2aor s GLU 77 CO 0.04 0.41 0.08 -1.17 -0.56 0.00 0.00 175.26 174.06 2aor s LEU 78 N -0.08 3.96 -0.08 2.70 2.96 -1.26 -0.20 118.68 126.68 2aor s LEU 78 Ca 0.03 0.17 -0.04 0.00 -0.22 0.00 0.00 54.13 54.07 2aor s LEU 78 Cb -0.13 -1.99 0.04 0.00 0.50 0.00 0.00 46.19 44.61 2aor s LEU 78 CO 0.02 0.23 0.19 -0.54 -1.32 0.00 0.00 176.35 174.92 2aor s LYS 79 N 0.06 0.15 0.41 1.98 1.02 -0.97 -4.94 119.74 117.45 2aor s LYS 79 Ca 0.07 0.40 -0.12 0.00 0.02 0.00 0.00 55.97 56.34 2aor s LYS 79 Cb -0.12 -0.11 -0.07 0.00 -0.52 0.00 0.00 37.83 37.01 2aor s LYS 79 CO 0.00 -0.14 0.80 0.95 -0.92 0.00 0.00 175.35 176.04 2aor s THR 80 N 1.02 4.72 -0.24 2.17 -4.23 -1.26 -1.32 115.64 116.50 2aor s THR 80 Ca -0.08 0.78 -0.04 0.00 -1.18 0.00 0.00 61.69 61.17 2aor s THR 80 Cb -0.09 -3.71 0.08 0.00 1.34 0.00 0.00 72.50 70.12 2aor s THR 80 CO -0.06 -0.49 0.10 -0.22 -0.54 0.00 0.00 174.62 173.42 2aor s LEU 81 N -3.73 0.65 0.13 4.79 2.96 -0.92 -4.86 118.68 117.70 2aor s LEU 81 Ca 0.53 -1.01 -0.31 0.00 -0.22 0.00 0.00 54.13 53.12 2aor s LEU 81 Cb -0.10 -0.37 -0.09 0.00 0.50 0.00 0.00 46.19 46.13 2aor s LEU 81 CO 0.29 -0.39 1.45 -2.16 -1.32 0.00 0.00 176.35 174.22 2aor s PRO 82 N 2.06 4.28 0.05 0.98 0.04 -1.26 -1.40 135.00 139.75 2aor s PRO 82 Ca 0.05 2.17 0.09 0.00 0.04 0.00 0.00 61.00 63.35 2aor s PRO 82 Cb -0.16 -3.22 -0.03 0.00 0.04 0.00 0.00 34.50 31.13 2aor s PRO 82 CO -0.22 -0.50 -0.24 0.96 0.04 0.00 0.00 177.00 177.04 2aor s ILE 83 N 1.15 1.96 0.85 0.56 -4.36 0.74 -0.29 121.20 121.81 2aor s ILE 83 Ca 0.66 -1.34 -0.09 0.00 -0.26 0.00 0.00 60.65 59.63 2aor s ILE 83 Cb -0.39 -1.69 0.17 0.00 1.25 0.00 0.00 42.46 41.80 2aor s ILE 83 CO 0.30 0.29 1.18 0.54 0.24 0.00 0.00 174.94 177.49 2aor s ASN 84 N -1.26 3.66 0.64 4.36 2.20 0.24 -1.75 114.94 123.03 2aor s ASN 84 Ca 0.10 -0.04 0.29 0.00 -0.94 0.00 0.00 52.86 52.28 2aor s ASN 84 Cb -0.10 -0.15 1.59 0.00 -2.00 0.00 0.00 41.25 40.59 2aor s ASN 84 CO 0.02 -2.35 1.92 0.00 -2.94 0.00 0.00 177.10 173.75 2aor h ALA 85 N -1.14 1.58 -0.59 3.54 0.00 -1.99 -0.02 119.26 120.64 2aor h ALA 85 Ca -0.41 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2aor h ALA 85 Cb 1.25 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2aor h ALA 85 CO 0.39 -0.43 0.00 0.39 0.00 0.00 0.00 179.25 179.60 2aor n GLU 86 N -3.15 2.74 -0.63 0.00 4.71 -1.26 -4.94 120.64 118.11 2aor n GLU 86 Ca 0.01 -2.44 0.00 0.00 -0.01 0.00 0.00 57.16 54.72 2aor n GLU 86 Cb 0.45 -1.47 0.00 0.00 -1.01 0.00 0.00 31.44 29.41 2aor n GLU 86 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2aor n GLY 87 N 1.28 0.66 3.89 0.62 0.00 -0.02 -5.07 105.19 106.55 2aor n GLY 87 Ca 0.20 -0.20 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2aor n GLY 87 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2aor s TYR 88 N -2.00 3.56 0.20 1.61 5.04 -1.25 -4.78 117.35 119.73 2aor s TYR 88 Ca 0.00 0.41 -0.33 0.00 -2.44 0.00 0.00 57.07 54.72 2aor s TYR 88 Cb 0.00 -1.87 -0.13 0.00 0.35 0.00 0.00 41.96 40.31 2aor s TYR 88 CO 0.00 0.68 1.59 -2.30 -1.34 0.00 0.00 175.55 174.18 2aor n PRO 89 N 1.32 2.36 0.07 4.97 -0.02 -1.26 0.80 135.00 143.24 2aor n PRO 89 Ca -0.14 0.85 0.02 0.00 -2.02 0.00 0.00 63.50 62.20 2aor n PRO 89 Cb 0.53 -2.62 -0.05 0.00 -0.02 0.00 0.00 33.50 31.35 2aor n PRO 89 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2aor h LEU 90 N 5.74 0.00 -8.37 2.45 3.38 -0.97 -3.44 115.31 114.10 2aor h LEU 90 Ca -0.45 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.35 2aor h LEU 90 Cb 1.24 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.84 2aor h LEU 90 CO 0.87 0.51 -0.60 -1.61 0.09 0.00 0.00 178.44 177.70 2aor s GLU 91 N -2.97 0.94 0.87 1.13 0.41 -1.26 -5.07 118.70 112.76 2aor s GLU 91 Ca -0.01 -1.39 -0.12 0.00 -0.41 0.00 0.00 54.97 53.04 2aor s GLU 91 Cb 0.08 0.26 0.12 0.00 -1.78 0.00 0.00 34.13 32.81 2aor s GLU 91 CO 0.79 -0.28 1.14 0.95 -0.49 0.00 0.00 175.26 177.38 2aor s THR 92 N -4.03 2.13 -0.20 3.63 -4.23 -1.26 -4.73 115.64 106.95 2aor s THR 92 Ca 0.22 0.04 -0.03 0.00 -1.18 0.00 0.00 61.69 60.74 2aor s THR 92 Cb 0.07 -2.85 -0.01 0.00 1.34 0.00 0.00 72.50 71.05 2aor s THR 92 CO 0.01 -0.06 -0.05 -0.89 -0.54 0.00 0.00 174.62 173.10 2aor s THR 93 N -3.33 3.49 0.11 3.99 2.01 -0.93 -4.93 115.64 116.04 2aor s THR 93 Ca 0.63 -0.47 -0.30 0.00 0.31 0.00 0.00 61.69 61.85 2aor s THR 93 Cb -0.14 -2.56 -0.07 0.00 0.01 0.00 0.00 72.50 69.74 2aor s THR 93 CO 0.52 0.45 1.23 0.12 -0.69 0.00 0.00 174.62 176.25 2aor s PHE 94 N 1.10 3.41 -0.09 4.92 5.36 -1.26 -0.39 117.98 131.02 2aor s PHE 94 Ca 0.01 1.28 -0.10 0.00 -0.96 0.00 0.00 56.93 57.16 2aor s PHE 94 Cb -0.15 -3.46 -0.03 0.00 -0.34 0.00 0.00 43.02 39.04 2aor s PHE 94 CO -0.00 -1.42 -0.20 0.28 -1.46 0.00 0.00 175.22 172.41 2aor n VAL 95 N 3.51 1.01 -3.59 3.12 0.31 0.14 -4.93 118.33 117.90 2aor n VAL 95 Ca 0.08 0.26 -0.06 0.00 -0.01 0.00 0.00 64.34 64.60 2aor n VAL 95 Cb 0.45 -1.98 -0.02 0.00 -0.91 0.00 0.00 33.84 31.39 2aor n VAL 95 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2aor s SER 96 N -5.39 -0.29 0.21 4.52 1.04 -1.24 -5.00 113.70 107.56 2aor s SER 96 Ca -0.17 -0.14 -0.30 0.00 0.48 0.00 0.00 55.95 55.82 2aor s SER 96 Cb 0.02 0.41 -0.09 0.00 0.10 