#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x8o n THR 3 N 1.20 0.00 -4.78 0.00 -2.24 -1.26 -5.00 114.28 102.20 1x8o n THR 3 Ca -0.13 -0.21 -0.33 0.00 -2.27 0.00 0.00 64.05 61.10 1x8o n THR 3 Cb 0.53 1.16 -0.13 0.00 -2.10 0.00 0.00 70.33 69.79 1x8o n THR 3 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1x8o s LYS 4 N -0.31 3.01 -0.84 -0.78 -0.14 -1.26 -5.04 119.74 114.38 1x8o s LYS 4 Ca 0.00 -0.67 -0.17 0.00 -1.36 0.00 0.00 55.97 53.78 1x8o s LYS 4 Cb 0.00 -2.55 0.16 0.00 -1.68 0.00 0.00 37.83 33.76 1x8o s LYS 4 CO 0.00 0.41 0.92 1.21 -0.76 0.00 0.00 175.35 177.13 1x8o s ASN 5 N -0.17 6.62 0.35 2.83 2.47 -1.26 -5.04 114.94 120.74 1x8o s ASN 5 Ca 0.00 -2.21 -0.28 0.00 0.42 0.00 0.00 52.86 50.79 1x8o s ASN 5 Cb -0.13 -2.31 -0.10 0.00 -1.45 0.00 0.00 41.25 37.26 1x8o s ASN 5 CO 0.03 -0.87 1.28 0.00 -3.72 0.00 0.00 177.10 173.82 1x8o s ALA 6 N 1.66 3.42 -0.18 1.71 0.00 -1.26 -4.99 121.76 122.13 1x8o s ALA 6 Ca 0.23 1.21 -0.14 0.00 0.00 0.00 0.00 51.96 53.27 1x8o s ALA 6 Cb -0.10 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.51 1x8o s ALA 6 CO -0.07 -0.64 0.30 0.42 0.00 0.00 0.00 175.76 175.78 1x8o s ILE 7 N -1.18 5.29 0.63 0.00 -1.09 -1.26 -5.01 121.20 118.57 1x8o s ILE 7 Ca 0.51 0.55 -0.15 0.00 -2.23 0.00 0.00 60.65 59.32 1x8o s ILE 7 Cb -0.38 -3.64 -0.01 0.00 -1.58 0.00 0.00 42.46 36.84 1x8o s ILE 7 CO 0.50 0.35 1.09 0.00 -1.23 0.00 0.00 174.94 175.66 1x8o s ALA 8 N 0.75 2.57 0.19 9.38 0.00 -1.26 -4.35 121.76 129.04 1x8o s ALA 8 Ca 0.16 0.50 -0.33 0.00 0.00 0.00 0.00 51.96 52.29 1x8o s ALA 8 Cb -0.13 -3.29 -0.14 0.00 0.00 0.00 0.00 23.12 19.56 1x8o s ALA 8 CO 0.05 -1.10 1.54 0.94 0.00 0.00 0.00 175.76 177.20 1x8o n GLN 9 N -2.25 2.18 -1.75 0.00 7.27 -0.14 -4.91 117.38 117.78 1x8o n GLN 9 Ca 0.10 0.78 -0.42 0.00 0.07 0.00 0.00 57.00 57.53 1x8o n GLN 9 Cb 0.52 -2.53 -0.03 0.00 2.41 0.00 0.00 30.24 30.61 1x8o n GLN 9 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 1x8o s THR 10 N 0.63 2.23 -0.95 1.69 2.01 -1.26 -2.33 115.64 117.67 1x8o s THR 10 Ca 0.75 0.08 0.00 0.00 0.31 0.00 0.00 61.69 62.84 1x8o s THR 10 Cb -0.65 -3.05 0.00 0.00 0.01 0.00 0.00 72.50 68.80 1x8o s THR 10 CO 0.41 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.95 1x8o n GLY 11 N 4.01 0.72 3.60 4.40 0.00 -1.26 -4.94 105.19 111.73 1x8o n GLY 11 Ca 0.16 -0.56 -0.49 0.00 0.00 0.00 0.00 46.02 45.13 1x8o n GLY 11 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1x8o n PHE 12 N -3.17 1.57 -3.31 1.61 7.35 -0.98 -4.92 117.46 115.61 1x8o n PHE 12 Ca -0.10 0.60 -0.47 0.00 -0.76 0.00 0.00 57.45 56.72 1x8o n PHE 12 Cb 0.41 -2.34 -0.03 0.00 0.35 0.00 0.00 39.48 37.87 1x8o n PHE 12 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 1x8o s ASN 13 N 0.21 6.59 0.15 -2.13 3.84 -1.26 -4.94 114.94 117.40 1x8o s ASN 13 Ca 0.75 -2.40 -0.14 0.00 0.21 0.00 0.00 52.86 51.28 1x8o s ASN 13 Cb -0.82 -2.22 0.03 0.00 -0.55 0.00 0.00 41.25 37.69 1x8o s ASN 13 CO 0.50 -0.68 1.72 0.50 -2.79 0.00 0.00 177.10 176.35 1x8o h LYS 14 N 8.15 0.71 -0.19 0.43 3.64 -2.00 -2.74 116.57 124.57 1x8o h LYS 14 Ca -0.01 -0.11 -0.06 0.00 -1.27 0.00 0.00 60.65 59.19 1x8o h LYS 14 Cb 1.06 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.74 1x8o h LYS 14 CO 0.85 0.61 -0.17 -0.44 -2.27 0.00 0.00 179.45 178.03 1x8o h ASP 15 N 0.64 0.30 -0.42 4.20 3.32 -1.92 0.14 116.42 122.68 1x8o h ASP 15 Ca 0.16 -0.08 -0.15 0.00 0.02 0.00 0.00 57.03 56.99 1x8o h ASP 15 Cb 0.15 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 1x8o h ASP 15 CO -0.02 0.50 -0.31 0.11 -1.72 0.00 0.00 179.24 177.79 1x8o h LYS 16 N 0.29 0.95 -0.08 3.56 1.57 -1.95 -3.16 116.57 117.76 1x8o h LYS 16 Ca 0.05 -0.47 -0.03 0.00 -1.87 0.00 0.00 60.65 58.34 1x8o h LYS 16 Cb 0.48 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.78 1x8o h LYS 16 CO 0.03 1.13 -0.07 -0.92 -0.57 0.00 0.00 179.45 179.05 1x8o h TYR 17 N 0.79 0.22 -1.23 -1.35 3.20 -1.18 -3.30 116.97 114.11 1x8o h TYR 17 Ca 0.08 -0.07 -0.73 0.00 3.14 0.00 0.00 58.73 61.15 1x8o h TYR 17 Cb 0.90 -0.05 -0.14 0.00 1.54 0.00 0.00 36.73 38.99 1x8o h TYR 17 CO 0.06 0.62 2.18 1.19 -1.64 0.00 0.00 178.16 180.57 1x8o n PHE 18 N -4.70 2.55 0.55 -3.82 3.72 0.01 -4.63 117.46 111.13 1x8o n PHE 18 Ca -0.07 -2.74 0.11 0.00 -0.05 0.00 0.00 57.45 54.70 1x8o n PHE 18 Cb 0.31 -1.75 0.16 0.00 -0.94 0.00 0.00 39.48 37.25 1x8o n PHE 18 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 1x8o n ASN 19 N 1.52 3.16 0.00 4.37 6.94 -1.12 -3.77 115.26 126.35 1x8o n ASN 19 Ca 0.61 -1.95 0.00 0.00 -0.02 0.00 0.00 54.58 53.21 1x8o n ASN 19 Cb 0.27 -0.14 0.00 0.00 -2.36 0.00 0.00 39.78 37.55 1x8o n ASN 19 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1x8o n GLY 20 N 1.34 0.75 3.99 4.83 0.00 0.45 -4.95 105.19 111.59 1x8o n GLY 20 Ca 0.16 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.95 1x8o n GLY 20 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1x8o s ASP 21 N -2.71 4.44 -0.02 1.61 2.15 -1.24 -4.68 116.67 116.21 1x8o s ASP 21 Ca 0.00 -0.33 -0.11 0.00 0.43 0.00 0.00 52.55 52.55 1x8o s ASP 21 Cb 0.00 -0.10 -0.05 0.00 -0.30 0.00 0.00 42.92 42.47 1x8o s ASP 21 CO 0.00 -1.79 0.31 -0.69 -0.17 0.00 0.00 175.17 172.82 1x8o s VAL 22 N -3.11 5.22 -0.08 1.11 1.01 -1.26 -2.60 120.40 120.70 1x8o s VAL 22 Ca 0.65 0.50 0.04 0.00 0.00 0.00 0.00 61.98 63.17 1x8o s VAL 22 Cb -0.06 -3.59 -0.01 0.00 0.00 0.00 0.00 36.38 32.72 1x8o s VAL 22 CO 0.44 0.52 -0.21 0.26 0.00 0.00 0.00 175.10 176.11 1x8o s TRP 23 N -1.14 2.57 -0.11 5.22 0.52 0.79 -4.63 118.94 122.16 1x8o s TRP 23 Ca 0.23 -0.71 -0.05 0.00 0.02 0.00 0.00 56.10 55.59 1x8o s TRP 23 Cb -0.14 -1.68 -0.04 0.00 -1.15 0.00 0.00 33.47 30.46 1x8o s TRP 23 CO 0.12 -0.21 0.06 0.71 0.02 0.00 0.00 176.95 177.64 1x8o s TYR 24 N -0.01 3.33 -0.27 -1.98 2.02 -0.23 -1.00 117.35 119.21 1x8o s TYR 24 Ca -0.07 0.29 -0.29 0.00 -0.37 0.00 0.00 57.07 56.64 1x8o s TYR 24 Cb -0.15 -1.89 0.01 0.00 -0.40 0.00 0.00 41.96 39.54 1x8o s TYR 24 CO 0.05 0.52 1.06 0.08 -1.57 0.00 0.00 175.55 175.69 1x8o s VAL 25 N -0.74 4.60 -0.13 0.71 1.01 -0.52 -1.13 120.40 124.20 1x8o s VAL 25 Ca 0.12 1.89 0.19 0.00 0.00 0.00 0.00 61.98 