#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2re9 s ARG 18 N 0.00 1.07 0.00 3.23 0.52 -1.26 -5.06 118.95 117.46 2re9 s ARG 18 Ca 0.00 -1.42 0.04 0.00 -0.52 0.00 0.00 55.73 53.83 2re9 s ARG 18 Cb 0.00 0.29 0.01 0.00 0.52 0.00 0.00 34.95 35.77 2re9 s ARG 18 CO 0.00 -0.35 0.49 0.00 0.02 0.00 0.00 175.30 175.46 2re9 n ALA 19 N -0.18 2.49 1.86 2.13 0.00 -1.26 -4.53 120.51 121.03 2re9 n ALA 19 Ca -0.04 -0.40 0.06 0.00 0.00 0.00 0.00 53.44 53.06 2re9 n ALA 19 Cb 0.64 -0.14 0.35 0.00 0.00 0.00 0.00 19.45 20.30 2re9 n ALA 19 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2re9 n ASP 20 N -0.18 0.00 -0.14 0.00 5.68 -1.26 -3.13 116.55 117.52 2re9 n ASP 20 Ca 0.02 -1.49 0.11 0.00 -0.50 0.00 0.00 54.79 52.92 2re9 n ASP 20 Cb 0.09 0.00 0.56 0.00 -1.14 0.00 0.00 41.12 40.63 2re9 n ASP 20 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2re9 n GLY 21 N 0.60 -0.67 1.04 6.12 0.00 -1.26 -3.22 105.19 107.80 2re9 n GLY 21 Ca 0.09 -0.21 0.08 0.00 0.00 0.00 0.00 46.02 45.98 2re9 n GLY 21 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2re9 n ASP 22 N -0.53 3.02 -4.74 1.61 3.85 -1.18 -4.93 116.55 113.65 2re9 n ASP 22 Ca 0.16 -2.11 -0.40 0.00 -0.71 0.00 0.00 54.79 51.72 2re9 n ASP 22 Cb 0.14 -0.39 -0.05 0.00 -1.35 0.00 0.00 41.12 39.46 2re9 n ASP 22 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 2re9 s LYS 23 N -1.46 4.79 0.22 0.11 1.02 -1.20 -4.82 119.74 118.41 2re9 s LYS 23 Ca 0.35 1.48 -0.32 0.00 0.02 0.00 0.00 55.97 57.50 2re9 s LYS 23 Cb 0.20 -3.32 -0.14 0.00 -0.52 0.00 0.00 37.83 34.06 2re9 s LYS 23 CO 0.21 0.40 1.44 -2.30 -0.92 0.00 0.00 175.35 174.19 2re9 n PRO 24 N 1.99 2.05 -3.68 -1.68 -0.02 -1.25 -4.69 135.00 127.72 2re9 n PRO 24 Ca -0.00 0.73 -0.13 0.00 -2.02 0.00 0.00 63.50 62.08 2re9 n PRO 24 Cb 0.48 -2.41 -0.07 0.00 -0.02 0.00 0.00 33.50 31.47 2re9 n PRO 24 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2re9 s ARG 25 N -0.12 0.86 -0.28 -0.52 0.52 -1.15 -1.98 118.95 116.28 2re9 s ARG 25 Ca 0.71 -0.27 -0.24 0.00 -0.52 0.00 0.00 55.73 55.40 2re9 s ARG 25 Cb -0.66 0.38 0.10 0.00 0.52 0.00 0.00 34.95 35.30 2re9 s ARG 25 CO 0.47 -0.28 0.90 0.00 0.02 0.00 0.00 175.30 176.42 2re9 s ALA 26 N -2.07 -1.92 -0.16 2.13 0.00 -0.37 -1.52 121.76 117.86 2re9 s ALA 26 Ca -0.08 1.98 -0.02 0.00 0.00 0.00 0.00 51.96 53.84 2re9 s ALA 26 Cb -0.02 -1.36 0.05 0.00 0.00 0.00 0.00 23.12 21.79 2re9 s ALA 26 CO 0.00 -0.29 -0.00 -1.58 0.00 0.00 0.00 175.76 173.89 2re9 s HIS 27 N 0.41 1.24 0.09 0.00 5.04 -0.36 -0.94 115.29 120.77 2re9 s HIS 27 Ca 0.01 -0.84 0.05 0.00 -1.54 0.00 0.00 55.06 52.74 2re9 s HIS 27 Cb -0.05 -1.10 -0.04 0.00 0.04 0.00 0.00 32.58 31.43 2re9 s HIS 27 CO -0.05 -0.56 -0.00 -0.51 -2.34 0.00 0.00 174.74 171.27 2re9 s LEU 28 N 1.78 3.45 0.15 8.88 1.43 0.16 -0.68 118.68 133.86 2re9 s LEU 28 Ca 0.01 -0.18 0.10 0.00 -1.03 0.00 0.00 54.13 53.02 2re9 s LEU 28 Cb -0.16 -2.18 -0.04 0.00 0.03 0.00 0.00 46.19 43.84 2re9 s LEU 28 CO -0.07 0.18 -0.22 0.42 0.23 0.00 0.00 176.35 176.88 2re9 s THR 29 N -1.30 2.05 0.73 5.49 -4.23 -1.02 -1.31 115.64 116.05 2re9 s THR 29 Ca 0.26 -1.84 -0.15 0.00 -1.18 0.00 0.00 61.69 58.78 2re9 s THR 29 Cb -0.12 -1.90 0.04 0.00 1.34 0.00 0.00 72.50 71.87 2re9 s THR 29 CO 0.18 -0.11 1.20 0.54 -0.54 0.00 0.00 174.62 175.89 2re9 s VAL 30 N -1.52 2.35 0.16 2.29 0.11 -0.52 -0.28 120.40 122.99 2re9 s VAL 30 Ca 0.15 0.17 -0.03 0.00 -2.93 0.00 0.00 61.98 59.34 2re9 s VAL 30 Cb -0.08 -2.72 -0.03 0.00 -1.53 0.00 0.00 36.38 32.01 2re9 s VAL 30 CO 0.07 -0.10 0.13 0.68 -3.33 0.00 0.00 175.10 172.55 2re9 s VAL 31 N -2.03 0.06 0.07 2.04 -7.23 -1.26 -4.66 120.40 107.39 2re9 s VAL 31 Ca 0.74 -1.85 -0.34 0.00 -1.81 0.00 0.00 61.98 58.72 2re9 s VAL 31 Cb -0.28 -2.18 -0.13 0.00 0.56 0.00 0.00 36.38 34.35 2re9 s VAL 31 CO 0.46 -0.26 1.73 -1.14 -0.31 0.00 0.00 175.10 175.57 2re9 n ARG 32 N -0.18 2.27 -3.21 4.82 3.00 -1.26 -4.85 116.66 117.25 2re9 n ARG 32 Ca -0.03 0.83 -0.31 0.00 -0.00 0.00 0.00 57.85 58.34 2re9 n ARG 32 Cb 0.64 -2.64 -0.04 0.00 0.00 0.00 0.00 32.46 30.41 2re9 n ARG 32 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.63 176.98 2re9 s GLN 33 N 2.34 3.79 -0.31 -0.14 -1.52 -1.26 -4.99 119.66 117.58 2re9 s GLN 33 Ca 0.84 0.33 -0.21 0.00 -1.95 0.00 0.00 55.36 54.37 2re9 s GLN 33 Cb -0.65 -2.54 -0.01 0.00 -0.22 0.00 0.00 33.01 29.59 2re9 s GLN 33 CO 0.43 0.18 0.68 -0.08 -0.25 0.00 0.00 175.29 176.25 2re9 s THR 34 N -2.04 4.89 -0.14 -0.19 -1.32 -1.26 -4.99 115.64 110.59 2re9 s THR 34 Ca 0.49 0.96 -0.35 0.00 -1.21 0.00 0.00 61.69 61.58 2re9 s THR 34 Cb -0.11 -4.05 -0.12 0.00 -1.51 0.00 0.00 72.50 66.71 2re9 s THR 34 CO 0.25 -0.18 1.89 -0.81 -2.21 0.00 0.00 174.62 173.56 2re9 n PRO 35 N 5.98 1.96 -4.43 7.08 -0.04 -1.26 -4.96 135.00 139.33 2re9 n PRO 35 Ca 0.01 0.71 -0.26 0.00 -0.04 0.00 0.00 63.50 63.92 2re9 n PRO 35 Cb 0.49 -2.57 -0.11 0.00 -0.04 0.00 0.00 33.50 31.27 2re9 n PRO 35 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 2re9 s THR 36 N 4.29 2.47 -0.21 0.52 -1.32 -1.26 -5.12 115.64 115.01 2re9 s THR 36 Ca 0.95 -2.13 -0.13 0.00 -1.21 0.00 0.00 61.69 59.17 2re9 s THR 36 Cb -0.75 -2.23 -0.05 0.00 -1.51 0.00 0.00 72.50 67.96 2re9 s THR 36 CO 0.54 -0.22 0.26 0.00 -2.21 0.00 0.00 174.62 172.99 2re9 s GLN 37 N -2.99 4.14 0.13 7.08 -2.07 -1.26 -5.04 119.66 119.65 2re9 s GLN 37 Ca 0.24 -0.04 -0.13 0.00 -1.82 0.00 0.00 55.36 53.61 2re9 s GLN 37 Cb -0.07 -3.51 0.02 0.00 -1.09 0.00 0.00 33.01 28.35 2re9 s GLN 37 CO 0.12 0.07 0.33 -3.38 -1.32 0.00 