0.00 0.00 66.02 66.47 2aor s SER 96 CO 0.25 -0.70 1.26 -0.76 0.98 0.00 0.00 173.24 174.27 2aor s LEU 97 N -2.65 4.44 -0.09 2.42 1.43 -1.26 -0.53 118.68 122.44 2aor s LEU 97 Ca 0.08 2.38 -0.30 0.00 -1.03 0.00 0.00 54.13 55.26 2aor s LEU 97 Cb -0.01 -3.61 -0.02 0.00 0.03 0.00 0.00 46.19 42.58 2aor s LEU 97 CO -0.05 -0.46 1.05 0.00 0.23 0.00 0.00 176.35 177.12 2aor s ALA 98 N -0.15 3.42 -0.35 4.21 0.00 -0.06 -4.84 121.76 123.98 2aor s ALA 98 Ca 0.54 0.43 -0.29 0.00 0.00 0.00 0.00 51.96 52.64 2aor s ALA 98 Cb -0.35 -3.45 -0.01 0.00 0.00 0.00 0.00 23.12 19.31 2aor s ALA 98 CO 0.40 -0.64 1.64 -1.25 0.00 0.00 0.00 175.76 175.91 2aor s PRO 99 N 2.05 3.46 0.32 0.00 0.04 -1.26 -4.73 135.00 134.88 2aor s PRO 99 Ca 0.50 1.26 0.23 0.00 0.04 0.00 0.00 61.00 63.03 2aor s PRO 99 Cb -0.20 -4.12 0.18 0.00 0.04 0.00 0.00 34.50 30.41 2aor s PRO 99 CO 0.19 -1.71 1.34 -0.07 0.04 0.00 0.00 177.00 176.78 2aor h LEU 100 N 12.99 0.00 -9.07 -3.56 3.38 -1.93 -3.44 115.31 113.68 2aor h LEU 100 Ca -0.31 -0.00 -0.42 0.00 0.09 0.00 0.00 57.88 57.23 2aor h LEU 100 Cb 1.14 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.75 2aor h LEU 100 CO 1.05 0.00 -0.59 0.68 0.09 0.00 0.00 178.44 179.67 2aor s VAL 101 N -3.28 0.73 -1.54 1.22 -7.23 -1.26 -4.00 120.40 105.04 2aor s VAL 101 Ca 0.03 -2.00 -0.13 0.00 -1.81 0.00 0.00 61.98 58.07 2aor s VAL 101 Cb 0.07 -2.64 0.09 0.00 0.56 0.00 0.00 36.38 34.46 2aor s VAL 101 CO 0.73 0.00 0.95 0.00 -0.31 0.00 0.00 175.10 176.47 2aor n GLN 102 N -0.60 -5.31 -0.37 4.82 6.02 -1.26 -4.85 117.38 115.83 2aor n GLN 102 Ca -0.01 0.58 0.08 0.00 -0.01 0.00 0.00 57.00 57.64 2aor n GLN 102 Cb 0.66 -5.44 0.23 0.00 1.02 0.00 0.00 30.24 26.71 2aor n GLN 102 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 2aor n ASN 103 N -2.83 3.47 0.00 1.08 0.23 -1.26 -4.99 115.26 110.96 2aor n ASN 103 Ca 0.03 -3.07 0.00 0.00 -0.53 0.00 0.00 54.58 51.01 2aor n ASN 103 Cb 0.53 -0.52 0.00 0.00 -2.08 0.00 0.00 39.78 37.71 2aor n ASN 103 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 2aor n SER 104 N -0.75 0.00 -2.54 0.53 3.41 -1.26 -3.21 113.62 109.80 2aor n SER 104 Ca 0.21 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.49 2aor n SER 104 Cb 0.84 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.82 2aor n SER 104 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2aor n GLY 105 N 0.00 5.88 3.75 5.00 0.00 -1.26 -5.04 105.19 113.52 2aor n GLY 105 Ca 0.00 -2.59 -0.41 0.00 0.00 0.00 0.00 46.02 43.01 2aor n GLY 105 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2aor s VAL 106 N -5.14 2.33 0.26 1.61 -7.23 -1.20 -5.02 120.40 106.01 2aor s VAL 106 Ca 0.52 0.28 0.07 0.00 -1.81 0.00 0.00 61.98 61.04 2aor s VAL 106 Cb 0.43 -3.18 -0.03 0.00 0.56 0.00 0.00 36.38 34.16 2aor s VAL 106 CO -0.21 0.04 0.23 -0.54 -0.31 0.00 0.00 175.10 174.32 2aor s LYS 107 N -0.44 2.96 0.16 4.82 3.01 -1.26 -5.04 119.74 123.95 2aor s LYS 107 Ca 0.62 -1.05 -0.12 0.00 -1.01 0.00 0.00 55.97 54.40 2aor s LYS 107 Cb -0.45 -2.59 0.04 0.00 -1.01 0.00 0.00 37.83 33.81 2aor s LYS 107 CO 0.46 0.36 1.65 2.35 0.51 0.00 0.00 175.35 180.68 2aor h TRP 108 N 1.42 0.92 -0.90 3.18 2.91 -1.96 -3.06 115.95 118.46 2aor h TRP 108 Ca -0.48 -0.12 0.20 0.00 1.13 0.00 0.00 58.89 59.61 2aor h TRP 108 Cb 1.24 -0.26 -0.07 0.00 -0.51 0.00 0.00 29.16 29.57 2aor h TRP 108 CO 0.54 0.82 0.59 0.93 -1.03 0.00 0.00 178.44 180.29 2aor h GLU 109 N 0.76 0.41 -0.45 2.65 3.07 -2.02 -1.07 114.58 117.94 2aor h GLU 109 Ca 0.16 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 59.00 2aor h GLU 109 Cb 0.38 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 28.20 2aor h GLU 109 CO 0.01 0.27 0.00 -1.71 -1.40 0.00 0.00 179.01 176.18 2aor n ASN 110 N -4.52 3.32 -4.77 1.42 2.85 -1.20 -4.86 115.26 107.50 2aor n ASN 110 Ca 0.19 -1.95 -0.35 0.00 -0.11 0.00 0.00 54.58 52.37 2aor n ASN 110 Cb 0.68 -0.30 0.02 0.00 1.24 0.00 0.00 39.78 41.43 2aor n ASN 110 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 2aor s SER 111 N -1.13 5.44 0.21 1.20 1.04 -0.41 -4.90 113.70 115.15 2aor s SER 111 Ca 0.35 2.18 -0.10 0.00 0.48 0.00 0.00 55.95 58.86 2aor s SER 111 Cb 0.19 -2.58 0.15 0.00 0.10 0.00 0.00 66.02 63.88 2aor s SER 111 CO 0.26 -1.41 1.83 0.45 0.98 0.00 0.00 173.24 175.35 2aor h HIS 112 N 0.84 1.02 -0.00 5.02 3.86 -1.92 -1.37 115.15 122.60 2aor h HIS 112 Ca -0.49 -0.02 0.03 0.00 -1.16 0.00 0.00 60.37 58.73 2aor h HIS 112 Cb 1.27 -0.33 -0.04 0.00 1.06 0.00 0.00 27.41 29.37 2aor h HIS 112 CO 0.51 0.71 -0.18 0.28 0.86 0.00 0.00 177.93 180.10 2aor h VAL 113 N 1.04 0.56 -0.23 2.45 2.07 -1.93 0.94 116.25 121.14 2aor h VAL 113 Ca 0.27 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.80 2aor h VAL 113 Cb 0.01 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.32 2aor h VAL 113 CO -0.05 0.00 0.11 -0.09 0.02 0.00 0.00 177.57 177.56 2aor h ARG 114 N -0.30 0.23 -0.75 1.57 2.43 -1.76 -0.45 114.38 115.35 2aor h ARG 114 Ca 0.06 -0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.30 2aor h ARG 114 Cb 0.37 -0.05 -0.07 0.00 -0.42 0.00 0.00 29.97 29.80 2aor h ARG 114 CO -0.17 0.15 0.42 0.45 -1.51 0.00 0.00 179.97 179.30 2aor h HIS 115 N 0.23 0.76 0.00 2.20 3.86 -0.76 -0.08 115.15 121.35 2aor h HIS 115 Ca 0.10 0.03 -0.10 0.00 -1.16 0.00 0.00 60.37 59.23 2aor h HIS 115 Cb 0.03 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.26 2aor h HIS 115 CO -0.10 0.32 -0.50 0.87 0.86 0.00 0.00 177.93 179.38 2aor h LYS 116 N 0.72 0.00 -0.32 2.45 1.57 -0.37 -3.27 116.57 117.35 2aor h LYS 116 Ca 0.36 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.14 2aor h LYS 116 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.62 2aor h LYS 116 CO -0.23 0.50 0.00 1.28 -0.57 0.00 0.00 179.45 180.42 2aor n LEU 117 N -3.45 3.17 -0.13 2.94 4.77 -0.22 -4.45 117.00 119.64 2aor n LEU 117 Ca 0.00 -1.48 -0.10 0.00 -0.03 0.00 0.00 56.01 54.40 2aor n LEU 117 Cb 0.63 -0.20 0.04 0.00 -2.33 0.00 0.00 43.42 41.55 2aor n LEU 117 CO 0.39 0.68 0.68 0.77 -1.33 0.00 0.00 177.39 178.58 2aor h SER 118 N 3.83 0.92 -2.47 -1.43 4.64 -1.08 -3.39 113.55 114.57 2aor h SER 118 Ca 0.00 -0.35 -0.29 0.00 -0.47 0.00 0.00 61.79 60.68 2aor h SER 118 Cb 0.88 -0.25 -0.35 0.00 -0.31 0.00 0.00 62.40 62.37 2aor h SER 118 CO 0.00 1.11 -0.60 0.00 -0.87 0.00 0.00 176.83 176.47 2aor s VAL 120 N 2.36 2.07 -0.55 0.00 1.01 -0.10 -1.31 120.40 123.89 2aor s VAL 120 Ca 0.07 -1.04 -0.17 0.00 0.00 0.00 0.00 61.98 60.84 2aor s VAL 120 Cb -0.15 -1.76 0.11 0.00 0.00 0.00 0.00 36.38 34.57 2aor s VAL 120 CO -0.12 0.57 0.56 -0.22 0.00 0.00 0.00 175.10 175.89 2aor s LEU 121 N 0.07 5.78 0.06 3.92 2.96 0.72 0.30 118.68 132.49 2aor s LEU 121 Ca -0.11 -1.57 -0.26 0.00 -0.22 0.00 0.00 54.13 51.98 2aor s LEU 121 Cb -0.16 -2.25 -0.05 0.00 0.50 0.00 0.00 46.19 44.22 2aor s LEU 121 CO 0.06 -0.92 0.80 0.26 -1.32 0.00 0.00 176.35 175.23 2aor s TRP 122 N 2.03 3.75 -0.47 5.38 0.52 0.10 -2.30 118.94 127.95 2aor s TRP 122 Ca 0.07 1.53 0.04 0.00 0.02 0.00 0.00 56.10 57.75 2aor s TRP 122 Cb -0.27 -2.86 0.12 0.00 -1.15 0.00 0.00 33.47 29.32 2aor s TRP 122 CO 0.05 0.26 0.21 -1.64 0.02 0.00 0.00 176.95 175.85 2aor s MET 123 N -0.04 1.78 0.33 4.98 -1.94 -0.43 -1.37 119.30 122.60 2aor s MET 123 Ca 0.40 -2.38 -0.29 0.00 -1.71 0.00 0.00 55.69 51.71 2aor s MET 123 Cb -0.21 -3.17 -0.10 0.00 2.01 0.00 0.00 34.83 33.35 2aor s MET 123 CO 0.24 -1.08 1.39 -2.14 -0.01 0.00 0.00 175.02 173.42 2aor s PRO 124 N 0.05 4.27 0.03 2.03 0.02 -1.26 -2.16 135.00 137.97 2aor s PRO 124 Ca 0.16 2.34 0.01 0.00 0.02 0.00 0.00 61.00 63.53 2aor s PRO 124 Cb -0.24 -3.05 -0.02 0.00 0.02 0.00 0.00 34.50 31.21 2aor s PRO 124 CO -0.02 -0.34 -0.06 0.96 -0.33 0.00 0.00 177.00 177.22 2aor s ILE 125 N -0.90 0.36 0.16 2.83 -5.25 -0.50 0.49 121.20 118.40 2aor s ILE 125 Ca 0.52 -0.90 -0.30 0.00 -0.99 0.00 0.00 60.65 58.98 2aor s ILE 125 Cb -0.42 -0.44 -0.08 0.00 2.95 0.00 0.00 42.46 44.47 2aor s ILE 125 CO 0.54 -0.36 1.27 -1.61 -1.79 0.00 0.00 174.94 172.98 2aor s GLU 126 N -1.35 4.42 0.00 0.37 2.02 -0.57 -0.18 118.70 123.41 2aor s GLU 126 Ca -0.11 1.95 0.00 0.00 0.02 0.00 0.00 54.97 56.84 2aor s GLU 126 Cb -0.09 -3.24 0.00 0.00 0.10 0.00 0.00 34.13 30.90 2aor s GLU 126 CO -0.00 -0.22 0.38 0.41 0.02 0.00 0.00 175.26 175.85 2aor n GLY 127 N 2.60 -0.90 3.64 -1.39 0.00 -0.71 -4.74 105.19 103.68 2aor n GLY 127 Ca 0.07 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.56 2aor n GLY 127 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2aor n SER 128 N -0.18 2.12 0.16 1.61 7.64 -1.26 -4.85 113.62 118.86 2aor n SER 128 Ca 0.00 1.09 0.06 0.00 1.01 0.00 0.00 58.87 61.04 2aor n SER 128 Cb 0.01 -1.22 0.54 0.00 -1.01 0.00 0.00 64.21 62.54 2aor n SER 128 CO 0.00 0.00 0.00 0.08 -3.01 0.00 0.00 175.04 172.11 2aor h ARG 129 N 5.68 0.19 0.00 1.43 0.11 -1.98 -2.37 114.38 117.44 2aor h ARG 129 Ca -0.47 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 59.59 2aor h ARG 129 Cb 1.32 -0.04 0.00 0.00 1.11 0.00 0.00 29.97 32.36 2aor h ARG 129 CO 0.85 0.16 0.00 -2.39 0.10 0.00 0.00 179.97 178.68 2aor n HIS 130 N -4.49 0.63 -3.51 4.08 1.44 -1.26 -4.59 115.22 107.53 2aor n HIS 130 Ca -0.01 0.26 -0.37 0.00 -2.01 0.00 0.00 57.72 55.59 2aor n HIS 130 Cb 0.10 -0.91 -0.07 0.00 0.12 0.00 0.00 29.99 29.23 2aor n HIS 130 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 2aor s ILE 131 N -3.27 5.29 0.24 0.61 1.01 -0.89 -5.04 121.20 119.15 2aor s ILE 131 Ca 0.04 0.58 -0.30 0.00 0.00 0.00 0.00 60.65 60.97 2aor s ILE 131 Cb 0.09 -3.65 -0.10 0.00 0.01 0.00 0.00 42.46 38.81 2aor s ILE 131 CO 0.35 0.37 1.47 -2.84 0.00 0.00 0.00 174.94 174.28 2aor s PRO 132 N 0.61 4.24 0.20 2.79 0.02 -1.26 -4.85 135.00 136.74 2aor s PRO 132 Ca 0.17 2.34 -0.17 0.00 0.02 0.00 0.00 61.00 63.36 2aor s PRO 132 Cb -0.13 -3.10 0.18 0.00 0.02 0.00 0.00 34.50 31.47 2aor s PRO 132 CO 0.05 -0.46 1.36 -0.11 -0.33 0.00 0.00 177.00 177.50 2aor n LEU 133 N 2.49 -0.61 -0.29 -5.54 7.94 -1.26 -0.13 117.00 119.59 2aor n LEU 133 Ca 0.08 1.53 0.25 0.00 -1.11 0.00 0.00 56.01 56.76 2aor n LEU 133 Cb 0.40 -0.34 0.57 0.00 0.53 0.00 0.00 43.42 44.58 2aor n LEU 133 CO 0.61 -1.36 1.24 0.03 -1.11 0.00 0.00 177.39 176.80 2aor h ARG 134 N 0.00 0.29 -0.00 1.96 3.08 -1.89 -2.01 114.38 115.80 2aor h ARG 134 Ca 0.29 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.32 2aor h ARG 134 Cb 0.51 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.49 2aor h