64.18 1x8o s VAL 25 Cb -0.12 -4.35 -0.25 0.00 0.00 0.00 0.00 36.38 31.67 1x8o s VAL 25 CO 0.03 -0.31 0.39 0.35 0.00 0.00 0.00 175.10 175.55 1x8o n THR 26 N 5.56 0.96 -3.68 3.92 -2.24 -0.20 -4.65 114.28 113.95 1x8o n THR 26 Ca 0.12 -0.72 -0.15 0.00 -2.27 0.00 0.00 64.05 61.04 1x8o n THR 26 Cb 0.46 -0.42 -0.08 0.00 -2.10 0.00 0.00 70.33 68.20 1x8o n THR 26 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1x8o s ASP 27 N -5.31 -0.40 0.08 3.42 1.11 -1.19 -0.98 116.67 113.39 1x8o s ASP 27 Ca -0.08 0.48 -0.07 0.00 0.18 0.00 0.00 52.55 53.06 1x8o s ASP 27 Cb 0.09 0.54 -0.01 0.00 1.07 0.00 0.00 42.92 44.61 1x8o s ASP 27 CO 0.85 -0.43 0.14 -0.72 1.18 0.00 0.00 175.17 176.18 1x8o s TYR 28 N -0.92 0.23 -0.13 4.23 1.13 0.04 -0.82 117.35 121.10 1x8o s TYR 28 Ca -0.10 -0.67 -0.05 0.00 -1.41 0.00 0.00 57.07 54.85 1x8o s TYR 28 Cb -0.03 -0.13 0.06 0.00 -1.10 0.00 0.00 41.96 40.76 1x8o s TYR 28 CO 0.05 -0.49 0.27 -1.17 -2.51 0.00 0.00 175.55 171.70 1x8o s LEU 29 N -2.80 -0.25 -0.21 -3.49 2.96 -0.26 -0.36 118.68 114.27 1x8o s LEU 29 Ca 0.04 0.61 -0.07 0.00 -0.22 0.00 0.00 54.13 54.49 1x8o s LEU 29 Cb 0.05 0.74 -0.04 0.00 0.50 0.00 0.00 46.19 47.45 1x8o s LEU 29 CO -0.10 -0.23 0.07 -0.62 -1.32 0.00 0.00 176.35 174.15 1x8o s ASP 30 N 2.31 5.46 0.61 3.68 3.68 -1.26 -0.63 116.67 130.51 1x8o s ASP 30 Ca -0.00 -0.02 0.39 0.00 2.13 0.00 0.00 52.55 55.04 1x8o s ASP 30 Cb -0.12 -1.95 1.87 0.00 -1.45 0.00 0.00 42.92 41.27 1x8o s ASP 30 CO -0.09 0.10 2.17 -0.07 0.13 0.00 0.00 175.17 177.41 1x8o h LEU 31 N 7.28 0.00 -7.52 -1.34 3.38 -1.43 -2.75 115.31 112.93 1x8o h LEU 31 Ca -0.37 0.00 -0.78 0.00 0.09 0.00 0.00 57.88 56.82 1x8o h LEU 31 Cb 1.17 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 41.63 1x8o h LEU 31 CO 0.65 0.00 0.33 -1.61 0.09 0.00 0.00 178.44 177.90 1x8o s GLU 32 N -3.89 4.00 0.56 1.13 2.02 -1.26 -4.97 118.70 116.28 1x8o s GLU 32 Ca -0.02 -3.23 0.24 0.00 0.02 0.00 0.00 54.97 51.99 1x8o s GLU 32 Cb 0.11 -4.43 1.58 0.00 0.10 0.00 0.00 34.13 31.49 1x8o s GLU 32 CO 0.48 -1.25 2.20 -1.00 0.02 0.00 0.00 175.26 175.71 1x8o h PRO 33 N 6.54 0.00 0.00 0.39 0.13 -1.88 -1.72 132.00 135.46 1x8o h PRO 33 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1x8o h PRO 33 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 1x8o h PRO 33 CO 0.98 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.50 1x8o n ASP 34 N -4.14 0.00 0.26 1.44 10.43 -1.26 -3.13 116.55 120.16 1x8o n ASP 34 Ca -0.02 0.24 0.15 0.00 2.57 0.00 0.00 54.79 57.73 1x8o n ASP 34 Cb 0.12 -0.39 0.62 0.00 1.84 0.00 0.00 41.12 43.30 1x8o n ASP 34 CO 0.00 0.00 0.00 0.44 -1.07 0.00 0.00 177.20 176.57 1x8o h ASP 35 N 0.00 0.00 -4.46 -2.24 5.19 -1.70 -3.45 116.42 109.77 1x8o h ASP 35 Ca 0.00 0.00 -0.31 0.00 -0.62 0.00 0.00 57.03 56.10 1x8o h ASP 35 Cb 0.29 0.00 -0.18 0.00 0.18 0.00 0.00 39.33 39.61 1x8o h ASP 35 CO 0.00 0.06 -0.73 0.68 -3.12 0.00 0.00 179.24 176.12 1x8o s VAL 36 N -3.66 0.88 1.04 -1.35 -7.23 -1.18 -5.08 120.40 103.82 1x8o s VAL 36 Ca 0.01 -1.56 -0.12 0.00 -1.81 0.00 0.00 61.98 58.50 1x8o s VAL 36 Cb 0.09 -1.26 0.22 0.00 0.56 0.00 0.00 36.38 35.99 1x8o s VAL 36 CO 0.57 -0.54 1.07 -2.84 -0.31 0.00 0.00 175.10 173.05 1x8o s PRO 37 N -2.63 0.03 0.34 4.82 0.02 -1.26 -4.95 135.00 131.37 1x8o s PRO 37 Ca 0.03 0.93 0.18 0.00 0.02 0.00 0.00 61.00 62.17 1x8o s PRO 37 Cb -0.04 -1.66 0.24 0.00 0.02 0.00 0.00 34.50 33.07 1x8o s PRO 37 CO -0.00 -3.11 1.54 0.87 -0.33 0.00 0.00 177.00 175.96 1x8o h LYS 38 N -2.19 0.00 -4.82 5.54 1.57 -1.99 -3.43 116.57 111.25 1x8o h LYS 38 Ca -0.55 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 57.70 1x8o h LYS 38 Cb 1.31 0.00 -0.33 0.00 0.08 0.00 0.00 32.23 33.30 1x8o h LYS 38 CO 0.50 0.33 -0.82 1.03 -0.57 0.00 0.00 179.45 179.92 1x8o s ARG 39 N -3.11 1.74 0.22 3.15 1.81 -1.26 -4.95 118.95 116.56 1x8o s ARG 39 Ca 0.04 -0.49 -0.22 0.00 -1.72 0.00 0.00 55.73 53.34 1x8o s ARG 39 Cb 0.07 -1.45 0.04 0.00 -0.45 0.00 0.00 34.95 33.16 1x8o s ARG 39 CO 0.71 0.11 0.71 -0.47 -0.68 0.00 0.00 175.30 175.68 1x8o s TYR 40 N 0.42 -0.30 -0.03 -0.53 6.14 -1.26 -4.49 117.35 117.29 1x8o s TYR 40 Ca -0.11 -0.06 -0.08 0.00 0.64 0.00 0.00 57.07 57.46 1x8o s TYR 40 Cb -0.14 0.65 0.01 0.00 0.42 0.00 0.00 41.96 42.90 1x8o s TYR 40 CO 0.03 -1.06 0.19 0.00 0.64 0.00 0.00 175.55 175.35 1x8o s ALA 42 N -0.76 -1.78 0.20 0.00 0.00 -1.26 -1.00 121.76 117.17 1x8o s ALA 42 Ca -0.08 1.47 -0.16 0.00 0.00 0.00 0.00 51.96 53.18 1x8o s ALA 42 Cb -0.05 -0.26 0.02 0.00 0.00 0.00 0.00 23.12 22.83 1x8o s ALA 42 CO 0.01 -0.36 0.50 0.00 0.00 0.00 0.00 175.76 175.91 1x8o s ALA 43 N -0.89 -0.74 0.08 0.00 0.00 -0.77 -1.44 121.76 118.01 1x8o s ALA 43 Ca -0.08 -0.40 -0.11 0.00 0.00 0.00 0.00 51.96 51.36 1x8o s ALA 43 Cb -0.01 0.88 0.01 0.00 0.00 0.00 0.00 23.12 24.00 1x8o s ALA 43 CO 0.08 -0.80 0.25 -0.48 0.00 0.00 0.00 175.76 174.80 1x8o s LEU 44 N -2.91 1.13 0.15 0.00 0.05 -0.17 -1.09 118.68 115.83 1x8o s LEU 44 Ca 0.12 -0.48 0.07 0.00 0.05 0.00 0.00 54.13 53.89 1x8o s LEU 44 Cb -0.01 1.24 -0.04 0.00 -2.05 0.00 0.00 46.19 45.33 1x8o s LEU 44 CO -0.00 -0.72 -0.06 0.00 -0.55 0.00 0.00 176.35 175.03 1x8o s ALA 45 N -3.49 3.07 -0.07 1.48 0.00 0.23 -0.15 121.76 122.83 1x8o s ALA 45 Ca 0.02 -1.33 -0.03 0.00 0.00 0.00 0.00 51.96 50.62 1x8o s ALA 45 Cb 0.03 -0.92 0.04 0.00 0.00 0.00 0.00 23.12 22.27 1x8o s ALA 45 CO -0.09 0.55 0.16 0.00 0.00 0.00 0.00 175.76 176.38 1x8o s ALA 46 N -1.52 -0.30 0.00 0.00 0.00 -1.07 -1.11 121.76 117.77 1x8o s ALA 46 Ca 0.25 0.72 -0.30 0.00 0.00 0.00 0.00 51.96 52.63 1x8o s ALA 46 Cb -0.10 -0.48 0.11 0.00 0.00 0.00 0.00 23.12 22.66 1x8o s ALA 46 CO 0.16 -0.16 1.26 0.20 0.00 0.00 0.00 175.76 177.22 1x8o s GLY 47 N 1.19 -0.36 -0.15 0.00 0.00 -0.65 -0.41 107.32 106.93 1x8o s GLY 47 Ca -0.09 0.56 -0.12 0.00 0.00 0.00 0.00 44.72 45.06 1x8o s GLY 47 CO -0.06 0.74 0.25 -1.59 0.00 0.00 0.00 173.10 172.44 1x8o s THR 48 N -2.43 5.33 -0.17 0.90 2.01 -1.25 -0.82 115.64 119.21 1x8o s THR 48 Ca 0.16 0.45 0.00 0.00 0.31 0.00 0.00 61.69 62.61 1x8o s THR 48 Cb 0.04 -3.58 0.04 0.00 0.01 0.00 0.00 72.50 69.01 1x8o s THR 48 CO -0.03 0.44 -0.10 0.00 -0.69 0.00 0.00 174.62 174.24 1x8o s ALA 49 N 0.16 1.79 -1.45 7.40 0.00 0.02 -4.76 121.76 124.92 1x8o s ALA 49 Ca 0.15 -0.99 -0.02 0.00 0.00 0.00 0.00 51.96 51.10 1x8o s ALA 49 Cb -0.13 -1.15 0.02 0.00 0.00 0.00 0.00 23.12 21.86 1x8o s ALA 49 CO 0.03 -0.65 0.42 0.45 0.00 0.00 0.00 175.76 176.01 1x8o n SER 50 N 4.77 -0.52 0.00 0.00 2.88 -1.26 -1.25 113.62 118.24 1x8o n SER 50 Ca -0.15 -1.03 0.00 0.00 -1.33 0.00 0.00 58.87 56.36 1x8o n SER 50 Cb 0.48 -2.89 0.00 0.00 -0.75 0.00 0.00 64.21 61.05 1x8o n SER 50 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x8o n GLY 51 N -1.98 2.19 3.65 0.46 0.00 -1.26 -5.02 105.19 103.24 1x8o n GLY 51 Ca -0.27 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.40 1x8o n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x8o s LYS 52 N -0.14 3.65 -0.18 1.61 -0.14 -0.38 -5.07 119.74 119.08 1x8o s LYS 52 Ca 0.00 -0.36 -0.29 0.00 -1.36 0.00 0.00 55.97 53.96 1x8o s LYS 52 Cb 0.00 -3.07 -0.00 0.00 -1.68 0.00 0.00 37.83 33.08 1x8o s LYS 52 CO 0.00 0.43 1.09 -1.17 -0.76 0.00 0.00 175.35 174.94 1x8o s LEU 53 N -0.08 4.16 0.08 3.17 2.96 -1.26 -0.80 118.68 126.91 1x8o s LEU 53 Ca 0.06 1.51 0.05 0.00 -0.22 0.00 0.00 54.13 55.52 1x8o s LEU 53 Cb -0.12 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 42.99 1x8o s LEU 53 CO 0.01 -0.63 -0.13 -0.54 -1.32 0.00 0.00 176.35 173.74 1x8o s LYS 54 N 2.92 0.83 0.04 1.98 -0.14 -0.00 -1.38 119.74 123.99 1x8o s LYS 54 Ca 0.48 -1.02 0.04 0.00 -1.36 0.00 0.00 55.97 54.11 1x8o s LYS 54 Cb -0.18 -0.74 -0.02 0.00 -1.68 0.00 0.00 37.83 35.21 1x8o s LYS 54 CO 0.12 0.15 -0.12 -1.21 -0.76 0.00 0.00 175.35 173.53 1x8o s GLU 55 N -2.05 0.77 -0.10 1.68 2.02 -0.74 -1.64 118.70 118.64 1x8o s GLU 55 Ca 0.00 -0.73 0.04 0.00 0.02 0.00 0.00 54.97 54.30 1x8o s GLU 55 Cb -0.08 -0.72 -0.00 0.00 0.10 0.00 0.00 34.13 33.43 1x8o s GLU 55 CO 0.02 0.17 -0.23 0.00 0.02 0.00 0.00 175.26 175.24 1x8o s ALA 56 N -0.96 2.22 0.13 5.21 0.00 -0.26 -1.63 121.76 126.47 1x8o s ALA 56 Ca -0.02 -0.96 0.08 0.00 0.00 0.00 0.00 51.96 51.06 1x8o s ALA 56 Cb -0.08 -0.85 -0.04 0.00 0.00 0.00 0.00 23.12 22.15 1x8o s ALA 56 CO 0.01 0.29 -0.10 -0.51 0.00 0.00 0.00 175.76 175.45 1x8o s LEU 57 N 0.33 2.99 -0.04 0.00 1.43 0.16 -0.60 118.68 122.95 1x8o s LEU 57 Ca -0.18 -0.47 0.01 0.00 -1.03 0.00 0.00 54.13 52.46 1x8o s LEU 57 Cb -0.18 -1.75 0.02 0.00 0.03 0.00 0.00 46.19 44.31 1x8o s LEU 57 CO 0.09 0.15 -0.03 -0.47 0.23 0.00 0.00 176.35 176.32 1x8o s TYR 58 N -1.38 0.59 -0.02 0.29 5.04 -0.25 -1.62 117.35 120.00 1x8o s TYR 58 Ca 0.22 -0.13 0.06 0.00 -2.44 0.00 0.00 57.07 54.78 1x8o s TYR 58 Cb -0.10 -0.58 -0.01 0.00 0.35 0.00 0.00 41.96 41.61 1x8o s TYR 58 CO 0.14 -0.18 -0.19 -1.01 -1.34 0.00 0.00 175.55 172.97 1x8o s HIS 59 N 1.01 1.79 -0.13 4.97 3.76 -0.38 -1.86 115.29 124.46 1x8o s HIS 59 Ca -0.10 -0.39 -0.06 0.00 -0.15 0.00 0.00 55.06 54.36 1x8o s HIS 59 Cb -0.14 -1.17 0.06 0.00 1.11 0.00 0.00 32.58 32.44 1x8o s HIS 59 CO -0.01 -0.07 0.29 -0.47 -0.85 0.00 0.00 174.74 173.63 1x8o s TYR 60 N -0.33 -0.44 -0.40 1.40 5.04 -0.17 -1.59 117.35 120.86 1x8o s TYR 60 Ca 0.04 0.99 -0.20 0.00 -2.44 0.00 0.00 57.07 55.46 1x8o s TYR 60 Cb -0.09 0.06 0.01 0.00 0.35 0.00 0.00 41.96 42.30 1x8o s TYR 60 CO 0.00 -0.32 0.62 0.34 -1.34 0.00 0.00 175.55 174.85 1x8o s ASP 61 N 1.87 6.34 0.26 4.32 -1.08 -0.25 -0.98 116.67 127.16 1x8o s ASP 61 Ca -0.04 -0.18 0.24 0.00 -0.52 0.00 0.00 52.55 52.05 1x8o s ASP 61 Cb -0.11 -2.31 0.95 0.00 -1.46 0.00 0.00 42.92 39.99 1x8o s ASP 61 CO -0.09 -0.68 1.73 -0.81 0.52 0.00 0.00 175.17 175.84 1x8o n PRO 62 N 6.11 0.22 -0.06 4.34 -0.04 -1.26 -0.38 135.00 143.93 1x8o n PRO 62 Ca -0.02 0.38 -0.21 0.00 -0.04 0.00 0.00 63.50 63.61 1x8o n PRO 62 Cb 0.48 -1.87 -0.12 0.00 -0.04 0.00 0.00 33.50 31.94 1x8o n PRO 62 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1x8o h LYS 63 N 0.00 0.10 0.00 0.54 1.57 -1.92 -3.40 116.57 113.46 1x8o h LYS 63 Ca 0.00 -0.17 -0.00 0.00 -1.87 0.00 0.00 60.65 58.61 1x8o h LYS 63 Cb 0.46 0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.83 1x8o h LYS 63 CO 0.00 1.08 -0.70 1.79 -0.57 0.00 0.00 179.45 181.05 1x8o h THR 64 N -0.65 0.02 0.00 -0.16 1.35 -1.96 -3.47 112.91 108.03 1x8o h THR 64 Ca -0.35 -1.03 0.00 0.00 -0.55 0.00 0.00 66.41 64.49 1x8o h THR 64 Cb 1.53 1.67 0.00 0.00 -1.73 0.00 0.00 68.15 69.62 1x8o h THR 64 CO -0.10 0.01 0.00 0.00 -0.25 0.00 0.00 175.52 175.18 1x8o n GLN 65 N -2.81 -0.36 -1.68 4.72 6.02 0.49 -5.00 117.38 118.75 1x8o n GLN 65 Ca 0.01 0.09 -0.44 0.00 -0.01 0.00 0.00 57.00 56.65 1x8o n GLN 65 Cb 0.55 -3.35 -0.04 0.00 1.02 0.00 0.00 30.24 28.42 1x8o n GLN 65 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1x8o n ASP 66 N -0.18 3.81 -3.83 1.08 2.03 -1.24 -4.78 116.55 113.44 1x8o n ASP 66 Ca 0.00 1.00 -0.13 0.00 0.52 0.00 0.00 54.79 56.18 1x8o n ASP 66 Cb 0.09 -1.50 -0.15 0.00 -0.72 0.00 0.00 41.12 38.84 1x8o n ASP 66 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1x8o s THR 67 N 2.70 -0.02 -0.07 5.18 2.01 -1.26 -1.09 115.64 123.08 1x8o s THR 67 Ca 0.83 0.08 -0.22 0.00 0.31 0.00 0.00 61.69 62.69 1x8o s THR 67 Cb -0.54 -0.05 0.05 0.00 0.01 0.00 0.00 72.50 71.97 1x8o s THR 67 CO 0.40 0.03 0.52 0.72 -0.69 0.00 0.00 174.62 175.60 1x8o s PHE 68 N 0.42 -0.47 0.14 4.92 -0.71 -0.62 -5.02 117.98 116.64 1x8o s PHE 68 Ca -0.03 0.89 0.07 0.00 -1.04 0.00 0.00 56.93 56.82 1x8o s PHE 68 Cb -0.05 0.25 -0.04 0.00 -1.21 0.00 0.00 43.02 41.97 1x8o s PHE 68 CO -0.01 -0.46 -0.07 0.71 -1.34 0.00 0.00 175.22 174.05 1x8o s TYR 69 N -0.91 2.75 0.03 3.49 1.51 -1.24 -1.25 117.35 121.74 1x8o s TYR 69 Ca -0.09 -0.16 0.01 0.00 -1.01 0.00 0.00 57.07 55.81 1x8o s TYR 69 Cb -0.03 -1.38 -0.03 0.00 -0.11 0.00 0.00 41.96 40.41 1x8o s TYR 69 CO 0.06 0.48 -0.04 -0.51 -1.11 0.00 0.00 175.55 174.42 1x8o s ASP 70 N -2.58 0.49 -0.02 2.29 1.11 -0.64 -1.48 116.67 115.85 1x8o s ASP 70 Ca 0.24 -0.61 0.08 0.00 0.18 0.00 0.00 52.55 52.44 1x8o s ASP 70 Cb -0.10 0.10 -0.02 0.00 1.07 0.00 0.00 42.92 43.97 1x8o s ASP 70 CO 0.16 -0.33 -0.26 -0.69 1.18 0.00 0.00 175.17 175.23 1x8o s VAL 71 N -1.91 2.02 0.02 -1.27 1.01 -0.42 -0.66 120.40 119.18 1x8o