#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2re9 n ARG 18 N 0.00 3.34 0.00 1.96 5.12 -1.26 -5.08 116.66 120.74 2re9 n ARG 18 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 2re9 n ARG 18 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 2re9 n ARG 18 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2re9 n ALA 19 N -3.00 0.00 0.08 7.54 0.00 -1.26 -4.82 120.51 119.05 2re9 n ALA 19 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.53 2re9 n ALA 19 Cb 0.00 0.00 0.18 0.00 0.00 0.00 0.00 19.45 19.63 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 0.00 3.13 0.00 0.00 5.75 -1.26 -4.42 116.55 119.74 2re9 n ASP 20 Ca 0.00 -1.91 0.03 0.00 -0.01 0.00 0.00 54.79 52.91 2re9 n ASP 20 Cb 0.00 -0.24 0.20 0.00 -1.03 0.00 0.00 41.12 40.05 2re9 n ASP 20 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2re9 n GLY 21 N 1.08 -0.53 1.94 6.12 0.00 -1.26 -2.68 105.19 109.85 2re9 n GLY 21 Ca 0.16 -0.04 -0.16 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 -0.70 3.72 -4.81 1.61 3.85 -1.26 -4.98 116.55 113.99 2re9 n ASP 22 Ca 0.05 -3.55 -0.38 0.00 -0.71 0.00 0.00 54.79 50.20 2re9 n ASP 22 Cb 0.02 -0.77 -0.06 0.00 -1.35 0.00 0.00 41.12 38.96 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 -3.22 3.99 0.07 0.11 1.02 -1.09 -4.93 119.74 115.69 2re9 s LYS 23 Ca 0.54 0.36 -0.34 0.00 0.02 0.00 0.00 55.97 56.54 2re9 s LYS 23 Cb 0.45 -3.27 -0.14 0.00 -0.52 0.00 0.00 37.83 34.36 2re9 s LYS 23 CO 0.09 0.58 1.64 -2.30 -0.92 0.00 0.00 175.35 174.44 2re9 n PRO 24 N 2.26 2.04 -3.75 -1.68 -0.02 -1.25 -4.66 135.00 127.94 2re9 n PRO 24 Ca -0.13 0.74 -0.12 0.00 -2.02 0.00 0.00 63.50 61.97 2re9 n PRO 24 Cb 0.52 -2.51 -0.08 0.00 -0.02 0.00 0.00 33.50 31.41 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 1.82 0.78 -0.24 -0.52 0.52 -1.11 -1.75 118.95 118.45 2re9 s ARG 25 Ca 0.84 -0.42 -0.26 0.00 -0.52 0.00 0.00 55.73 55.37 2re9 s ARG 25 Cb -0.72 0.34 0.10 0.00 0.52 0.00 0.00 34.95 35.19 2re9 s ARG 25 CO 0.43 -0.24 0.91 0.00 0.02 0.00 0.00 175.30 176.42 2re9 s ALA 26 N -2.23 -1.89 -0.17 2.13 0.00 -0.40 -1.42 121.76 117.77 2re9 s ALA 26 Ca -0.07 1.83 -0.01 0.00 0.00 0.00 0.00 51.96 53.70 2re9 s ALA 26 Cb -0.02 -1.13 0.04 0.00 0.00 0.00 0.00 23.12 22.02 2re9 s ALA 26 CO -0.01 -0.29 -0.03 -1.58 0.00 0.00 0.00 175.76 173.85 2re9 s HIS 27 N -0.05 1.53 -0.01 0.00 5.04 -0.60 -1.29 115.29 119.90 2re9 s HIS 27 Ca 0.00 -1.00 -0.00 0.00 -1.54 0.00 0.00 55.06 52.52 2re9 s HIS 27 Cb -0.04 -1.23 -0.04 0.00 0.04 0.00 0.00 32.58 31.31 2re9 s HIS 27 CO -0.02 -0.60 0.06 -0.51 -2.34 0.00 0.00 174.74 171.34 2re9 s LEU 28 N 1.69 3.83 0.17 8.88 1.02 0.32 -1.06 118.68 133.52 2re9 s LEU 28 Ca 0.00 0.13 0.10 0.00 0.02 0.00 0.00 54.13 54.39 2re9 s LEU 28 Cb -0.15 -2.18 -0.04 0.00 0.02 0.00 0.00 46.19 43.83 2re9 s LEU 28 CO -0.07 0.29 -0.23 0.42 0.02 0.00 0.00 176.35 176.78 2re9 s THR 29 N -1.14 2.15 0.65 5.49 -4.23 -0.88 -0.73 115.64 116.95 2re9 s THR 29 Ca 0.21 -1.91 -0.16 0.00 -1.18 0.00 0.00 61.69 58.65 2re9 s THR 29 Cb -0.12 -1.98 -0.00 0.00 1.34 0.00 0.00 72.50 71.74 2re9 s THR 29 CO 0.12 -0.13 1.16 0.54 -0.54 0.00 0.00 174.62 175.77 2re9 s VAL 30 N -1.61 2.84 0.10 2.29 0.11 -0.39 -0.04 120.40 123.70 2re9 s VAL 30 Ca 0.17 0.44 -0.03 0.00 -2.93 0.00 0.00 61.98 59.63 2re9 s VAL 30 Cb -0.08 -3.03 -0.03 0.00 -1.53 0.00 0.00 36.38 31.71 2re9 s VAL 30 CO 0.08 -0.20 0.07 0.68 -3.33 0.00 0.00 175.10 172.40 2re9 s VAL 31 N -2.02 0.14 0.18 2.04 -7.23 -1.26 -4.67 120.40 107.58 2re9 s VAL 31 Ca 0.72 -1.73 -0.33 0.00 -1.81 0.00 0.00 61.98 58.83 2re9 s VAL 31 Cb -0.25 -1.76 -0.13 0.00 0.56 0.00 0.00 36.38 34.79 2re9 s VAL 31 CO 0.39 -0.65 1.62 -1.14 -0.31 0.00 0.00 175.10 175.01 2re9 n ARG 32 N -0.03 2.35 -2.78 4.82 0.63 -1.26 -4.83 116.66 115.55 2re9 n ARG 32 Ca -0.10 0.85 -0.40 0.00 -0.92 0.00 0.00 57.85 57.28 2re9 n ARG 32 Cb 0.63 -2.64 -0.06 0.00 0.45 0.00 0.00 32.46 30.83 2re9 n ARG 32 CO 0.00 0.00 0.00 -0.65 -2.51 0.00 0.00 177.63 174.47 2re9 s GLN 33 N 0.99 4.80 -0.24 -0.14 -1.52 -1.26 -5.03 119.66 117.27 2re9 s GLN 33 Ca 0.78 1.43 -0.24 0.00 -1.95 0.00 0.00 55.36 55.38 2re9 s GLN 33 Cb -0.62 -3.25 -0.01 0.00 -0.22 0.00 0.00 33.01 28.91 2re9 s GLN 33 CO 0.36 0.51 0.80 0.99 -0.25 0.00 0.00 175.29 177.71 2re9 s THR 34 N -1.20 4.86 0.07 -0.19 2.01 -1.26 -4.99 115.64 114.94 2re9 s THR 34 Ca 0.41 1.52 -0.37 0.00 0.31 0.00 0.00 61.69 63.56 2re9 s THR 34 Cb -0.25 -4.09 -0.18 0.00 0.01 0.00 0.00 72.50 67.99 2re9 s THR 34 CO 0.31 -0.06 1.17 -2.65 -0.69 0.00 0.00 174.62 172.70 2re9 n PRO 35 N 5.93 0.67 -4.19 4.92 -0.02 -1.26 -4.98 135.00 136.08 2re9 n PRO 35 Ca 0.05 0.24 -0.15 0.00 -2.02 0.00 0.00 63.50 61.62 2re9 n PRO 35 Cb 0.48 -1.78 -0.11 0.00 -0.02 0.00 0.00 33.50 32.07 2re9 n PRO 35 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 2re9 s THR 36 N 0.12 0.99 -1.05 3.45 -1.32 -1.26 -5.06 115.64 111.51 2re9 s THR 36 Ca 0.84 -1.68 -0.02 0.00 -1.21 0.00 0.00 61.69 59.62 2re9 s THR 36 Cb -1.05 -1.42 0.30 0.00 -1.51 0.00 0.00 72.50 68.82 2re9 s THR 36 CO 0.52 -0.56 1.85 0.00 -2.21 0.00 0.00 174.62 174.21 2re9 n GLN 37 N 0.49 5.34 -0.80 7.08 3.00 -1.26 -5.02 117.38 126.21 2re9 n GLN 37 Ca -0.15 -4.57 -0.30 0.00 -0.01 0.00 0.00 57.00 51.96 2re9 n GLN 37 Cb 0.58 -2.49 0.17 0.00 0.00 0.00 0.00 30.24 28.50 2re9 n GLN 37 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.06 173.68 2re9 s HIS 38 N -4.01 1.77 0.03 1.08 -3.43 -1.26 -4.97 115.29 104.49 2re9 s HIS 38 Ca 0.40 1.57 -0.28 0.00 -0.80 0.00 0.00 55.06 55.95 2re9 s HIS 38 Cb 0.18 -3.23 -0.04 0.00 -1.43 0.00 0.00 32.58 28.06 2re9 s HIS 38 CO -0.11 -2.85 0.87 -0.59 -2.00 0.00 0.00 174.74 170.05 2re9 s PHE 39 N -2.68 3.70 0.57 0.38 -0.71 -1.26 -4.93 117.98 113.06 2re9 s PHE 39 Ca 0.66 1.59 0.28 0.00 -1.04 0.00 0.00 56.93 58.42 2re9 s PHE 39 Cb -0.22 -2.97 1.51 0.00 -1.21 0.00 0.00 43.02 40.13 2re9 s PHE 39 CO 0.59 0.13 1.97 -0.22 -1.34 0.00 0.00 175.22 176.36 2re9 h LYS 40 N 6.19 0.00 -1.99 1.99 1.63 -2.03 -2.39 116.57 119.97 2re9 h LYS 40 Ca -0.42 0.00 -0.54 0.00 -0.85 0.00 0.00 60.65 58.83 2re9 h LYS 40 Cb 1.21 0.00 -0.19 0.00 -0.60 0.00 0.00 32.23 32.65 2re9 h LYS 40 CO 0.73 0.00 0.50 0.27 -3.45 0.00 0.00 179.45 177.50 2re9 n ASN 41 N -3.92 6.65 0.00 4.20 2.04 -1.26 -4.86 115.26 118.11 2re9 n ASN 41 Ca 0.07 -3.31 0.00 0.00 -0.44 0.00 0.00 54.58 50.90 2re9 n ASN 41 Cb 0.58 -1.20 0.00 0.00 -2.53 0.00 0.00 39.78 36.62 2re9 n ASN 41 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2re9 n GLN 42 N 0.64 0.00 -3.08 -3.83 10.64 -0.90 -5.14 117.38 115.70 2re9 n GLN 42 Ca 0.50 0.00 -0.39 0.00 -1.83 0.00 0.00 57.00 55.27 2re9 n GLN 42 Cb 0.50 0.00 -0.05 0.00 -0.86 0.00 0.00 30.24 29.83 2re9 n GLN 42 CO 0.00 0.00 0.00 -0.06 -1.83 0.00 0.00 177.06 175.17 2re9 s PHE 43 N -2.00 3.56 0.55 2.61 0.08 -1.26 -4.67 117.98 116.85 2re9 s PHE 43 Ca 0.00 1.19 -0.21 0.00 0.12 0.00 0.00 56.93 58.03 2re9 s PHE 43 Cb 0.00 -2.77 -0.05 0.00 -0.57 0.00 0.00 43.02 39.63 2re9 s PHE 43 CO 0.00 0.08 1.27 -1.25 -0.10 0.00 0.00 175.22 175.22 2re9 s PRO 44 N 0.83 3.15 0.16 0.24 0.04 -1.21 -4.58 135.00 133.64 2re9 s PRO 44 Ca 0.36 2.00 -0.15 0.00 0.04 0.00 0.00 61.00 63.25 2re9 s PRO 44 Cb -0.17 -2.15 -0.07 0.00 0.04 0.00 0.00 34.50 32.15 2re9 s PRO 44 CO 0.17 -1.11 0.58 0.00 0.04 0.00 0.00 177.00 176.68 2re9 s ALA 45 N -1.44 3.55 0.38 8.56 0.00 -1.26 -1.86 121.76 129.68 2re9 s ALA 45 Ca 0.73 -0.07 -0.09 0.00 0.00 0.00 0.00 51.96 52.53 2re9 s ALA 45 Cb -0.35 -2.58 -0.06 0.00 0.00 0.00 0.00 23.12 20.13 2re9 s ALA 45 CO 0.40 0.43 0.72 -0.51 0.00 0.00 0.00 175.76 176.79 2re9 s LEU 46 N -1.93 3.87 0.15 0.00 1.43 -0.55 -4.98 118.68 116.67 2re9 s LEU 46 Ca 0.38 1.01 0.08 0.00 -1.03 0.00 0.00 54.13 54.58 2re9 s LEU 46 Cb -0.15 -3.88 -0.04 0.00 0.03 0.00 0.00 46.19 42.14 2re9 s LEU 46 CO 0.19 -0.36 -0.09 -1.38 0.23 0.00 0.00 176.35 174.95 2re9 s HIS 47 N -2.33 2.69 0.35 0.29 -3.43 -1.26 -4.75 115.29 106.86 2re9 s HIS 47 Ca 0.49 -0.19 0.03 0.00 -0.80 0.00 0.00 55.06 54.59 2re9 s HIS 47 Cb -0.10 -1.35 -0.05 0.00 -1.43 0.00 0.00 32.58 29.65 2re9 s HIS 47 CO 0.32 0.48 0.08 -1.58 -2.00 0.00 0.00 174.74 172.04 2re9 s TRP 48 N -1.54 1.86 -0.05 0.38 0.52 -1.26 -4.32 118.94 114.54 2re9 s TRP 48 Ca 0.24 -1.08 -0.17 0.00 0.02 0.00 0.00 56.10 55.10 2re9 s TRP 48 Cb -0.10 -1.22 -0.05 0.00 -1.15 0.00 0.00 33.47 30.96 2re9 s TRP 48 CO 0.15 -0.12 0.47 -2.00 0.02 0.00 0.00 176.95 175.47 2re9 s GLU 49 N -3.85 4.19 0.00 4.98 2.56 0.94 -4.95 118.70 122.58 2re9 s GLU 49 Ca 0.32 0.48 0.00 0.00 0.00 0.00 0.00 54.97 55.77 2re9 s GLU 49 Cb 0.07 -3.34 0.00 0.00 2.00 0.00 0.00 34.13 32.85 2re9 s GLU 49 CO 0.15 0.39 0.35 -2.39 -0.56 0.00 0.00 175.26 173.20 2re9 n HIS 50 N 2.82 0.00 -0.14 5.30 1.44 -1.26 -2.07 115.22 121.32 2re9 n HIS 50 Ca -0.10 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.61 2re9 n HIS 50 Cb 0.52 0.00 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 -0.03 1.73 -3.59 -1.40 0.28 -1.26 -2.56 120.64 113.82 2re9 n GLU 51 Ca 0.00 0.00 -0.31 0.00 -0.16 0.00 0.00 57.16 56.69 2re9 n GLU 51 Cb 0.07 -0.14 -0.05 0.00 1.43 0.00 0.00 31.44 32.75 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 0.00 4.22 0.00 -1.84 1.43 -1.26 -4.77 118.68 116.47 2re9 s LEU 52 Ca 0.00 0.67 0.00 0.00 -1.03 0.00 0.00 54.13 53.77 2re9 s LEU 52 Cb 0.00 -3.42 0.00 0.00 0.03 0.00 0.00 46.19 42.80 2re9 s LEU 52 CO 0.00 -0.00 0.00 0.61 0.23 0.00 0.00 176.35 177.19 2re9 n GLY 53 N -0.08 3.67 0.00 -3.19 0.00 -1.26 -1.87 105.19 102.46 2re9 n GLY 53 Ca -0.02 -0.07 0.14 0.00 0.00 0.00 0.00 46.02 46.07 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 0.00 -4.83 0.99 4.77 -1.26 -4.87 117.00 111.81 2re9 n LEU 54 Ca 0.00 0.40 -0.33 0.00 -0.03 0.00 0.00 56.01 56.06 2re9 n LEU 54 Cb 0.00 -0.40 -0.05 0.00 -2.33 0.00 0.00 43.42 40.63 2re9 n LEU 54 CO 0.00 -0.00 0.67 0.00 -1.33 0.00 0.00 177.39 176.73 2re9 s ALA 55 N -2.81 3.02 -0.06 -1.18 0.00 -0.78 -4.87 121.76 115.08 2re9 s ALA 55 Ca 0.20 0.34 -0.30 0.00 0.00 0.00 0.00 51.96 52.20 2re9 s ALA 55 Cb 0.19 -3.15 0.11 0.00 0.00 0.00 0.00 23.12 20.28 2re9 s ALA 55 CO 0.49 -0.08 0.97 -0.59 0.00 0.00 0.00 175.76 176.56 2re9 s PHE 56 N -2.34 -0.30 -0.00 0.00 -0.71 -0.22 -4.03 117.98 110.38 2re9 s PHE 56 Ca 0.61 0.22 0.01 0.00 -1.04 0.00 0.00 56.93 56.73 2re9 s PHE 56 Cb -0.10 0.52 0.00 0.00 -1.21 0.00 0.00 43.02 42.23 2re9 s PHE 56 CO 0.21 -0.45 -0.02 0.95 -1.34 0.00 0.00 175.22 174.58 2re9 s THR 57 N -2.76 0.15 0.24 -4.49 -4.23 -1.20 -1.56 115.64 101.80 2re9 s THR 57 Ca 0.05 -0.06 -0.17 0.00 -1.18 0.00 0.00 61.69 60.34 2re9 s THR 57 Cb -0.01 -0.15 0.01 0.00 1.34 0.00 0.00 72.50 73.69 2re9 s THR 57 CO -0.07 0.06 0.57 -1.59 -0.54 0.00 0.00 174.62 173.04 2re9 s LYS 58 N 0.08 1.59 -1.42 3.99 -2.85 -0.51 -4.92 119.74 115.70 2re9 s LYS 58 Ca -0.01 -1.07 -0.06 0.00 -1.00 0.00 0.00 