ARG 134 CO -0.87 0.19 -0.32 0.39 -1.07 0.00 0.00 179.97 178.30 2aor n GLU 135 N -4.50 0.50 -2.13 0.04 1.02 0.81 -0.64 120.64 115.74 2aor n GLU 135 Ca 0.24 -0.27 -0.39 0.00 -0.02 0.00 0.00 57.16 56.71 2aor n GLU 135 Cb 0.91 -1.49 -0.01 0.00 -0.02 0.00 0.00 31.44 30.83 2aor n GLU 135 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2aor s ARG 136 N -2.69 3.99 0.24 3.49 0.52 -0.76 -4.76 118.95 118.99 2aor s ARG 136 Ca 0.20 2.06 -0.04 0.00 -0.52 0.00 0.00 55.73 57.43 2aor s ARG 136 Cb 0.19 -2.74 -0.05 0.00 0.52 0.00 0.00 34.95 32.87 2aor s ARG 136 CO 0.58 -0.44 0.49 -1.01 0.02 0.00 0.00 175.30 174.94 2aor s HIS 137 N -1.30 3.48 -0.21 -0.53 3.76 -1.26 -1.06 115.29 118.16 2aor s HIS 137 Ca 0.57 0.55 -0.11 0.00 -0.15 0.00 0.00 55.06 55.92 2aor s HIS 137 Cb -0.36 -2.02 -0.05 0.00 1.11 0.00 0.00 32.58 31.26 2aor s HIS 137 CO 0.46 0.27 0.16 0.42 -0.85 0.00 0.00 174.74 175.20 2aor s ILE 138 N -1.96 5.38 0.22 0.60 1.01 -0.15 -1.52 121.20 124.78 2aor s ILE 138 Ca 0.42 0.23 -0.04 0.00 0.00 0.00 0.00 60.65 61.27 2aor s ILE 138 Cb -0.11 -3.50 0.05 0.00 0.01 0.00 0.00 42.46 38.91 2aor s ILE 138 CO 0.29 0.40 0.30 0.61 0.00 0.00 0.00 174.94 176.54 2aor n GLY 139 N 3.80 -1.05 3.78 6.18 0.00 0.18 -0.69 105.19 117.39 2aor n GLY 139 Ca -0.15 -1.70 -0.39 0.00 0.00 0.00 0.00 46.02 43.77 2aor n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aor s ALA 140 N -3.90 3.44 0.66 4.61 0.00 -1.26 -4.44 121.76 120.88 2aor s ALA 140 Ca 0.17 0.35 -0.17 0.00 0.00 0.00 0.00 51.96 52.32 2aor s ALA 140 Cb -0.00 -2.95 -0.00 0.00 0.00 0.00 0.00 23.12 20.16 2aor s ALA 140 CO 0.12 0.29 1.24 -1.25 0.00 0.00 0.00 175.76 176.17 2aor s PRO 141 N -1.22 2.53 -0.27 0.00 0.04 -1.26 -4.43 135.00 130.38 2aor s PRO 141 Ca 0.36 1.90 -0.00 0.00 0.04 0.00 0.00 61.00 63.30 2aor s PRO 141 Cb -0.23 -1.86 0.08 0.00 0.04 0.00 0.00 34.50 32.53 2aor s PRO 141 CO 0.26 -1.57 0.04 0.42 0.04 0.00 0.00 177.00 176.19 2aor s ILE 142 N -1.65 1.11 -0.39 0.56 1.01 -0.47 -4.99 121.20 116.39 2aor s ILE 142 Ca 0.78 -1.27 -0.26 0.00 0.00 0.00 0.00 60.65 59.90 2aor s ILE 142 Cb -0.33 -1.67 0.02 0.00 0.01 0.00 0.00 42.46 40.49 2aor s ILE 142 CO 0.40 -0.42 0.96 0.12 0.00 0.00 0.00 174.94 176.00 2aor s PHE 143 N 1.54 3.04 0.03 3.97 5.36 -1.26 -0.72 117.98 129.93 2aor s PHE 143 Ca 0.04 0.76 0.09 0.00 -0.96 0.00 0.00 56.93 56.85 2aor s PHE 143 Cb -0.18 -3.78 -0.03 0.00 -0.34 0.00 0.00 43.02 38.70 2aor s PHE 143 CO -0.15 -0.90 -0.25 -0.46 -1.46 0.00 0.00 175.22 171.99 2aor s TRP 144 N 3.64 2.22 -0.05 10.12 -0.00 0.15 -4.99 118.94 130.03 2aor s TRP 144 Ca 0.40 -0.41 0.03 0.00 -0.00 0.00 0.00 56.10 56.12 2aor s TRP 144 Cb -0.11 -1.35 0.00 0.00 -0.00 0.00 0.00 33.47 32.01 2aor s TRP 144 CO 0.21 0.09 -0.14 0.15 -0.00 0.00 0.00 176.95 177.25 2aor s LYS 145 N -1.10 1.61 0.35 5.86 3.01 -1.26 -0.92 119.74 127.29 2aor s LYS 145 Ca 0.11 -0.50 -0.28 0.00 -1.01 0.00 0.00 55.97 54.29 2aor s LYS 145 Cb -0.10 -1.39 -0.09 0.00 -1.01 0.00 0.00 37.83 35.24 2aor s LYS 145 CO 0.01 0.16 1.24 -1.25 0.51 0.00 0.00 175.35 176.02 2aor s PRO 146 N 0.24 4.28 0.96 -1.68 0.04 -1.26 -5.00 135.00 132.58 2aor s PRO 146 Ca -0.07 2.05 -0.12 0.00 0.04 0.00 0.00 61.00 62.90 2aor s PRO 146 Cb -0.12 -2.95 0.17 0.00 0.04 0.00 0.00 34.50 31.63 2aor s PRO 146 CO 0.02 -0.19 1.11 0.95 0.04 0.00 0.00 177.00 178.93 2aor s THR 147 N -1.22 2.12 0.37 1.26 -4.23 -1.26 -4.71 115.64 107.95 2aor s THR 147 Ca 0.51 0.04 0.06 0.00 -1.18 0.00 0.00 61.69 61.12 2aor s THR 147 Cb -0.36 -2.62 0.29 0.00 1.34 0.00 0.00 72.50 71.15 2aor s THR 147 CO 0.47 -0.05 1.97 0.00 -0.54 0.00 0.00 174.62 176.47 2aor h ALA 148 N -1.73 1.71 -0.10 3.99 0.00 -1.99 -0.39 119.26 120.74 2aor h ALA 148 Ca -0.53 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.29 2aor h ALA 148 Cb 1.33 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2aor h ALA 148 CO 0.59 0.19 -0.20 1.49 0.00 0.00 0.00 179.25 181.31 2aor h GLU 149 N 0.73 0.31 -0.67 0.00 4.57 -2.00 -2.44 114.58 115.10 2aor h GLU 149 Ca 0.29 -0.20 0.03 0.00 -1.18 0.00 0.00 59.36 58.30 2aor h GLU 149 Cb 0.23 0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 28.80 2aor h GLU 149 CO -0.09 0.80 0.42 1.96 -1.18 0.00 0.00 179.01 180.91 2aor h GLN 150 N -0.14 0.80 -0.27 1.92 4.20 -1.76 -1.11 115.11 118.76 2aor h GLN 150 Ca 0.00 -0.05 -0.08 0.00 0.06 0.00 0.00 58.65 58.59 2aor h GLN 150 Cb 0.79 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.38 2aor h GLN 150 CO 0.04 0.53 -0.17 1.49 -0.67 0.00 0.00 178.83 180.05 2aor h GLU 151 N 0.82 0.47 -0.59 1.46 4.81 -1.12 -1.01 114.58 119.43 2aor h GLU 151 Ca 0.27 -0.15 -0.08 0.00 -0.13 0.00 0.00 59.36 59.27 2aor h GLU 151 Cb 0.01 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 2aor h GLU 151 CO -0.10 0.63 0.06 -0.09 -0.73 0.00 0.00 179.01 178.78 2aor h ARG 152 N 0.43 1.00 -0.20 1.92 2.43 -0.87 -0.78 114.38 118.31 2aor h ARG 152 Ca 0.07 -0.29 -0.00 0.00 -0.81 0.00 0.00 59.98 58.95 2aor h ARG 152 Cb 0.55 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 2aor h ARG 152 CO 0.04 0.96 0.11 1.96 -1.51 0.00 0.00 179.97 181.53 2aor h GLN 153 N 0.90 0.28 -0.45 0.20 4.20 -0.78 -1.10 115.11 118.36 2aor h GLN 153 Ca 0.17 