s VAL 71 Ca -0.10 -1.09 0.01 0.00 0.00 0.00 0.00 61.98 60.80 1x8o s VAL 71 Cb -0.07 -1.68 -0.02 0.00 0.00 0.00 0.00 36.38 34.62 1x8o s VAL 71 CO -0.02 0.57 -0.04 -0.44 0.00 0.00 0.00 175.10 175.17 1x8o s SER 72 N -0.57 0.43 -0.22 3.32 0.01 -0.65 -1.25 113.70 114.77 1x8o s SER 72 Ca 0.09 -0.36 -0.16 0.00 1.31 0.00 0.00 55.95 56.83 1x8o s SER 72 Cb -0.10 0.04 -0.04 0.00 0.21 0.00 0.00 66.02 66.13 1x8o s SER 72 CO -0.01 -0.16 0.42 -0.70 0.41 0.00 0.00 173.24 173.20 1x8o s GLU 73 N -1.02 4.14 0.06 12.44 2.12 -1.26 -1.79 118.70 133.39 1x8o s GLU 73 Ca -0.09 0.21 -0.26 0.00 0.36 0.00 0.00 54.97 55.19 1x8o s GLU 73 Cb -0.07 -3.57 -0.05 0.00 0.26 0.00 0.00 34.13 30.69 1x8o s GLU 73 CO -0.00 -0.13 0.82 -0.51 -0.54 0.00 0.00 175.26 174.90 1x8o s LEU 74 N 1.60 4.46 0.03 2.70 1.02 -0.48 -3.76 118.68 124.25 1x8o s LEU 74 Ca 0.19 1.54 0.00 0.00 0.02 0.00 0.00 54.13 55.88 1x8o s LEU 74 Cb -0.15 -3.33 -0.04 0.00 0.02 0.00 0.00 46.19 42.69 1x8o s LEU 74 CO 0.09 -0.01 0.13 -1.10 0.02 0.00 0.00 176.35 175.47 1x8o s GLN 75 N -0.02 3.17 -0.12 1.70 -1.52 0.14 -4.60 119.66 118.41 1x8o s GLN 75 Ca 0.41 -0.49 -0.20 0.00 -1.95 0.00 0.00 55.36 53.12 1x8o s GLN 75 Cb -0.21 -2.91 -0.04 0.00 -0.22 0.00 0.00 33.01 29.63 1x8o s GLN 75 CO 0.25 0.63 0.57 0.08 -0.25 0.00 0.00 175.29 176.57 1x8o s VAL 76 N -1.33 5.11 -0.20 1.09 1.01 -1.26 -1.49 120.40 123.33 1x8o s VAL 76 Ca 0.28 1.14 0.01 0.00 0.00 0.00 0.00 61.98 63.40 1x8o s VAL 76 Cb -0.12 -3.91 -0.21 0.00 0.00 0.00 0.00 36.38 32.14 1x8o s VAL 76 CO 0.20 0.26 0.02 -0.62 0.00 0.00 0.00 175.10 174.96 1x8o n GLU 77 N 4.01 0.69 -3.85 2.72 -0.58 -0.06 -4.95 120.64 118.61 1x8o n GLU 77 Ca -0.04 0.18 -0.02 0.00 -0.42 0.00 0.00 57.16 56.86 1x8o n GLU 77 Cb 0.51 -1.59 0.01 0.00 -0.57 0.00 0.00 31.44 29.80 1x8o n GLU 77 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 1x8o s SER 78 N -6.60 -0.03 0.06 1.62 1.04 -1.07 -5.02 113.70 103.70 1x8o s SER 78 Ca -0.28 -0.53 -0.31 0.00 0.48 0.00 0.00 55.95 55.32 1x8o s SER 78 Cb 0.08 0.43 -0.08 0.00 0.10 0.00 0.00 66.02 66.54 1x8o s SER 78 CO 0.68 -0.83 1.73 -0.22 0.98 0.00 0.00 173.24 175.58 1x8o s LEU 79 N -3.34 4.38 0.00 2.42 2.96 -1.26 -1.34 118.68 122.50 1x8o s LEU 79 Ca 0.20 2.54 0.00 0.00 -0.22 0.00 0.00 54.13 56.66 1x8o s LEU 79 Cb -0.01 -3.56 0.00 0.00 0.50 0.00 0.00 46.19 43.12 1x8o s LEU 79 CO 0.03 -0.94 0.00 0.61 -1.32 0.00 0.00 176.35 174.73 1x8o n GLY 80 N 4.13 0.46 2.85 7.98 0.00 -1.26 -4.76 105.19 114.59 1x8o n GLY 80 Ca 0.17 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.95 1x8o n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x8o s LYS 81 N -0.26 0.98 0.12 1.61 1.02 -0.45 -1.02 119.74 121.74 1x8o s LYS 81 Ca 0.00 -0.07 0.04 0.00 0.02 0.00 0.00 55.97 55.96 1x8o s LYS 81 Cb 0.00 -1.14 -0.04 0.00 -0.52 0.00 0.00 37.83 36.13 1x8o s LYS 81 CO 0.00 -0.23 -0.10 0.71 -0.92 0.00 0.00 175.35 174.82 1x8o s TYR 82 N 1.59 1.15 -0.13 3.18 2.02 -0.03 -0.89 117.35 124.24 1x8o s TYR 82 Ca 0.00 -0.75 0.02 0.00 -0.37 0.00 0.00 57.07 55.98 1x8o s TYR 82 Cb -0.13 -0.61 0.01 0.00 -0.40 0.00 0.00 41.96 40.83 1x8o s TYR 82 CO -0.04 0.02 -0.21 0.99 -1.57 0.00 0.00 175.55 174.73 1x8o s THR 83 N -3.08 1.99 -0.17 -0.71 2.01 -0.56 -1.30 115.64 113.82 1x8o s THR 83 Ca 0.12 -0.94 0.01 0.00 0.31 0.00 0.00 61.69 61.19 1x8o s THR 83 Cb 0.01 -1.77 0.02 0.00 0.01 0.00 0.00 72.50 70.77 1x8o s THR 83 CO -0.00 0.54 -0.20 0.00 -0.69 0.00 0.00 174.62 174.26 1x8o s ALA 84 N 0.81 2.32 -0.28 7.40 0.00 0.32 -0.68 121.76 131.65 1x8o s ALA 84 Ca -0.08 -1.18 -0.10 0.00 0.00 0.00 0.00 51.96 50.61 1x8o s ALA 84 Cb -0.16 -1.14 -0.03 0.00 0.00 0.00 0.00 23.12 21.80 1x8o s ALA 84 CO -0.01 -0.26 0.15 -0.80 0.00 0.00 0.00 175.76 174.84 1x8o s ASN 85 N 1.15 5.66 0.12 0.00 0.01 -1.25 -0.62 114.94 120.01 1x8o s ASN 85 Ca 0.01 -0.22 -0.01 0.00 -0.71 0.00 0.00 52.86 51.93 1x8o s ASN 85 Cb -0.14 -2.04 -0.04 0.00 0.41 0.00 0.00 41.25 39.44 1x8o s ASN 85 CO -0.10 -0.09 0.30 0.72 -1.51 0.00 0.00 177.10 176.42 1x8o s PHE 86 N 1.68 3.50 -0.07 2.20 -0.12 -1.24 -4.09 117.98 119.83 1x8o s PHE 86 Ca 0.06 0.34 0.05 0.00 -0.05 0.00 0.00 56.93 57.33 1x8o s PHE 86 Cb -0.16 -1.84 -0.01 0.00 -0.63 0.00 0.00 43.02 40.38 1x8o s PHE 86 CO 0.08 0.50 -0.23 -1.59 -0.05 0.00 0.00 175.22 173.93 1x8o s LYS 87 N -2.78 2.75 0.10 1.99 -2.85 -0.38 -4.13 119.74 114.45 1x8o s LYS 87 Ca 0.37 -0.86 -0.30 0.00 -1.00 0.00 0.00 55.97 54.18 1x8o s LYS 87 Cb -0.12 -2.26 -0.06 0.00 -2.06 0.00 0.00 37.83 33.33 1x8o s LYS 87 CO 0.27 0.33 0.98 0.21 0.10 0.00 0.00 175.35 177.25 1x8o s LYS 88 N -0.03 4.67 0.11 1.78 2.20 -0.42 -1.30 119.74 126.74 1x8o s LYS 88 Ca -0.07 1.48 0.02 0.00 -0.36 0.00 0.00 55.97 57.04 1x8o s LYS 88 Cb -0.15 -3.38 -0.04 0.00 -1.51 0.00 0.00 37.83 32.75 1x8o s LYS 88 CO 0.05 0.16 -0.08 0.14 -0.36 0.00 0.00 175.35 175.26 1x8o s VAL 89 N 0.13 0.81 1.08 4.02 -7.23 -0.55 -0.45 120.40 118.22 1x8o s VAL 89 Ca 0.48 -1.91 -0.18 0.00 -1.81 0.00 0.00 61.98 58.56 1x8o s VAL 89 Cb -0.24 -1.66 0.25 0.00 0.56 0.00 0.00 36.38 35.29 1x8o s VAL 89 CO 0.30 -0.81 1.24 1.51 -0.31 0.00 0.00 175.10 177.04 1x8o s ASP 90 N -2.98 2.02 0.41 4.85 1.47 -0.38 -3.65 116.67 118.41 1x8o s ASP 90 Ca 0.12 0.36 0.29 0.00 1.18 0.00 0.00 52.55 54.50 1x8o s ASP 90 Cb 0.04 -0.44 1.39 0.00 -0.34 0.00 0.00 42.92 43.57 1x8o s ASP 90 CO -0.03 -3.42 1.88 0.07 0.68 0.00 0.00 175.17 174.34 1x8o h LYS 91 N -2.11 0.00 -0.19 2.11 2.10 -1.95 -1.16 116.57 115.37 1x8o h LYS 91 Ca -0.44 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.21 1x8o h LYS 91 Cb 1.25 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.58 1x8o h LYS 91 CO 0.33 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.87 1x8o n ASN 92 N -2.58 2.63 0.00 7.07 3.02 -1.26 -4.78 115.26 119.36 1x8o n ASN 92 Ca -0.00 -1.86 0.00 0.00 -0.03 0.00 0.00 54.58 52.69 1x8o n ASN 92 Cb 0.16 -0.12 0.00 0.00 -0.61 0.00 0.00 39.78 39.21 1x8o n ASN 92 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1x8o n GLY 93 N 1.33 0.74 3.73 7.41 0.00 -0.44 -5.00 105.19 112.96 1x8o n GLY 93 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1x8o n GLY 93 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1x8o