0.00 175.29 171.11 2re9 s HIS 38 N 1.01 0.00 0.41 9.60 -3.43 -1.26 -5.16 115.29 116.47 2re9 s HIS 38 Ca 0.13 -0.37 -0.18 0.00 -0.80 0.00 0.00 55.06 53.84 2re9 s HIS 38 Cb -0.14 0.13 -0.10 0.00 -1.43 0.00 0.00 32.58 31.04 2re9 s HIS 38 CO 0.05 -0.68 0.88 -0.06 -2.00 0.00 0.00 174.74 172.94 2re9 s PHE 39 N -3.85 3.36 0.27 0.38 0.08 -1.26 -4.94 117.98 112.01 2re9 s PHE 39 Ca 0.06 1.45 -0.07 0.00 0.12 0.00 0.00 56.93 58.49 2re9 s PHE 39 Cb 0.03 -2.73 0.47 0.00 -0.57 0.00 0.00 43.02 40.22 2re9 s PHE 39 CO -0.09 -0.09 1.58 -0.22 -0.10 0.00 0.00 175.22 176.30 2re9 h LYS 40 N 1.82 0.01 0.00 0.44 3.64 -2.01 0.66 116.57 121.13 2re9 h LYS 40 Ca -0.48 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 2re9 h LYS 40 Cb 1.18 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 2re9 h LYS 40 CO 0.62 0.01 0.00 0.27 -2.27 0.00 0.00 179.45 178.08 2re9 n ASN 41 N -5.54 0.00 -4.79 4.20 0.23 -1.26 -4.73 115.26 103.37 2re9 n ASN 41 Ca 0.15 -0.86 -0.36 0.00 -0.53 0.00 0.00 54.58 52.98 2re9 n ASN 41 Cb 0.51 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 38.14 2re9 n ASN 41 CO 0.00 0.00 0.00 -1.10 -0.93 0.00 0.00 177.26 175.23 2re9 s GLN 42 N -2.00 3.93 -0.35 -3.83 -0.21 0.23 -5.07 119.66 112.36 2re9 s GLN 42 Ca 0.27 -0.08 -0.00 0.00 0.02 0.00 0.00 55.36 55.57 2re9 s GLN 42 Cb 0.13 -3.33 0.09 0.00 1.00 0.00 0.00 33.01 30.90 2re9 s GLN 42 CO 0.21 0.48 0.09 -0.06 -2.12 0.00 0.00 175.29 173.89 2re9 s PHE 43 N -0.20 3.53 0.51 0.91 0.40 -1.26 -4.75 117.98 117.11 2re9 s PHE 43 Ca 0.13 -2.43 -0.23 0.00 -0.60 0.00 0.00 56.93 53.81 2re9 s PHE 43 Cb -0.12 -2.78 -0.06 0.00 0.51 0.00 0.00 43.02 40.57 2re9 s PHE 43 CO 0.02 -0.92 1.35 -2.14 0.70 0.00 0.00 175.22 174.23 2re9 s PRO 44 N 1.10 3.38 0.39 0.24 0.02 -1.23 -4.57 135.00 134.34 2re9 s PRO 44 Ca 0.04 2.21 -0.12 0.00 0.02 0.00 0.00 61.00 63.16 2re9 s PRO 44 Cb -0.21 -2.39 -0.07 0.00 0.02 0.00 0.00 34.50 31.85 2re9 s PRO 44 CO -0.04 -0.99 0.77 0.00 -0.33 0.00 0.00 177.00 176.41 2re9 s ALA 45 N -1.31 3.33 0.25 -1.55 0.00 -1.26 -2.18 121.76 119.03 2re9 s ALA 45 Ca 0.67 -0.12 -0.08 0.00 0.00 0.00 0.00 51.96 52.44 2re9 s ALA 45 Cb -0.39 -2.74 -0.06 0.00 0.00 0.00 0.00 23.12 19.92 2re9 s ALA 45 CO 0.48 0.06 0.54 -0.51 0.00 0.00 0.00 175.76 176.34 2re9 s LEU 46 N -3.64 4.13 0.03 0.00 1.43 -0.21 -4.96 118.68 115.45 2re9 s LEU 46 Ca 0.52 0.84 -0.07 0.00 -1.03 0.00 0.00 54.13 54.39 2re9 s LEU 46 Cb -0.10 -3.62 -0.05 0.00 0.03 0.00 0.00 46.19 42.45 2re9 s LEU 46 CO 0.28 -0.11 0.31 -1.00 0.23 0.00 0.00 176.35 176.05 2re9 s HIS 47 N -1.91 3.58 0.22 0.29 3.76 -1.26 -4.51 115.29 115.46 2re9 s HIS 47 Ca 0.46 0.63 0.04 0.00 -0.15 0.00 0.00 55.06 56.04 2re9 s HIS 47 Cb -0.11 -2.03 -0.05 0.00 1.11 0.00 0.00 32.58 31.50 2re9 s HIS 47 CO 0.24 0.58 -0.03 -1.58 -0.85 0.00 0.00 174.74 173.11 2re9 s TRP 48 N -1.34 1.57 -0.13 1.40 0.52 -1.26 -3.99 118.94 115.71 2re9 s TRP 48 Ca 0.29 -0.86 -0.11 0.00 0.02 0.00 0.00 56.10 55.45 2re9 s TRP 48 Cb -0.13 -0.89 -0.05 0.00 -1.15 0.00 0.00 33.47 31.25 2re9 s TRP 48 CO 0.17 0.03 0.24 -2.00 0.02 0.00 0.00 176.95 175.41 2re9 s GLU 49 N -3.82 3.95 0.00 4.98 2.56 0.61 -4.92 118.70 122.06 2re9 s GLU 49 Ca 0.26 0.03 0.00 0.00 0.00 0.00 0.00 54.97 55.26 2re9 s GLU 49 Cb 0.05 -3.32 0.00 0.00 2.00 0.00 0.00 34.13 32.86 2re9 s GLU 49 CO 0.08 0.48 0.60 -2.39 -0.56 0.00 0.00 175.26 173.47 2re9 n HIS 50 N 2.80 0.00 0.00 5.30 1.44 -1.26 -2.44 115.22 121.07 2re9 n HIS 50 Ca -0.15 -0.14 0.00 0.00 -2.01 0.00 0.00 57.72 55.42 2re9 n HIS 50 Cb 0.53 -0.01 0.00 0.00 0.12 0.00 0.00 29.99 30.63 2re9 n HIS 50 CO 0.00 0.00 0.00 -0.85 -2.81 0.00 0.00 176.34 172.68 2re9 n GLU 51 N -0.14 2.54 -3.23 -1.40 0.28 -1.26 -3.17 120.64 114.27 2re9 n GLU 51 Ca 0.00 0.00 -0.34 0.00 -0.16 0.00 0.00 57.16 56.66 2re9 n GLU 51 Cb 0.10 -0.46 -0.06 0.00 1.43 0.00 0.00 31.44 32.45 2re9 n GLU 51 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 2re9 s LEU 52 N -0.54 4.21 0.00 -1.84 1.43 -1.26 -4.72 118.68 115.96 2re9 s LEU 52 Ca 0.00 1.20 0.00 0.00 -1.03 0.00 0.00 54.13 54.30 2re9 s LEU 52 Cb 0.00 -3.71 0.00 0.00 0.03 0.00 0.00 46.19 42.51 2re9 s LEU 52 CO 0.00 -0.06 0.00 0.61 0.23 0.00 0.00 176.35 177.13 2re9 n GLY 53 N 0.19 3.68 0.09 -3.19 0.00 -1.26 -2.22 105.19 102.49 2re9 n GLY 53 Ca -0.00 -0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.10 2re9 n GLY 53 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2re9 n LEU 54 N 0.00 0.68 -4.80 0.99 4.77 -1.26 -4.92 117.00 112.45 2re9 n LEU 54 Ca 0.00 -0.08 -0.34 0.00 -0.03 0.00 0.00 56.01 55.56 2re9 n LEU 54 Cb 0.00 -0.21 -0.04 0.00 -2.33 0.00 0.00 43.42 40.85 2re9 n LEU 54 CO 0.00 0.14 0.71 0.00 -1.33 0.00 0.00 177.39 176.91 2re9 s ALA 55 N -2.80 2.89 -0.15 -1.18 0.00 -0.94 -4.87 121.76 114.71 2re9 s ALA 55 Ca 0.17 0.57 -0.34 0.00 0.00 0.00 0.00 51.96 52.36 2re9 s ALA 55 Cb 0.18 -3.24 0.13 0.00 0.00 0.00 0.00 23.12 20.19 2re9 s ALA 55 CO 0.62 -0.28 1.13 -0.59 0.00 0.00 0.00 175.76 176.64 2re9 s PHE 56 N -2.03 -0.18 -0.06 0.00 -0.71 0.14 -4.15 117.98 110.99 2re9 s PHE 56 Ca 0.66 0.11 -0.04 0.00 -1.04 0.00 0.00 56.93 56.62 2re9 s PHE 56 Cb -0.15 0.52 0.03 0.00 -1.21 0.00 0.00 43.02 42.20 2re9 s PHE 56 CO 0.20 -0.28 0.16 0.95 -1.34 0.00 0.00 175.22 174.91 2re9 s THR 57 N -2.57 -0.02 0.24 -4.49 -4.23 -1.25 -1.22 115.64 102.10 2re9 s THR 57 Ca 0.08 0.08 -0.06 0.00 -1.18 0.00 0.00 61.69 60.61 2re9 s THR 57 Cb -0.01 -0.24 -0.02 0.00 1.34 0.00 0.00 72.50 73.57 2re9 s THR 57 CO -0.06 0.03 0.32 -1.59 -0.54 0.00 0.00 174.62 