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.86 2aor h GLN 153 Cb 0.47 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 2aor h GLN 153 CO 0.02 0.25 0.29 -0.07 -0.67 0.00 0.00 178.83 178.66 2aor h LEU 154 N 0.23 0.51 -0.71 1.46 3.38 -1.03 -1.96 115.31 117.19 2aor h LEU 154 Ca 0.07 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 2aor h LEU 154 Cb 0.05 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 2aor h LEU 154 CO -0.01 0.37 0.43 0.50 0.09 0.00 0.00 178.44 179.81 2aor h LYS 155 N 0.60 0.96 -0.17 1.13 3.64 -0.98 0.30 116.57 122.06 2aor h LYS 155 Ca 0.17 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.45 2aor h LYS 155 Cb -0.06 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.55 2aor h LYS 155 CO -0.04 0.68 0.08 0.37 -2.27 0.00 0.00 179.45 178.28 2aor h GLN 156 N 0.97 0.24 -0.43 1.90 4.15 -0.89 -0.81 115.11 120.24 2aor h GLN 156 Ca 0.26 -0.03 -0.03 0.00 0.77 0.00 0.00 58.65 59.61 2aor h GLN 156 Cb -0.03 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.60 2aor h GLN 156 CO -0.05 0.28 0.15 -0.44 -1.93 0.00 0.00 178.83 176.84 2aor h ASP 157 N 0.15 0.61 -0.26 -0.69 3.32 -1.14 -1.24 116.42 117.17 2aor h ASP 157 Ca 0.06 -0.19 0.04 0.00 0.02 0.00 0.00 57.03 56.96 2aor h ASP 157 Cb 0.11 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.46 2aor h ASP 157 CO -0.01 0.64 -0.00 -0.25 -1.72 0.00 0.00 179.24 177.90 2aor h TRP 158 N 0.55 -0.02 -0.68 4.55 7.01 -0.79 0.92 115.95 127.50 2aor h TRP 158 Ca 0.14 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.14 2aor h TRP 158 Cb 0.24 0.05 -0.03 0.00 -2.10 0.00 0.00 29.16 27.31 2aor h TRP 158 CO 0.01 -0.04 0.34 0.93 -2.79 0.00 0.00 178.44 176.89 2aor h GLU 159 N 0.08 0.97 -0.25 2.65 5.08 -0.98 0.25 114.58 122.38 2aor h GLU 159 Ca 0.12 -0.13 -0.04 0.00 -1.00 0.00 0.00 59.36 58.31 2aor h GLU 159 Cb 0.16 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 2aor h GLU 159 CO -0.21 0.75 0.01 1.49 -1.00 0.00 0.00 179.01 180.05 2aor h GLU 160 N 0.94 0.44 -0.42 2.33 4.81 -0.76 -0.74 114.58 121.19 2aor h GLU 160 Ca 0.24 -0.14 -0.08 0.00 -0.13 0.00 0.00 59.36 59.25 2aor h GLU 160 Cb 0.09 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 2aor h GLU 160 CO -0.03 0.61 -0.03 -0.07 -0.73 0.00 0.00 179.01 178.75 2aor h LEU 161 N 0.22 0.75 -0.78 1.64 3.38 -0.68 -2.83 115.31 117.01 2aor h LEU 161 Ca 0.07 -0.33 -0.09 0.00 0.09 0.00 0.00 57.88 57.63 2aor h LEU 161 Cb 0.40 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 2aor h LEU 161 CO 0.01 0.90 -0.01 0.24 0.09 0.00 0.00 178.44 179.68 2aor h MET 162 N 0.59 0.92 -0.64 1.13 2.86 -0.44 -2.20 114.93 117.14 2aor h MET 162 Ca 0.11 -0.27 0.04 0.00 -2.06 0.00 0.00 59.70 57.52 2aor h MET 162 Cb 0.54 -0.09 -0.05 0.00 0.06 0.00 0.00 31.60 32.06 2aor h MET 162 CO 0.03 0.91 0.38 -0.44 1.06 0.00 0.00 176.91 178.85 2aor h ASP 163 N 0.85 0.60 -0.84 1.22 3.32 -1.05 0.18 116.42 120.70 2aor h ASP 163 Ca 0.16 0.01 0.03 0.00 0.02 0.00 0.00 57.03 57.25 2aor h ASP 163 Cb 0.51 -0.11 -0.05 0.00 0.22 0.00 0.00 39.33 39.90 2aor h ASP 163 CO 0.03 0.41 0.53 -0.07 -1.72 0.00 0.00 179.24 178.42 2aor h LEU 164 N 0.73 0.88 -0.14 1.55 4.07 -1.23 -1.47 115.31 119.70 2aor h LEU 164 Ca 0.27 -0.00 -0.06 0.00 0.08 0.00 0.00 57.88 58.17 2aor h LEU 164 Cb 0.08 -0.20 -0.00 0.00 1.08 0.00 0.00 40.66 41.63 2aor h LEU 164 CO -0.13 0.60 -0.15 0.40 -1.08 0.00 0.00 178.44 178.08 2aor h ILE 165 N 1.04 1.35 -0.09 1.22 2.04 -0.69 -1.13 117.51 121.24 2aor h ILE 165 Ca 0.34 -1.32 -0.06 0.00 1.00 0.00 0.00 64.86 64.82 2aor h ILE 165 Cb 0.02 1.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.98 2aor h ILE 165 CO -0.12 0.39 -0.20 0.58 0.00 0.00 0.00 178.15 178.80 2aor h VAL 166 N -0.02 1.19 -0.18 1.67 2.07 -0.51 -2.57 116.25 117.90 2aor h VAL 166 Ca 0.02 -0.87 0.00 0.00 0.82 0.00 0.00 66.70 66.67 2aor h VAL 166 Cb 0.69 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.80 2aor h VAL 166 CO 0.04 0.26 0.00 0.18 0.02 0.00 0.00 177.57 178.07 2aor n LEU 167 N -4.24 1.43 -1.89 2.57 4.77 -0.57 -4.87 117.00 114.19 2aor n LEU 167 Ca -0.01 -0.72 -0.19 0.00 -0.03 0.00 0.00 56.01 55.06 2aor n LEU 167 Cb 0.30 -0.26 -0.04 0.00 -2.33 0.00 0.00 43.42 41.08 2aor n LEU 167 CO 0.38 0.29 -0.22 0.61 -1.33 0.00 0.00 177.39 177.12 2aor n GLY 168 N 0.60 0.60 2.15 -0.72 0.00 -0.97 -4.84 105.19 102.01 2aor n GLY 168 Ca 0.07 -0.08 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 2aor n GLY 168 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2aor n LYS 169 N -2.67 2.32 -0.13 1.61 5.02 -0.43 -3.62 118.16 120.25 2aor n LYS 169 Ca -0.21 -2.71 0.06 0.00 -2.02 0.00 0.00 58.31 53.42 2aor n LYS 169 Cb 0.66 -2.06 0.38 0.00 -0.02 0.00 0.00 35.03 33.98 2aor n LYS 169 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2aor h LEU 170 N 1.80 0.60 -2.33 -0.35 3.38 -1.83 -1.33 115.31 115.25 2aor h LEU 170 Ca 0.52 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.49 2aor h LEU 170 Cb 1.38 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.99 2aor h LEU 170 CO 1.23 0.40 -0.01 -2.24 0.09 0.00 0.00 178.44 177.91 2aor h ASP 171 N 0.69 0.00 0.33 -0.43 2.03 -1.95 -0.81 116.42 116.29 2aor h ASP 171 Ca 0.27 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.57 