s ASN 94 N -2.32 7.17 -0.02 1.61 0.01 -1.26 -4.79 114.94 115.33 1x8o s ASN 94 Ca 0.00 2.09 -0.30 0.00 -0.71 0.00 0.00 52.86 53.93 1x8o s ASN 94 Cb 0.00 -2.60 -0.04 0.00 0.41 0.00 0.00 41.25 39.02 1x8o s ASN 94 CO 0.00 -0.34 1.21 -0.69 -1.51 0.00 0.00 177.10 175.77 1x8o s VAL 95 N 0.26 4.18 -0.26 1.60 1.01 -1.26 -1.25 120.40 124.67 1x8o s VAL 95 Ca 0.53 1.53 0.02 0.00 0.00 0.00 0.00 61.98 64.06 1x8o s VAL 95 Cb -0.30 -3.98 -0.17 0.00 0.00 0.00 0.00 36.38 31.93 1x8o s VAL 95 CO 0.33 0.03 -0.23 0.29 0.00 0.00 0.00 175.10 175.52 1x8o n LYS 96 N 4.87 0.65 -3.70 2.72 5.02 0.41 -4.92 118.16 123.22 1x8o n LYS 96 Ca 0.10 0.15 -0.23 0.00 -2.02 0.00 0.00 58.31 56.32 1x8o n LYS 96 Cb 0.46 -1.52 -0.18 0.00 -0.02 0.00 0.00 35.03 33.78 1x8o n LYS 96 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1x8o s VAL 97 N -2.52 0.10 0.82 -0.18 1.01 -0.85 -4.98 120.40 113.81 1x8o s VAL 97 Ca -0.35 0.13 -0.11 0.00 0.00 0.00 0.00 61.98 61.65 1x8o s VAL 97 Cb 0.09 -0.43 0.09 0.00 0.00 0.00 0.00 36.38 36.12 1x8o s VAL 97 CO 0.60 0.08 1.10 0.00 0.00 0.00 0.00 175.10 176.88 1x8o s ALA 98 N 2.07 1.98 0.20 5.51 0.00 -1.26 -1.30 121.76 128.96 1x8o s ALA 98 Ca 0.04 0.24 -0.32 0.00 0.00 0.00 0.00 51.96 51.91 1x8o s ALA 98 Cb -0.13 -3.28 -0.15 0.00 0.00 0.00 0.00 23.12 19.56 1x8o s ALA 98 CO -0.05 -2.04 1.25 0.28 0.00 0.00 0.00 175.76 175.20 1x8o n VAL 99 N -3.70 0.93 -4.02 0.00 0.31 -1.26 -4.77 118.33 105.82 1x8o n VAL 99 Ca 0.09 -0.23 -0.13 0.00 -0.01 0.00 0.00 64.34 64.06 1x8o n VAL 99 Cb 0.53 -1.08 -0.13 0.00 -0.91 0.00 0.00 33.84 32.26 1x8o n VAL 99 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1x8o s THR 100 N -0.16 0.26 0.22 2.52 2.01 -1.26 -5.06 115.64 114.17 1x8o s THR 100 Ca 0.71 -0.46 -0.14 0.00 0.31 0.00 0.00 61.69 62.11 1x8o s THR 100 Cb -0.78 -0.28 0.25 0.00 0.01 0.00 0.00 72.50 71.71 1x8o s THR 100 CO 0.51 -0.13 1.60 0.00 -0.69 0.00 0.00 174.62 175.91 1x8o h ALA 101 N 5.50 0.35 0.00 7.40 0.00 -1.99 -1.33 119.26 129.18 1x8o h ALA 101 Ca -0.29 0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1x8o h ALA 101 Cb 1.20 0.62 0.00 0.00 0.00 0.00 0.00 17.79 19.61 1x8o h ALA 101 CO 0.47 -0.48 0.00 0.41 0.00 0.00 0.00 179.25 179.65 1x8o n GLY 102 N -1.47 -1.16 3.30 0.00 0.00 -1.26 -4.63 105.19 99.97 1x8o n GLY 102 Ca 0.08 -0.11 -0.44 0.00 0.00 0.00 0.00 46.02 45.56 1x8o n GLY 102 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1x8o s ASN 103 N -2.64 5.98 0.14 1.61 -0.87 -0.50 -3.98 114.94 114.68 1x8o s ASN 103 Ca 0.22 -1.67 -0.14 0.00 -1.57 0.00 0.00 52.86 49.70 1x8o s ASN 103 Cb 0.17 -2.12 0.02 0.00 -0.02 0.00 0.00 41.25 39.29 1x8o s ASN 103 CO 0.40 -0.72 0.36 -0.72 -2.57 0.00 0.00 177.10 173.85 1x8o s TYR 104 N 1.53 -0.02 0.04 2.20 1.13 -0.77 -3.70 117.35 117.75 1x8o s TYR 104 Ca 0.04 -0.33 0.04 0.00 -1.41 0.00 0.00 57.07 55.41 1x8o s TYR 104 Cb -0.27 0.17 -0.02 0.00 -1.10 0.00 0.00 41.96 40.75 1x8o s TYR 104 CO 0.03 -0.71 -0.11 1.52 -2.51 0.00 0.00 175.55 173.76 1x8o s TYR 105 N -3.85 0.98 0.42 -3.49 1.13 0.21 -0.54 117.35 112.20 1x8o s TYR 105 Ca 0.07 -0.37 -0.09 0.00 -1.41 0.00 0.00 57.07 55.27 1x8o s TYR 105 Cb 0.02 -0.58 -0.06 0.00 -1.10 0.00 0.00 41.96 40.24 1x8o s TYR 105 CO -0.08 0.00 0.77 0.95 -2.51 0.00 0.00 175.55 174.68 1x8o s THR 106 N -0.94 4.82 -0.16 -3.49 -4.23 -0.54 -0.52 115.64 110.58 1x8o s THR 106 Ca -0.02 0.53 -0.05 0.00 -1.18 0.00 0.00 61.69 60.97 1x8o s THR 106 Cb -0.08 -3.76 0.08 0.00 1.34 0.00 0.00 72.50 70.08 1x8o s THR 106 CO 0.01 -0.59 0.32 0.12 -0.54 0.00 0.00 174.62 173.93 1x8o s PHE 107 N -2.45 -0.56 -0.11 3.99 5.36 -0.42 -2.87 117.98 120.91 1x8o s PHE 107 Ca 0.50 1.07 0.02 0.00 -0.96 0.00 0.00 56.93 57.56 1x8o s PHE 107 Cb -0.10 0.04 0.01 0.00 -0.34 0.00 0.00 43.02 42.63 1x8o s PHE 107 CO 0.34 -0.44 -0.18 0.99 -1.46 0.00 0.00 175.22 174.48 1x8o s THR 108 N 2.48 1.67 -0.57 0.12 2.01 -0.03 -0.85 115.64 120.47 1x8o s THR 108 Ca 0.02 -0.75 -0.20 0.00 0.31 0.00 0.00 61.69 61.06 1x8o s THR 108 Cb -0.13 -1.50 0.07 0.00 0.01 0.00 0.00 72.50 70.96 1x8o s THR 108 CO -0.11 0.47 0.75 -0.69 -0.69 0.00 0.00 174.62 174.35 1x8o s VAL 109 N 0.85 4.71 -0.19 3.82 1.01 -0.19 -1.30 120.40 129.11 1x8o s VAL 109 Ca -0.09 -0.55 0.16 0.00 0.00 0.00 0.00 61.98 61.50 1x8o s VAL 109 Cb -0.15 -4.46 0.09 0.00 0.00 0.00 0.00 36.38 31.86 1x8o s VAL 109 CO -0.00 -1.06 1.46 0.24 0.00 0.00 0.00 175.10 175.74 1x8o h MET 110 N 9.19 0.00 -1.92 2.72 2.86 -1.13 -0.36 114.93 126.29 1x8o h MET 110 Ca -0.28 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.33 1x8o h MET 110 Cb 1.09 0.00 -0.20 0.00 0.06 0.00 0.00 31.60 32.55 1x8o h MET 110 CO 1.06 0.45 0.25 -0.47 1.06 0.00 0.00 176.91 179.26 1x8o s TYR 111 N -2.99 -0.62 -0.14 -0.22 5.04 -1.03 -3.10 117.35 114.29 1x8o s TYR 111 Ca 0.04 1.11 -0.29 0.00 -2.44 0.00 0.00 57.07 55.49 1x8o s TYR 111 Cb 0.07 0.41 0.08 0.00 0.35 0.00 0.00 41.96 42.87 1x8o s TYR 111 CO 0.74 -0.54 0.74 0.00 -1.34 0.00 0.00 175.55 175.15 1x8o s ALA 112 N -1.03 -1.80 0.00 3.97 0.00 -1.26 -1.41 121.76 120.22 1x8o s ALA 112 Ca -0.08 1.60 0.00 0.00 0.00 0.00 0.00 51.96 53.48 1x8o s ALA 112 Cb -0.01 -0.52 0.00 0.00 0.00 0.00 0.00 23.12 22.59 1x8o s ALA 112 CO 0.08 -0.35 0.00 -0.40 0.00 0.00 0.00 175.76 175.09 1x8o n ASP 113 N 1.53 0.18 -0.17 0.00 5.75 -0.26 -4.96 116.55 118.62 1x8o n ASP 113 Ca -0.16 -0.38 0.10 0.00 -0.01 0.00 0.00 54.79 54.33 1x8o n ASP 113 Cb 0.56 0.00 0.52 0.00 -1.03 0.00 0.00 41.12 41.17 1x8o n ASP 113 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1x8o n ASP 114 N -1.08 0.52 0.00 -1.12 8.00 -1.26 -3.78 116.55 117.83 1x8o n ASP 114 Ca 0.00 -1.49 0.00 0.00 0.71 0.00 0.00 54.79 54.01 1x8o n ASP 114 Cb 0.00 -0.03 0.00 0.00 -0.02 0.00 0.00 41.12 41.07 1x8o n ASP 114 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1x8o n SER 115 N -0.45 0.51 -3.90 -2.24 3.41 -1.26 -4.89 113.62 104.81 1x8o n SER 115 Ca 0.15 -0.04 -0.08 0.00 -0.26 0.00 0.00 58.87 58.64 1x8o n SER 115 Cb 0.15 0.19 -0.08 0.00 -0.26 0.00 0.00 64.21 64.21 1x8o n SER 115 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1x8o s SER 116 N -0.29 0.18 0.15 4.04 1.04 -1.25 -1.04 