172.78 2re9 s LYS 58 N 0.61 1.42 -1.46 3.99 -2.85 -0.58 -4.93 119.74 115.95 2re9 s LYS 58 Ca -0.04 -1.48 -0.04 0.00 -1.00 0.00 0.00 55.97 53.40 2re9 s LYS 58 Cb -0.06 0.37 0.03 0.00 -2.06 0.00 0.00 37.83 36.12 2re9 s LYS 58 CO -0.03 -0.54 0.56 0.09 0.10 0.00 0.00 175.35 175.53 2re9 n ASN 59 N -0.44 -1.28 0.00 0.03 5.03 -1.26 -1.96 115.26 115.37 2re9 n ASN 59 Ca 0.00 -0.97 0.00 0.00 0.87 0.00 0.00 54.58 54.49 2re9 n ASN 59 Cb 0.64 -3.19 0.00 0.00 -1.02 0.00 0.00 39.78 36.21 2re9 n ASN 59 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2re9 n ARG 60 N -4.41 0.00 -2.34 3.52 1.74 -1.26 -3.87 116.66 110.04 2re9 n ARG 60 Ca -0.22 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.44 2re9 n ARG 60 Cb 0.64 -1.64 -0.02 0.00 -1.02 0.00 0.00 32.46 30.42 2re9 n ARG 60 CO 0.00 0.00 0.00 1.41 -1.52 0.00 0.00 177.63 177.52 2re9 s MET 61 N -0.09 4.06 0.02 5.56 1.75 -0.83 -4.54 119.30 125.24 2re9 s MET 61 Ca 0.00 1.58 0.08 0.00 -1.25 0.00 0.00 55.69 56.10 2re9 s MET 61 Cb 0.00 -3.86 -0.03 0.00 2.84 0.00 0.00 34.83 33.78 2re9 s MET 61 CO 0.00 -0.94 -0.22 -0.80 -0.65 0.00 0.00 175.02 172.41 2re9 s ASN 62 N 2.70 3.48 -0.11 1.11 0.02 -1.20 -4.03 114.94 116.91 2re9 s ASN 62 Ca 0.59 -0.47 -0.04 0.00 -1.02 0.00 0.00 52.86 51.93 2re9 s ASN 62 Cb -0.22 -0.48 -0.03 0.00 0.02 0.00 0.00 41.25 40.54 2re9 s ASN 62 CO 0.21 0.28 0.02 -0.47 0.02 0.00 0.00 177.10 177.16 2re9 s TYR 63 N -0.81 3.21 -0.28 2.20 5.04 -1.26 0.64 117.35 126.09 2re9 s TYR 63 Ca 0.12 0.16 -0.05 0.00 -2.44 0.00 0.00 57.07 54.87 2re9 s TYR 63 Cb -0.10 -1.88 0.16 0.00 0.35 0.00 0.00 41.96 40.49 2re9 s TYR 63 CO 0.02 0.39 0.57 0.99 -1.34 0.00 0.00 175.55 176.19 2re9 s THR 64 N -0.54 -0.92 -0.90 4.34 2.01 0.54 -4.98 115.64 115.18 2re9 s THR 64 Ca 0.10 0.01 -0.07 0.00 0.31 0.00 0.00 61.69 62.03 2re9 s THR 64 Cb -0.12 -0.95 0.00 0.00 0.01 0.00 0.00 72.50 71.44 2re9 s THR 64 CO 0.02 -0.01 0.67 -3.20 -0.69 0.00 0.00 174.62 171.41 2re9 n ASN 65 N 5.43 -5.59 0.00 3.53 4.05 -1.26 -1.91 115.26 119.51 2re9 n ASN 65 Ca -0.05 -0.80 0.00 0.00 0.45 0.00 0.00 54.58 54.18 2re9 n ASN 65 Cb 0.50 -2.87 0.00 0.00 1.23 0.00 0.00 39.78 38.64 2re9 n ASN 65 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 2re9 n LYS 66 N -2.95 0.00 -4.09 1.20 5.02 -1.26 -4.98 118.16 111.09 2re9 n LYS 66 Ca -0.18 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 55.80 2re9 n LYS 66 Cb 0.62 -1.66 -0.07 0.00 -0.02 0.00 0.00 35.03 33.90 2re9 n LYS 66 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2re9 s PHE 67 N -1.45 3.17 -0.19 2.13 0.08 -0.80 -4.51 117.98 116.41 2re9 s PHE 67 Ca 0.00 0.09 -0.05 0.00 0.12 0.00 0.00 56.93 57.08 2re9 s PHE 67 Cb 0.00 -1.63 -0.03 0.00 -0.57 0.00 0.00 43.02 40.79 2re9 s PHE 67 CO 0.00 0.51 0.01 -1.17 -0.10 0.00 0.00 175.22 174.47 2re9 s LEU 68 N -2.18 3.37 -0.24 -0.37 2.96 -0.18 -0.34 118.68 121.70 2re9 s LEU 68 Ca 0.27 -0.13 -0.12 0.00 -0.22 0.00 0.00 54.13 53.92 2re9 s LEU 68 Cb -0.12 -1.85 -0.05 0.00 0.50 0.00 0.00 46.19 44.68 2re9 s LEU 68 CO 0.19 0.10 0.24 -0.22 -1.32 0.00 0.00 176.35 175.35 2re9 s LEU 69 N 0.77 4.10 -0.13 -0.68 2.96 0.21 -1.21 118.68 124.69 2re9 s LEU 69 Ca 0.01 0.21 -0.29 0.00 -0.22 0.00 0.00 54.13 53.83 2re9 s LEU 69 Cb -0.14 -2.24 -0.01 0.00 0.50 0.00 0.00 46.19 44.30 2re9 s LEU 69 CO 0.02 -0.02 0.99 -0.63 -1.32 0.00 0.00 176.35 175.40 2re9 s ILE 70 N 1.35 4.78 -0.48 6.68 -1.09 -0.51 -3.23 121.20 128.70 2re9 s ILE 70 Ca 0.11 1.99 0.22 0.00 -2.23 0.00 0.00 60.65 60.74 2re9 s ILE 70 Cb -0.14 -4.29 -0.26 0.00 -1.58 0.00 0.00 42.46 36.19 2re9 s ILE 70 CO 0.07 -0.02 0.73 -0.81 -1.23 0.00 0.00 174.94 173.68 2re9 n PRO 71 N 5.23 0.36 -3.88 2.79 -0.04 -1.26 -1.24 135.00 136.96 2re9 n PRO 71 Ca 0.09 -0.09 -0.16 0.00 -0.04 0.00 0.00 63.50 63.30 2re9 n PRO 71 Cb 0.48 -1.53 -0.16 0.00 -0.04 0.00 0.00 33.50 32.26 2re9 n PRO 71 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2re9 s GLU 72 N -3.28 0.15 0.27 0.54 2.12 -1.26 -4.82 118.70 112.43 2re9 s GLU 72 Ca -0.00 0.10 -0.29 0.00 0.36 0.00 0.00 54.97 55.13 2re9 s GLU 72 Cb 0.15 -0.34 -0.10 0.00 0.26 0.00 0.00 34.13 34.10 2re9 s GLU 72 CO 0.88 -0.12 1.31 -1.12 -0.54 0.00 0.00 175.26 175.67 2re9 s SER 73 N 0.87 6.84 0.00 -1.70 0.01 -1.26 -4.46 113.70 113.99 2re9 s SER 73 Ca -0.08 2.55 0.00 0.00 1.31 0.00 0.00 55.95 59.73 2re9 s SER 73 Cb -0.11 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.49 2re9 s SER 73 CO -0.02 -0.52 0.00 0.61 0.41 0.00 0.00 173.24 173.72 2re9 n GLY 74 N 1.57 -2.33 3.65 3.44 0.00 -0.45 -4.93 105.19 106.14 2re9 n GLY 74 Ca 0.03 -1.25 -0.40 0.00 0.00 0.00 0.00 46.02 44.40 2re9 n GLY 74 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2re9 s ASP 75 N -1.03 6.64 0.05 1.61 1.01 -1.26 -0.99 116.67 122.70 2re9 s ASP 75 Ca 0.00 0.78 0.07 0.00 0.71 0.00 0.00 52.55 54.12 2re9 s ASP 75 Cb 0.00 -2.34 -0.03 0.00 1.01 0.00 0.00 42.92 41.56 2re9 s ASP 75 CO 0.00 -0.28 -0.19 -0.31 0.21 0.00 0.00 175.17 174.60 2re9 s TYR 76 N 2.00 2.54 -0.20 4.23 1.51 0.07 -0.68 117.35 126.82 2re9 s TYR 76 Ca 0.27 -0.27 -0.12 0.00 -1.01 0.00 0.00 57.07 55.95 2re9 s TYR 76 Cb -0.16 -1.45 -0.05 0.00 -0.11 0.00 0.00 41.96 40.20 2re9 s TYR 76 CO 0.10 0.26 0.22 0.12 -1.11 0.00 0.00 175.55 175.13 2re9 s PHE 77 N -0.94 3.39 -0.02 2.71 5.36 -0.45 -0.99 117.98 127.04 2re9 s PHE 77 Ca 0.15 0.41 0.08 0.00 -0.96 0.00 0.00 56.93 56.60 2re9 s PHE 77 Cb -0.10 -2.29 -0.02 0.00 -0.34 0.00 0.00 43.02 40.27 2re9 s PHE 77 CO 0.05 0.17 -0.26 0.42 -1.46 0.00 0.00 175.22 174.15 2re9 s