55.97 53.83 2re9 s LYS 58 Cb -0.02 0.53 0.04 0.00 -2.06 0.00 0.00 37.83 36.31 2re9 s LYS 58 CO -0.00 -0.69 0.79 0.09 0.10 0.00 0.00 175.35 175.64 2re9 n ASN 59 N -0.40 -2.58 0.00 0.03 5.03 -1.26 -1.72 115.26 114.37 2re9 n ASN 59 Ca -0.04 -0.83 0.00 0.00 0.87 0.00 0.00 54.58 54.58 2re9 n ASN 59 Cb 0.61 -3.85 0.00 0.00 -1.02 0.00 0.00 39.78 35.52 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 -4.46 0.00 -1.79 3.52 1.74 -1.26 -3.74 116.66 110.67 2re9 n ARG 60 Ca -0.16 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.51 2re9 n ARG 60 Cb 0.61 -2.07 -0.02 0.00 -1.02 0.00 0.00 32.46 29.97 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 -0.03 4.14 -0.21 5.56 1.75 -0.70 -4.60 119.30 125.21 2re9 s MET 61 Ca 0.00 2.56 0.01 0.00 -1.25 0.00 0.00 55.69 57.01 2re9 s MET 61 Cb 0.00 -3.04 0.04 0.00 2.84 0.00 0.00 34.83 34.67 2re9 s MET 61 CO 0.00 -0.63 -0.12 1.21 -0.65 0.00 0.00 175.02 174.82 2re9 s ASN 62 N 0.61 3.57 -0.44 1.11 3.84 -1.19 -4.28 114.94 118.15 2re9 s ASN 62 Ca 0.65 -0.95 -0.19 0.00 0.21 0.00 0.00 52.86 52.58 2re9 s ASN 62 Cb -0.47 -1.35 0.03 0.00 -0.55 0.00 0.00 41.25 38.90 2re9 s ASN 62 CO 0.45 -0.13 0.55 -0.47 -2.79 0.00 0.00 177.10 174.71 2re9 s TYR 63 N 1.31 3.11 -0.02 0.43 5.04 -1.26 0.09 117.35 126.05 2re9 s TYR 63 Ca -0.02 -0.27 -0.00 0.00 -2.44 0.00 0.00 57.07 54.35 2re9 s TYR 63 Cb -0.16 -3.18 0.02 0.00 0.35 0.00 0.00 41.96 38.99 2re9 s TYR 63 CO -0.08 -0.82 0.03 -0.08 -1.34 0.00 0.00 175.55 173.25 2re9 s THR 64 N 2.50 -0.05 -1.42 4.34 -1.32 0.40 -4.91 115.64 115.18 2re9 s THR 64 Ca 0.17 0.18 -0.01 0.00 -1.21 0.00 0.00 61.69 60.81 2re9 s THR 64 Cb -0.16 -0.08 0.01 0.00 -1.51 0.00 0.00 72.50 70.76 2re9 s THR 64 CO 0.16 0.07 0.47 -3.20 -2.21 0.00 0.00 174.62 169.91 2re9 n ASN 65 N 3.97 -0.62 0.00 8.08 5.15 -1.26 -0.65 115.26 129.93 2re9 n ASN 65 Ca -0.25 -0.99 0.00 0.00 -0.60 0.00 0.00 54.58 52.74 2re9 n ASN 65 Cb 0.52 -3.13 0.00 0.00 -0.53 0.00 0.00 39.78 36.64 2re9 n ASN 65 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 2re9 n LYS 66 N -4.40 0.00 -4.17 1.20 5.02 -1.26 -4.99 118.16 109.56 2re9 n LYS 66 Ca -0.28 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 55.69 2re9 n LYS 66 Cb 0.67 -3.21 -0.08 0.00 -0.02 0.00 0.00 35.03 32.40 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 -2.79 3.09 -0.39 2.13 0.08 0.17 -4.62 117.98 115.67 2re9 s PHE 67 Ca 0.00 0.06 -0.13 0.00 0.12 0.00 0.00 56.93 56.98 2re9 s PHE 67 Cb 0.00 -1.62 0.02 0.00 -0.57 0.00 0.00 43.02 40.84 2re9 s PHE 67 CO 0.00 0.49 0.26 -1.17 -0.10 0.00 0.00 175.22 174.70 2re9 s LEU 68 N -1.97 4.89 -0.23 -0.37 2.96 0.04 -0.45 118.68 123.55 2re9 s LEU 68 Ca 0.24 -0.88 -0.22 0.00 -0.22 0.00 0.00 54.13 53.05 2re9 s LEU 68 Cb -0.12 -2.11 -0.02 0.00 0.50 0.00 0.00 46.19 44.45 2re9 s LEU 68 CO 0.15 -0.40 0.69 -0.22 -1.32 0.00 0.00 176.35 175.25 2re9 s LEU 69 N 1.64 4.10 -0.21 -0.68 2.96 0.11 -1.26 118.68 125.34 2re9 s LEU 69 Ca 0.04 0.85 -0.29 0.00 -0.22 0.00 0.00 54.13 54.51 2re9 s LEU 69 Cb -0.19 -2.96 -0.00 0.00 0.50 0.00 0.00 46.19 43.53 2re9 s LEU 69 CO 0.09 -0.38 1.21 -0.63 -1.32 0.00 0.00 176.35 175.32 2re9 s ILE 70 N 2.38 4.37 -1.07 6.68 -1.09 -0.08 -3.17 121.20 129.23 2re9 s ILE 70 Ca 0.30 1.63 0.26 0.00 -2.23 0.00 0.00 60.65 60.61 2re9 s ILE 70 Cb -0.16 -4.12 0.07 0.00 -1.58 0.00 0.00 42.46 36.67 2re9 s ILE 70 CO 0.09 -0.22 1.51 -0.81 -1.23 0.00 0.00 174.94 174.28 2re9 n PRO 71 N 6.66 0.07 -3.70 2.79 -0.04 -1.26 -0.08 135.00 139.44 2re9 n PRO 71 Ca 0.13 -0.04 -0.11 0.00 -0.04 0.00 0.00 63.50 63.45 2re9 n PRO 71 Cb 0.45 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.30 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 -2.95 0.36 0.39 0.54 2.12 -1.26 -4.84 118.70 113.06 2re9 s GLU 72 Ca 0.13 0.74 -0.27 0.00 0.36 0.00 0.00 54.97 55.93 2re9 s GLU 72 Cb 0.18 -0.03 -0.09 0.00 0.26 0.00 0.00 34.13 34.44 2re9 s GLU 72 CO 0.66 -0.16 1.33 -1.12 -0.54 0.00 0.00 175.26 175.43 2re9 s SER 73 N 1.34 6.37 0.00 -1.70 0.01 -1.26 -4.37 113.70 114.09 2re9 s SER 73 Ca -0.09 2.72 0.00 0.00 1.31 0.00 0.00 55.95 59.89 2re9 s SER 73 Cb -0.09 -2.64 0.00 0.00 0.21 0.00 0.00 66.02 63.50 2re9 s SER 73 CO -0.12 -0.82 0.00 0.61 0.41 0.00 0.00 173.24 173.33 2re9 n GLY 74 N 0.67 -1.41 3.69 3.44 0.00 0.12 -4.91 105.19 106.79 2re9 n GLY 74 Ca 0.03 -1.19 -0.36 0.00 0.00 0.00 0.00 46.02 44.50 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 -3.90 6.17 0.06 1.61 1.01 -1.26 0.42 116.67 120.78 2re9 s ASP 75 Ca 0.00 0.18 0.10 0.00 0.71 0.00 0.00 52.55 53.54 2re9 s ASP 75 Cb 0.00 -2.11 -0.03 0.00 1.01 0.00 0.00 42.92 41.79 2re9 s ASP 75 CO 0.00 0.11 -0.26 -0.31 0.21 0.00 0.00 175.17 174.92 2re9 s TYR 76 N 0.77 2.28 -0.21 4.23 1.51 0.38 -0.74 117.35 125.57 2re9 s TYR 76 Ca 0.08 -0.40 -0.11 0.00 -1.01 0.00 0.00 57.07 55.63 2re9 s TYR 76 Cb -0.13 -1.33 -0.05 0.00 -0.11 0.00 0.00 41.96 40.34 2re9 s TYR 76 CO 0.02 0.17 0.19 0.12 -1.11 0.00 0.00 175.55 174.94 2re9 s PHE 77 N -0.86 3.37 -0.00 2.71 2.19 -0.72 -0.49 117.98 124.17 2re9 s PHE 77 Ca 0.12 0.35 0.07 0.00 0.33 0.00 0.00 56.93 57.79 2re9 s PHE 77 Cb -0.10 -2.27 -0.02 0.00 -1.31 0.00 0.00 43.02 39.33 2re9 s PHE 77 CO 0.03 0.16 -0.20 0.96 1.83 0.00 0.00 175.22 177.99 2re9 s ILE 78 N 0.77 1.62 0.11 3.12 -4.36 0.61 -1.95 121.20 121.12 2re9 s ILE 78 Ca 0.10 -0.94 -0.05 0.00 -0.26 0.00 0.00 60.65 59.49 2re9 s ILE 78 Cb -0.13 -1.36 -0.02 0.00 1.25 0.00 0.00 42.46 