113.70 116.53 1x8o s SER 116 Ca 0.00 -0.71 -0.22 0.00 0.48 0.00 0.00 55.95 55.50 1x8o s SER 116 Cb 0.00 0.32 0.06 0.00 0.10 0.00 0.00 66.02 66.50 1x8o s SER 116 CO 0.00 -0.71 0.57 0.00 0.98 0.00 0.00 173.24 174.08 1x8o s ALA 117 N -3.87 -1.51 -0.11 5.32 0.00 -0.80 -1.10 121.76 119.69 1x8o s ALA 117 Ca 0.05 0.44 0.01 0.00 0.00 0.00 0.00 51.96 52.47 1x8o s ALA 117 Cb 0.05 0.83 0.02 0.00 0.00 0.00 0.00 23.12 24.02 1x8o s ALA 117 CO -0.11 -0.74 -0.13 -1.17 0.00 0.00 0.00 175.76 173.61 1x8o s LEU 118 N -2.70 1.62 0.20 0.00 2.96 -0.50 -0.49 118.68 119.76 1x8o s LEU 118 Ca 0.01 -0.40 0.08 0.00 -0.22 0.00 0.00 54.13 53.60 1x8o s LEU 118 Cb -0.01 -1.03 -0.04 0.00 0.50 0.00 0.00 46.19 45.61 1x8o s LEU 118 CO -0.12 -0.02 -0.17 0.27 -1.32 0.00 0.00 176.35 175.00 1x8o s ILE 119 N 1.14 1.84 -0.03 6.68 -5.25 -0.42 -0.75 121.20 124.42 1x8o s ILE 119 Ca -0.04 -2.11 0.07 0.00 -0.99 0.00 0.00 60.65 57.58 1x8o s ILE 119 Cb -0.14 -1.99 -0.02 0.00 2.95 0.00 0.00 42.46 43.27 1x8o s ILE 119 CO -0.03 -0.46 -0.24 -2.28 -1.79 0.00 0.00 174.94 170.13 1x8o s HIS 120 N -2.55 2.24 -0.00 1.37 5.65 -0.42 -1.16 115.29 120.41 1x8o s HIS 120 Ca 0.20 -0.50 0.02 0.00 0.25 0.00 0.00 55.06 55.03 1x8o s HIS 120 Cb -0.03 -1.45 -0.00 0.00 -1.18 0.00 0.00 32.58 29.91 1x8o s HIS 120 CO 0.08 -0.09 -0.05 -0.08 -0.65 0.00 0.00 174.74 173.95 1x8o s THR 121 N -0.44 0.39 -0.29 0.89 -1.32 0.15 -0.85 115.64 114.18 1x8o s THR 121 Ca 0.05 -0.21 0.00 0.00 -1.21 0.00 0.00 61.69 60.33 1x8o s THR 121 Cb -0.11 -0.33 0.06 0.00 -1.51 0.00 0.00 72.50 70.61 1x8o s THR 121 CO 0.00 0.11 -0.04 0.00 -2.21 0.00 0.00 174.62 172.48 1x8o s LEU 123 N 1.17 4.40 -0.11 0.00 2.96 -1.26 -1.46 118.68 124.37 1x8o s LEU 123 Ca -0.06 1.28 0.03 0.00 -0.22 0.00 0.00 54.13 55.16 1x8o s LEU 123 Cb -0.20 -3.09 0.01 0.00 0.50 0.00 0.00 46.19 43.40 1x8o s LEU 123 CO -0.03 -0.00 -0.21 -1.00 -1.32 0.00 0.00 176.35 173.79 1x8o s HIS 124 N 0.18 2.41 -0.28 5.38 3.76 0.30 -4.68 115.29 122.35 1x8o s HIS 124 Ca 0.36 -1.09 0.02 0.00 -0.15 0.00 0.00 55.06 54.20 1x8o s HIS 124 Cb -0.19 -1.64 0.17 0.00 1.11 0.00 0.00 32.58 32.02 1x8o s HIS 124 CO 0.20 -0.49 0.46 0.21 -0.85 0.00 0.00 174.74 174.27 1x8o s LYS 125 N 0.64 0.45 3.19 1.40 2.20 -1.26 -1.85 119.74 124.52 1x8o s LYS 125 Ca -0.12 0.32 0.00 0.00 -0.36 0.00 0.00 55.97 55.81 1x8o s LYS 125 Cb -0.16 -0.15 0.00 0.00 -1.51 0.00 0.00 37.83 36.00 1x8o s LYS 125 CO 0.03 -0.96 0.00 0.41 -0.36 0.00 0.00 175.35 174.46 1x8o n GLY 126 N 5.37 2.99 1.54 5.54 0.00 -1.26 -2.05 105.19 117.32 1x8o n GLY 126 Ca 0.01 0.02 -0.05 0.00 0.00 0.00 0.00 46.02 45.99 1x8o n GLY 126 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1x8o n ASN 127 N 2.95 3.68 -4.79 1.61 2.04 -1.26 -4.98 115.26 114.51 1x8o n ASN 127 Ca 0.00 -3.43 -0.35 0.00 -0.44 0.00 0.00 54.58 50.36 1x8o n ASN 127 Cb 0.00 -0.68 -0.04 0.00 -2.53 0.00 0.00 39.78 36.53 1x8o n ASN 127 CO 0.00 0.00 0.00 -0.75 -0.44 0.00 0.00 177.26 176.07 1x8o s LYS 128 N -3.10 3.94 -0.34 -3.83 2.47 -0.87 -5.04 119.74 112.97 1x8o s LYS 128 Ca 0.49 1.43 -0.06 0.00 -1.56 0.00 0.00 55.97 56.27 1x8o s LYS 128 Cb 0.42 -2.27 0.04 0.00 -1.46 0.00 0.00 37.83 34.55 1x8o s LYS 128 CO 0.08 -0.32 0.10 0.34 0.16 0.00 0.00 175.35 175.71 1x8o s ASP 129 N -1.80 5.30 0.15 1.43 2.15 -1.26 -4.74 116.67 117.90 1x8o s ASP 129 Ca 0.64 -1.12 0.09 0.00 0.43 0.00 0.00 52.55 52.59 1x8o s ASP 129 Cb -0.19 -1.87 -0.04 0.00 -0.30 0.00 0.00 42.92 40.52 1x8o s ASP 129 CO 0.23 -0.32 -0.21 -0.76 -0.17 0.00 0.00 175.17 173.94 1x8o s LEU 130 N 1.41 2.38 0.50 -1.34 1.02 -1.26 -4.50 118.68 116.88 1x8o s LEU 130 Ca -0.01 -0.79 0.07 0.00 0.02 0.00 0.00 54.13 53.41 1x8o s LEU 130 Cb -0.19 -0.95 0.02 0.00 0.02 0.00 0.00 46.19 45.09 1x8o s LEU 130 CO 0.03 0.05 0.43 -0.83 0.02 0.00 0.00 176.35 176.04 1x8o s GLY 131 N -2.36 2.23 0.00 -3.19 0.00 -1.25 -0.62 107.32 102.14 1x8o s GLY 131 Ca 0.13 -1.60 -0.30 0.00 0.00 0.00 0.00 44.72 42.96 1x8o s GLY 131 CO 0.06 -1.84 2.02 1.22 0.00 0.00 0.00 173.10 174.56 1x8o n ASP 132 N -1.72 4.05 -4.21 1.64 8.00 -1.26 -4.63 116.55 118.43 1x8o n ASP 132 Ca 0.02 0.80 -0.34 0.00 0.71 0.00 0.00 54.79 55.98 1x8o n ASP 132 Cb 0.63 -1.53 -0.15 0.00 -0.02 0.00 0.00 41.12 40.05 1x8o n ASP 132 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1x8o s LEU 133 N 5.05 2.45 -0.04 0.64 2.96 -0.59 -1.06 118.68 128.09 1x8o s LEU 133 Ca 0.91 -0.54 -0.03 0.00 -0.22 0.00 0.00 54.13 54.25 1x8o s LEU 133 Cb -0.42 -1.58 -0.04 0.00 0.50 0.00 0.00 46.19 44.65 1x8o s LEU 133 CO 0.41 0.00 0.13 -0.31 -1.32 0.00 0.00 176.35 175.26 1x8o s TYR 134 N 1.31 3.46 -0.01 5.38 2.02 0.19 -0.67 117.35 129.03 1x8o s TYR 134 Ca 0.04 0.35 0.00 0.00 -0.37 0.00 0.00 57.07 57.09 1x8o s TYR 134 Cb -0.14 -1.83 0.02 0.00 -0.40 0.00 0.00 41.96 39.61 1x8o s TYR 134 CO -0.08 0.63 0.02 0.00 -1.57 0.00 0.00 175.55 174.55 1x8o s ALA 135 N -1.18 0.08 -0.16 3.71 0.00 -0.31 -1.10 121.76 122.80 1x8o s ALA 135 Ca 0.22 0.18 -0.19 0.00 0.00 0.00 0.00 51.96 52.17 1x8o s ALA 135 Cb -0.12 -0.16 -0.04 0.00 0.00 0.00 0.00 23.12 22.80 1x8o s ALA 135 CO 0.12 -0.06 0.51 0.08 0.00 0.00 0.00 175.76 176.41 1x8o s VAL 136 N 0.67 5.14 0.16 0.00 1.01 0.00 -1.30 120.40 126.07 1x8o s VAL 136 Ca -0.06 0.98 0.08 0.00 0.00 0.00 0.00 61.98 62.98 1x8o s VAL 136 Cb -0.08 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 32.42 1x8o s VAL 136 CO -0.02 0.25 -0.05 -0.76 0.00 0.00 0.00 175.10 174.52 1x8o s LEU 137 N 1.12 3.15 0.02 3.92 1.43 0.36 -1.04 118.68 127.65 1x8o s LEU 137 Ca 0.26 -0.45 -0.05 0.00 -1.03 0.00 0.00 54.13 52.86 1x8o s LEU 137 Cb -0.15 -1.85 -0.01 0.00 0.03 0.00 0.00 46.19 44.21 1x8o s LEU 137 CO 0.10 0.12 0.09 0.21 0.23 0.00 0.00 176.35 177.09 1x8o s ASN 138 N -2.73 0.14 0.43 2.29 3.84 -0.28 -1.91 114.94 116.72 1x8o s ASN 138 Ca 0.25 -0.42 0.22 0.00 0.21 0.00 0.00 52.86 53.12 1x8o s ASN 138 Cb -0.10 0.20 0.94 0.00 -0.55 0.00 0.00 41.25 41.74 1x8o s ASN 138 CO 0.16 -0.43 1.85 0.03 -2.79 0.00 0.00 177.10 175.92 1x8o h ARG 139 N 4.03 0.00 -5.00 0.43 2.47 -1.35 -0.60 114.38 114.36 1x8o h ARG 139 Ca -0.32 0.00 -0.65 0.00 -1.26 0.00 0.00 59.98 57.75 1x8o h ARG 139 Cb 1.19 0.00 -0.23 