ILE 78 N 0.71 2.03 0.14 3.12 1.01 -0.09 -1.86 121.20 126.26 2re9 s ILE 78 Ca 0.11 -1.10 -0.12 0.00 0.00 0.00 0.00 60.65 59.54 2re9 s ILE 78 Cb -0.13 -1.69 0.01 0.00 0.01 0.00 0.00 42.46 40.67 2re9 s ILE 78 CO 0.03 0.57 0.32 -0.72 0.00 0.00 0.00 174.94 175.14 2re9 s TYR 79 N -0.61 0.09 -0.21 3.97 -0.85 -0.64 -1.47 117.35 117.64 2re9 s TYR 79 Ca 0.10 -0.45 -0.29 0.00 -0.52 0.00 0.00 57.07 55.91 2re9 s TYR 79 Cb -0.10 0.10 0.14 0.00 0.38 0.00 0.00 41.96 42.48 2re9 s TYR 79 CO -0.01 -0.69 1.08 0.45 -1.52 0.00 0.00 175.55 174.86 2re9 s SER 80 N -2.88 -0.31 -0.01 -0.18 0.15 -0.17 -1.18 113.70 109.11 2re9 s SER 80 Ca 0.08 0.41 0.03 0.00 0.70 0.00 0.00 55.95 57.17 2re9 s SER 80 Cb 0.03 0.35 -0.01 0.00 -1.71 0.00 0.00 66.02 64.68 2re9 s SER 80 CO -0.07 -0.24 -0.09 -1.58 1.20 0.00 0.00 173.24 172.46 2re9 s GLN 81 N -0.80 0.79 -0.11 5.44 0.74 -0.56 -0.99 119.66 124.17 2re9 s GLN 81 Ca 0.01 -0.32 -0.01 0.00 0.05 0.00 0.00 55.36 55.09 2re9 s GLN 81 Cb -0.02 -0.76 0.03 0.00 1.10 0.00 0.00 33.01 33.37 2re9 s GLN 81 CO -0.02 0.18 -0.03 0.08 -0.55 0.00 0.00 175.29 174.96 2re9 s VAL 82 N -0.14 0.69 -0.13 1.34 1.01 -0.75 -1.40 120.40 121.02 2re9 s VAL 82 Ca 0.02 -0.18 -0.18 0.00 0.00 0.00 0.00 61.98 61.64 2re9 s VAL 82 Cb -0.05 -0.85 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 2re9 s VAL 82 CO -0.00 0.22 0.47 -0.89 0.00 0.00 0.00 175.10 174.89 2re9 s THR 83 N 1.83 5.19 0.18 3.92 2.01 -1.22 -1.84 115.64 125.71 2re9 s THR 83 Ca 0.04 0.92 0.07 0.00 0.31 0.00 0.00 61.69 63.03 2re9 s THR 83 Cb -0.13 -3.81 -0.04 0.00 0.01 0.00 0.00 72.50 68.53 2re9 s THR 83 CO -0.07 0.32 0.04 -0.36 -0.69 0.00 0.00 174.62 173.86 2re9 s PHE 84 N 0.71 2.93 -0.11 4.92 0.40 0.17 -1.01 117.98 125.99 2re9 s PHE 84 Ca 0.25 -0.11 -0.25 0.00 -0.60 0.00 0.00 56.93 56.23 2re9 s PHE 84 Cb -0.15 -1.41 0.06 0.00 0.51 0.00 0.00 43.02 42.03 2re9 s PHE 84 CO 0.10 0.52 0.60 -0.98 0.70 0.00 0.00 175.22 176.16 2re9 s ARG 85 N -3.05 0.87 -0.13 0.44 1.70 0.72 -1.12 118.95 118.37 2re9 s ARG 85 Ca 0.29 0.40 -0.34 0.00 -0.47 0.00 0.00 55.73 55.61 2re9 s ARG 85 Cb -0.09 0.41 0.14 0.00 -0.57 0.00 0.00 34.95 34.84 2re9 s ARG 85 CO 0.20 -0.22 1.36 0.20 -1.08 0.00 0.00 175.30 175.77 2re9 s GLY 86 N -0.67 -0.38 0.34 3.88 0.00 -0.77 -4.57 107.32 105.15 2re9 s GLY 86 Ca -0.07 1.21 -0.27 0.00 0.00 0.00 0.00 44.72 45.59 2re9 s GLY 86 CO 0.06 0.32 1.08 1.06 0.00 0.00 0.00 173.10 175.62 2re9 s MET 87 N -2.17 4.39 0.04 2.90 -1.94 -1.26 -1.87 119.30 119.38 2re9 s MET 87 Ca 0.13 1.69 -0.30 0.00 -1.71 0.00 0.00 55.69 55.50 2re9 s MET 87 Cb 0.04 -2.88 -0.08 0.00 2.01 0.00 0.00 34.83 33.93 2re9 s MET 87 CO -0.05 0.02 1.69 0.99 -0.01 0.00 0.00 175.02 177.66 2re9 s THR 88 N -1.39 3.16 0.00 2.05 2.01 -1.05 -4.88 115.64 115.54 2re9 s THR 88 Ca 0.51 0.48 0.00 0.00 0.31 0.00 0.00 61.69 62.99 2re9 s THR 88 Cb -0.28 -3.31 0.00 0.00 0.01 0.00 0.00 72.50 68.92 2re9 s THR 88 CO 0.35 -0.02 0.00 -1.54 -0.69 0.00 0.00 174.62 172.73 2re9 n SER 89 N 6.20 -0.81 -1.90 3.53 3.41 -1.26 -4.93 113.62 117.86 2re9 n SER 89 Ca 0.17 -0.40 0.03 0.00 -0.26 0.00 0.00 58.87 58.41 2re9 n SER 89 Cb 0.41 0.00 0.37 0.00 -0.26 0.00 0.00 64.21 64.74 2re9 n SER 89 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 2re9 n GLU 90 N -1.21 4.52 -0.21 4.33 0.00 -1.26 -4.49 120.64 122.32 2re9 n GLU 90 Ca 0.00 -3.14 0.13 0.00 0.00 0.00 0.00 57.16 54.15 2re9 n GLU 90 Cb 0.00 -2.25 0.44 0.00 0.00 0.00 0.00 31.44 29.63 2re9 n GLU 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2re9 s SER 92 N -5.89 5.72 0.00 0.00 1.04 -1.26 -4.65 113.70 108.65 2re9 s SER 92 Ca -0.09 -1.86 0.00 0.00 0.48 0.00 0.00 55.95 54.48 2re9 s SER 92 Cb 0.21 -2.02 0.00 0.00 0.10 0.00 0.00 66.02 64.32 2re9 s SER 92 CO 0.78 -0.69 0.00 -0.62 0.98 0.00 0.00 173.24 173.69 2re9 n GLU 93 N 4.92 0.00 -3.47 4.02 -0.58 -1.25 -4.98 120.64 119.30 2re9 n GLU 93 Ca -0.08 0.00 -0.43 0.00 -0.42 0.00 0.00 57.16 56.23 2re9 n GLU 93 Cb 0.41 0.00 -0.06 0.00 -0.57 0.00 0.00 31.44 31.21 2re9 n GLU 93 CO 0.00 0.00 0.00 -1.50 -0.48 0.00 0.00 177.13 175.15 2re9 s ILE 94 N 1.19 4.66 0.00 -3.67 2.07 -1.26 -5.06 121.20 119.14 2re9 s ILE 94 Ca 0.00 -1.99 0.00 0.00 -1.41 0.00 0.00 60.65 57.25 2re9 s ILE 94 Cb 0.00 -4.00 0.00 0.00 0.13 0.00 0.00 42.46 38.59 2re9 s ILE 94 CO 0.00 -0.86 0.00 0.54 -1.91 0.00 0.00 174.94 172.71 2re9 n ARG 95 N 4.64 2.79 0.00 3.50 5.12 -1.26 -5.12 116.66 126.33 2re9 n ARG 95 Ca -0.03 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.89 2re9 n ARG 95 Cb 0.41 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.71 2re9 n ARG 95 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 2re9 n GLN 96 N 0.00 2.55 -0.87 5.56 6.02 -1.25 -4.92 117.38 124.47 2re9 n GLN 96 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 57.00 56.90 2re9 n GLN 96 Cb 0.00 0.00 -0.12 0.00 1.02 0.00 0.00 30.24 31.14 2re9 n GLN 96 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2re9 n ALA 97 N -3.00 5.74 0.00 -1.58 0.00 -1.26 -4.07 120.51 116.34 2re9 n ALA 97 Ca 0.00 -1.36 0.00 0.00 0.00 0.00 0.00 53.44 52.08 2re9 n ALA 97 Cb 0.00 -1.96 0.00 0.00 0.00 0.00 0.00 19.45 17.49 2re9 n ALA 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2re9 n GLY 98 N 2.19 1.97 2.86 0.00 0.00 -1.26 -5.10 105.19 105.85 2re9 n GLY 98 Ca 0.32 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.04 2re9 n GLY 98 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2re9 s ARG 99 N -0.06 1.93 0.66 1.61 3.00 -1.26 -5.11 118.95 119.73 2re9 s ARG 99 Ca 0.00 -2.70 -0.11 0.00 0.00 0.00 0.00 55.73 52.92 2re9 s ARG 99 Cb 0.00 -3.05 0.16 0.00 0.00 0.00 0.00 34.95 32.06 2re9 s ARG 99 CO 0.00 -1.19 0.73 -0.35 0.00 0.00 0.00 175.30 174.49 2re9 n PRO 100 N 2.82 -1.52 -4.39 3.54 -0.04 -1.26 -3.78 135.00 130.37 2re9 n PRO 100 Ca 0.12 -1.15 -0.21 0.00 -0.04 0.00 0.00 63.50 62.22 2re9 n PRO 100 Cb 0.34 -0.90 -0.10 0.00 -0.04 0.00 0.00 33.50 32.80 2re9 n PRO 100 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2re9 s ASN 101 N -3.61 2.96 0.35 3.54 2.20 -1.26 -5.03 114.94 114.09 2re9 s ASN 101 Ca 0.44 -1.01 -0.28 0.00 -0.94 0.00 0.00 52.86 51.07 2re9 s ASN 101 Cb -0.03 -0.20 -0.12 0.00 -2.00 0.00 0.00 41.25 38.90 2re9 s ASN 101 CO 0.32 -0.08 1.32 0.29 -2.94 0.00 0.00 177.10 176.01 2re9 n LYS 102 N -0.43 2.22 -2.87 3.55 4.76 -1.26 -4.99 118.16 119.14 2re9 n LYS 102 Ca -0.07 0.78 -0.27 0.00 -2.87 0.00 0.00 58.31 55.88 2re9 n LYS 102 Cb 0.60 -2.39 -0.01 0.00 -1.84 0.00 0.00 35.03 31.39 2re9 n LYS 102 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2re9 s PRO 103 N -1.93 3.54 0.06 1.97 0.04 -1.26 -4.95 135.00 132.47 2re9 s PRO 103 Ca 0.55 0.06 -0.01 0.00 0.04 0.00 0.00 61.00 61.64 2re9 s PRO 103 Cb -0.55 -2.46 0.01 0.00 0.04 0.00 0.00 34.50 31.54 2re9 s PRO 103 CO 0.62 -0.09 0.07 -0.25 0.04 0.00 0.00 177.00 177.40 2re9 n ASP 104 N -2.05 -0.19 -3.60 6.66 10.43 -0.53 -4.78 116.55 122.48 2re9 n ASP 104 Ca -0.01 -0.94 -0.05 0.00 2.57 0.00 0.00 54.79 56.36 2re9 n ASP 104 Cb 0.55 -0.06 -0.02 0.00 1.84 0.00 0.00 41.12 43.44 2re9 n ASP 104 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 2re9 s SER 105 N -1.35 -0.23 0.05 -2.24 1.04 -1.26 -0.55 113.70 109.16 2re9 s SER 105 Ca 0.04 -0.12 0.04 0.00 0.48 0.00 0.00 55.95 56.40 2re9 s SER 105 Cb -0.00 0.33 -0.02 0.00 0.10 0.00 0.00 66.02 66.42 2re9 s SER 105 CO 0.03 -0.57 -0.12 0.27 0.98 0.00 0.00 173.24 173.83 2re9 s ILE 106 N -2.93 0.93 -0.06 -1.02 -4.36 -0.50 -4.89 121.20 108.36 2re9 s ILE 106 Ca 0.09 -1.13 -0.11 0.00 -0.26 0.00 0.00 60.65 59.24 2re9 s ILE 106 Cb -0.00 -0.90 0.02 0.00 1.25 0.00 0.00 42.46 42.83 2re9 s ILE 106 CO -0.05 -0.20 0.27 -0.89 0.24 0.00 0.00 174.94 174.32 2re9 s THR 107 N -1.15 0.03 -0.05 8.37 2.01 -1.26 -1.41 115.64 122.18 2re9 s THR 107 Ca -0.03 -0.24 0.03 0.00 0.31 0.00 0.00 61.69 61.76 2re9 s THR 107 Cb -0.09 -0.47 0.00 0.00 0.01 0.00 0.00 72.50 71.95 2re9 s THR 107 CO 0.01 -0.13 -0.14 -0.69 -0.69 0.00 0.00 174.62 172.98 2re9 s VAL 108 N -0.51 1.24 -0.03 3.82 1.01 0.19 -1.50 120.40 124.62 2re9 s VAL 108 Ca -0.06 -0.59 0.01 0.00 0.00 0.00 0.00 61.98 61.34 2re9 s VAL 108 Cb -0.04 -1.09 0.02 0.00 0.00 0.00 0.00 36.38 35.28 2re9 s VAL 108 CO 0.02 0.37 -0.02 0.68 0.00 0.00 0.00 175.10 176.14 2re9 s VAL 109 N 0.25 0.34 -0.25 2.92 -7.23 -0.08 -0.52 120.40 115.83 2re9 s VAL 109 Ca -0.07 -0.02 -0.14 0.00 -1.81 0.00 0.00 61.98 59.94 2re9 s VAL 109 Cb -0.12 -0.39 -0.04 0.00 0.56 0.00 0.00 36.38 36.38 2re9 s VAL 109 CO 0.02 0.17 0.32 -0.63 -0.31 0.00 0.00 175.10 174.68 2re9 s ILE 110 N 0.90 5.22 0.09 -0.62 1.01 -0.09 -0.88 121.20 126.84 2re9 s ILE 110 Ca -0.10 0.49 0.07 0.00 0.00 0.00 0.00 60.65 61.11 2re9 s ILE 110 Cb -0.13 -3.65 -0.04 0.00 0.01 0.00 0.00 42.46 38.64 2re9 s ILE 110 CO -0.01 0.22 -0.11 -0.89 0.00 0.00 0.00 174.94 174.15 2re9 s THR 111 N 1.72 3.30 -0.13 2.92 2.01 -0.01 -0.82 115.64 124.62 2re9 s THR 111 Ca 0.14 -1.23 0.00 0.00 0.31 0.00 0.00 61.69 60.91 2re9 s THR 111 Cb -0.15 -2.52 -0.01 0.00 0.01 0.00 0.00 72.50 69.83 2re9 s THR 111 CO 0.09 0.16 -0.15 -0.75 -0.69 0.00 0.00 174.62 173.28 2re9 s LYS 112 N -2.06 3.32 -0.13 4.92 2.20 0.23 -1.69 119.74 126.54 2re9 s LYS 112 Ca 0.20 -0.72 0.03 0.00 -0.36 0.00 0.00 55.97 55.12 2re9 s LYS 112 Cb -0.11 -2.58 0.01 0.00 -1.51 0.00 0.00 37.83 33.63 2re9 s LYS 112 CO 0.12 0.19 -0.22 0.08 -0.36 0.00 0.00 175.35 175.16 2re9 s VAL 113 N 0.39 2.14 -0.07 4.02 1.01 0.60 -0.74 120.40 127.75 2re9 s VAL 113 Ca -0.12 -0.97 0.04 0.00 0.00 0.00 0.00 61.98 60.93 2re9 s VAL 113 Cb -0.16 -1.85 -0.02 0.00 0.00 0.00 0.00 36.38 34.35 2re9 s VAL 113 CO 0.06 0.55 -0.18 -0.89 0.00 0.00 0.00 175.10 174.64 2re9 s THR 114 N 0.66 2.72 0.31 3.92 2.01 -1.24 -1.14 115.64 122.89 2re9 s THR 114 Ca -0.10 -0.83 0.01 0.00 0.31 0.00 0.00 61.69 61.08 2re9 s THR 114 Cb -0.16 -2.06 0.17 0.00 0.01 0.00 0.00 72.50 70.46 2re9 s THR 114 CO 0.02 0.57 1.86 -0.78 -0.69 0.00 0.00 174.62 175.60 2re9 h ASP 115 N 5.84 0.66 1.15 3.53 1.82 -1.95 -1.57 116.42 125.89 2re9 h ASP 115 Ca -0.38 -0.11 0.00 0.00 -0.39 0.00 0.00 57.03 56.15 2re9 h ASP 115 Cb 1.17 -0.17 0.00 0.00 0.68 0.00 0.00 39.33 41.01 2re9 h ASP 115 CO 0.50 0.66 0.00 -1.54 -1.61 0.00 0.00 179.24 177.25 2re9 n SER 116 N -4.30 0.75 -3.88 2.28 3.41 -1.26 -4.41 113.62 106.21 2re9 n SER 116 Ca 0.03 0.61 -0.30 0.00 -0.26 0.00 0.00 58.87 58.96 2re9 n SER 116 Cb 0.21 -0.80 -0.15 0.00 -0.26 0.00 0.00 64.21 63.21 2re9 n SER 116 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 2re9 s TYR 117 N -3.19 2.45 0.01 7.33 1.51 -0.59 -5.04 117.35 119.82 2re9 s TYR 117 Ca 0.08 -2.03 -0.02 0.00 -1.01 0.00 0.00 57.07 54.09 2re9 s TYR 117 Cb 0.11 -1.95 -0.01 0.00 -0.11 0.00 0.00 41.96 40.00 2re9 s TYR 117 CO 0.51 -0.85 1.03 -1.00 -1.11 0.00 0.00 175.55 174.13 2re9 h PRO 118 N 7.93 -0.05 -6.15 -1.71 0.13 -1.77 -3.28 132.00 127.09 2re9 h PRO 118 Ca -0.13 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.34 2re9 h PRO 118 Cb 1.04 0.01 0.01 0.00 0.13 0.00 0.00 31.00 32.19 2re9 h PRO 118 CO 0.46 -0.04 1.13 0.39 -0.23 0.00 