42.20 2re9 s ILE 78 CO 0.02 0.40 0.14 -0.72 0.24 0.00 0.00 174.94 175.03 2re9 s TYR 79 N -0.55 0.45 -0.19 1.37 -0.85 -0.22 -1.39 117.35 115.97 2re9 s TYR 79 Ca 0.08 -0.88 -0.28 0.00 -0.52 0.00 0.00 57.07 55.47 2re9 s TYR 79 Cb -0.08 -0.22 0.11 0.00 0.38 0.00 0.00 41.96 42.15 2re9 s TYR 79 CO -0.00 -0.55 0.95 0.45 -1.52 0.00 0.00 175.55 174.88 2re9 s SER 80 N -2.94 -0.46 -0.04 -0.18 0.15 0.27 -0.74 113.70 109.76 2re9 s SER 80 Ca 0.13 0.67 0.03 0.00 0.70 0.00 0.00 55.95 57.47 2re9 s SER 80 Cb 0.06 0.60 0.01 0.00 -1.71 0.00 0.00 66.02 64.97 2re9 s SER 80 CO -0.05 -0.31 -0.11 -1.58 1.20 0.00 0.00 173.24 172.40 2re9 s GLN 81 N -0.57 1.25 -0.12 5.44 0.74 -0.34 -0.61 119.66 125.44 2re9 s GLN 81 Ca -0.01 -0.36 -0.00 0.00 0.05 0.00 0.00 55.36 55.04 2re9 s GLN 81 Cb -0.02 -1.11 0.03 0.00 1.10 0.00 0.00 33.01 33.00 2re9 s GLN 81 CO -0.00 0.10 -0.09 0.08 -0.55 0.00 0.00 175.29 174.83 2re9 s VAL 82 N 0.35 1.13 -0.18 1.34 1.01 -0.76 -0.92 120.40 122.38 2re9 s VAL 82 Ca -0.07 -0.37 -0.19 0.00 0.00 0.00 0.00 61.98 61.35 2re9 s VAL 82 Cb -0.11 -1.14 -0.03 0.00 0.00 0.00 0.00 36.38 35.09 2re9 s VAL 82 CO 0.01 0.37 0.54 -0.89 0.00 0.00 0.00 175.10 175.13 2re9 s THR 83 N 1.66 5.10 0.23 3.92 2.01 -1.23 -1.59 115.64 125.75 2re9 s THR 83 Ca 0.05 1.01 0.07 0.00 0.31 0.00 0.00 61.69 63.13 2re9 s THR 83 Cb -0.13 -3.86 -0.04 0.00 0.01 0.00 0.00 72.50 68.48 2re9 s THR 83 CO -0.09 0.19 0.16 -0.36 -0.69 0.00 0.00 174.62 173.84 2re9 s PHE 84 N 1.51 3.09 -0.00 4.92 0.40 0.60 -0.73 117.98 127.77 2re9 s PHE 84 Ca 0.26 -0.10 -0.28 0.00 -0.60 0.00 0.00 56.93 56.21 2re9 s PHE 84 Cb -0.16 -1.41 0.08 0.00 0.51 0.00 0.00 43.02 42.05 2re9 s PHE 84 CO 0.10 0.53 0.74 -0.98 0.70 0.00 0.00 175.22 176.31 2re9 s ARG 85 N -3.63 1.01 -0.04 0.44 1.70 0.30 -0.77 118.95 117.97 2re9 s ARG 85 Ca 0.32 -0.05 -0.29 0.00 -0.47 0.00 0.00 55.73 55.23 2re9 s ARG 85 Cb -0.08 0.47 0.10 0.00 -0.57 0.00 0.00 34.95 34.87 2re9 s ARG 85 CO 0.24 -0.38 1.32 0.20 -1.08 0.00 0.00 175.30 175.60 2re9 s GLY 86 N -1.82 -0.18 -0.14 3.88 0.00 -0.29 -4.60 107.32 104.18 2re9 s GLY 86 Ca -0.04 0.13 -0.15 0.00 0.00 0.00 0.00 44.72 44.66 2re9 s GLY 86 CO -0.01 5.67 0.34 1.06 0.00 0.00 0.00 173.10 180.16 2re9 s MET 87 N -2.03 4.26 0.36 2.90 -1.94 -1.26 -1.09 119.30 120.49 2re9 s MET 87 Ca 0.29 0.19 -0.26 0.00 -1.71 0.00 0.00 55.69 54.21 2re9 s MET 87 Cb 0.00 -3.42 -0.12 0.00 2.01 0.00 0.00 34.83 33.30 2re9 s MET 87 CO -0.02 0.24 1.02 2.41 -0.01 0.00 0.00 175.02 178.67 2re9 n THR 88 N 3.52 2.19 -1.33 2.05 -1.04 -0.53 -4.92 114.28 114.21 2re9 n THR 88 Ca -0.11 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.40 2re9 n THR 88 Cb 0.52 -1.12 0.00 0.00 -1.82 0.00 0.00 70.33 67.91 2re9 n THR 88 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2re9 n SER 89 N 0.84 0.00 -0.21 8.00 3.41 -1.26 -4.98 113.62 119.42 2re9 n SER 89 Ca 0.09 -0.06 0.14 0.00 -0.26 0.00 0.00 58.87 58.78 2re9 n SER 89 Cb 0.36 0.00 0.53 0.00 -0.26 0.00 0.00 64.21 64.84 2re9 n SER 89 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2re9 n GLU 90 N -0.06 0.90 -0.24 4.33 4.71 -1.26 -4.29 120.64 124.73 2re9 n GLU 90 Ca 0.00 -0.42 0.03 0.00 -0.01 0.00 0.00 57.16 56.76 2re9 n GLU 90 Cb 0.00 -1.49 0.12 0.00 -1.01 0.00 0.00 31.44 29.06 2re9 n GLU 90 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2re9 h SER 92 N 0.07 0.00 -1.35 0.00 4.64 -1.75 -3.31 113.55 111.85 2re9 h SER 92 Ca 0.37 0.00 -0.69 0.00 -0.47 0.00 0.00 61.79 61.00 2re9 h SER 92 Cb 0.62 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 62.60 2re9 h SER 92 CO -0.66 0.00 1.80 -1.61 -0.87 0.00 0.00 176.83 175.49 2re9 s GLU 93 N -5.02 3.95 0.44 4.77 2.02 0.11 -4.99 118.70 119.98 2re9 s GLU 93 Ca -0.05 -2.05 -0.23 0.00 0.02 0.00 0.00 54.97 52.66 2re9 s GLU 93 Cb 0.19 -5.35 -0.11 0.00 0.10 0.00 0.00 34.13 28.97 2re9 s GLU 93 CO 0.72 -2.09 0.81 0.44 0.02 0.00 0.00 175.26 175.16 2re9 n ILE 94 N 5.90 2.30 -1.43 -1.63 -5.35 -1.25 -4.85 119.36 113.06 2re9 n ILE 94 Ca 0.42 -0.50 -0.40 0.00 -0.27 0.00 0.00 62.75 62.00 2re9 n ILE 94 Cb 0.46 -0.89 0.02 0.00 -1.74 0.00 0.00 39.64 37.48 2re9 n ILE 94 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2re9 n ARG 95 N 0.20 0.46 0.00 6.28 1.74 -0.04 -4.76 116.66 120.53 2re9 n ARG 95 Ca 0.11 0.17 0.04 0.00 -0.77 0.00 0.00 57.85 57.40 2re9 n ARG 95 Cb 0.40 -1.49 0.25 0.00 -1.02 0.00 0.00 32.46 30.60 2re9 n ARG 95 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2re9 n GLN 96 N 0.53 0.44 -0.80 5.56 6.02 -1.26 -1.98 117.38 125.88 2re9 n GLN 96 Ca 0.11 0.00 0.03 0.00 -0.01 0.00 0.00 57.00 57.13 2re9 n GLN 96 Cb 0.43 -1.30 0.33 0.00 1.02 0.00 0.00 30.24 30.72 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 -0.80 3.85 -1.73 -1.58 0.00 -1.26 -4.91 120.51 114.07 2re9 n ALA 97 Ca 0.06 -2.22 -0.18 0.00 0.00 0.00 0.00 53.44 51.10 2re9 n ALA 97 Cb 0.03 -1.02 -0.06 0.00 0.00 0.00 0.00 19.45 18.40 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 -0.02 1.22 3.23 0.00 0.00 -0.84 -4.98 105.19 103.80 2re9 n GLY 98 Ca 0.30 -0.15 -0.30 0.00 0.00 0.00 0.00 46.02 45.87 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 -3.87 2.33 0.60 1.61 3.00 -1.24 -4.99 118.95 116.38 2re9 s ARG 99 Ca 0.00 -0.83 -0.17 0.00 0.00 0.00 0.00 55.73 54.74 2re9 s ARG 99 Cb 0.00 -1.99 -0.03 0.00 0.00 0.00 0.00 34.95 32.92 2re9 s ARG 99 CO 0.00 0.35 1.10 -1.25 0.00 0.00 0.00 175.30 175.49 2re9 s PRO 100 N -0.12 3.16 0.22 