0.00 -1.65 0.00 0.00 29.97 29.28 1x8o h ARG 139 CO 0.46 0.26 -0.64 1.21 0.56 0.00 0.00 179.97 181.82 1x8o s ASN 140 N -6.32 5.03 0.59 7.04 3.84 -1.26 -4.82 114.94 119.03 1x8o s ASN 140 Ca -0.01 -0.21 0.39 0.00 0.21 0.00 0.00 52.86 53.24 1x8o s ASN 140 Cb 0.11 -1.89 1.96 0.00 -0.55 0.00 0.00 41.25 40.88 1x8o s ASN 140 CO 0.65 -0.01 2.17 0.07 -2.79 0.00 0.00 177.10 177.19 1x8o h LYS 141 N 8.02 0.00 -0.25 0.43 2.10 -1.95 -2.37 116.57 122.56 1x8o h LYS 141 Ca -0.38 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.27 1x8o h LYS 141 Cb 1.17 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.50 1x8o h LYS 141 CO 0.59 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.79 1x8o n ASP 142 N -2.97 2.95 -4.71 7.07 8.00 -1.26 -4.93 116.55 120.70 1x8o n ASP 142 Ca -0.02 -1.87 -0.42 0.00 0.71 0.00 0.00 54.79 53.20 1x8o n ASP 142 Cb 0.14 -0.15 -0.03 0.00 -0.02 0.00 0.00 41.12 41.06 1x8o n ASP 142 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1x8o s ALA 143 N -1.33 3.48 0.41 2.24 0.00 -0.89 -5.01 121.76 120.64 1x8o s ALA 143 Ca 0.29 0.90 -0.25 0.00 0.00 0.00 0.00 51.96 52.89 1x8o s ALA 143 Cb 0.17 -3.50 -0.08 0.00 0.00 0.00 0.00 23.12 19.72 1x8o s ALA 143 CO 0.25 -0.58 1.24 0.00 0.00 0.00 0.00 175.76 176.67 1x8o s ALA 144 N 1.37 3.19 0.19 0.00 0.00 -1.26 -4.94 121.76 120.30 1x8o s ALA 144 Ca 0.61 1.11 -0.32 0.00 0.00 0.00 0.00 51.96 53.36 1x8o s ALA 144 Cb -0.31 -3.44 -0.11 0.00 0.00 0.00 0.00 23.12 19.26 1x8o s ALA 144 CO 0.28 -0.71 1.68 0.00 0.00 0.00 0.00 175.76 177.02 1x8o s ALA 145 N -1.33 3.88 0.67 0.00 0.00 -1.26 -4.98 121.76 118.73 1x8o s ALA 145 Ca 0.57 1.51 -0.01 0.00 0.00 0.00 0.00 51.96 54.04 1x8o s ALA 145 Cb -0.35 -3.68 0.11 0.00 0.00 0.00 0.00 23.12 19.21 1x8o s ALA 145 CO 0.44 -0.91 0.79 0.41 0.00 0.00 0.00 175.76 176.49 1x8o n GLY 146 N 3.93 0.62 0.28 0.00 0.00 -1.26 -4.87 105.19 103.88 1x8o n GLY 146 Ca 0.15 -2.01 -0.02 0.00 0.00 0.00 0.00 46.02 44.15 1x8o n GLY 146 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1x8o h ASP 147 N -0.49 0.63 -0.02 1.61 5.19 -1.98 -1.16 116.42 120.20 1x8o h ASP 147 Ca -0.26 -0.13 -0.00 0.00 -0.62 0.00 0.00 57.03 56.02 1x8o h ASP 147 Cb 0.95 -0.17 -0.00 0.00 0.18 0.00 0.00 39.33 40.29 1x8o h ASP 147 CO 0.28 0.69 0.01 0.11 -3.12 0.00 0.00 179.24 177.21 1x8o h LYS 148 N 0.63 0.03 -0.08 3.56 1.57 -1.99 -0.91 116.57 119.38 1x8o h LYS 148 Ca 0.13 -0.01 -0.18 0.00 -1.87 0.00 0.00 60.65 58.72 1x8o h LYS 148 Cb 0.38 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 1x8o h LYS 148 CO 0.01 0.20 -0.71 -0.24 -0.57 0.00 0.00 179.45 178.14 1x8o h VAL 149 N -0.14 1.38 -0.50 0.50 3.04 -1.94 -2.02 116.25 116.57 1x8o h VAL 149 Ca 0.01 -2.11 -0.08 0.00 -1.01 0.00 0.00 66.70 63.51 1x8o h VAL 149 Cb 0.18 2.08 -0.02 0.00 -2.01 0.00 0.00 31.29 31.52 1x8o h VAL 149 CO -0.00 0.63 -0.00 0.11 -1.01 0.00 0.00 177.57 177.30 1x8o h LYS 150 N 0.28 0.84 -0.74 4.17 1.57 -1.15 -0.76 116.57 120.77 1x8o h LYS 150 Ca -0.03 -0.23 -0.06 0.00 -1.87 0.00 0.00 60.65 58.46 1x8o h LYS 150 Cb 1.28 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.46 1x8o h LYS 150 CO 0.12 0.84 0.23 0.77 -0.57 0.00 0.00 179.45 180.84 1x8o h SER 151 N 0.78 1.07 -0.39 0.86 0.02 -1.05 -1.68 113.55 113.16 1x8o h SER 151 Ca 0.15 -0.20 -0.04 0.00 -0.84 0.00 0.00 61.79 60.85 1x8o h SER 151 Cb 0.47 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 1x8o h SER 151 CO 0.02 0.99 0.10 0.00 -1.14 0.00 0.00 176.83 176.81 1x8o h ALA 152 N 1.14 1.31 -0.22 3.77 0.00 -0.73 0.15 119.26 124.69 1x8o h ALA 152 Ca 0.24 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.97 1x8o h ALA 152 Cb 0.30 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1x8o h ALA 152 CO -0.01 0.48 0.12 0.28 0.00 0.00 0.00 179.25 180.13 1x8o h VAL 153 N 0.68 1.02 -0.93 0.00 2.07 -0.67 -1.79 116.25 116.64 1x8o h VAL 153 Ca 0.15 -0.09 0.02 0.00 0.82 0.00 0.00 66.70 67.60 1x8o h VAL 153 Cb 0.27 0.74 -0.05 0.00 -1.52 0.00 0.00 31.29 30.73 1x8o h VAL 153 CO -0.00 0.05 0.61 -1.28 0.02 0.00 0.00 177.57 176.97 1x8o h SER 154 N 0.26 1.05 0.52 0.57 0.87 -0.63 -2.10 113.55 114.09 1x8o h SER 154 Ca 0.09 -0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.61 1x8o h SER 154 Cb -0.00 -0.25 -0.00 0.00 -0.44 0.00 0.00 62.40 61.70 1x8o h SER 154 CO -0.04 0.75 -0.07 0.00 -0.53 0.00 0.00 176.83 176.94 1x8o h ALA 155 N 1.36 1.12 -0.08 6.23 0.00 -0.23 0.84 119.26 128.49 1x8o h ALA 155 Ca 0.35 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1x8o h ALA 155 Cb -0.10 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1x8o h ALA 155 CO -0.09 0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.24 1x8o n ALA 156 N -2.18 2.56 -2.73 0.00 0.00 -0.72 -4.90 120.51 112.54 1x8o n ALA 156 Ca -0.01 -0.30 -0.15 0.00 0.00 0.00 0.00 53.44 52.98 1x8o n ALA 156 Cb 0.24 -1.18 0.02 0.00 0.00 0.00 0.00 19.45 18.53 1x8o n ALA 156 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1x8o n THR 157 N -0.26 -1.31 -4.36 0.00 -1.04 0.29 -5.03 114.28 102.57 1x8o n THR 157 Ca 0.14 0.00 -0.27 0.00 -2.04 0.00 0.00 64.05 61.88 1x8o n THR 157 Cb 0.18 -2.66 -0.08 0.00 -1.82 0.00 0.00 70.33 65.94 1x8o n THR 157 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1x8o s LEU 158 N -4.66 2.93 -0.21 -4.42 1.43 -0.84 -5.03 118.68 107.87 1x8o s LEU 158 Ca 0.19 -1.25 0.02 0.00 -1.03 0.00 0.00 54.13 52.05 1x8o s LEU 158 Cb -0.08 -1.16 0.04 0.00 0.03 0.00 0.00 46.19 45.02 1x8o s LEU 158 CO 0.23 -0.57 -0.12 -1.61 0.23 0.00 0.00 176.35 174.51 1x8o s GLU 159 N -3.85 2.29 0.43 1.70 0.41 -1.26 -3.76 118.70 114.66 1x8o s GLU 159 Ca 0.35 -1.00 0.12 0.00 -0.41 0.00 0.00 54.97 54.03 1x8o s GLU 159 Cb 0.06 -2.60 0.99 0.00 -1.78 0.00 0.00 34.13 30.80 1x8o s GLU 159 CO 0.19 -0.43 2.01 0.35 -0.49 0.00 0.00 175.26 176.89 1x8o h PHE 160 N 7.90 0.44 -0.20 1.61 3.57 -1.90 -1.36 116.94 127.01 1x8o h PHE 160 Ca -0.29 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.28 1x8o h PHE 160 Cb 1.09 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.68 1x8o h PHE 160 CO 0.54 0.23 0.30 0.66 -2.23 0.00 0.00 178.31 177.81 1x8o h SER 161 N 0.43 0.00 0.59 0.41 4.64 -2.00 -1.12 113.55 116.51 1x8o h SER 161 