2aor h ASP 171 Cb 0.20 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.70 2aor h ASP 171 CO -0.08 0.01 -0.12 0.00 -1.03 0.00 0.00 179.24 178.01 2aor n GLN 172 N -4.02 0.74 -2.86 4.15 6.02 -0.50 -4.88 117.38 116.02 2aor n GLN 172 Ca -0.03 -0.28 -0.41 0.00 -0.01 0.00 0.00 57.00 56.26 2aor n GLN 172 Cb 0.09 -1.49 -0.04 0.00 1.02 0.00 0.00 30.24 29.82 2aor n GLN 172 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2aor s ILE 173 N -2.46 4.89 0.21 5.09 1.01 -0.31 -5.04 121.20 124.59 2aor s ILE 173 Ca 0.29 1.71 0.03 0.00 0.00 0.00 0.00 60.65 62.68 2aor s ILE 173 Cb 0.20 -4.17 -0.05 0.00 0.01 0.00 0.00 42.46 38.45 2aor s ILE 173 CO 0.47 0.07 -0.02 0.28 0.00 0.00 0.00 174.94 175.75 2aor s THR 174 N 1.82 1.00 -0.60 2.92 -1.32 -1.26 -5.03 115.64 113.16 2aor s THR 174 Ca 0.41 -2.03 0.22 0.00 -1.21 0.00 0.00 61.69 59.08 2aor s THR 174 Cb -0.17 -2.25 0.22 0.00 -1.51 0.00 0.00 72.50 68.79 2aor s THR 174 CO 0.16 -0.40 1.66 0.00 -2.21 0.00 0.00 174.62 173.83 2aor n ALA 175 N -0.36 1.69 0.83 11.08 0.00 -1.25 -2.84 120.51 129.66 2aor n ALA 175 Ca -0.06 0.05 0.10 0.00 0.00 0.00 0.00 53.44 53.53 2aor n ALA 175 Cb 0.63 -1.36 0.48 0.00 0.00 0.00 0.00 19.45 19.20 2aor n ALA 175 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2aor n ARG 176 N -2.08 0.12 -3.22 0.00 1.74 -1.26 -4.68 116.66 107.29 2aor n ARG 176 Ca 0.03 0.12 -0.39 0.00 -0.77 0.00 0.00 57.85 56.84 2aor n ARG 176 Cb 0.23 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 30.11 2aor n ARG 176 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2aor s ILE 177 N -2.82 4.66 0.00 0.55 1.01 -1.13 -4.94 121.20 118.53 2aor s ILE 177 Ca 0.14 1.31 0.00 0.00 0.00 0.00 0.00 60.65 62.10 2aor s ILE 177 Cb 0.14 -3.94 0.00 0.00 0.01 0.00 0.00 42.46 38.66 2aor s ILE 177 CO 0.35 0.54 0.00 0.61 0.00 0.00 0.00 174.94 176.45 2aor n GLY 178 N 1.68 2.82 0.13 6.18 0.00 -1.26 -4.42 105.19 110.32 2aor n GLY 178 Ca -0.09 -1.41 -0.18 0.00 0.00 0.00 0.00 46.02 44.33 2aor n GLY 178 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2aor h GLU 179 N 0.00 0.37 0.00 1.61 4.81 -1.92 -3.41 114.58 116.04 2aor h GLU 179 Ca 0.00 -0.46 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 2aor h GLU 179 Cb 0.00 0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.53 2aor h GLU 179 CO 0.00 1.15 -0.26 1.33 -0.73 0.00 0.00 179.01 180.50 2aor n VAL 180 N -4.19 0.00 -4.26 0.32 0.24 -1.26 -4.98 118.33 104.20 2aor n VAL 180 Ca -0.12 -0.26 -0.18 0.00 -2.04 0.00 0.00 64.34 61.75 2aor n VAL 180 Cb 0.72 0.79 -0.13 0.00 -1.47 0.00 0.00 33.84 33.75 2aor n VAL 180 CO 0.00 0.00 0.00 -0.32 -2.14 0.00 0.00 176.83 174.37 2aor s MET 181 N -1.04 0.73 0.27 7.34 -2.45 -1.26 -0.54 119.30 122.35 2aor s MET 181 Ca 0.00 -0.58 0.02 0.00 -1.25 0.00 0.00 55.69 53.87 2aor s MET 181 Cb 0.00 -0.67 -0.04 0.00 1.25 0.00 0.00 34.83 35.36 2aor s MET 181 CO 0.00 0.17 0.13 1.14 1.05 0.00 0.00 175.02 177.50 2aor s GLN 182 N -0.89 1.44 -0.15 4.11 -2.07 0.37 -4.20 119.66 118.27 2aor s GLN 182 Ca -0.01 -1.79 -0.01 0.00 -1.82 0.00 0.00 55.36 51.73 2aor s GLN 182 Cb -0.07 -0.11 -0.02 0.00 -1.09 0.00 0.00 33.01 31.73 2aor s GLN 182 CO 0.01 -0.37 -0.10 -0.51 -1.32 0.00 0.00 175.29 173.00 2aor s LEU 183 N -3.31 2.86 0.23 2.60 1.43 -1.26 -0.40 118.68 120.83 2aor s LEU 183 Ca 0.37 -0.29 0.00 0.00 -1.03 0.00 0.00 54.13 53.19 2aor s LEU 183 Cb 0.07 -1.67 -0.05 0.00 0.03 0.00 0.00 46.19 44.57 2aor s LEU 183 CO 0.15 0.14 0.11 -0.13 0.23 0.00 0.00 176.35 176.85 2aor s ARG 184 N 0.50 1.32 0.77 1.70 0.52 -0.88 -3.84 118.95 119.04 2aor s ARG 184 Ca -0.07 -1.70 -0.13 0.00 -0.52 0.00 0.00 55.73 53.30 2aor s ARG 184 Cb -0.15 -0.01 0.06 0.00 0.52 0.00 0.00 34.95 35.37 2aor s ARG 184 CO 0.04 -0.34 1.16 -2.14 0.02 0.00 0.00 175.30 174.04 2aor s PRO 185 N -4.09 2.00 -0.33 3.54 0.02 -1.26 -0.96 135.00 133.92 2aor s PRO 185 Ca 0.38 1.57 0.02 0.00 0.02 0.00 0.00 61.00 62.99 2aor s PRO 185 Cb 0.07 -1.84 0.15 0.00 0.02 0.00 0.00 34.50 32.91 2aor s PRO 185 CO 0.13 -1.90 0.38 0.21 -0.33 0.00 0.00 177.00 175.49 2aor s LYS 186 N -4.26 0.50 -0.00 5.54 2.47 -0.83 -4.50 119.74 118.67 2aor s LYS 186 Ca 0.69 -0.33 -0.00 0.00 -1.56 0.00 0.00 55.97 54.77 2aor s LYS 186 Cb -0.24 -0.53 0.00 0.00 -1.46 0.00 0.00 37.83 35.60 2aor s LYS 186 CO 0.49 -1.10 0.01 0.41 0.16 0.00 0.00 175.35 175.32 2aor n GLY 187 N 4.88 0.47 0.26 5.54 0.00 -1.26 -4.53 105.19 110.54 2aor n GLY 187 Ca 0.04 -0.81 -0.08 0.00 0.00 0.00 0.00 46.02 45.17 2aor n GLY 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aor h ALA 188 N 2.00 0.72 -1.88 4.61 0.00 -1.99 -3.48 119.26 119.24 2aor h ALA 188 Ca -0.00 -0.19 0.07 0.00 0.00 0.00 0.00 54.91 54.78 2aor h ALA 188 Cb 0.01 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2aor h ALA 188 CO 0.00 0.38 0.23 0.27 0.00 0.00 0.00 179.25 180.14 2aor n ASN 189 N -4.45 -0.62 0.00 0.00 0.23 -1.26 -5.00 115.26 104.16 2aor n ASN 189 Ca 0.02 -1.31 0.04 0.00 -0.53 0.00 0.00 54.58 52.81 2aor n ASN 189 Cb 0.20 1.00 0.23 0.00 -2.08 0.00 0.00 39.78 39.13 2aor n ASN 189 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 2aor n SER 190 N -0.80 0.00 -0.59 0.53 3.41 -1.26 -1.94 113.62 112.97 2aor n SER 190 Ca -0.00 0.04 0.09 0.00 -0.26 0.00 0.00 58.87 58.73 2aor n SER 190 Cb 0.22 -0.20 0.04 0.00 -0.26 0.00 0.00 64.21 64.00 2aor n SER 190 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2aor n ARG 191 N -1.20 1.61 -2.02 4.33 1.74 -1.26 -4.96 116.66 114.89 2aor n ARG 191 Ca 0.05 -1.25 -0.37 0.00 -0.77 0.00 0.00 57.85 55.51 2aor n ARG 191 Cb 0.06 -1.36 0.02 0.00 -1.02 0.00 0.00 32.46 30.16 2aor n ARG 191 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2aor s ALA 192 N -1.86 2.85 0.05 7.54 0.00 -0.82 -5.02 121.76 124.49 2aor s ALA 192 Ca 0.19 1.12 0.00 0.00 0.00 0.00 0.00 51.96 53.27 2aor s ALA 192 Cb 0.15 -3.47 -0.03 0.00 0.00 0.00 0.00 23.12 19.77 2aor s ALA 192 CO 0.36 -1.03 -0.05 0.14 0.00 0.00 0.00 175.76 175.18 2aor s VAL 193 N -1.45 0.35 0.18 0.00 -7.23 -1.26 -4.18 120.40 106.82 2aor s VAL 193 Ca 0.69 -1.46 -0.13 0.00 -1.81 0.00 0.00 61.98 59.27 2aor s VAL 193 Cb -0.34 -1.04 0.01 0.00 0.56 0.00 0.00 36.38 35.57 2aor s VAL 193 CO 0.40 -0.72 0.40 0.28 -0.31 0.00 0.00 175.10 175.15 2aor s THR 194 N -2.71 0.05 0.33 5.32 -1.32 0.69 -4.82 115.64 113.17 2aor s THR 194 Ca -0.01 -1.09 -0.27 0.00 -1.21 0.00 0.00 61.69 59.10 2aor s THR 194 Cb -0.01 -1.71 -0.09 0.00 -1.51 0.00 0.00 72.50 69.18 2aor s THR 194 CO -0.04 -0.22 1.11 -0.54 -2.21 0.00 0.00 174.62 172.72 2aor s LYS 195 N -3.92 4.42 0.04 7.08 -0.14 -1.26 -0.92 119.74 125.05 2aor s LYS 195 Ca 0.13 1.76 0.00 0.00 -1.36 0.00 0.00 55.97 56.51 2aor s LYS 195 Cb 0.01 -2.95 -0.00 0.00 -1.68 0.00 0.00 37.83 33.21 2aor s LYS 195 CO -0.01 0.03 0.05 0.41 -0.76 0.00 0.00 175.35 175.07 2aor n GLY 196 N 0.89 3.34 3.34 -3.33 0.00 -0.11 -4.33 105.19 104.99 2aor n GLY 196 Ca 0.01 -1.51 -0.34 0.00 0.00 0.00 0.00 46.02 44.18 2aor n GLY 196 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2aor s ILE 197 N -2.36 3.25 0.75 -0.61 1.01 -1.26 -1.78 121.20 120.21 2aor s ILE 197 Ca 0.04 -0.56 -0.13 0.00 0.00 0.00 0.00 60.65 60.01 2aor s ILE 197 Cb 0.00 -2.43 0.18 0.00 0.01 0.00 0.00 42.46 40.22 2aor s ILE 197 CO 0.03 0.47 0.82 0.61 0.00 0.00 0.00 174.94 176.86 2aor n GLY 198 N 4.26 -2.06 0.00 6.18 0.00 0.35 -4.24 105.19 109.68 2aor n GLY 198 Ca -0.18 -1.58 0.07 0.00 0.00 0.00 0.00 46.02 44.33 2aor n GLY 198 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2aor n LYS 199 N -3.36 0.00 0.00 1.61 5.02 -1.24 -2.78 118.16 117.42 2aor n LYS 199 Ca 0.11 0.25 0.00 0.00 -2.02 0.00 0.00 58.31 56.65 2aor n LYS 199 Cb 0.39 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.90 2aor n LYS 199 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2aor n ASN 200 N -1.51 0.63 0.00 4.39 3.02 -1.26 -4.97 115.26 115.56 2aor n ASN 200 Ca 0.04 -0.83 0.00 0.00 -0.03 0.00 0.00 54.58 53.76 2aor n ASN 200 Cb 0.17 0.31 0.00 0.00 -0.61 0.00 0.00 39.78 39.65 2aor n ASN 200 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2aor n GLY 201 N 0.31 0.57 3.78 7.41 0.00 -1.12 -5.08 105.19 111.05 2aor n GLY 201 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2aor n GLY 201 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2aor s GLU 202 N -0.65 3.10 -0.36 1.61 8.01 -1.26 -4.65 118.70 124.49 2aor s GLU 202 Ca 0.00 1.46 -0.24 0.00 0.01 0.00 0.00 54.97 56.20 2aor s GLU 202 Cb 0.00 -1.98 0.01 0.00 -4.31 0.00 0.00 34.13 27.85 2aor s GLU 202 CO 0.00 -1.02 0.81 0.42 0.01 0.00 0.00 175.26 175.48 2aor s ILE 203 N -2.11 4.71 0.46 -1.63 1.01 -1.26 -0.50 121.20 121.88 2aor s ILE 203 Ca 0.69 0.98 0.06 0.00 0.00 0.00 0.00 60.65 62.38 2aor s ILE 203 Cb -0.21 -4.23 -0.01 0.00 0.01 0.00 0.00 42.46 38.02 2aor s ILE 203 CO 0.35 -0.43 0.30 0.27 0.00 0.00 0.00 174.94 175.42 2aor s ILE 204 N 3.16 2.12 -0.05 2.92 -4.36 -0.73 -4.90 121.20 119.37 2aor s ILE 204 Ca 0.33 -1.55 -0.16 0.00 -0.26 0.00 0.00 60.65 59.01 2aor s ILE 204 Cb -0.13 -2.68 -0.05 0.00 1.25 0.00 0.00 42.46 40.85 2aor s ILE 204 CO 0.17 0.00 0.42 -1.81 0.24 0.00 0.00 174.94 173.95 2aor s ASP 205 N -4.08 6.74 0.14 4.36 -0.00 -1.26 -0.94 116.67 121.63 2aor s ASP 205 Ca 0.39 0.88 -0.16 0.00 -0.00 0.00 0.00 52.55 53.65 2aor s ASP 205 Cb 0.00 -2.25 0.03 0.00 -0.00 0.00 0.00 42.92 40.70 2aor s ASP 205 CO 0.22 0.21 0.43 0.28 -0.00 0.00 0.00 175.17 176.32 2aor s THR 206 N -0.45 0.06 0.07 -1.27 -1.32 -0.09 -4.88 115.64 107.75 2aor s THR 206 Ca 0.24 -0.60 -0.31 0.00 -1.21 0.00 0.00 61.69 59.80 2aor s THR 206 Cb -0.16 -1.25 -0.08 0.00 -1.51 0.00 0.00 72.50 69.50 2aor s THR 206 CO 0.12 -0.26 1.57 -0.22 -2.21 0.00 0.00 174.62 173.61 2aor s LEU 207 N -2.82 4.36 0.43 9.08 2.96 -1.26 -0.22 118.68 131.21 2aor s LEU 207 Ca 0.04 2.41 -0.25 0.00 -0.22 0.00 0.00 54.13 56.11 2aor s LEU 207 Cb 0.01 -3.57 -0.08 0.00 0.50 0.00 0.00 46.19 43.05 2aor s LEU 207 CO -0.10 -0.82 1.31 -2.16 -1.32 0.00 0.00 176.35 173.25 2aor s PRO 208 N 2.27 3.83 0.14 0.98 0.04 -1.26 -4.86 135.00 136.15 2aor s PRO 208 Ca 0.70 2.16 0.08 0.00 0.04 0.00 0.00 61.00 63.98 2aor s PRO 208 Cb -0.38 -2.66 -0.04 0.00 0.04 0.00 0.00 34.50 31.46 2aor s PRO 208 CO 0.31 -0.61 -0.19 -0.51 0.04 0.00 0.00 177.00 176.04 2aor s LEU 209 N -2.64 2.39 0.11 -3.56 1.43 -1.26 -1.96 118.68 113.20 2aor s LEU 209 Ca 0.59 -0.81 0.04 0.00 -1.03 0.00 0.00 54.13 52.93 2aor s LEU 209 Cb -0.38 -0.82 -0.04 0.00 0.03 0.00 0.00 46.19 