3.54 0.04 -1.26 -0.86 135.00 139.71 2re9 s PRO 100 Ca -0.03 1.40 -0.04 0.00 0.04 0.00 0.00 61.00 62.37 2re9 s PRO 100 Cb -0.13 -2.00 -0.05 0.00 0.04 0.00 0.00 34.50 32.36 2re9 s PRO 100 CO 0.03 -0.97 0.45 -0.80 0.04 0.00 0.00 177.00 175.75 2re9 s ASN 101 N -2.36 6.45 0.28 6.66 0.01 -1.26 -4.82 114.94 119.89 2re9 s ASN 101 Ca 0.68 0.58 -0.30 0.00 -0.71 0.00 0.00 52.86 53.11 2re9 s ASN 101 Cb -0.20 -2.08 -0.10 0.00 0.41 0.00 0.00 41.25 39.27 2re9 s ASN 101 CO 0.35 -0.07 1.41 -0.75 -1.51 0.00 0.00 177.10 176.52 2re9 s LYS 102 N -3.20 4.28 0.78 -0.60 2.36 -1.26 -4.98 119.74 117.13 2re9 s LYS 102 Ca 0.41 2.29 -0.11 0.00 -2.55 0.00 0.00 55.97 56.01 2re9 s LYS 102 Cb -0.11 -3.09 0.06 0.00 -1.05 0.00 0.00 37.83 33.64 2re9 s LYS 102 CO 0.28 -0.37 1.09 -1.25 1.55 0.00 0.00 175.35 176.65 2re9 s PRO 103 N -0.83 2.19 0.75 4.03 0.04 -1.26 -4.94 135.00 134.98 2re9 s PRO 103 Ca 0.56 0.76 -0.03 0.00 0.04 0.00 0.00 61.00 62.33 2re9 s PRO 103 Cb -0.41 -1.92 0.13 0.00 0.04 0.00 0.00 34.50 32.34 2re9 s PRO 103 CO 0.47 -1.58 1.04 -0.51 0.04 0.00 0.00 177.00 176.46 2re9 s ASP 104 N -3.80 4.22 0.04 6.66 -0.00 -0.57 -4.85 116.67 118.36 2re9 s ASP 104 Ca 0.60 -0.21 -0.24 0.00 -0.00 0.00 0.00 52.55 52.70 2re9 s ASP 104 Cb -0.15 -0.15 0.06 0.00 -0.00 0.00 0.00 42.92 42.68 2re9 s ASP 104 CO 0.55 -1.95 0.55 -0.94 -0.00 0.00 0.00 175.17 173.38 2re9 s SER 105 N -4.74 -0.49 0.00 0.27 1.04 -1.26 0.35 113.70 108.87 2re9 s SER 105 Ca 0.67 0.26 0.08 0.00 0.48 0.00 0.00 55.95 57.43 2re9 s SER 105 Cb -0.06 0.51 -0.02 0.00 0.10 0.00 0.00 66.02 66.55 2re9 s SER 105 CO 0.45 -0.72 -0.24 0.27 0.98 0.00 0.00 173.24 173.99 2re9 s ILE 106 N -2.31 1.92 -0.01 -1.02 -4.36 -0.61 -4.93 121.20 109.88 2re9 s ILE 106 Ca -0.06 -1.12 -0.03 0.00 -0.26 0.00 0.00 60.65 59.19 2re9 s ILE 106 Cb -0.01 -1.61 0.00 0.00 1.25 0.00 0.00 42.46 42.09 2re9 s ILE 106 CO -0.00 0.47 0.06 -0.89 0.24 0.00 0.00 174.94 174.81 2re9 s THR 107 N -0.64 0.03 -0.05 8.37 2.01 -1.26 -1.27 115.64 122.84 2re9 s THR 107 Ca 0.10 -0.27 0.04 0.00 0.31 0.00 0.00 61.69 61.87 2re9 s THR 107 Cb -0.09 -0.18 -0.00 0.00 0.01 0.00 0.00 72.50 72.23 2re9 s THR 107 CO -0.00 -0.15 -0.17 -0.69 -0.69 0.00 0.00 174.62 172.92 2re9 s VAL 108 N -0.44 1.42 -0.02 3.82 1.01 -0.14 -1.59 120.40 124.46 2re9 s VAL 108 Ca -0.05 -0.71 0.01 0.00 0.00 0.00 0.00 61.98 61.24 2re9 s VAL 108 Cb -0.03 -1.22 0.01 0.00 0.00 0.00 0.00 36.38 35.13 2re9 s VAL 108 CO 0.00 0.41 -0.04 -0.69 0.00 0.00 0.00 175.10 174.78 2re9 s VAL 109 N 0.08 0.38 -0.23 2.92 1.01 0.47 -0.86 120.40 124.17 2re9 s VAL 109 Ca -0.05 -0.12 -0.07 0.00 0.00 0.00 0.00 61.98 61.74 2re9 s VAL 109 Cb -0.12 -0.38 -0.03 0.00 0.00 0.00 0.00 36.38 35.85 2re9 s VAL 109 CO 0.02 0.15 0.06 -0.63 0.00 0.00 0.00 175.10 174.71 2re9 s ILE 110 N 0.40 4.39 0.06 2.22 1.01 -0.02 0.27 121.20 129.54 2re9 s ILE 110 Ca -0.04 -0.15 0.07 0.00 0.00 0.00 0.00 60.65 60.53 2re9 s ILE 110 Cb -0.08 -3.03 -0.03 0.00 0.01 0.00 0.00 42.46 39.32 2re9 s ILE 110 CO -0.00 0.37 -0.17 -0.89 0.00 0.00 0.00 174.94 174.24 2re9 s THR 111 N 1.32 2.87 -0.09 2.92 2.01 0.21 -1.15 115.64 123.72 2re9 s THR 111 Ca 0.05 -1.26 0.01 0.00 0.31 0.00 0.00 61.69 60.80 2re9 s THR 111 Cb -0.15 -2.24 -0.02 0.00 0.01 0.00 0.00 72.50 70.10 2re9 s THR 111 CO 0.03 0.27 -0.12 -0.75 -0.69 0.00 0.00 174.62 173.36 2re9 s LYS 112 N -1.66 3.00 -0.10 4.92 2.20 0.06 -1.22 119.74 126.94 2re9 s LYS 112 Ca 0.16 -0.67 0.03 0.00 -0.36 0.00 0.00 55.97 55.14 2re9 s LYS 112 Cb -0.11 -2.54 0.00 0.00 -1.51 0.00 0.00 37.83 33.67 2re9 s LYS 112 CO 0.07 0.42 -0.22 0.08 -0.36 0.00 0.00 175.35 175.34 2re9 s VAL 113 N -0.18 1.91 0.28 4.02 1.01 0.11 -0.78 120.40 126.77 2re9 s VAL 113 Ca 0.00 -0.92 0.11 0.00 0.00 0.00 0.00 61.98 61.17 2re9 s VAL 113 Cb -0.13 -1.67 -0.05 0.00 0.00 0.00 0.00 36.38 34.53 2re9 s VAL 113 CO 0.03 0.53 -0.14 -0.89 0.00 0.00 0.00 175.10 174.62 2re9 s THR 114 N 0.48 2.68 -0.14 3.92 2.01 -1.26 -0.66 115.64 122.67 2re9 s THR 114 Ca -0.16 -2.27 0.20 0.00 0.31 0.00 0.00 61.69 59.76 2re9 s THR 114 Cb -0.17 -2.46 0.18 0.00 0.01 0.00 0.00 72.50 70.06 2re9 s THR 114 CO 0.06 -0.37 1.60 -0.78 -0.69 0.00 0.00 174.62 174.43 2re9 h ASP 115 N 2.15 0.00 0.00 3.53 3.58 -1.97 -3.38 116.42 120.33 2re9 h ASP 115 Ca -0.41 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.04 2re9 h ASP 115 Cb 1.26 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.31 2re9 h ASP 115 CO 0.61 0.30 0.00 -1.20 -2.88 0.00 0.00 179.24 176.07 2re9 n SER 116 N -3.24 0.00 -4.75 2.28 7.64 -1.26 -4.85 113.62 109.43 2re9 n SER 116 Ca 0.02 0.10 -0.39 0.00 1.01 0.00 0.00 58.87 59.62 2re9 n SER 116 Cb 0.60 0.00 0.03 0.00 -1.01 0.00 0.00 64.21 63.83 2re9 n SER 116 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 2re9 s TYR 117 N -0.21 2.34 -0.09 1.43 5.04 -1.26 -4.97 117.35 119.63 2re9 s TYR 117 Ca 0.00 1.35 -0.27 0.00 -2.44 0.00 0.00 57.07 55.71 2re9 s TYR 117 Cb 0.00 -3.82 -0.25 0.00 0.35 0.00 0.00 41.96 38.23 2re9 s TYR 117 CO 0.00 -2.88 0.91 -1.00 -1.34 0.00 0.00 175.55 171.24 2re9 h PRO 118 N 1.70 0.08 -6.79 4.97 0.13 -1.89 -3.40 132.00 126.81 2re9 h PRO 118 Ca -0.51 -0.11 -0.48 0.00 -0.87 0.00 0.00 66.00 64.03 2re9 h PRO 118 Cb 1.29 0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.43 2re9 h PRO 118 CO 0.58 0.95 0.23 -1.21 -0.23 0.00 0.00 178.00 178.32 2re9 s GLU 119 N -2.73 4.32 0.63 0.86 2.02 -1.26 -4.95 118.70 117.60 2re9 s GLU 119 