0.00 178.00 179.71 2re9 n GLU 119 N -2.54 1.56 -1.92 0.86 -0.58 -1.26 -4.77 120.64 111.99 2re9 n GLU 119 Ca -0.01 0.54 -0.36 0.00 -0.42 0.00 0.00 57.16 56.91 2re9 n GLU 119 Cb 0.03 -2.44 0.04 0.00 -0.57 0.00 0.00 31.44 28.50 2re9 n GLU 119 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 2re9 s PRO 120 N 4.54 2.88 -0.19 3.49 0.04 -1.26 -4.87 135.00 139.63 2re9 s PRO 120 Ca 0.99 1.93 -0.06 0.00 0.04 0.00 0.00 61.00 63.90 2re9 s PRO 120 Cb -0.85 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 31.72 2re9 s PRO 120 CO 0.55 -1.31 0.02 0.99 0.04 0.00 0.00 177.00 177.29 2re9 s THR 121 N -1.51 4.20 -0.35 1.26 2.01 0.08 -4.93 115.64 116.41 2re9 s THR 121 Ca 0.78 -0.23 -0.27 0.00 0.31 0.00 0.00 61.69 62.28 2re9 s THR 121 Cb -0.33 -2.89 0.02 0.00 0.01 0.00 0.00 72.50 69.30 2re9 s THR 121 CO 0.36 0.44 1.00 -1.10 -0.69 0.00 0.00 174.62 174.63 2re9 s GLN 122 N 0.74 3.95 -0.15 4.92 -0.21 -1.26 -0.60 119.66 127.04 2re9 s GLN 122 Ca 0.01 0.81 -0.17 0.00 0.02 0.00 0.00 55.36 56.03 2re9 s GLN 122 Cb -0.14 -3.77 -0.24 0.00 1.00 0.00 0.00 33.01 29.86 2re9 s GLN 122 CO 0.02 -0.93 0.39 -0.07 -2.12 0.00 0.00 175.29 172.59 2re9 h LEU 123 N 10.09 0.20 -8.10 2.90 3.38 -1.34 -3.48 115.31 118.96 2re9 h LEU 123 Ca -0.22 -0.74 -0.38 0.00 0.09 0.00 0.00 57.88 56.64 2re9 h LEU 123 Cb 1.07 -0.07 -0.27 0.00 0.09 0.00 0.00 40.66 41.49 2re9 h LEU 123 CO 1.01 1.57 -0.77 -0.76 0.09 0.00 0.00 178.44 179.58 2re9 s LEU 124 N -7.63 2.09 -0.05 1.67 2.01 -1.15 -4.98 118.68 110.64 2re9 s LEU 124 Ca -0.24 -0.28 -0.02 0.00 0.01 0.00 0.00 54.13 53.60 2re9 s LEU 124 Cb 0.05 -0.42 0.04 0.00 0.01 0.00 0.00 46.19 45.87 2re9 s LEU 124 CO 0.69 0.04 0.09 -0.32 1.01 0.00 0.00 176.35 177.86 2re9 s MET 125 N -0.62 -0.00 -0.23 1.70 -2.45 -1.26 -0.91 119.30 115.52 2re9 s MET 125 Ca 0.01 0.36 0.01 0.00 -1.25 0.00 0.00 55.69 54.82 2re9 s MET 125 Cb -0.05 -0.30 0.04 0.00 1.25 0.00 0.00 34.83 35.76 2re9 s MET 125 CO 0.00 -0.24 -0.13 0.20 1.05 0.00 0.00 175.02 175.90 2re9 s GLY 126 N 1.63 1.55 -0.04 2.11 0.00 0.32 -4.98 107.32 107.91 2re9 s GLY 126 Ca -0.03 -1.49 0.03 0.00 0.00 0.00 0.00 44.72 43.23 2re9 s GLY 126 CO -0.04 0.46 -0.11 -1.08 0.00 0.00 0.00 173.10 172.33 2re9 s THR 127 N 1.23 1.01 -0.01 0.90 -1.32 -1.26 -0.64 115.64 115.54 2re9 s THR 127 Ca -0.02 -0.46 0.03 0.00 -1.21 0.00 0.00 61.69 60.03 2re9 s THR 127 Cb -0.17 -0.90 -0.00 0.00 -1.51 0.00 0.00 72.50 69.92 2re9 s THR 127 CO -0.08 0.31 -0.09 -0.54 -2.21 0.00 0.00 174.62 172.01 2re9 s LYS 128 N 0.31 0.79 0.34 7.08 1.02 -0.50 -5.01 119.74 123.76 2re9 s LYS 128 Ca -0.06 -0.32 -0.26 0.00 0.02 0.00 0.00 55.97 55.34 2re9 s LYS 128 Cb -0.11 -0.76 -0.10 0.00 -0.52 0.00 0.00 37.83 36.34 2re9 s LYS 128 CO 0.02 0.18 0.98 -1.54 -0.92 0.00 0.00 175.35 174.07 2re9 s SER 129 N -0.13 7.20 -0.10 2.83 1.04 -1.26 -1.41 113.70 121.86 2re9 s SER 129 Ca 0.02 1.93 0.01 0.00 0.48 0.00 0.00 55.95 58.39 2re9 s SER 129 Cb -0.05 -2.59 0.02 0.00 0.10 0.00 0.00 66.02 63.51 2re9 s SER 129 CO -0.00 -0.17 -0.12 -0.69 0.98 0.00 0.00 173.24 173.23 2re9 s VAL 130 N -1.57 1.29 -0.43 5.02 1.01 0.28 -4.89 120.40 121.11 2re9 s VAL 130 Ca 0.51 -0.51 0.06 0.00 0.00 0.00 0.00 61.98 62.04 2re9 s VAL 130 Cb -0.21 -1.21 0.32 0.00 0.00 0.00 0.00 36.38 35.28 2re9 s VAL 130 CO 0.26 0.40 1.18 0.00 0.00 0.00 0.00 175.10 176.94 2re9 s GLU 132 N 0.22 3.74 -0.17 0.00 2.02 -1.26 -4.78 118.70 118.47 2re9 s GLU 132 Ca 0.22 0.88 0.16 0.00 0.02 0.00 0.00 54.97 56.24 2re9 s GLU 132 Cb 0.29 -2.10 0.60 0.00 0.10 0.00 0.00 34.13 33.02 2re9 s GLU 132 CO -0.08 -0.45 1.51 1.33 0.02 0.00 0.00 175.26 177.59 2re9 n VAL 133 N -2.15 2.27 -3.63 2.63 0.24 -1.26 -4.61 118.33 111.82 2re9 n VAL 133 Ca 0.06 -1.64 -0.20 0.00 -2.04 0.00 0.00 64.34 60.52 2re9 n VAL 133 Cb 0.54 -0.17 0.01 0.00 -1.47 0.00 0.00 33.84 32.76 2re9 n VAL 133 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2re9 n GLY 134 N -0.02 2.60 0.33 7.63 0.00 -1.26 -5.03 105.19 109.44 2re9 n GLY 134 Ca 0.23 -2.26 -0.12 0.00 0.00 0.00 0.00 46.02 43.86 2re9 n GLY 134 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2re9 h SER 135 N 0.43 -0.94 -4.16 1.61 0.87 -1.96 -3.40 113.55 106.00 2re9 h SER 135 Ca -0.27 0.12 -0.35 0.00 -1.23 0.00 0.00 61.79 60.06 2re9 h SER 135 Cb 1.04 0.38 -0.09 0.00 -0.44 0.00 0.00 62.40 63.29 2re9 h SER 135 CO 0.42 -0.38 -0.30 -0.46 -0.53 0.00 0.00 176.83 175.58 2re9 n ASN 136 N -5.41 -0.83 -3.70 6.23 6.94 -1.26 -2.53 115.26 114.70 2re9 n ASN 136 Ca -0.05 -2.79 -0.10 0.00 -0.02 0.00 0.00 54.58 51.62 2re9 n ASN 136 Cb 0.32 1.73 -0.04 0.00 -2.36 0.00 0.00 39.78 39.43 2re9 n ASN 136 CO 0.00 0.00 0.00 -1.66 -1.03 0.00 0.00 177.26 174.57 2re9 s TRP 137 N -3.17 -0.11 -0.15 -2.53 1.48 -0.78 -4.79 118.94 108.88 2re9 s TRP 137 Ca 0.31 -0.22 -0.29 0.00 -1.06 0.00 0.00 56.10 54.84 2re9 s TRP 137 Cb 0.01 0.28 0.09 0.00 -1.16 0.00 0.00 33.47 32.69 2re9 s TRP 137 CO 0.22 -0.79 0.81 -0.59 -4.06 0.00 0.00 176.95 172.55 2re9 s PHE 138 N -3.85 -0.58 -0.19 1.66 -0.12 -1.26 -1.84 117.98 111.80 2re9 s PHE 138 Ca 0.07 1.14 -0.30 0.00 -0.05 0.00 0.00 56.93 57.79 2re9 s PHE 138 Cb 0.01 0.39 0.14 0.00 -0.63 0.00 0.00 43.02 42.93 2re9 s PHE 138 CO -0.07 -0.45 1.09 1.14 -0.05 0.00 0.00 175.22 176.88 2re9 s GLN 139 N -0.73 0.45 0.24 1.99 -2.07 -0.27 -4.99 119.66 114.29 2re9 s GLN 139 Ca -0.05 0.10 0.03 0.00 -1.82 0.00 0.00 55.36 53.62 2re9 s GLN 139 Cb -0.02 0.21 -0.03 0.00 -1.09 0.00 0.00 33.01 32.08 2re9 s GLN 139 CO 0.04 -0.14 0.39 -1.25 -1.32 0.00 0.00 175.29 173.01 2re9 