44.99 2aor s LEU 209 CO 0.48 -0.02 -0.11 -0.83 0.23 0.00 0.00 176.35 176.10 2aor s GLY 210 N -2.43 0.92 0.09 -3.19 0.00 -0.14 -0.89 107.32 101.69 2aor s GLY 210 Ca 0.12 -1.22 -0.25 0.00 0.00 0.00 0.00 44.72 43.37 2aor s GLY 210 CO 0.06 -1.29 0.78 -1.36 0.00 0.00 0.00 173.10 171.29 2aor s PHE 211 N -2.34 3.80 -0.01 1.90 0.08 0.32 -2.07 117.98 119.66 2aor s PHE 211 Ca 0.07 1.55 0.04 0.00 0.12 0.00 0.00 56.93 58.70 2aor s PHE 211 Cb -0.04 -2.82 -0.01 0.00 -0.57 0.00 0.00 43.02 39.59 2aor s PHE 211 CO 0.01 0.35 -0.11 0.71 -0.10 0.00 0.00 175.22 176.08 2aor s TYR 212 N -0.41 1.02 0.15 0.36 1.51 0.46 -0.68 117.35 119.76 2aor s TYR 212 Ca 0.38 -0.19 -0.26 0.00 -1.01 0.00 0.00 57.07 55.99 2aor s TYR 212 Cb -0.22 -0.66 -0.08 0.00 -0.11 0.00 0.00 41.96 40.90 2aor s TYR 212 CO 0.25 -0.02 0.78 -0.51 -1.11 0.00 0.00 175.55 174.94 2aor s LEU 213 N -0.27 4.58 0.59 -1.29 1.43 0.47 -0.48 118.68 123.71 2aor s LEU 213 Ca 0.04 1.63 -0.15 0.00 -1.03 0.00 0.00 54.13 54.63 2aor s LEU 213 Cb -0.04 -3.30 -0.04 0.00 0.03 0.00 0.00 46.19 42.83 2aor s LEU 213 CO -0.00 0.18 1.04 -0.13 0.23 0.00 0.00 176.35 177.66 2aor s ARG 214 N -0.98 3.42 0.47 1.70 0.52 0.30 -2.19 118.95 122.19 2aor s ARG 214 Ca 0.36 1.08 0.13 0.00 -0.52 0.00 0.00 55.73 56.79 2aor s ARG 214 Cb -0.23 -2.05 1.10 0.00 0.52 0.00 0.00 34.95 34.29 2aor s ARG 214 CO 0.26 -0.72 2.07 0.87 0.02 0.00 0.00 175.30 177.81 2aor h LYS 215 N 0.32 0.26 -0.27 3.54 1.57 -1.89 -1.05 116.57 119.05 2aor h LYS 215 Ca -0.46 -0.02 -0.09 0.00 -1.87 0.00 0.00 60.65 58.22 2aor h LYS 215 Cb 1.21 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.45 2aor h LYS 215 CO 0.58 0.17 -0.20 0.93 -0.57 0.00 0.00 179.45 180.37 2aor h GLU 216 N 0.26 0.48 0.21 3.15 3.07 -1.93 0.26 114.58 120.08 2aor h GLU 216 Ca 0.12 -0.16 -0.01 0.00 -0.50 0.00 0.00 59.36 58.81 2aor h GLU 216 Cb 0.17 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.04 2aor h GLU 216 CO -0.02 0.66 -0.10 0.35 -1.40 0.00 0.00 179.01 178.49 2aor h PHE 217 N 0.44 -0.26 -0.15 4.33 3.57 -1.48 -2.02 116.94 121.36 2aor h PHE 217 Ca 0.07 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.49 2aor h PHE 217 Cb 0.59 0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.41 2aor h PHE 217 CO 0.02 0.08 -0.25 1.79 -2.23 0.00 0.00 178.31 177.72 2aor h THR 218 N -0.65 1.24 -0.51 4.41 1.35 -1.48 -1.53 112.91 115.73 2aor h THR 218 Ca -0.03 -1.13 -0.00 0.00 -0.55 0.00 0.00 66.41 64.70 2aor h THR 218 Cb 0.46 1.41 -0.03 0.00 -1.73 0.00 0.00 68.15 68.27 2aor h THR 218 CO 0.05 0.35 0.31 0.00 -0.25 0.00 0.00 175.52 175.98 2aor h ALA 219 N 1.50 1.58 -0.28 6.62 0.00 -0.88 -0.70 119.26 127.10 2aor h ALA 219 Ca 0.04 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 2aor h ALA 219 Cb 0.58 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2aor h ALA 219 CO 0.04 0.37 -0.23 0.37 0.00 0.00 0.00 179.25 179.80 2aor h GLN 220 N 0.70 0.53 -0.23 0.00 4.15 -0.52 -0.78 115.11 118.97 2aor h GLN 220 Ca 0.19 -0.19 -0.03 0.00 0.77 0.00 0.00 58.65 59.38 2aor h GLN 220 Cb -0.03 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.61 2aor h GLN 220 CO -0.04 0.72 0.01 0.82 -1.93 0.00 0.00 178.83 178.41 2aor h ILE 221 N 0.47 1.25 -0.93 2.39 2.04 -0.85 -1.28 117.51 120.60 2aor h ILE 221 Ca 0.07 -0.87 -0.01 0.00 1.00 0.00 0.00 64.86 65.05 2aor h ILE 221 Cb 0.65 1.38 -0.04 0.00 -0.74 0.00 0.00 36.82 38.06 2aor h ILE 221 CO 0.05 0.27 0.55 -0.07 0.00 0.00 0.00 178.15 178.94 2aor h LEU 222 N 0.17 1.13 -0.13 1.44 3.38 -0.99 -2.10 115.31 118.20 2aor h LEU 222 Ca 0.06 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 2aor h LEU 222 Cb 0.39 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 2aor h LEU 222 CO 0.01 0.88 0.04 -1.13 0.09 0.00 0.00 178.44 178.32 2aor h ASN 223 N 1.29 0.20 -0.96 -0.43 -1.24 -0.97 -1.33 115.58 112.13 2aor h ASN 223 Ca 0.33 -0.22 0.04 0.00 0.71 0.00 0.00 56.30 57.17 2aor h ASN 223 Cb -0.03 -0.05 -0.06 0.00 0.73 0.00 0.00 38.32 38.91 2aor h ASN 223 CO -0.06 0.36 0.63 0.00 -1.29 0.00 0.00 177.43 177.07 2aor h ALA 224 N 0.84 1.39 -0.00 1.57 0.00 -1.08 -0.96 119.26 121.02 2aor h ALA 224 Ca 0.04 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2aor h ALA 224 Cb 0.24 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 2aor h ALA 224 CO -0.00 0.51 0.00 0.35 0.00 0.00 0.00 179.25 180.11 2aor h PHE 225 N 1.19 0.00 -0.41 0.00 3.57 -1.12 -2.79 116.94 117.39 2aor h PHE 225 Ca 0.39 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.90 2aor h PHE 225 Cb 0.03 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.75 2aor h PHE 225 CO -0.00 0.14 0.27 -0.07 -2.23 0.00 0.00 178.31 176.42 2aor h LEU 226 N -0.14 0.44 0.00 0.59 3.38 -0.75 -0.95 115.31 117.89 2aor h LEU 226 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2aor h LEU 226 Cb 0.14 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2aor h LEU 226 CO -0.00 0.32 0.00 -0.62 0.09 0.00 0.00 178.44 178.23 2aor n GLU 227 N -4.48 0.41 0.00 1.13 -0.58 -0.41 -5.11 120.64 111.61 2aor n GLU 227 Ca 0.04 0.06 0.13 0.00 -0.42 0.00 0.00 57.16 56.96 2aor n GLU 227 Cb 0.09 -1.50 0.21 0.00 -0.57 0.00 0.00 31.44 29.67 2aor n GLU 227 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06