Ca -0.17 1.04 -0.15 0.00 0.02 0.00 0.00 54.97 55.71 2re9 s GLU 119 Cb -0.01 -2.66 -0.01 0.00 0.10 0.00 0.00 34.13 31.55 2re9 s GLU 119 CO 0.72 0.24 1.09 -1.25 0.02 0.00 0.00 175.26 176.08 2re9 s PRO 120 N -2.37 3.02 -0.17 0.39 0.04 -1.26 -4.82 135.00 129.82 2re9 s PRO 120 Ca 0.50 1.29 -0.03 0.00 0.04 0.00 0.00 61.00 62.80 2re9 s PRO 120 Cb -0.15 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.38 2re9 s PRO 120 CO 0.20 -1.06 -0.05 0.99 0.04 0.00 0.00 177.00 177.12 2re9 s THR 121 N -2.42 3.63 -0.31 1.26 2.01 0.04 -4.94 115.64 114.90 2re9 s THR 121 Ca 0.65 -0.44 -0.26 0.00 0.31 0.00 0.00 61.69 61.95 2re9 s THR 121 Cb -0.18 -2.60 0.01 0.00 0.01 0.00 0.00 72.50 69.73 2re9 s THR 121 CO 0.40 0.47 0.92 -1.10 -0.69 0.00 0.00 174.62 174.63 2re9 s GLN 122 N 0.71 4.01 -0.10 4.92 -0.21 -1.26 -0.76 119.66 126.96 2re9 s GLN 122 Ca -0.02 0.81 -0.09 0.00 0.02 0.00 0.00 55.36 56.07 2re9 s GLN 122 Cb -0.15 -3.73 -0.27 0.00 1.00 0.00 0.00 33.01 29.86 2re9 s GLN 122 CO 0.02 -0.78 0.45 -0.07 -2.12 0.00 0.00 175.29 172.80 2re9 h LEU 123 N 9.74 0.45 -7.70 2.90 3.38 -1.50 -3.48 115.31 119.10 2re9 h LEU 123 Ca -0.22 -0.92 -0.21 0.00 0.09 0.00 0.00 57.88 56.61 2re9 h LEU 123 Cb 1.08 -0.15 -0.27 0.00 0.09 0.00 0.00 40.66 41.42 2re9 h LEU 123 CO 0.95 1.81 -0.64 -0.76 0.09 0.00 0.00 178.44 179.89 2re9 s LEU 124 N -7.20 1.79 -0.08 1.67 1.02 -1.15 -5.00 118.68 109.74 2re9 s LEU 124 Ca -0.21 0.06 -0.03 0.00 0.02 0.00 0.00 54.13 53.96 2re9 s LEU 124 Cb 0.06 0.23 0.04 0.00 0.02 0.00 0.00 46.19 46.54 2re9 s LEU 124 CO 0.78 -0.06 0.17 -0.32 0.02 0.00 0.00 176.35 176.94 2re9 s MET 125 N -0.16 0.10 -0.22 1.70 -2.45 -1.26 -0.84 119.30 116.17 2re9 s MET 125 Ca -0.02 0.46 0.02 0.00 -1.25 0.00 0.00 55.69 54.90 2re9 s MET 125 Cb -0.02 -0.18 0.04 0.00 1.25 0.00 0.00 34.83 35.92 2re9 s MET 125 CO 0.00 -0.20 -0.15 0.20 1.05 0.00 0.00 175.02 175.92 2re9 s GLY 126 N 1.49 1.53 -0.03 2.11 0.00 -0.04 -4.99 107.32 107.38 2re9 s GLY 126 Ca -0.06 -1.49 0.04 0.00 0.00 0.00 0.00 44.72 43.21 2re9 s GLY 126 CO -0.07 0.45 -0.14 -1.08 0.00 0.00 0.00 173.10 172.26 2re9 s THR 127 N 1.20 1.21 -0.01 0.90 -1.32 -1.26 -0.97 115.64 115.39 2re9 s THR 127 Ca -0.02 -0.60 0.02 0.00 -1.21 0.00 0.00 61.69 59.88 2re9 s THR 127 Cb -0.16 -1.04 -0.00 0.00 -1.51 0.00 0.00 72.50 69.78 2re9 s THR 127 CO -0.09 0.35 -0.05 -0.75 -2.21 0.00 0.00 174.62 171.88 2re9 s LYS 128 N 0.06 0.46 0.31 7.08 2.20 -0.40 -5.02 119.74 124.43 2re9 s LYS 128 Ca -0.03 -0.18 -0.25 0.00 -0.36 0.00 0.00 55.97 55.16 2re9 s LYS 128 Cb -0.10 -0.45 -0.10 0.00 -1.51 0.00 0.00 37.83 35.67 2re9 s LYS 128 CO 0.01 0.09 0.91 -1.54 -0.36 0.00 0.00 175.35 174.47 2re9 s SER 129 N -0.02 7.27 -0.14 1.43 1.04 -1.26 -1.57 113.70 120.45 2re9 s SER 129 Ca 0.01 1.76 0.00 0.00 0.48 0.00 0.00 55.95 58.20 2re9 s SER 129 Cb -0.03 -2.55 0.02 0.00 0.10 0.00 0.00 66.02 63.56 2re9 s SER 129 CO -0.00 -0.07 -0.13 -0.69 0.98 0.00 0.00 173.24 173.33 2re9 s VAL 130 N -1.64 1.44 -0.46 5.02 1.01 0.15 -4.91 120.40 121.02 2re9 s VAL 130 Ca 0.50 -0.55 0.07 0.00 0.00 0.00 0.00 61.98 61.99 2re9 s VAL 130 Cb -0.18 -1.37 0.29 0.00 0.00 0.00 0.00 36.38 35.12 2re9 s VAL 130 CO 0.23 0.44 0.95 0.00 0.00 0.00 0.00 175.10 176.71 2re9 s GLU 132 N 0.09 3.73 -0.11 0.00 8.01 -1.26 -4.67 118.70 124.49 2re9 s GLU 132 Ca 0.29 0.79 0.14 0.00 0.01 0.00 0.00 54.97 56.19 2re9 s GLU 132 Cb 0.26 -2.13 -0.20 0.00 -4.31 0.00 0.00 34.13 27.76 2re9 s GLU 132 CO -0.14 -0.42 0.14 1.33 0.01 0.00 0.00 175.26 176.18 2re9 n VAL 133 N -2.25 0.69 -0.52 2.63 0.24 -1.26 -4.09 118.33 113.77 2re9 n VAL 133 Ca 0.06 -0.53 -0.29 0.00 -2.04 0.00 0.00 64.34 61.53 2re9 n VAL 133 Cb 0.54 -0.39 0.27 0.00 -1.47 0.00 0.00 33.84 32.79 2re9 n VAL 133 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2re9 s GLY 134 N -4.48 1.48 0.18 7.63 0.00 -1.26 -4.93 107.32 105.95 2re9 s GLY 134 Ca -0.07 -0.51 -0.09 0.00 0.00 0.00 0.00 44.72 44.04 2re9 s GLY 134 CO 0.61 0.35 1.64 1.48 0.00 0.00 0.00 173.10 177.18 2re9 h SER 135 N -2.99 1.04 -5.55 1.64 4.64 -1.96 -3.41 113.55 106.96 2re9 h SER 135 Ca -0.53 -0.30 -0.22 0.00 -0.47 0.00 0.00 61.79 60.27 2re9 h SER 135 Cb 1.34 -0.28 -0.14 0.00 -0.31 0.00 0.00 62.40 63.01 2re9 h SER 135 CO 0.40 1.08 -0.55 0.54 -0.87 0.00 0.00 176.83 177.43 2re9 s ASN 136 N -6.54 0.15 0.09 4.97 4.22 -1.26 -1.46 114.94 115.12 2re9 s ASN 136 Ca -0.12 -1.34 -0.12 0.00 -2.14 0.00 0.00 52.86 49.14 2re9 s ASN 136 Cb 0.13 0.41 0.01 0.00 1.28 0.00 0.00 41.25 43.09 2re9 s ASN 136 CO 0.85 -0.88 0.27 -1.66 -2.04 0.00 0.00 177.10 173.64 2re9 s TRP 137 N -4.12 0.00 -0.23 1.54 1.48 -0.25 -4.79 118.94 112.57 2re9 s TRP 137 Ca 0.37 -0.35 -0.24 0.00 -1.06 0.00 0.00 56.10 54.83 2re9 s TRP 137 Cb 0.06 0.06 0.06 0.00 -1.16 0.00 0.00 33.47 32.49 2re9 s TRP 137 CO 0.12 -0.58 0.66 -0.59 -4.06 0.00 0.00 176.95 172.50 2re9 s PHE 138 N -3.58 -0.72 -0.13 1.66 -0.12 -1.26 -1.13 117.98 112.69 2re9 s PHE 138 Ca 0.02 1.71 -0.29 0.00 -0.05 0.00 0.00 56.93 58.32 2re9 s PHE 138 Cb 0.03 0.26 0.09 0.00 -0.63 0.00 0.00 43.02 42.77 2re9 s PHE 138 CO -0.10 -0.37 0.79 1.14 -0.05 0.00 0.00 175.22 176.63 2re9 s GLN 139 N 0.20 0.86 0.10 1.99 -2.07 0.06 -4.99 119.66 115.81 2re9 s GLN 139 Ca -0.01 0.39 -0.03 0.00 -1.82 0.00 0.00 55.36 53.89 2re9 s GLN 139 Cb -0.04 0.41 -0.05 0.00 -1.09 0.00 0.00 33.01 32.24 2re9 s GLN 139 CO 0.02 -0.23 0.30 -1.25 -1.32 0.00 0.00 175.29 172.81 2re9 s PRO 140 N -0.77 3.55 -0.20 9.60 0.04 -1.26 -0.29 135.00 145.67 2re9 s PRO 140 Ca -0.06 -0.21 0.01 0.00 0.04 0.00 0.00 61.00 60.78 2re9 s PRO 140 Cb -0.01 -2.95 0.04 0.00 0.04 0.00 0.00 34.50 31.62 2re9 s PRO 140 CO 0.05 0.54 -0.13 0.42 0.04 0.00 0.00 177.00 177.92 2re9 s ILE 141 N -1.56 1.81 -0.10 0.56 1.01 -0.62 -4.97 121.20 117.33 2re9 s ILE 141 Ca 0.37 -1.06 -0.01 0.00 0.00 0.00 0.00 60.65 59.95 2re9 s ILE 141 Cb -0.13 -1.81 -0.03 0.00 0.01 0.00 0.00 42.46 40.50 2re9 s ILE 141 CO 0.25 0.25 -0.05 -0.47 0.00 0.00 0.00 174.94 174.92 2re9 s TYR 142 N 1.33 3.00 0.00 3.97 5.04 -1.26 -1.82 117.35 127.61 2re9 s TYR 142 Ca -0.01 -0.08 0.02 0.00 -2.44 0.00 0.00 57.07 54.56 2re9 s TYR 142 Cb -0.16 -1.81 -0.01 0.00 0.35 0.00 0.00 41.96 40.33 2re9 s TYR 142 CO -0.09 0.21 -0.05 -0.51 -1.34 0.00 0.00 175.55 173.77 2re9 s LEU 143 N -0.38 2.04 -0.28 6.97 1.43 0.22 -5.00 118.68 123.68 2re9 s LEU 143 Ca 0.06 -0.15 -0.20 0.00 -1.03 0.00 0.00 54.13 52.81 2re9 s LEU 143 Cb -0.12 -0.24 0.09 0.00 0.03 0.00 0.00 46.19 45.96 2re9 s LEU 143 CO 0.02 0.02 0.80 -0.83 0.23 0.00 0.00 176.35 176.59 2re9 s GLY 144 N -0.32 -0.43 0.14 -3.19 0.00 -1.26 -0.57 107.32 101.70 2re9 s GLY 144 Ca 0.00 2.47 -0.25 0.00 0.00 0.00 0.00 44.72 46.94 2re9 s GLY 144 CO -0.00 2.16 1.02 0.00 0.00 0.00 0.00 173.10 176.28 2re9 s ALA 145 N 1.02 -1.70 -0.10 3.20 0.00 -0.48 -5.00 121.76 118.70 2re9 s ALA 145 Ca -0.05 0.06 -0.03 0.00 0.00 0.00 0.00 51.96 51.94 2re9 s ALA 145 Cb -0.05 0.64 -0.03 0.00 0.00 0.00 0.00 23.12 23.68 2re9 s ALA 145 CO -0.11 -1.05 0.04 1.41 0.00 0.00 0.00 175.76 176.05 2re9 s MET 146 N -2.90 3.11 0.01 0.00 -2.45 -1.26 -0.28 119.30 115.53 2re9 s MET 146 Ca 0.15 -0.33 -0.05 0.00 -1.25 0.00 0.00 55.69 54.21 2re9 s MET 146 Cb -0.01 -2.90 -0.01 0.00 1.25 0.00 0.00 34.83 33.16 2re9 s MET 146 CO 0.02 0.72 0.08 -0.06 1.05 0.00 0.00 175.02 176.83 2re9 s PHE 147 N -0.91 0.13 -0.19 4.11 0.08 0.35 -4.96 117.98 116.59 2re9 s PHE 147 Ca 0.14 -0.29 -0.22 0.00 0.12 0.00 0.00 56.93 56.67 2re9 s PHE 147 Cb -0.12 -0.10 -0.02 0.00 -0.57 0.00 0.00 43.02 42.21 2re9 s PHE 147 CO 0.03 -0.25 0.70 -1.12 -0.10 0.00 0.00 175.22 174.47 2re9 s SER 148 N -1.43 6.77 0.08 1.36 0.01 -1.26 -0.47 113.70 118.76 2re9 s SER 148 Ca -0.15 0.94 0.08 0.00 1.31 0.00 0.00 55.95 58.13 2re9 s SER 148 Cb -0.08 -2.38 -0.03 0.00 0.21 0.00 0.00 66.02 63.73 2re9 s SER 148 CO 0.01 -0.32 -0.21 -0.76 0.41 0.00 0.00 173.24 172.36 2re9 s LEU 149 N 2.03 2.26 0.05 2.44 1.43 0.17 -4.98 118.68 122.08 2re9 s LEU 149 Ca 0.32 -0.64 0.03 0.00 -1.03 0.00 0.00 54.13 52.81 2re9 s LEU 149 Cb -0.16 -0.95 -0.04 0.00 0.03 0.00 0.00 46.19 45.08 2re9 s LEU 149 CO 0.11 0.10 0.01 -1.10 0.23 0.00 0.00 176.35 175.70 2re9 s GLN 150 N -1.67 2.68 0.18 1.70 -0.21 -1.26 0.11 119.66 121.19 2re9 s GLN 150 Ca 0.07 -0.73 -0.33 0.00 0.02 0.00 0.00 55.36 54.40 2re9 s GLN 150 Cb -0.10 -2.61 -0.15 0.00 1.00 0.00 0.00 33.01 31.15 2re9 s GLN 150 CO 0.04 0.58 1.28 -1.91 -2.12 0.00 0.00 175.29 173.15 2re9 n GLU 151 N 0.91 1.45 0.00 2.91 2.13 -1.26 -0.93 120.64 125.84 2re9 n GLU 151 Ca -0.12 0.52 0.00 0.00 0.66 0.00 0.00 57.16 58.22 2re9 n GLU 151 Cb 0.52 -2.09 0.00 0.00 0.27 0.00 0.00 31.44 30.14 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 2.22 3.02 3.73 8.31 0.00 0.88 -4.93 105.19 118.42 2re9 n GLY 152 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 2re9 n GLY 152 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2re9 s ASP 153 N -0.25 4.49 -0.03 1.61 -0.00 -0.11 -4.71 116.67 117.67 2re9 s ASP 153 Ca 0.00 2.45 0.04 0.00 -0.00 0.00 0.00 52.55 55.04 2re9 s ASP 153 Cb 0.00 -2.60 -0.00 0.00 -0.00 0.00 0.00 42.92 40.32 2re9 s ASP 153 CO 0.00 -2.07 -0.14 -0.54 -0.00 0.00 0.00 175.17 172.42 2re9 s LYS 154 N -3.63 1.41 -0.06 8.23 1.02 0.16 -0.90 119.74 125.97 2re9 s LYS 154 Ca 0.78 -0.50 0.03 0.00 0.02 0.00 0.00 55.97 56.30 2re9 s LYS 154 Cb -0.32 -1.27 -0.02 0.00 -0.52 0.00 0.00 37.83 35.69 2re9 s LYS 154 CO 0.41 0.22 -0.14 -0.51 -0.92 0.00 0.00 175.35 174.42 2re9 s LEU 155 N 0.01 2.75 0.05 3.17 1.02 -0.39 0.09 118.68 125.38 2re9 s LEU 155 Ca -0.02 -0.21 -0.06 0.00 0.02 0.00 0.00 54.13 53.87 2re9 s LEU 155 Cb -0.09 -1.57 -0.01 0.00 0.02 0.00 0.00 46.19 44.54 2re9 s LEU 155 CO 0.01 0.32 0.11 0.00 0.02 0.00 0.00 176.35 176.81 2re9 s MET 156 N -0.56 0.65 -0.21 1.70 0.23 -0.36 -0.78 119.30 119.98 2re9 s MET 156 Ca 0.08 -0.84 -0.05 0.00 -1.03 0.00 0.00 55.69 53.86 2re9 s MET 156 Cb -0.11 0.26 -0.02 0.00 -1.53 0.00 0.00 34.83 33.42 2re9 s MET 156 CO 0.01 -0.17 -0.01 0.08 -2.03 0.00 0.00 175.02 172.90 2re9 s VAL 157 N -3.02 3.74 0.06 5.16 1.01 -1.26 -0.62 120.40 125.48 2re9 s VAL 157 Ca -0.02 -0.38 0.05 0.00 0.00 0.00 0.00 61.98 61.63 2re9 s VAL 157 Cb 0.01 -2.70 -0.04 0.00 0.00 0.00 0.00 36.38 33.66 2re9 s VAL 157 CO -0.06 0.42 -0.06 0.20 0.00 0.00 0.00 175.10 175.60 2re9 s ASN 158 N 1.19 4.67 0.11 3.32 0.01 0.14 -1.49 114.94 122.89 2re9 s ASN 158 Ca 0.03 -0.23 0.04 0.00 -0.71 0.00 0.00 52.86 51.99 2re9 s ASN 158 Cb -0.15 -1.04 -0.04 0.00 0.41 0.00 0.00 41.25 40.44 2re9 s ASN 158 CO 0.00 0.22 -0.11 0.68 -1.51 0.00 0.00 177.10 176.38 2re9 s VAL 159 N -1.16 1.05 0.21 1.60 -7.23 -0.78 -0.40 120.40 113.69 2re9 s VAL 159 Ca 0.21 -1.69 -0.05 0.00 -1.81 0.00 0.00 61.98 58.64 2re9 s VAL 159 Cb -0.11 -1.44 0.03 0.00 0.56 0.00 0.00 36.38 35.42 2re9 s VAL 159 CO 0.13 -0.54 1.62 0.77 -0.31 0.00 0.00 175.10 176.76 2re9 h