s PRO 140 N -1.14 3.46 -0.15 9.60 0.04 -1.26 -0.65 135.00 144.91 2re9 s PRO 140 Ca 0.01 -0.58 -0.00 0.00 0.04 0.00 0.00 61.00 60.48 2re9 s PRO 140 Cb -0.01 -2.85 0.03 0.00 0.04 0.00 0.00 34.50 31.71 2re9 s PRO 140 CO -0.01 0.39 -0.09 0.42 0.04 0.00 0.00 177.00 177.74 2re9 s ILE 141 N -1.98 1.29 -0.05 0.56 1.01 -0.77 -4.97 121.20 116.29 2re9 s ILE 141 Ca 0.36 -0.55 0.01 0.00 0.00 0.00 0.00 60.65 60.48 2re9 s ILE 141 Cb -0.10 -1.31 -0.03 0.00 0.01 0.00 0.00 42.46 41.03 2re9 s ILE 141 CO 0.30 0.32 -0.07 -0.47 0.00 0.00 0.00 174.94 175.02 2re9 s TYR 142 N 1.59 2.91 -0.03 3.97 5.04 -1.26 -1.82 117.35 127.75 2re9 s TYR 142 Ca 0.03 -0.00 -0.02 0.00 -2.44 0.00 0.00 57.07 54.64 2re9 s TYR 142 Cb -0.14 -1.68 0.01 0.00 0.35 0.00 0.00 41.96 40.50 2re9 s TYR 142 CO -0.09 0.33 0.08 -0.51 -1.34 0.00 0.00 175.55 174.02 2re9 s LEU 143 N -0.93 1.63 -0.28 6.97 1.43 -0.16 -4.96 118.68 122.38 2re9 s LEU 143 Ca 0.13 0.15 -0.19 0.00 -1.03 0.00 0.00 54.13 53.20 2re9 s LEU 143 Cb -0.11 0.25 0.09 0.00 0.03 0.00 0.00 46.19 46.45 2re9 s LEU 143 CO 0.03 -0.04 0.76 -0.83 0.23 0.00 0.00 176.35 176.50 2re9 s GLY 144 N 0.15 -0.49 0.14 -3.19 0.00 -1.26 -1.00 107.32 101.67 2re9 s GLY 144 Ca -0.01 2.45 -0.25 0.00 0.00 0.00 0.00 44.72 46.91 2re9 s GLY 144 CO -0.00 2.24 0.95 0.00 0.00 0.00 0.00 173.10 176.28 2re9 s ALA 145 N 1.19 -1.66 -0.15 3.20 0.00 -0.54 -5.00 121.76 118.80 2re9 s ALA 145 Ca -0.07 0.19 -0.07 0.00 0.00 0.00 0.00 51.96 52.02 2re9 s ALA 145 Cb -0.05 0.63 -0.04 0.00 0.00 0.00 0.00 23.12 23.66 2re9 s ALA 145 CO -0.13 -1.01 0.08 1.41 0.00 0.00 0.00 175.76 176.10 2re9 s MET 146 N -3.28 3.69 0.03 0.00 -2.45 -1.26 -0.91 119.30 115.12 2re9 s MET 146 Ca 0.12 -0.29 0.01 0.00 -1.25 0.00 0.00 55.69 54.27 2re9 s MET 146 Cb -0.01 -3.16 -0.02 0.00 1.25 0.00 0.00 34.83 32.89 2re9 s MET 146 CO 0.01 0.48 -0.04 -0.06 1.05 0.00 0.00 175.02 176.46 2re9 s PHE 147 N -0.20 0.40 -0.22 4.11 0.08 -0.16 -4.97 117.98 117.02 2re9 s PHE 147 Ca 0.08 -0.55 -0.22 0.00 0.12 0.00 0.00 56.93 56.37 2re9 s PHE 147 Cb -0.12 -0.27 -0.02 0.00 -0.57 0.00 0.00 43.02 42.05 2re9 s PHE 147 CO 0.01 -0.17 0.68 -1.12 -0.10 0.00 0.00 175.22 174.52 2re9 s SER 148 N -1.58 6.70 0.23 1.36 0.01 -1.26 -0.75 113.70 118.41 2re9 s SER 148 Ca -0.13 0.86 0.11 0.00 1.31 0.00 0.00 55.95 58.10 2re9 s SER 148 Cb -0.09 -2.37 -0.05 0.00 0.21 0.00 0.00 66.02 63.73 2re9 s SER 148 CO -0.01 -0.34 -0.20 -0.76 0.41 0.00 0.00 173.24 172.33 2re9 s LEU 149 N 2.22 2.52 0.08 2.44 1.43 -0.16 -4.98 118.68 122.22 2re9 s LEU 149 Ca 0.30 -0.96 0.06 0.00 -1.03 0.00 0.00 54.13 52.50 2re9 s LEU 149 Cb -0.16 -1.02 -0.04 0.00 0.03 0.00 0.00 46.19 45.00 2re9 s LEU 149 CO 0.10 0.02 -0.07 -1.10 0.23 0.00 0.00 176.35 175.53 2re9 s GLN 150 N -3.18 2.33 0.22 1.70 -1.52 -1.26 -1.34 119.66 116.61 2re9 s GLN 150 Ca 0.24 -0.91 -0.32 0.00 -1.95 0.00 0.00 55.36 52.43 2re9 s GLN 150 Cb -0.05 -2.41 -0.14 0.00 -0.22 0.00 0.00 33.01 30.19 2re9 s GLN 150 CO 0.11 0.54 1.44 -1.91 -0.25 0.00 0.00 175.29 175.22 2re9 n GLU 151 N 0.88 2.05 0.00 2.91 2.13 -1.26 -0.61 120.64 126.75 2re9 n GLU 151 Ca -0.13 0.73 0.00 0.00 0.66 0.00 0.00 57.16 58.42 2re9 n GLU 151 Cb 0.52 -2.41 0.00 0.00 0.27 0.00 0.00 31.44 29.82 2re9 n GLU 151 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2re9 n GLY 152 N 2.42 3.11 3.69 8.31 0.00 -0.37 -4.96 105.19 117.39 2re9 n GLY 152 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 2re9 n GLY 152 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2re9 n ASP 153 N 0.00 1.41 -4.02 1.61 10.43 0.22 -4.73 116.55 121.48 2re9 n ASP 153 Ca 0.00 0.72 -0.22 0.00 2.57 0.00 0.00 54.79 57.86 2re9 n ASP 153 Cb 0.00 -1.51 -0.16 0.00 1.84 0.00 0.00 41.12 41.29 2re9 n ASP 153 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 2re9 s LYS 154 N -3.61 1.19 -0.03 -1.24 1.02 -0.29 -1.43 119.74 115.36 2re9 s LYS 154 Ca 0.78 -0.37 0.02 0.00 0.02 0.00 0.00 55.97 56.43 2re9 s LYS 154 Cb -0.34 -1.08 -0.03 0.00 -0.52 0.00 0.00 37.83 35.86 2re9 s LYS 154 CO 0.46 0.12 -0.08 -0.51 -0.92 0.00 0.00 175.35 174.42 2re9 s LEU 155 N 0.25 3.09 0.05 3.17 1.02 -0.35 -0.29 118.68 125.61 2re9 s LEU 155 Ca -0.05 -0.11 -0.11 0.00 0.02 0.00 0.00 54.13 53.89 2re9 s LEU 155 Cb -0.10 -1.71 0.01 0.00 0.02 0.00 0.00 46.19 44.40 2re9 s LEU 155 CO 0.01 0.32 0.23 0.00 0.02 0.00 0.00 176.35 176.93 2re9 s MET 156 N -1.07 0.75 -0.20 1.70 0.23 -0.68 -1.01 119.30 119.02 2re9 s MET 156 Ca 0.14 -0.64 -0.03 0.00 -1.03 0.00 0.00 55.69 54.13 2re9 s MET 156 Cb -0.11 0.31 -0.01 0.00 -1.53 0.00 0.00 34.83 33.50 2re9 s MET 156 CO 0.04 -0.23 -0.06 0.08 -2.03 0.00 0.00 175.02 172.82 2re9 s VAL 157 N -2.75 3.29 -0.01 5.16 1.01 -1.26 -0.83 120.40 125.00 2re9 s VAL 157 Ca -0.04 -0.53 0.02 0.00 0.00 0.00 0.00 61.98 61.43 2re9 s VAL 157 Cb -0.00 -2.47 -0.03 0.00 0.00 0.00 0.00 36.38 33.87 2re9 s VAL 157 CO -0.05 0.45 -0.03 0.20 0.00 0.00 0.00 175.10 175.67 2re9 s ASN 158 N 1.26 4.92 0.15 3.32 0.01 -0.05 -1.05 114.94 123.49 2re9 s ASN 158 Ca 0.03 -0.05 0.06 0.00 -0.71 0.00 0.00 52.86 52.19 2re9 s ASN 158 Cb -0.14 -1.24 -0.04 0.00 0.41 0.00 0.00 41.25 40.24 2re9 s ASN 158 CO -0.02 0.29 -0.13 0.68 -1.51 0.00 0.00 177.10 176.40 2re9 s VAL 159 N -1.03 1.39 0.22 1.60 -7.23 -0.93 -0.90 120.40 113.53 2re9 s VAL 159 Ca 0.18 -1.91 -0.02 0.00 -1.81 0.00 0.00 61.98 58.42 2re9 s VAL 159 Cb -0.11 -1.72 0.01 0.00 0.56 0.00 0.00 36.38 35.11 2re9 s VAL 159 CO 0.09 -0.53 1.60 0.77 -0.31 0.00 0.00 175.10 176.72 2re9 h SER 160 N 3.14 0.63 -2.51 4.85 4.64 -1.60 -3.25 113.55 119.46 2re9 h SER 160 Ca -0.39 -0.27 -0.32 0.00 -0.47 0.00 0.00 61.79 60.35 2re9 h SER 160 Cb 1.20 -0.18 -0.36 0.00 -0.31 0.00 0.00 62.40 62.76 2re9 h SER 160 CO 0.56 0.94 -0.63 -0.62 -0.87 0.00 0.00 176.83 176.21 2re9 s ASP 161 N -6.83 1.40 0.37 4.97 -1.08 -1.26 -4.84 116.67 109.39 2re9 s ASP 161 Ca -0.08 -0.25 0.05 0.00 -0.52 0.00 0.00 52.55 51.76 2re9 s ASP 161 Cb 0.13 0.38 0.74 0.00 -1.46 0.00 0.00 42.92 42.71 2re9 s ASP 161 CO 0.82 -0.33 1.98 0.40 0.52 0.00 0.00 175.17 178.56 2re9 h ILE 162 N 6.31 1.05 0.00 4.11 1.08 -1.93 -2.20 117.51 125.93 2re9 h ILE 162 Ca -0.17 -0.26 0.00 0.00 -0.39 0.00 0.00 64.86 64.04 2re9 h ILE 162 Cb 1.15 0.24 0.00 0.00 -3.07 0.00 0.00 36.82 35.14 2re9 h ILE 162 CO 0.29 0.14 0.00 -1.54 -0.69 0.00 0.00 178.15 176.34 2re9 n SER 163 N -4.47 0.00 -0.35 1.72 3.41 -1.26 -2.41 113.62 110.26 2re9 n SER 163 Ca 0.09 0.32 0.11 0.00 -0.26 0.00 0.00 58.87 59.12 2re9 n SER 163 Cb 0.18 -0.41 -0.04 0.00 -0.26 0.00 0.00 64.21 63.68 2re9 n SER 163 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2re9 n LEU 164 N -1.41 1.72 -4.69 1.04 4.77 -0.83 -4.93 117.00 112.66 2re9 n LEU 164 Ca 0.06 -0.69 -0.42 0.00 -0.03 0.00 0.00 56.01 54.93 2re9 n LEU 164 Cb 0.17 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.23 2re9 n LEU 164 CO 0.14 0.34 0.80 -0.69 -1.33 0.00 0.00 177.39 176.66 2re9 s VAL 165 N -2.59 4.66 -0.42 4.08 1.01 -1.01 -0.20 120.40 125.92 2re9 s VAL 165 Ca 0.15 1.93 -0.29 0.00 0.00 0.00 0.00 61.98 63.78 2re9 s VAL 165 Cb 0.17 -4.24 0.02 0.00 0.00 0.00 0.00 36.38 32.33 2re9 s VAL 165 CO 0.65 0.04 1.14 -0.62 0.00 0.00 0.00 175.10 176.30 2re9 s ASP 166 N 1.15 6.71 0.00 3.32 -1.08 -0.18 -4.86 116.67 121.72 2re9 s ASP 166 Ca 0.51 0.67 0.17 0.00 -0.52 0.00 0.00 52.55 53.38 2re9 s ASP 166 Cb -0.20 -2.55 0.45 0.00 -1.46 0.00 0.00 42.92 39.16 2re9 s ASP 166 CO 0.21 -1.15 1.37 0.00 0.52 0.00 0.00 175.17 176.12 2re9 n TYR 167 N 7.61 0.67 -0.03 -5.34 0.18 -1.26 -4.64 117.16 114.35 2re9 n TYR 167 Ca 0.12 -0.46 -0.11 0.00 1.88 0.00 0.00 57.90 59.33 2re9 n TYR 167 Cb 0.48 -0.01 0.03 0.00 -0.38 0.00 0.00 39.34 39.46 2re9 n TYR 167 CO 0.00 0.00 0.00 1.15 -2.08 0.00 0.00 176.86 175.93 2re9 h THR 168 N 3.20 1.30 -4.26 -3.48 2.02 -1.93 -3.41 112.91 106.35 2re9 h THR 168 Ca 0.00 -1.76 -0.58 0.00 0.77 0.00 0.00 66.41 64.84 2re9 h THR 168 Cb 0.85 1.70 -0.30 0.00 -1.74 0.00 0.00 68.15 68.67 2re9 h THR 168 CO 0.00 0.56 -0.85 -0.54 0.37 0.00 0.00 175.52 175.06 2re9 s LYS 169 N -4.06 1.68 0.55 6.66 -0.14 -1.26 -5.00 119.74 118.16 2re9 s LYS 169 Ca -0.08 -0.69 0.35 0.00 -1.36 0.00 0.00 55.97 54.19 2re9 s LYS 169 Cb 0.11 -1.57 1.61 0.00 -1.68 0.00 0.00 37.83 36.30 2re9 s LYS 169 CO 0.86 0.38 2.05 1.05 -0.76 0.00 0.00 175.35 178.93 2re9 h GLU 170 N 5.81 0.00 -0.01 1.68 4.11 -1.85 -2.64 114.58 121.68 2re9 h GLU 170 Ca -0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.06 2re9 h GLU 170 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 2re9 h GLU 170 CO 0.48 0.00 -0.36 -0.40 0.07 0.00 0.00 179.01 178.80 2re9 n ASP 171 N -2.98 1.14 -0.06 3.06 3.85 -1.26 -4.26 116.55 116.04 2re9 n ASP 171 Ca -0.00 -0.93 -0.02 0.00 -0.71 0.00 0.00 54.79 53.14 2re9 n ASP 171 Cb 0.23 0.25 -0.14 0.00 -1.35 0.00 0.00 41.12 40.10 2re9 n ASP 171 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 2re9 n LYS 172 N -0.68 0.91 -3.74 0.11 5.02 -1.00 -4.91 118.16 113.86 2re9 n LYS 172 Ca 0.10 -0.07 -0.24 0.00 -2.02 0.00 0.00 58.31 56.09 2re9 n LYS 172 Cb 0.37 -1.45 -0.17 0.00 -0.02 0.00 0.00 35.03 33.75 2re9 n LYS 172 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2re9 s THR 173 N -2.77 0.31 0.32 -0.18 2.01 -1.21 -3.37 115.64 110.75 2re9 s THR 173 Ca -0.08 0.02 -0.09 0.00 0.31 0.00 0.00 61.69 61.85 2re9 s THR 173 Cb 0.08 -0.58 0.01 0.00 0.01 0.00 0.00 72.50 72.02 2re9 s THR 173 CO 0.75 0.13 0.53 0.72 -0.69 0.00 0.00 174.62 176.07 2re9 s PHE 174 N 1.99 0.63 -0.28 4.92 -0.71 -0.49 -1.44 117.98 122.59 2re9 s PHE 174 Ca 0.04 -0.99 -0.16 0.00 -1.04 0.00 0.00 56.93 54.78 2re9 s PHE 174 Cb -0.13 0.19 0.09 0.00 -1.21 0.00 0.00 43.02 41.96 2re9 s PHE 174 CO -0.06 -1.16 0.72 0.12 -1.34 0.00 0.00 175.22 173.50 2re9 s PHE 175 N -3.28 -1.04 0.28 3.49 5.36 -0.43 -1.50 117.98 120.86 2re9 s PHE 175 Ca 0.25 2.05 -0.08 0.00 -0.96 0.00 0.00 56.93 58.19 2re9 s PHE 175 Cb -0.01 0.62 -0.01 0.00 -0.34 0.00 0.00 43.02 43.28 2re9 s PHE 175 CO 0.14 -0.52 0.44 0.20 -1.46 0.00 0.00 175.22 174.03 2re9 s GLY 176 N 1.71 1.00 -0.17 13.12 0.00 -0.32 0.40 107.32 123.05 2re9 s GLY 176 Ca -0.10 -1.22 -0.29 0.00 0.00 0.00 0.00 44.72 43.11 2re9 s GLY 176 CO -0.19 -0.86 0.94 0.00 0.00 0.00 0.00 173.10 172.98 2re9 s ALA 177 N -3.65 -1.91 -0.04 3.20 0.00 -0.12 -1.62 121.76 117.63 2re9 s ALA 177 Ca 0.27 1.61 -0.12 0.00 0.00 0.00 0.00 51.96 53.73 2re9 s ALA 177 Cb 0.00 -0.74 0.02 0.00 0.00 0.00 0.00 23.12 22.40 2re9 s ALA 177 CO 0.14 -0.31 0.27 -0.59 0.00 0.00 0.00 175.76 175.27 2re9 s PHE 178 N -0.82 -0.19 0.12 0.00 -0.71 -0.78 -1.23 117.98 114.38 2re9 s PHE 178 Ca -0.02 0.37 -0.30 0.00 -1.04 0.00 0.00 56.93 55.94 2re9 s PHE 178 Cb -0.01 0.08 -0.07 0.00 -1.21 0.00 0.00 43.02 41.81 2re9 s PHE 178 CO 0.02 -0.29 1.14 -1.17 -1.34 0.00 0.00 175.22 173.57 2re9 s LEU 179 N -0.84 4.43 0.00 -1.99 2.96 -0.84 -1.34 118.68 121.06 2re9 s LEU 179 Ca -0.09 2.05 0.27 0.00 -0.22 0.00 0.00 54.13 56.13 2re9 s LEU 179 Cb -0.05 -3.59 1.59 0.00 0.50 0.00 0.00 46.19 44.65 2re9 s LEU 179 CO 0.02 -0.33 1.94 0.18 -1.32 0.00 0.00 176.35 176.85