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 1x8o h SER 161 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 1x8o h SER 161 CO -0.06 0.00 -0.56 0.29 -0.87 0.00 0.00 176.83 175.63 1x8o n LYS 162 N -3.49 0.09 -2.26 4.77 5.02 -0.51 -4.91 118.16 116.87 1x8o n LYS 162 Ca 0.02 0.02 -0.35 0.00 -2.02 0.00 0.00 58.31 55.98 1x8o n LYS 162 Cb 0.42 -1.55 0.00 0.00 -0.02 0.00 0.00 35.03 33.88 1x8o n LYS 162 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1x8o s PHE 163 N -3.05 2.69 -0.19 2.13 0.40 -0.42 -4.93 117.98 114.60 1x8o s PHE 163 Ca 0.09 1.55 -0.16 0.00 -0.60 0.00 0.00 56.93 57.81 1x8o s PHE 163 Cb 0.16 -3.27 -0.04 0.00 0.51 0.00 0.00 43.02 40.38 1x8o s PHE 163 CO 0.71 -1.54 0.38 0.42 0.70 0.00 0.00 175.22 175.89 1x8o s ILE 164 N -1.81 5.22 0.40 0.64 1.01 0.51 -4.86 121.20 122.32 1x8o s ILE 164 Ca 0.72 0.68 -0.21 0.00 0.00 0.00 0.00 60.65 61.85 1x8o s ILE 164 Cb -0.23 -3.71 -0.11 0.00 0.01 0.00 0.00 42.46 38.42 1x8o s ILE 164 CO 0.27 0.29 0.92 -0.55 0.00 0.00 0.00 174.94 175.87 1x8o s SER 165 N 0.89 6.97 0.00 3.58 0.15 -1.26 -0.78 113.70 123.25 1x8o s SER 165 Ca 0.19 1.65 0.25 0.00 0.70 0.00 0.00 55.95 58.74 1x8o s SER 165 Cb -0.14 -2.52 0.58 0.00 -1.71 0.00 0.00 66.02 62.23 1x8o s SER 165 CO 0.07 -0.29 1.48 0.35 1.20 0.00 0.00 173.24 176.05 1x8o n THR 166 N -0.42 0.09 0.32 6.45 -2.24 -0.16 -4.65 114.28 113.67 1x8o n THR 166 Ca 0.06 -0.43 0.15 0.00 -2.27 0.00 0.00 64.05 61.56 1x8o n THR 166 Cb 0.53 0.95 0.51 0.00 -2.10 0.00 0.00 70.33 70.23 1x8o n THR 166 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1x8o h LYS 167 N 3.58 0.00 -0.70 -0.78 2.10 -1.91 -2.99 116.57 115.87 1x8o h LYS 167 Ca 0.00 0.00 -0.14 0.00 -2.00 0.00 0.00 60.65 58.51 1x8o h LYS 167 Cb 0.77 0.00 -0.08 0.00 -0.90 0.00 0.00 32.23 32.01 1x8o h LYS 167 CO 0.00 0.00 0.18 0.39 -2.00 0.00 0.00 179.45 178.02 1x8o n GLU 168 N -2.84 4.13 -0.20 0.07 1.02 -1.26 -4.46 120.64 117.10 1x8o n GLU 168 Ca 0.02 -3.07 0.07 0.00 -0.02 0.00 0.00 57.16 54.16 1x8o n GLU 168 Cb 0.35 -2.23 0.18 0.00 -0.02 0.00 0.00 31.44 29.72 1x8o n GLU 168 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1x8o n ASN 169 N 0.13 3.09 -2.42 1.62 3.02 -1.13 -4.96 115.26 114.62 1x8o n ASN 169 Ca 0.36 -1.95 -0.20 0.00 -0.03 0.00 0.00 54.58 52.76 1x8o n ASN 169 Cb 1.32 -0.27 -0.01 0.00 -0.61 0.00 0.00 39.78 40.22 1x8o n ASN 169 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1x8o n ASN 170 N 0.85 -5.79 -4.75 6.41 5.03 -1.26 -4.89 115.26 110.85 1x8o n ASN 170 Ca 0.14 -0.01 -0.40 0.00 0.87 0.00 0.00 54.58 55.18 1x8o n ASN 170 Cb 0.47 -4.82 -0.05 0.00 -1.02 0.00 0.00 39.78 34.36 1x8o n ASN 170 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1x8o s ALA 172 N -0.88 2.14 0.25 0.00 0.00 -1.26 -5.14 121.76 116.87 1x8o s ALA 172 Ca 0.45 -1.07 0.11 0.00 0.00 0.00 0.00 51.96 51.45 1x8o s ALA 172 Cb -0.29 -0.61 -0.05 0.00 0.00 0.00 0.00 23.12 22.17 1x8o s ALA 172 CO 0.36 0.47 -0.17 0.71 0.00 0.00 0.00 175.76 177.13 1x8o s TYR 173 N -0.38 2.39 -0.76 0.00 2.02 -1.26 -5.07 117.35 114.30 1x8o s TYR 173 Ca 0.03 -0.31 -0.09 0.00 -0.37 0.00 0.00 57.07 56.33 1x8o s TYR 173 Cb -0.12 -1.08 0.20 0.00 -0.40 0.00 0.00 41.96 40.56 1x8o s TYR 173 CO 0.01 0.64 0.65 0.34 -1.57 0.00 0.00 175.55 175.62 1x8o s ASP 174 N -3.29 6.15 0.31 2.29 -1.08 -1.26 -4.93 116.67 114.86 1x8o s ASP 174 Ca 0.28 -2.81 -0.01 0.00 -0.52 0.00 0.00 52.55 49.49 1x8o s ASP 174 Cb -0.06 -2.06 0.48 0.00 -1.46 0.00 0.00 42.92 39.82 1x8o s ASP 174 CO 0.15 -0.47 1.93 0.78 0.52 0.00 0.00 175.17 178.08 1x8o h ASN 175 N 7.40 0.83 -0.63 -0.34 2.35 -2.00 -2.43 115.58 120.76 1x8o h ASN 175 Ca 0.06 -0.06 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 1x8o h ASN 175 Cb 1.00 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 39.13 1x8o h ASN 175 CO 0.74 0.67 0.31 0.44 -1.65 0.00 0.00 177.43 177.94 1x8o h ASP 176 N 0.94 0.82 -0.53 5.81 3.32 -2.00 -1.01 116.42 123.78 1x8o h ASP 176 Ca 0.24 -0.12 -0.02 0.00 0.02 0.00 0.00 57.03 57.15 1x8o h ASP 176 Cb 0.02 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.33 1x8o h ASP 176 CO -0.04 0.71 0.24 -1.28 -1.72 0.00 0.00 179.24 177.15 1x8o h SER 177 N 0.87 0.70 -0.77 6.45 0.87 -1.79 -1.11 113.55 118.77 1x8o h SER 177 Ca 0.22 -0.14 0.01 0.00 -1.23 0.00 0.00 61.79 60.64 1x8o h SER 177 Cb 0.10 -0.18 -0.04 0.00 -0.44 0.00 0.00 62.40 61.84 1x8o h SER 177 CO -0.03 0.65 0.51 -0.07 -0.53 0.00 0.00 176.83 177.36 1x8o h LEU 178 N 0.71 0.89 -0.41 2.23 3.38 -0.97 0.09 115.31 121.22 1x8o h LEU 178 Ca 0.18 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.05 1x8o h LEU 178 Cb 0.14 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1x8o h LEU 178 CO -0.02 0.65 -0.03 0.11 0.09 0.00 0.00 178.44 179.23 1x8o h LYS 179 N 1.05 0.75 -0.12 1.13 1.57 -1.05 -3.05 116.57 116.85 1x8o h LYS 179 Ca 0.28 -0.26 -0.11 0.00 -1.87 0.00 0.00 60.65 58.69 1x8o h LYS 179 Cb -0.12 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.12 1x8o h LYS 179 CO -0.06 0.85 -0.42 1.03 -0.57 0.00 0.00 179.45 180.27 1x8o h SER 180 N 0.58 0.30 0.11 0.86 0.87 -0.87 -2.80 113.55 112.59 1x8o h SER 180 Ca 0.11 -0.13 -0.01 0.00 -1.23 0.00 0.00 61.79 60.54 1x8o h SER 180 Cb 0.53 -0.08 -0.00 0.00 -0.44 0.00 0.00 62.40 62.41 1x8o h SER 180 CO 0.03 0.69 -0.03 -0.07 -0.53 0.00 0.00 176.83 176.92 1x8o h LEU 181 N 0.23 0.00 -2.04 2.23 3.38 -0.88 -1.91 115.31 116.33 1x8o h LEU 181 Ca 0.02 0.00 0.12 0.00 0.09 0.00 0.00 57.88 58.11 1x8o h LEU 181 Cb 0.85 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 1x8o h LEU 181 CO 0.07 0.03 0.33 -0.07 0.09 0.00 0.00 178.44 178.88 1x8o h LEU 182 N 0.00 0.00 -0.17 1.67 3.38 -1.47 -1.63 115.31 117.09 1x8o h LEU 182 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1x8o h LEU 182 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1x8o h LEU 182 CO 0.00 0.00 -0.24 0.35 0.09 0.00 0.00 178.44 178.64 1x8o n THR 183 N -4.17 0.00 1.08 0.22 -2.24 -0.72 -4.72 114.28 103.74 1x8o n THR 183 Ca 0.07 -0.04 0.12 0.00 -2.27 0.00 0.00 64.05 61.93 1x8o n THR 183 Cb 0.52 0.05 0.17 0.00 -2.10 0.00 0.00 70.33 68.96 1x8o n THR 183 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79