SER 160 N 3.48 0.81 -2.34 4.85 4.64 -1.62 -3.20 113.55 120.17 2re9 h SER 160 Ca -0.38 -0.30 -0.28 0.00 -0.47 0.00 0.00 61.79 60.36 2re9 h SER 160 Cb 1.19 -0.22 -0.34 0.00 -0.31 0.00 0.00 62.40 62.72 2re9 h SER 160 CO 0.53 1.01 -0.59 -0.62 -0.87 0.00 0.00 176.83 176.29 2re9 s ASP 161 N -6.75 1.16 0.40 4.97 -1.08 -1.26 -4.85 116.67 109.26 2re9 s ASP 161 Ca -0.09 -0.18 0.06 0.00 -0.52 0.00 0.00 52.55 51.82 2re9 s ASP 161 Cb 0.13 0.56 0.81 0.00 -1.46 0.00 0.00 42.92 42.95 2re9 s ASP 161 CO 0.84 -0.33 2.03 0.40 0.52 0.00 0.00 175.17 178.63 2re9 h ILE 162 N 6.28 1.12 0.00 4.11 2.04 -1.94 -2.26 117.51 126.86 2re9 h ILE 162 Ca -0.17 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.40 2re9 h ILE 162 Cb 1.14 0.55 0.00 0.00 -0.74 0.00 0.00 36.82 37.78 2re9 h ILE 162 CO 0.29 0.13 0.00 -1.54 0.00 0.00 0.00 178.15 177.03 2re9 n SER 163 N -4.44 0.14 -0.83 1.72 3.41 -1.26 -1.90 113.62 110.46 2re9 n SER 163 Ca 0.03 0.54 0.12 0.00 -0.26 0.00 0.00 58.87 59.29 2re9 n SER 163 Cb 0.08 -0.57 0.07 0.00 -0.26 0.00 0.00 64.21 63.54 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 -1.66 2.72 -4.71 1.04 4.77 -0.85 -4.94 117.00 113.37 2re9 n LEU 164 Ca 0.03 -0.94 -0.41 0.00 -0.03 0.00 0.00 56.01 54.66 2re9 n LEU 164 Cb 0.17 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.22 2re9 n LEU 164 CO 0.14 0.46 0.61 -0.69 -1.33 0.00 0.00 177.39 176.59 2re9 s VAL 165 N -2.09 4.91 -0.41 4.08 1.01 -0.80 -0.54 120.40 126.56 2re9 s VAL 165 Ca 0.25 1.88 -0.28 0.00 0.00 0.00 0.00 61.98 63.82 2re9 s VAL 165 Cb 0.19 -4.24 0.02 0.00 0.00 0.00 0.00 36.38 32.36 2re9 s VAL 165 CO 0.37 0.16 1.08 -0.62 0.00 0.00 0.00 175.10 176.09 2re9 s ASP 166 N 0.97 6.73 0.00 3.32 -1.08 0.10 -4.85 116.67 121.86 2re9 s ASP 166 Ca 0.47 0.65 0.16 0.00 -0.52 0.00 0.00 52.55 53.32 2re9 s ASP 166 Cb -0.20 -2.53 0.31 0.00 -1.46 0.00 0.00 42.92 39.04 2re9 s ASP 166 CO 0.24 -1.07 1.22 0.00 0.52 0.00 0.00 175.17 176.08 2re9 n TYR 167 N 7.35 0.39 -0.04 -5.34 0.18 -1.26 -4.62 117.16 113.82 2re9 n TYR 167 Ca 0.11 -0.28 -0.10 0.00 1.88 0.00 0.00 57.90 59.51 2re9 n TYR 167 Cb 0.48 -0.01 -0.04 0.00 -0.38 0.00 0.00 39.34 39.39 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 3.10 1.06 -4.25 -3.48 2.02 -1.92 -3.40 112.91 106.04 2re9 h THR 168 Ca 0.00 -0.12 -0.57 0.00 0.77 0.00 0.00 66.41 66.49 2re9 h THR 168 Cb 0.77 0.82 -0.27 0.00 -1.74 0.00 0.00 68.15 67.73 2re9 h THR 168 CO 0.00 0.05 -0.84 -0.54 0.37 0.00 0.00 175.52 174.56 2re9 s LYS 169 N -6.11 1.43 0.23 6.66 -0.14 -1.26 -5.02 119.74 115.53 2re9 s LYS 169 Ca -0.13 -0.83 0.20 0.00 -1.36 0.00 0.00 55.97 53.85 2re9 s LYS 169 Cb 0.08 -1.47 0.94 0.00 -1.68 0.00 0.00 37.83 35.69 2re9 s LYS 169 CO 0.69 0.39 1.62 -0.85 -0.76 0.00 0.00 175.35 176.44 2re9 n GLU 170 N 2.15 0.14 0.00 1.68 0.28 -1.26 -2.29 120.64 121.35 2re9 n GLU 170 Ca -0.16 0.48 0.12 0.00 -0.16 0.00 0.00 57.16 57.43 2re9 n GLU 170 Cb 0.53 -1.84 0.09 0.00 1.43 0.00 0.00 31.44 31.65 2re9 n GLU 170 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 2re9 n ASP 171 N -2.12 2.13 -0.09 -1.84 3.85 -1.26 -4.38 116.55 112.83 2re9 n ASP 171 Ca 0.01 -1.56 -0.13 0.00 -0.71 0.00 0.00 54.79 52.40 2re9 n ASP 171 Cb 0.15 0.31 -0.14 0.00 -1.35 0.00 0.00 41.12 40.08 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 0.24 0.68 -3.82 0.11 5.02 -0.97 -4.91 118.16 114.50 2re9 n LYS 172 Ca 0.11 0.09 -0.25 0.00 -2.02 0.00 0.00 58.31 56.25 2re9 n LYS 172 Cb 0.48 -1.56 -0.17 0.00 -0.02 0.00 0.00 35.03 33.76 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 -2.52 0.64 0.28 -0.18 2.01 -1.23 -3.50 115.64 111.14 2re9 s THR 173 Ca -0.18 -0.06 -0.11 0.00 0.31 0.00 0.00 61.69 61.64 2re9 s THR 173 Cb 0.07 -0.75 0.00 0.00 0.01 0.00 0.00 72.50 71.83 2re9 s THR 173 CO 0.75 0.29 0.51 0.72 -0.69 0.00 0.00 174.62 176.20 2re9 s PHE 174 N 1.87 0.47 -0.22 4.92 -0.71 -0.09 -1.27 117.98 122.95 2re9 s PHE 174 Ca 0.05 -0.84 -0.13 0.00 -1.04 0.00 0.00 56.93 54.97 2re9 s PHE 174 Cb -0.13 0.21 0.07 0.00 -1.21 0.00 0.00 43.02 41.96 2re9 s PHE 174 CO -0.06 -1.08 0.54 0.12 -1.34 0.00 0.00 175.22 173.39 2re9 s PHE 175 N -3.66 -0.80 0.22 3.49 5.36 0.09 -1.20 117.98 121.48 2re9 s PHE 175 Ca 0.23 1.67 -0.11 0.00 -0.96 0.00 0.00 56.93 57.76 2re9 s PHE 175 Cb -0.01 0.42 -0.01 0.00 -0.34 0.00 0.00 43.02 43.08 2re9 s PHE 175 CO 0.12 -0.42 0.39 0.20 -1.46 0.00 0.00 175.22 174.05 2re9 s GLY 176 N 1.40 0.60 -0.13 13.12 0.00 0.08 0.12 107.32 122.50 2re9 s GLY 176 Ca -0.09 -0.94 -0.30 0.00 0.00 0.00 0.00 44.72 43.39 2re9 s GLY 176 CO -0.15 -0.75 0.80 0.00 0.00 0.00 0.00 173.10 173.00 2re9 s ALA 177 N -4.02 -1.83 -0.10 3.20 0.00 -0.41 -1.05 121.76 117.54 2re9 s ALA 177 Ca 0.22 1.53 -0.15 0.00 0.00 0.00 0.00 51.96 53.57 2re9 s ALA 177 Cb 0.01 -0.46 0.03 0.00 0.00 0.00 0.00 23.12 22.71 2re9 s ALA 177 CO 0.07 -0.34 0.38 -0.59 0.00 0.00 0.00 175.76 175.28 2re9 s PHE 178 N -0.86 -0.36 0.22 0.00 -0.71 -0.82 -1.28 117.98 114.16 2re9 s PHE 178 Ca -0.06 0.81 -0.30 0.00 -1.04 0.00 0.00 56.93 56.34 2re9 s PHE 178 Cb -0.01 0.14 -0.09 0.00 -1.21 0.00 0.00 43.02 41.86 2re9 s PHE 178 CO 0.05 -0.28 1.19 -1.17 -1.34 0.00 0.00 175.22 173.67 2re9 s LEU 179 N -0.33 4.47 0.00 -1.99 2.96 -0.71 -1.76 118.68 121.31 2re9 s LEU 179 Ca -0.05 2.28 0.29 0.00 -0.22 0.00 0.00 54.13 56.44 2re9 s LEU 179 Cb -0.03 -3.61 1.72 0.00 0.50 0.00 0.00 46.19 44.77 2re9 s LEU 179 CO 0.02 -0.35 2.06 0.18 -1.32 0.00 0.00 176.35 176.95